++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 01:15:44 on 15 Sep 2019 + ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Please cite: I. Uson & G.M. Sheldrick (2018), "An introduction to experimental phasing of macromolecules illustrated by SHELX; new autotracing features" Acta Cryst. D74, 106-116 (Open Access) if SHELXE proves useful. Command line parameters: ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.phi -a -n -t20 Cell and symmetry only from ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.ins Phases from ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.phi Native data from ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.hkl Listing output to ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.lst Phases output to ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.phs Poly-Ala trace output to ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.pdb Summary of parameters to be employed: -a 30 global autotracing cycles, stop 3 cycles after CC>30 -b 5.0 extra B for revised heavy atom sites -c 0.400 fraction of pixels in crossover region -d 0.000 high resolution limit to be applied to input data -D unset do not fuse disulfides for NCS -e unset fill in missing data up to maximum resolution + 0.2 Ang. -f unset read intensity not F from native .hkl file -F 0.800 fractional weight for phases from previous global cycle -g 1.100 solvent gamma flipping factor -G 0.700 FOM threshold for initial tripeptides and chain building -i unset no structure inversion -k 4.5 minimum height/sigma for revised heavy atom sites -l 2 space for 2000000 reflections -L 6 minimum number of residues/chain (if more than 3 chains) -m 10 cycles of density modification -p unset no phosphate search -q unset no alpha-helix search -r 3.00 map resolution (multiplies maximum indices) -s 0.450 solvent fraction -S 2.42 radius of sphere of influence -t 10.00 time for initial searches (-t6 or more if difficult) -u 500 MB allocatable memory for fragment optimization -v unset density sharpening factor dependent on resolution -w 0.200 weight for experimental phases after cycle 1 -x unset no phase and trace diagnostics -z unset do not optimize heavy atoms Space group: P 1 21 1 Allowed origin shift code: 2 94470 Reflections read from file ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.phi 94470 Reflections read from file ./1vl5-1.9-parrot-noncs/1vl5-1.9-parrot-noncs.hkl 94470 Unique data, highest resolution = 1.850 Angstroms Anisotropic scaling: intensities multiplied by -0.000509h^2 +0.000571k^2 -0.000089l^2 +0.000000kl -0.000113hl +0.000000hk 22 Reflections with d > 2.050 and 0 in range 2.050 > d > 1.850 added Density sharpening factor set to 0.97 Fourier grid = 128 x 256 x 85 0.000 <= z <= 0.500 92 Point spherical net set up with radius 2.42A 32 Extra Fourier layers will be generated <|E^2-1|> = 0.718 = 0.300, Contrast = 0.353, Connect. = 0.724 for dens.mod. cycle 1 = 0.300, Contrast = 0.434, Connect. = 0.722 for dens.mod. cycle 2 = 0.300, Contrast = 0.542, Connect. = 0.754 for dens.mod. cycle 3 = 0.300, Contrast = 0.582, Connect. = 0.764 for dens.mod. cycle 4 = 0.300, Contrast = 0.608, Connect. = 0.771 for dens.mod. cycle 5 = 0.300, Contrast = 0.626, Connect. = 0.776 for dens.mod. cycle 6 = 0.300, Contrast = 0.639, Connect. = 0.780 for dens.mod. cycle 7 = 0.300, Contrast = 0.649, Connect. = 0.783 for dens.mod. cycle 8 = 0.300, Contrast = 0.657, Connect. = 0.785 for dens.mod. cycle 9 = 0.300, Contrast = 0.662, Connect. = 0.786 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 7083 peaks > 0.5 sigma used to seed fragment search Space for about 1274 unique residues taking solvent into account 1366 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 13 31.198 2.255 1.240 0.885 0.917 0.667 CB 1.405 B: 14 22.361 2.200 0.721 0.897 0.846 0.769 CA 1.386 C: 13 32.595 2.213 1.137 0.896 1.000 0.833 CB 1.426 13 residues pruned to eliminate duplicates D: 14 35.327 2.128 1.260 0.929 0.923 0.692 CB 1.545 14 residues pruned to eliminate duplicates E: 13 34.757 2.307 1.102 0.925 0.917 0.833 CB 1.584 13 residues pruned to eliminate duplicates F: 13 37.368 2.254 1.099 0.875 1.000 0.917 CA 1.659 G: 17 41.832 2.150 1.496 0.920 1.000 0.875 CB 1.373 H: 56 42.335 2.027 0.896 0.611 0.945 0.655 CB 1.414 I: 16 34.452 2.144 1.181 0.915 0.933 0.867 CB 1.440 J: 37 32.926 2.226 0.928 0.559 0.833 0.722 CB 1.449 17 residues pruned to eliminate duplicates K: 15 23.445 2.094 0.925 0.916 0.857 0.857 CB 1.281 15 residues pruned to eliminate duplicates L: 14 24.927 2.193 0.814 0.871 0.846 0.769 CB 1.498 14 residues pruned to eliminate duplicates M: 14 24.469 2.222 0.662 0.814 0.923 0.615 CB 1.516 N: 17 21.787 1.843 0.666 0.853 1.000 0.812 CA 1.311 O: 86 56.533 2.125 0.980 0.624 0.918 0.682 CB 1.412 73 residues pruned to eliminate duplicates P: 13 26.247 2.164 1.026 0.885 0.833 0.667 CB 1.496 13 residues pruned to eliminate duplicates Q: 14 33.659 2.175 0.893 0.884 1.000 0.769 CB 1.639 13 residues pruned to eliminate duplicates R: 85 45.831 2.085 0.811 0.549 0.881 0.667 CB 1.434 59 residues pruned to eliminate duplicates S: 13 20.270 1.942 0.809 0.808 0.917 0.583 CA 1.389 12 residues pruned to eliminate duplicates T: 15 31.949 2.030 1.130 0.876 1.000 0.857 CA 1.435 16 residues pruned to eliminate duplicates U: 13 26.541 2.110 0.871 0.904 1.000 0.750 CA 1.382 14 residues pruned to eliminate duplicates V: 13 39.739 2.227 1.289 0.910 1.000 0.750 CA 1.596 15 residues pruned to eliminate duplicates W: 31 18.092 1.998 0.724 0.333 0.833 0.533 CB 1.381 X: 15 28.276 2.051 1.209 0.549 1.000 0.714 CB 1.590 Y: 19 31.764 1.897 0.965 0.906 1.000 0.889 CB 1.429 Z: 30 47.614 2.283 1.312 0.675 0.897 0.690 CB 1.590 16 residues pruned to eliminate duplicates Z: 17 33.845 2.120 0.790 0.927 1.000 0.750 CB 1.562 18 residues pruned to eliminate duplicates Z: 14 33.262 2.167 1.009 0.899 0.923 0.692 CA 1.641 14 residues pruned to eliminate duplicates Z: 13 33.393 2.286 1.067 0.912 1.000 0.417 CB 1.445 13 residues pruned to eliminate duplicates Z: 34 36.391 2.121 1.106 0.655 0.909 0.727 CB 1.351 34 residues pruned to eliminate duplicates Z: 15 30.512 2.178 0.855 0.926 1.000 0.929 CB 1.415 15 residues pruned to eliminate duplicates Z: 14 26.052 2.119 0.874 0.929 1.000 0.846 CA 1.273 14 residues pruned to eliminate duplicates Z: 16 36.669 2.149 1.115 0.930 1.000 0.867 CB 1.457 16 residues pruned to eliminate duplicates Z: 50 43.801 2.184 1.174 0.583 0.857 0.633 CB 1.420 64 residues pruned to eliminate duplicates Z: 15 39.974 2.212 1.307 0.936 1.000 1.000 CB 1.458 15 residues pruned to eliminate duplicates Z: 15 24.563 1.972 1.043 0.830 0.929 0.857 CB 1.320 15 residues pruned to eliminate duplicates Z: 11 16.780 1.996 0.846 0.891 0.900 0.900 CB 1.150 Z: 15 26.840 2.156 0.719 0.922 1.000 0.857 CB 1.361 Z: 13 14.601 1.876 0.574 0.817 0.917 0.583 CA 1.182 Z: 9 15.660 2.207 0.452 0.883 1.000 1.000 CB 1.249 9 residues pruned to eliminate duplicates Z: 67 49.430 2.120 1.085 0.542 0.894 0.682 CB 1.478 32 residues pruned to eliminate duplicates Z: 33 39.801 2.130 1.182 0.623 0.875 0.688 CA 1.540 33 residues pruned to eliminate duplicates Z: 62 53.998 2.182 1.052 0.555 0.934 0.705 CB 1.567 36 residues pruned to eliminate duplicates Z: 17 24.619 2.114 0.665 0.765 1.000 0.812 CB 1.383 17 residues pruned to eliminate duplicates Z: 14 29.511 2.186 0.898 0.891 1.000 0.615 CB 1.418 14 residues pruned to eliminate duplicates Z: 13 24.944 2.267 0.706 0.901 1.000 1.000 CA 1.328 13 residues pruned to eliminate duplicates Z: 34 41.760 2.181 1.093 0.605 1.000 0.667 CB 1.442 16 residues pruned to eliminate duplicates Z: 56 41.701 1.924 0.927 0.660 0.945 0.636 CB 1.383 18 residues pruned to eliminate duplicates Z: 14 13.454 2.044 0.550 0.495 0.846 0.538 CB 1.399 Z: 14 29.705 2.250 0.915 0.926 1.000 0.769 CB 1.341 14 residues pruned to eliminate duplicates Z: 51 24.722 2.026 0.809 0.485 0.860 0.620 CB 1.127 31 residues pruned to eliminate duplicates Z: 16 27.163 2.094 0.503 0.927 1.000 0.800 CB 1.562 16 residues pruned to eliminate duplicates Z: 18 31.505 2.195 1.232 0.836 0.941 0.765 CB 1.240 18 residues pruned to eliminate duplicates Z: 16 38.007 2.245 1.315 0.947 1.000 0.667 CB 1.305 16 residues pruned to eliminate duplicates Z: 18 34.259 1.997 1.074 0.921 1.000 0.706 CB 1.412 18 residues pruned to eliminate duplicates Z: 20 26.453 1.923 0.916 0.730 0.895 0.684 CA 1.497 Z: 69 45.197 1.998 1.005 0.619 0.882 0.529 CB 1.386 69 residues pruned to eliminate duplicates Z: 18 33.936 2.008 0.983 0.911 1.000 0.706 CB 1.464 Z: 50 35.974 2.003 0.870 0.655 0.898 0.551 CB 1.323 50 residues pruned to eliminate duplicates Z: 18 14.594 1.817 0.577 0.617 0.941 0.706 CB 1.174 Z: 15 25.864 2.084 0.790 0.863 1.000 0.643 CB 1.360 15 residues pruned to eliminate duplicates Z: 10 15.360 1.935 0.986 0.865 0.889 0.778 CB 1.098 Z: 17 28.829 2.112 1.166 0.581 0.875 0.688 CB 1.666 17 residues pruned to eliminate duplicates Z: 15 30.708 2.072 1.093 0.835 0.929 0.643 CA 1.527 15 residues pruned to eliminate duplicates Z: 16 16.314 1.900 0.580 0.790 0.800 0.733 CB 1.359 Z: 54 36.380 2.011 0.692 0.636 0.868 0.698 CA 1.490 13 residues pruned to eliminate duplicates Z: 9 17.264 2.158 0.811 0.779 1.000 0.750 CB 1.221 9 residues pruned to eliminate duplicates Z: 14 25.445 2.106 0.886 0.902 1.000 0.769 CA 1.268 14 residues pruned to eliminate duplicates Z: 17 34.146 2.126 0.967 0.933 0.875 0.750 CA 1.629 17 residues pruned to eliminate duplicates Z: 83 55.127 2.094 1.006 0.556 0.927 0.610 CB 1.480 62 residues pruned to eliminate duplicates Z: 74 47.060 2.169 0.896 0.582 0.904 0.507 CB 1.370 74 residues pruned to eliminate duplicates Z: 50 37.622 2.144 0.800 0.593 0.918 0.633 CB 1.388 34 residues pruned to eliminate duplicates Z: 10 18.408 2.030 1.233 0.751 0.889 0.667 CA 1.218 10 residues pruned to eliminate duplicates Z: 15 25.714 2.093 0.916 0.885 1.000 0.786 CB 1.237 15 residues pruned to eliminate duplicates Z: 62 51.508 2.045 0.935 0.673 0.967 0.656 CB 1.469 62 residues pruned to eliminate duplicates Z: 16 29.401 2.247 1.128 0.932 0.933 0.600 CB 1.188 16 residues pruned to eliminate duplicates Z: 20 17.429 2.091 0.910 0.384 0.842 0.526 CB 1.345 20 residues pruned to eliminate duplicates Z: 60 48.495 2.160 0.997 0.582 0.881 0.661 CB 1.536 60 residues pruned to eliminate duplicates Z: 12 24.551 2.155 1.037 0.919 0.909 0.818 CB 1.307 Z: 9 11.382 2.120 0.349 0.846 0.750 0.625 CB 1.393 Z: 10 21.009 2.039 0.968 0.872 1.000 0.333 CA 1.272 10 residues pruned to eliminate duplicates Z: 32 15.181 1.828 0.581 0.397 0.871 0.581 CB 1.208 18 residues pruned to eliminate duplicates Z: 106 64.507 2.061 1.043 0.624 0.952 0.638 CB 1.396 50 residues pruned to eliminate duplicates Z: 7 11.229 2.057 0.366 0.685 1.000 0.833 CA 1.377 7 residues pruned to eliminate duplicates Z: 65 37.235 2.188 0.901 0.454 0.828 0.578 CB 1.416 116 residues pruned to eliminate duplicates Z: 8 17.101 2.197 0.766 0.838 1.000 0.857 CB 1.245 8 residues pruned to eliminate duplicates Z: 49 44.092 2.201 0.994 0.612 0.917 0.583 CB 1.423 49 residues pruned to eliminate duplicates Z: 10 9.389 1.957 0.077 0.848 0.778 0.667 CB 1.416 10 residues pruned to eliminate duplicates Z: 16 34.547 2.101 1.069 0.891 1.000 0.533 CB 1.475 16 residues pruned to eliminate duplicates Z: 13 40.107 2.254 1.235 0.926 1.000 0.917 CA 1.612 13 residues pruned to eliminate duplicates Z: 62 49.138 2.100 0.997 0.661 0.918 0.623 CB 1.407 62 residues pruned to eliminate duplicates Z: 113 66.647 2.052 1.004 0.664 0.955 0.679 CB 1.378 103 residues pruned to eliminate duplicates Z: 51 30.378 2.127 0.820 0.456 0.880 0.560 CB 1.319 15 residues pruned to eliminate duplicates Z: 23 16.401 1.974 0.806 0.382 0.955 0.591 CB 1.165 20 residues pruned to eliminate duplicates Z: 13 31.452 2.316 0.765 0.891 0.917 0.833 CA 1.742 13 residues pruned to eliminate duplicates Z: 14 25.384 2.105 0.617 0.925 1.000 0.923 CB 1.451 14 residues pruned to eliminate duplicates Z: 18 30.018 2.116 1.185 0.552 0.941 0.647 CB 1.590 15 residues pruned to eliminate duplicates Z: 14 16.944 1.939 1.136 0.504 0.846 0.462 CA 1.336 Z: 10 14.553 1.982 0.788 0.779 0.889 0.333 CB 1.205 Z: 69 41.858 1.986 0.949 0.631 0.897 0.574 CB 1.293 69 residues pruned to eliminate duplicates Z: 25 17.626 1.964 0.865 0.410 0.917 0.667 CB 1.178 25 residues pruned to eliminate duplicates Z: 17 34.700 2.113 0.764 0.918 1.000 0.938 CB 1.641 17 residues pruned to eliminate duplicates Z: 12 37.898 2.384 1.223 0.908 0.909 0.909 CA 1.684 12 residues pruned to eliminate duplicates Z: 11 6.236 1.807 0.644 0.280 0.800 0.400 CB 1.064 11 residues pruned to eliminate duplicates Z: 48 40.031 2.060 0.816 0.644 0.957 0.617 CB 1.425 41 residues pruned to eliminate duplicates Z: 7 9.266 2.060 0.256 0.774 0.833 0.833 CA 1.377 7 residues pruned to eliminate duplicates Z: 9 11.713 2.111 0.100 0.874 0.875 0.750 CA 1.483 9 residues pruned to eliminate duplicates Z: 15 41.678 2.175 1.358 0.933 1.000 0.786 CB 1.515 15 residues pruned to eliminate duplicates Z: 15 10.553 1.804 0.830 0.328 0.857 0.286 CB 1.204 15 residues pruned to eliminate duplicates Z: 16 32.314 2.085 1.088 0.922 0.933 0.467 CB 1.445 16 residues pruned to eliminate duplicates Z: 15 26.511 2.025 0.853 0.912 1.000 0.714 CA 1.337 15 residues pruned to eliminate duplicates Z: 13 25.094 2.061 1.032 0.901 0.917 0.833 CB 1.347 13 residues pruned to eliminate duplicates Z: 10 10.922 1.999 0.483 0.815 0.778 0.667 CB 1.200 9 residues pruned to eliminate duplicates Z: 83 52.929 2.048 0.873 0.650 0.951 0.610 CB 1.393 83 residues pruned to eliminate duplicates Z: 15 18.062 1.985 1.067 0.501 0.929 0.643 CB 1.265 15 residues pruned to eliminate duplicates Z: 17 29.930 2.098 1.459 0.552 0.938 0.688 CB 1.470 17 residues pruned to eliminate duplicates Z: 8 11.834 1.893 0.909 0.595 1.000 0.857 CB 1.130 Z: 17 38.775 2.127 0.848 0.918 1.000 0.812 CA 1.739 17 residues pruned to eliminate duplicates Z: 14 27.298 2.185 0.815 0.909 1.000 0.769 CA 1.355 17 residues pruned to eliminate duplicates Z: 10 22.830 1.982 0.962 0.879 1.000 0.778 CB 1.419 10 residues pruned to eliminate duplicates Z: 13 38.056 2.169 1.453 0.885 0.917 0.583 CB 1.627 13 residues pruned to eliminate duplicates Z: 18 24.807 1.981 0.627 0.882 0.941 0.824 CA 1.436 18 residues pruned to eliminate duplicates Z: 8 9.371 1.962 0.463 0.632 0.857 0.571 CA 1.272 13 residues pruned to eliminate duplicates Z: 12 32.831 2.180 1.272 0.926 1.000 0.818 CB 1.402 12 residues pruned to eliminate duplicates Z: 9 13.849 1.935 0.524 0.858 1.000 0.625 CB 1.222 Z: 61 50.915 2.161 1.036 0.575 0.883 0.650 CB 1.574 61 residues pruned to eliminate duplicates Z: 14 20.175 1.961 0.572 0.886 1.000 0.846 CA 1.310 14 residues pruned to eliminate duplicates Z: 13 33.756 2.309 1.002 0.914 0.917 0.667 CB 1.626 13 residues pruned to eliminate duplicates Z: 17 37.290 2.134 0.882 0.912 1.000 0.812 CB 1.644 17 residues pruned to eliminate duplicates Z: 16 14.036 1.949 0.851 0.371 0.867 0.600 CB 1.331 14 residues pruned to eliminate duplicates Z: 8 19.517 2.088 0.611 0.915 1.000 0.857 CA 1.551 9 residues pruned to eliminate duplicates Z: 10 15.104 2.082 0.391 0.807 0.889 0.556 CA 1.496 10 residues pruned to eliminate duplicates Z: 22 28.156 2.156 0.993 0.600 0.857 0.619 CB 1.516 22 residues pruned to eliminate duplicates Z: 11 15.980 1.995 0.779 0.867 1.000 0.700 CB 1.042 11 residues pruned to eliminate duplicates Z: 17 13.035 1.783 0.927 0.411 0.812 0.438 CB 1.282 17 residues pruned to eliminate duplicates Z: 36 36.735 2.190 0.863 0.580 0.943 0.657 CB 1.495 36 residues pruned to eliminate duplicates Z: 9 18.484 1.953 0.594 0.905 1.000 0.500 CA 1.494 8 residues pruned to eliminate duplicates Z: 17 39.402 2.158 1.403 0.913 0.938 0.688 CB 1.434 17 residues pruned to eliminate duplicates Z: 13 17.660 2.047 0.840 0.879 0.667 0.583 CB 1.473 13 residues pruned to eliminate duplicates Z: 24 16.660 1.887 0.830 0.439 0.826 0.435 CB 1.296 24 residues pruned to eliminate duplicates Z: 12 39.596 2.169 1.323 0.904 1.000 0.636 CA 1.688 12 residues pruned to eliminate duplicates Z: 34 28.567 2.030 0.765 0.516 0.909 0.576 CB 1.502 31 residues pruned to eliminate duplicates Z: 9 22.307 2.086 0.903 0.902 1.000 1.000 CB 1.418 9 residues pruned to eliminate duplicates Z: 16 35.665 2.128 0.900 0.942 1.000 1.000 CB 1.580 16 residues pruned to eliminate duplicates Z: 12 31.420 2.112 1.358 0.923 0.909 0.727 CA 1.471 12 residues pruned to eliminate duplicates Z: 19 18.417 2.114 0.704 0.381 0.944 0.500 CB 1.448 19 residues pruned to eliminate duplicates Z: 37 25.389 2.010 0.778 0.435 0.861 0.472 CB 1.469 37 residues pruned to eliminate duplicates Z: 17 39.817 2.175 1.457 0.933 1.000 0.562 CB 1.300 17 residues pruned to eliminate duplicates Z: 18 37.775 2.022 1.105 0.911 1.000 0.412 CA 1.526 18 residues pruned to eliminate duplicates Z: 10 14.377 1.856 0.886 0.802 1.000 0.778 CA 1.051 10 residues pruned to eliminate duplicates Z: 12 26.669 2.241 0.839 0.911 1.000 0.818 CB 1.383 12 residues pruned to eliminate duplicates Z: 16 41.117 2.124 1.249 0.931 1.000 0.733 CB 1.553 16 residues pruned to eliminate duplicates Z: 10 16.709 1.908 0.865 0.758 1.000 0.778 CA 1.244 10 residues pruned to eliminate duplicates Z: 85 63.492 2.136 1.042 0.634 0.952 0.667 CB 1.471 48 residues pruned to eliminate duplicates Z: 10 15.368 2.017 0.447 0.868 1.000 0.889 CB 1.283 10 residues pruned to eliminate duplicates Z: 9 19.178 2.209 0.893 0.755 1.000 0.625 CB 1.291 9 residues pruned to eliminate duplicates Z: 59 51.070 2.132 1.091 0.587 0.897 0.638 CB 1.544 59 residues pruned to eliminate duplicates Z: 10 10.750 1.945 0.618 0.828 0.889 0.556 CB 0.964 10 residues pruned to eliminate duplicates Z: 17 27.301 2.093 0.840 0.878 0.938 0.812 CB 1.372 17 residues pruned to eliminate duplicates Z: 13 36.606 2.214 1.460 0.903 0.917 0.750 CA 1.509 13 residues pruned to eliminate duplicates Z: 15 21.775 2.082 0.646 0.857 0.929 0.786 CA 1.347 15 residues pruned to eliminate duplicates Z: 16 33.235 2.190 1.275 0.819 0.867 0.533 CB 1.507 16 residues pruned to eliminate duplicates Z: 27 31.358 2.140 1.022 0.599 0.923 0.538 CB 1.401 27 residues pruned to eliminate duplicates Z: 12 26.973 2.127 1.039 0.929 0.909 0.727 CB 1.444 12 residues pruned to eliminate duplicates Z: 16 27.917 2.098 1.209 0.877 0.933 0.867 CB 1.210 16 residues pruned to eliminate duplicates Z: 17 31.203 2.016 1.056 0.740 0.938 0.938 CB 1.618 17 residues pruned to eliminate duplicates Z: 10 17.983 1.854 1.039 0.876 1.000 0.444 CA 1.152 10 residues pruned to eliminate duplicates Z: 15 14.404 1.977 0.974 0.482 0.857 0.786 CB 1.172 15 residues pruned to eliminate duplicates Z: 12 42.885 2.408 1.432 0.921 0.909 0.727 CA 1.709 12 residues pruned to eliminate duplicates Z: 16 19.575 1.990 1.023 0.469 0.933 0.600 CA 1.389 15 residues pruned to eliminate duplicates Z: 13 37.236 2.175 1.381 0.915 1.000 0.667 CA 1.467 13 residues pruned to eliminate duplicates Z: 11 15.397 2.051 0.744 0.895 0.700 0.500 CB 1.393 11 residues pruned to eliminate duplicates Z: 112 49.338 2.055 0.896 0.517 0.901 0.577 CB 1.312 112 residues pruned to eliminate duplicates Z: 16 22.926 1.896 0.771 0.913 1.000 0.800 CB 1.248 Z: 9 24.151 2.119 1.038 0.893 1.000 1.000 CB 1.419 10 residues pruned to eliminate duplicates Z: 14 17.823 1.956 0.515 0.747 1.000 0.692 CB 1.338 14 residues pruned to eliminate duplicates Z: 17 38.600 2.101 1.418 0.910 1.000 0.750 CB 1.348 17 residues pruned to eliminate duplicates Z: 11 12.017 1.721 0.485 0.911 0.900 0.700 CB 1.170 11 residues pruned to eliminate duplicates Z: 8 8.058 1.813 0.431 0.705 0.857 0.714 CA 1.137 8 residues pruned to eliminate duplicates Z: 10 13.846 1.828 0.614 0.885 0.889 0.778 CB 1.271 10 residues pruned to eliminate duplicates Z: 16 24.579 2.199 0.841 0.824 0.867 0.467 CB 1.367 16 residues pruned to eliminate duplicates Z: 15 33.239 2.091 1.225 0.936 1.000 0.929 CA 1.330 15 residues pruned to eliminate duplicates Z: 10 14.590 1.847 0.790 0.775 1.000 0.778 CA 1.153 10 residues pruned to eliminate duplicates Z: 16 22.684 1.777 0.787 0.905 1.000 0.800 CA 1.312 16 residues pruned to eliminate duplicates Z: 14 13.444 1.751 0.720 0.497 0.923 0.692 CB 1.346 14 residues pruned to eliminate duplicates Z: 24 16.770 1.950 0.619 0.414 0.957 0.565 CB 1.267 24 residues pruned to eliminate duplicates Z: 9 20.836 2.144 1.191 0.909 1.000 0.500 CB 1.113 10 residues pruned to eliminate duplicates Z: 13 28.489 2.167 1.366 0.834 0.833 0.667 CA 1.443 13 residues pruned to eliminate duplicates Z: 39 36.437 2.094 1.131 0.561 0.842 0.579 CB 1.483 39 residues pruned to eliminate duplicates Z: 17 36.060 2.101 1.353 0.891 0.938 0.625 CB 1.398 17 residues pruned to eliminate duplicates Z: 17 26.017 1.918 0.863 0.896 0.938 0.750 CA 1.391 17 residues pruned to eliminate duplicates Z: 16 19.309 2.064 0.752 0.817 0.933 0.600 CA 1.121 16 residues pruned to eliminate duplicates Z: 55 51.407 2.139 1.142 0.600 0.926 0.759 CB 1.499 55 residues pruned to eliminate duplicates Z: 9 10.691 1.860 0.640 0.594 0.750 0.625 CB 1.511 9 residues pruned to eliminate duplicates Z: 87 51.661 2.052 0.951 0.602 0.919 0.581 CB 1.375 84 residues pruned to eliminate duplicates Z: 16 39.747 2.271 1.384 0.926 0.933 0.400 CB 1.424 16 residues pruned to eliminate duplicates Z: 13 30.459 2.238 1.035 0.929 1.000 0.833 CA 1.351 13 residues pruned to eliminate duplicates Z: 10 11.765 1.737 0.618 0.881 0.889 0.778 CA 1.137 10 residues pruned to eliminate duplicates Z: 14 29.329 2.071 1.123 0.834 0.923 0.462 CB 1.503 14 residues pruned to eliminate duplicates Z: 16 28.385 2.029 1.024 0.902 0.933 0.733 CA 1.365 16 residues pruned to eliminate duplicates Z: 17 31.200 1.938 1.036 0.910 1.000 0.562 CA 1.402 17 residues pruned to eliminate duplicates Z: 12 10.335 1.725 0.737 0.493 0.818 0.636 CB 1.280 11 residues pruned to eliminate duplicates Z: 7 7.610 1.756 0.565 0.505 1.000 0.667 CB 1.126 7 residues pruned to eliminate duplicates Z: 35 43.442 2.224 1.142 0.604 0.912 0.735 CB 1.554 35 residues pruned to eliminate duplicates Z: 11 10.335 1.784 0.416 0.546 0.800 0.700 CB 1.546 11 residues pruned to eliminate duplicates Z: 16 34.784 2.174 0.977 0.925 0.933 0.733 CA 1.571 16 residues pruned to eliminate duplicates Z: 24 25.727 1.988 0.854 0.629 0.913 0.522 CB 1.412 24 residues pruned to eliminate duplicates Z: 16 24.732 1.981 0.837 0.905 0.933 0.800 CA 1.338 16 residues pruned to eliminate duplicates Z: 94 60.778 2.214 0.942 0.605 0.925 0.602 CB 1.434 94 residues pruned to eliminate duplicates Z: 6 6.787 1.965 0.463 0.458 0.800 0.400 CB 1.378 4 residues pruned to eliminate duplicates Z: 75 44.337 2.005 0.870 0.598 0.905 0.622 CB 1.383 75 residues pruned to eliminate duplicates Z: 12 30.444 2.165 1.335 0.913 1.000 0.727 CB 1.285 12 residues pruned to eliminate duplicates Z: 10 14.405 1.963 0.605 0.806 1.000 0.778 CB 1.167 10 residues pruned to eliminate duplicates Z: 15 30.989 2.053 1.178 0.885 1.000 0.857 CA 1.338 15 residues pruned to eliminate duplicates Z: 10 20.732 2.021 1.115 0.753 1.000 0.556 CA 1.290 10 residues pruned to eliminate duplicates Z: 16 32.480 2.198 0.997 0.931 1.000 0.933 CB 1.335 16 residues pruned to eliminate duplicates Z: 7 4.772 1.751 -0.179 0.677 1.000 0.500 CB 1.150 Z: 18 30.474 2.028 0.995 0.836 0.941 0.588 CB 1.453 18 residues pruned to eliminate duplicates Z: 16 37.587 2.120 1.148 0.917 0.933 0.667 CB 1.611 16 residues pruned to eliminate duplicates Z: 11 17.107 1.898 0.647 0.888 0.900 0.700 CA 1.386 11 residues pruned to eliminate duplicates Z: 52 27.474 1.847 0.858 0.607 0.863 0.431 CB 1.174 52 residues pruned to eliminate duplicates Z: 15 19.872 1.890 0.494 0.891 1.000 0.929 CB 1.352 15 residues pruned to eliminate duplicates Z: 14 23.825 2.176 0.610 0.919 1.000 0.846 CA 1.330 14 residues pruned to eliminate duplicates Z: 16 36.505 2.189 1.435 0.901 0.933 0.733 CB 1.353 16 residues pruned to eliminate duplicates Z: 14 13.840 1.765 0.693 0.882 0.923 0.538 CB 1.007 14 residues pruned to eliminate duplicates Z: 8 8.766 1.795 0.663 0.472 0.857 0.571 CA 1.332 10 residues pruned to eliminate duplicates Z: 10 16.825 1.992 0.654 0.812 0.889 0.444 CB 1.459 10 residues pruned to eliminate duplicates Z: 10 11.307 2.095 0.806 0.407 0.778 0.556 CB 1.413 10 residues pruned to eliminate duplicates Z: 16 35.218 2.195 1.265 0.883 1.000 0.733 CB 1.323 16 residues pruned to eliminate duplicates Z: 13 37.915 2.179 1.430 0.911 1.000 0.750 CA 1.465 13 residues pruned to eliminate duplicates Z: 8 15.446 2.178 0.797 0.806 0.857 0.714 CA 1.333 8 residues pruned to eliminate duplicates Z: 14 32.078 2.084 1.124 0.934 1.000 0.769 CA 1.402 14 residues pruned to eliminate duplicates Z: 26 23.394 1.993 0.817 0.496 0.920 0.480 CB 1.411 26 residues pruned to eliminate duplicates Z: 15 20.398 2.060 0.506 0.897 1.000 0.429 CA 1.258 15 residues pruned to eliminate duplicates Z: 86 60.496 2.121 1.026 0.648 0.918 0.624 CB 1.450 86 residues pruned to eliminate duplicates Z: 10 9.167 1.926 -0.067 0.841 1.000 0.778 CB 1.268 10 residues pruned to eliminate duplicates Z: 84 55.269 2.088 0.934 0.611 0.928 0.627 CB 1.458 84 residues pruned to eliminate duplicates Z: 9 20.969 2.082 0.878 0.848 1.000 0.875 CA 1.406 9 residues pruned to eliminate duplicates Z: 13 13.913 1.776 0.593 0.875 1.000 0.667 CB 1.032 13 residues pruned to eliminate duplicates Z: 15 28.730 2.089 1.490 0.542 1.000 0.643 CB 1.416 15 residues pruned to eliminate duplicates Z: 12 35.540 2.165 1.263 0.936 1.000 0.818 CB 1.523 12 residues pruned to eliminate duplicates Z: 16 30.074 2.090 0.768 0.935 1.000 1.000 CB 1.464 16 residues pruned to eliminate duplicates Z: 15 24.576 2.054 0.781 0.939 0.929 0.929 CA 1.343 15 residues pruned to eliminate duplicates Z: 26 30.755 2.080 0.949 0.596 0.960 0.720 CB 1.442 26 residues pruned to eliminate duplicates Z: 19 19.308 1.930 0.759 0.571 0.833 0.722 CB 1.502 17 residues pruned to eliminate duplicates Z: 16 45.565 2.164 1.334 0.953 1.000 0.867 CB 1.603 16 residues pruned to eliminate duplicates Z: 18 20.085 2.012 0.774 0.546 0.882 0.471 CB 1.478 18 residues pruned to eliminate duplicates Z: 17 31.465 2.102 1.129 0.916 1.000 0.875 CB 1.242 17 residues pruned to eliminate duplicates Z: 12 37.879 2.370 1.032 0.926 1.000 0.818 CA 1.663 16 residues pruned to eliminate duplicates Z: 9 13.180 2.052 0.605 0.690 0.875 0.750 CB 1.359 9 residues pruned to eliminate duplicates Z: 15 24.091 1.930 0.984 0.911 0.857 0.571 CB 1.391 15 residues pruned to eliminate duplicates Z: 58 50.294 2.096 1.011 0.640 0.982 0.684 CB 1.410 58 residues pruned to eliminate duplicates Z: 16 26.638 1.947 1.067 0.920 1.000 0.733 CA 1.203 16 residues pruned to eliminate duplicates Z: 10 11.380 1.927 0.749 0.729 0.778 0.556 CA 1.178 10 residues pruned to eliminate duplicates Z: 10 14.016 1.957 0.816 0.729 0.889 0.556 CA 1.203 10 residues pruned to eliminate duplicates Z: 10 11.936 1.857 0.995 0.423 0.778 0.667 CA 1.496 6 residues pruned to eliminate duplicates Z: 15 23.891 2.086 0.769 0.856 0.929 0.786 CA 1.374 15 residues pruned to eliminate duplicates Z: 14 18.979 1.746 0.648 0.929 1.000 0.923 CA 1.280 Z: 16 32.099 2.098 1.243 0.853 0.933 0.533 CB 1.395 16 residues pruned to eliminate duplicates Z: 13 30.879 2.311 0.960 0.894 0.833 0.500 CA 1.695 13 residues pruned to eliminate duplicates Z: 14 16.138 1.745 0.342 0.925 1.000 0.769 CA 1.341 14 residues pruned to eliminate duplicates Z: 13 11.262 1.781 0.773 0.485 0.917 0.583 CB 1.140 12 residues pruned to eliminate duplicates Z: 13 40.916 2.237 1.386 0.940 1.000 0.750 CA 1.536 13 residues pruned to eliminate duplicates Z: 12 12.428 1.893 0.458 0.800 0.818 0.636 CB 1.277 10 residues pruned to eliminate duplicates Z: 16 42.918 2.190 1.496 0.904 1.000 0.733 CB 1.443 16 residues pruned to eliminate duplicates Z: 14 33.324 2.116 1.115 0.944 1.000 0.769 CB 1.430 14 residues pruned to eliminate duplicates Z: 12 25.728 2.107 0.766 0.930 1.000 1.000 CB 1.458 12 residues pruned to eliminate duplicates Z: 19 31.022 2.145 1.241 0.815 0.944 0.778 CB 1.225 19 residues pruned to eliminate duplicates Z: 32 38.206 2.137 1.068 0.579 0.935 0.677 CB 1.537 32 residues pruned to eliminate duplicates Z: 64 40.438 2.052 0.816 0.619 0.889 0.603 CB 1.374 64 residues pruned to eliminate duplicates Z: 29 36.185 2.146 1.054 0.575 0.893 0.607 CB 1.617 29 residues pruned to eliminate duplicates Z: 99 49.024 2.072 0.879 0.534 0.847 0.561 CB 1.452 103 residues pruned to eliminate duplicates Z: 54 28.500 2.011 0.794 0.502 0.925 0.604 CB 1.172 42 residues pruned to eliminate duplicates Z: 10 12.472 1.829 0.470 0.887 0.889 0.889 CB 1.254 10 residues pruned to eliminate duplicates Z: 13 31.014 2.260 0.872 0.918 0.917 0.583 CA 1.629 13 residues pruned to eliminate duplicates Z: 9 15.015 2.211 0.603 0.817 0.875 0.750 CB 1.299 9 residues pruned to eliminate duplicates Z: 13 11.102 1.903 0.673 0.450 0.750 0.417 CA 1.413 13 residues pruned to eliminate duplicates Z: 18 28.069 2.089 0.767 0.903 1.000 0.706 CB 1.314 18 residues pruned to eliminate duplicates Z: 7 8.650 1.676 0.798 0.579 0.833 0.500 CA 1.304 7 residues pruned to eliminate duplicates Z: 9 9.679 1.758 0.544 0.868 0.875 0.500 CA 1.054 9 residues pruned to eliminate duplicates Z: 51 37.598 2.088 0.748 0.590 0.920 0.640 CB 1.454 51 residues pruned to eliminate duplicates Z: 56 47.381 2.241 1.045 0.597 0.909 0.618 CB 1.398 56 residues pruned to eliminate duplicates Z: 12 17.095 1.745 1.308 0.764 0.909 0.818 CB 1.113 12 residues pruned to eliminate duplicates Z: 14 26.890 2.084 1.047 0.909 0.923 0.769 CB 1.344 14 residues pruned to eliminate duplicates Z: 35 37.563 2.167 0.937 0.590 0.941 0.618 CB 1.496 35 residues pruned to eliminate duplicates Z: 13 26.906 2.074 0.907 0.899 1.000 0.500 CB 1.404 13 residues pruned to eliminate duplicates Z: 14 12.155 1.712 0.104 0.920 1.000 0.846 CA 1.256 14 residues pruned to eliminate duplicates Z: 21 11.287 1.752 0.840 0.368 0.750 0.400 CB 1.203 21 residues pruned to eliminate duplicates Z: 15 20.572 1.803 0.865 0.812 1.000 0.786 CB 1.246 15 residues pruned to eliminate duplicates Z: 15 21.449 2.138 0.557 0.866 0.929 0.786 CA 1.357 14 residues pruned to eliminate duplicates Z: 10 15.826 1.867 0.967 0.745 1.000 0.778 CA 1.154 10 residues pruned to eliminate duplicates Z: 15 32.284 2.048 1.116 0.933 1.000 0.643 CB 1.390 15 residues pruned to eliminate duplicates Z: 24 15.039 2.014 0.425 0.493 0.870 0.522 CB 1.266 21 residues pruned to eliminate duplicates Z: 12 33.446 2.171 1.116 0.925 1.000 0.909 CB 1.541 12 residues pruned to eliminate duplicates Z: 9 18.460 2.086 0.675 0.900 1.000 1.000 CB 1.335 9 residues pruned to eliminate duplicates Z: 16 9.025 1.847 0.677 0.300 0.800 0.600 CB 1.175 2 residues pruned to eliminate duplicates Z: 55 46.981 2.221 0.939 0.651 0.926 0.648 CB 1.393 55 residues pruned to eliminate duplicates Z: 11 8.729 1.799 0.551 0.460 0.900 0.500 CB 1.145 Z: 12 21.743 2.008 1.021 0.936 1.000 0.818 CB 1.125 12 residues pruned to eliminate duplicates Z: 22 14.759 1.951 0.670 0.519 0.857 0.667 CB 1.132 22 residues pruned to eliminate duplicates Z: 14 28.142 2.215 0.945 0.857 1.000 0.692 CB 1.335 14 residues pruned to eliminate duplicates Z: 14 22.661 2.129 0.846 0.869 0.846 0.692 CB 1.381 14 residues pruned to eliminate duplicates Z: 31 15.767 1.985 0.654 0.290 0.867 0.600 CB 1.281 31 residues pruned to eliminate duplicates Z: 13 13.741 1.679 0.768 0.751 0.917 0.750 CB 1.166 13 residues pruned to eliminate duplicates Z: 15 16.066 1.848 0.462 0.885 1.000 0.786 CA 1.148 15 residues pruned to eliminate duplicates Z: 13 38.042 2.177 1.397 0.892 0.917 0.750 CA 1.650 13 residues pruned to eliminate duplicates Z: 10 19.077 2.048 0.820 0.877 1.000 0.889 CB 1.239 10 residues pruned to eliminate duplicates Z: 11 18.643 1.999 0.882 0.870 1.000 0.800 CB 1.144 11 residues pruned to eliminate duplicates Z: 62 29.079 1.931 0.673 0.504 0.885 0.672 CB 1.296 53 residues pruned to eliminate duplicates Z: 7 8.510 1.605 0.353 0.727 1.000 0.500 CB 1.303 7 residues pruned to eliminate duplicates Z: 11 5.601 1.936 0.207 0.262 0.800 0.400 CB 1.243 11 residues pruned to eliminate duplicates Z: 9 11.795 2.042 0.258 0.795 1.000 0.500 CB 1.254 9 residues pruned to eliminate duplicates Z: 10 11.623 1.797 0.491 0.832 0.889 0.556 CB 1.222 10 residues pruned to eliminate duplicates Z: 15 29.226 2.075 0.984 0.924 1.000 0.714 CA 1.332 15 residues pruned to eliminate duplicates Z: 6 5.234 1.633 0.549 0.464 0.800 0.400 O 1.200 6 residues pruned to eliminate duplicates Z: 9 11.618 1.898 1.261 0.626 0.875 0.625 CB 0.971 9 residues pruned to eliminate duplicates Z: 16 29.872 2.010 0.952 0.908 1.000 0.400 CA 1.396 16 residues pruned to eliminate duplicates Z: 17 19.550 1.885 0.439 0.912 1.000 0.875 CA 1.276 17 residues pruned to eliminate duplicates Z: 19 27.563 1.971 0.916 0.659 0.944 0.722 CB 1.571 19 residues pruned to eliminate duplicates Z: 16 25.357 1.933 0.898 0.902 0.933 0.600 CA 1.364 16 residues pruned to eliminate duplicates Z: 18 24.641 1.850 1.032 0.897 0.882 0.412 CA 1.290 18 residues pruned to eliminate duplicates Z: 17 15.769 1.815 0.542 0.599 0.938 0.750 CB 1.367 18 residues pruned to eliminate duplicates Z: 9 4.368 1.546 0.342 0.361 0.750 0.375 CB 1.153 Z: 11 14.924 2.021 0.676 0.822 0.900 0.700 CB 1.171 11 residues pruned to eliminate duplicates Z: 14 24.262 2.145 0.901 0.880 0.846 0.692 CB 1.413 14 residues pruned to eliminate duplicates Z: 49 43.104 2.066 0.957 0.627 0.917 0.646 CB 1.489 49 residues pruned to eliminate duplicates Z: 10 15.556 1.942 1.010 0.829 0.778 0.667 CA 1.285 10 residues pruned to eliminate duplicates Z: 21 25.179 2.086 1.070 0.494 0.900 0.550 CB 1.457 21 residues pruned to eliminate duplicates Z: 37 18.742 1.911 0.578 0.320 0.917 0.583 CB 1.378 35 residues pruned to eliminate duplicates Z: 9 17.519 2.128 0.488 0.873 1.000 0.875 CB 1.424 9 residues pruned to eliminate duplicates Z: 18 24.291 1.813 0.873 0.904 1.000 0.824 CA 1.235 18 residues pruned to eliminate duplicates Z: 13 22.849 2.052 0.682 0.928 1.000 0.833 CA 1.338 13 residues pruned to eliminate duplicates Z: 46 27.155 1.926 0.959 0.449 0.889 0.533 CB 1.272 46 residues pruned to eliminate duplicates Z: 17 24.855 2.081 0.780 0.842 0.938 0.688 CB 1.333 17 residues pruned to eliminate duplicates Z: 10 11.800 1.591 0.712 0.825 1.000 0.889 CB 1.089 10 residues pruned to eliminate duplicates Z: 16 25.400 2.007 0.779 0.895 0.933 0.733 CA 1.411 16 residues pruned to eliminate duplicates Z: 16 23.201 1.965 0.821 0.678 0.933 0.533 CB 1.523 16 residues pruned to eliminate duplicates Z: 15 29.966 2.062 1.047 0.938 0.929 0.643 CB 1.421 15 residues pruned to eliminate duplicates Z: 10 9.936 1.766 0.275 0.868 0.889 0.889 CB 1.209 10 residues pruned to eliminate duplicates Z: 37 37.344 2.013 0.994 0.733 0.944 0.639 CB 1.331 37 residues pruned to eliminate duplicates Z: 14 17.065 1.860 0.427 0.767 1.000 0.692 CB 1.407 14 residues pruned to eliminate duplicates Z: 33 31.550 2.078 0.569 0.690 0.969 0.812 CB 1.484 33 residues pruned to eliminate duplicates Z: 34 33.444 2.016 1.016 0.654 0.939 0.727 CB 1.321 34 residues pruned to eliminate duplicates Z: 15 20.132 2.073 0.569 0.874 0.929 0.714 CA 1.297 15 residues pruned to eliminate duplicates Z: 19 12.860 1.764 0.502 0.569 1.000 0.778 CB 1.071 17 residues pruned to eliminate duplicates Z: 30 30.155 1.926 0.876 0.705 0.966 0.724 CA 1.332 30 residues pruned to eliminate duplicates Z: 28 40.739 2.207 1.279 0.632 0.926 0.704 CB 1.488 28 residues pruned to eliminate duplicates Z: 8 10.656 1.929 0.872 0.711 0.857 0.857 CA 1.074 8 residues pruned to eliminate duplicates Z: 85 50.970 2.056 0.957 0.615 0.917 0.631 CB 1.352 85 residues pruned to eliminate duplicates Z: 27 23.450 1.846 0.897 0.536 0.885 0.577 CA 1.432 27 residues pruned to eliminate duplicates Z: 36 42.934 2.123 1.302 0.598 0.914 0.686 CB 1.479 36 residues pruned to eliminate duplicates Z: 14 31.042 2.128 1.162 0.914 0.923 0.923 CB 1.434 14 residues pruned to eliminate duplicates Z: 10 15.474 1.876 0.893 0.801 1.000 0.889 CA 1.116 10 residues pruned to eliminate duplicates Z: 27 14.175 1.934 0.639 0.403 0.731 0.538 CB 1.329 27 residues pruned to eliminate duplicates Z: 9 21.173 2.145 0.960 0.920 1.000 0.875 CB 1.253 9 residues pruned to eliminate duplicates Z: 53 39.022 2.009 0.915 0.593 0.923 0.692 CB 1.395 53 residues pruned to eliminate duplicates Z: 9 9.068 1.748 0.495 0.581 0.875 0.750 CA 1.297 10 residues pruned to eliminate duplicates Z: 16 28.491 2.016 0.840 0.917 1.000 0.800 CA 1.399 16 residues pruned to eliminate duplicates Z: 17 34.234 2.086 1.102 0.918 0.938 0.625 CA 1.468 17 residues pruned to eliminate duplicates Z: 6 2.582 1.435 -0.003 0.622 1.000 0.400 CB 0.719 Z: 34 16.040 1.778 0.814 0.322 0.818 0.455 CB 1.287 38 residues pruned to eliminate duplicates Z: 8 15.107 1.685 0.855 0.746 1.000 0.714 C 1.465 8 residues pruned to eliminate duplicates Z: 9 13.158 1.940 0.727 0.769 0.875 0.875 CB 1.250 9 residues pruned to eliminate duplicates Z: 27 19.024 1.860 0.757 0.583 0.846 0.615 CB 1.246 27 residues pruned to eliminate duplicates Z: 18 24.355 1.829 0.801 0.903 1.000 0.706 CA 1.279 18 residues pruned to eliminate duplicates Z: 13 15.413 1.976 0.626 0.931 1.000 1.000 CB 0.968 13 residues pruned to eliminate duplicates Z: 15 22.098 1.925 0.769 0.910 1.000 0.786 CA 1.231 15 residues pruned to eliminate duplicates Z: 10 8.294 1.729 0.429 0.756 1.000 0.778 CB 0.890 10 residues pruned to eliminate duplicates Z: 12 15.989 1.719 1.197 0.803 1.000 0.636 CB 0.980 12 residues pruned to eliminate duplicates Z: 12 14.809 1.912 1.083 0.562 0.909 0.545 CB 1.161 12 residues pruned to eliminate duplicates Z: 18 22.526 1.794 0.847 0.872 1.000 0.824 CA 1.202 18 residues pruned to eliminate duplicates Z: 31 16.180 1.953 0.869 0.465 0.833 0.533 CB 1.005 31 residues pruned to eliminate duplicates Z: 39 15.728 1.832 0.610 0.416 0.842 0.526 CB 1.122 39 residues pruned to eliminate duplicates Z: 10 13.078 1.948 0.577 0.843 0.778 0.667 CA 1.358 10 residues pruned to eliminate duplicates Z: 12 17.137 1.983 0.858 0.892 1.000 0.545 CB 1.008 12 residues pruned to eliminate duplicates Z: 14 27.165 1.989 0.849 0.926 1.000 0.769 CB 1.437 14 residues pruned to eliminate duplicates Z: 8 7.614 1.858 0.816 0.476 0.714 0.429 CB 1.224 8 residues pruned to eliminate duplicates Z: 9 11.398 1.776 0.740 0.833 0.875 0.875 CA 1.118 9 residues pruned to eliminate duplicates Z: 33 39.278 2.025 1.104 0.789 0.906 0.594 CB 1.394 33 residues pruned to eliminate duplicates Z: 15 16.585 1.767 0.743 0.853 1.000 0.643 CB 1.064 15 residues pruned to eliminate duplicates Z: 6 6.505 1.455 0.548 0.769 1.000 0.400 CA 1.018 6 residues pruned to eliminate duplicates Z: 17 39.441 2.094 1.530 0.876 1.000 0.688 CB 1.353 17 residues pruned to eliminate duplicates Z: 82 61.707 2.077 1.045 0.674 0.963 0.704 CB 1.428 82 residues pruned to eliminate duplicates Z: 32 17.647 2.091 0.548 0.515 0.806 0.452 CB 1.196 33 residues pruned to eliminate duplicates Z: 9 10.590 1.892 0.588 0.737 0.750 0.500 CA 1.343 9 residues pruned to eliminate duplicates Z: 11 11.385 1.903 0.547 0.518 1.000 0.400 CB 1.201 11 residues pruned to eliminate duplicates Z: 17 16.733 1.656 0.681 0.835 0.938 0.750 CB 1.201 17 residues pruned to eliminate duplicates Z: 15 35.573 2.185 1.376 0.904 0.929 0.786 CB 1.405 15 residues pruned to eliminate duplicates Z: 9 18.114 2.068 0.916 0.908 1.000 0.750 CB 1.148 9 residues pruned to eliminate duplicates Z: 6 5.356 1.577 0.489 0.594 0.800 0.400 CB 1.166 6 residues pruned to eliminate duplicates Z: 13 27.281 2.127 1.013 0.826 0.917 0.583 CA 1.513 13 residues pruned to eliminate duplicates Z: 7 7.359 1.573 0.501 0.574 1.000 0.833 O 1.185 7 residues pruned to eliminate duplicates Z: 7 8.015 2.255 1.008 0.295 0.833 0.500 CB 1.090 7 residues pruned to eliminate duplicates Z: 6 7.484 1.532 0.631 0.866 1.000 1.000 CB 0.981 Z: 15 14.863 1.977 0.341 0.895 0.857 0.786 CA 1.253 15 residues pruned to eliminate duplicates Z: 22 19.753 1.999 0.713 0.536 0.952 0.714 CB 1.276 22 residues pruned to eliminate duplicates Z: 10 18.206 1.936 0.960 0.806 1.000 0.444 CB 1.225 10 residues pruned to eliminate duplicates Z: 10 14.397 2.026 0.475 0.888 1.000 0.889 CB 1.157 10 residues pruned to eliminate duplicates Z: 16 21.469 1.860 0.671 0.874 0.933 0.733 CB 1.391 16 residues pruned to eliminate duplicates Z: 17 20.021 1.760 0.535 0.888 1.000 0.812 CA 1.335 17 residues pruned to eliminate duplicates Z: 10 6.771 1.728 0.846 0.423 0.667 0.444 CA 1.150 7 residues pruned to eliminate duplicates Z: 12 16.353 1.981 0.582 0.919 1.000 1.000 CB 1.108 12 residues pruned to eliminate duplicates Z: 106 58.321 2.043 0.935 0.611 0.914 0.600 CB 1.418 106 residues pruned to eliminate duplicates Z: 6 6.715 1.713 0.803 0.648 0.800 0.600 CB 1.059 Z: 11 12.788 1.995 0.855 0.859 0.800 0.600 CA 1.005 11 residues pruned to eliminate duplicates Z: 16 35.044 2.155 1.265 0.900 0.933 0.667 CB 1.419 16 residues pruned to eliminate duplicates Z: 11 16.277 1.826 0.740 0.827 1.000 0.800 CB 1.221 11 residues pruned to eliminate duplicates Z: 22 31.104 2.185 1.083 0.578 0.905 0.571 CB 1.530 22 residues pruned to eliminate duplicates Z: 8 6.787 1.445 0.587 0.866 1.000 0.857 CB 0.819 6 residues pruned to eliminate duplicates Z: 6 10.018 1.712 0.945 0.682 1.000 0.800 CB 1.139 Z: 12 31.412 2.157 1.388 0.925 0.909 0.909 CB 1.420 12 residues pruned to eliminate duplicates Z: 57 44.213 2.191 1.039 0.588 0.911 0.554 CB 1.335 57 residues pruned to eliminate duplicates Z: 13 17.167 1.975 0.762 0.939 1.000 0.917 CB 0.990 13 residues pruned to eliminate duplicates Z: 67 44.444 2.065 0.927 0.575 0.894 0.652 CB 1.430 67 residues pruned to eliminate duplicates Z: 15 21.354 1.855 0.841 0.895 0.857 0.643 CB 1.397 15 residues pruned to eliminate duplicates Z: 13 13.266 1.662 0.948 0.751 0.833 0.750 CA 1.134 13 residues pruned to eliminate duplicates Z: 14 25.279 2.093 0.825 0.879 1.000 0.692 CA 1.332 14 residues pruned to eliminate duplicates Z: 16 40.268 2.170 1.425 0.919 0.933 0.733 CB 1.491 16 residues pruned to eliminate duplicates Z: 57 47.138 2.081 0.987 0.613 0.929 0.536 CB 1.475 57 residues pruned to eliminate duplicates Z: 28 31.197 2.187 1.014 0.578 0.889 0.704 CB 1.422 28 residues pruned to eliminate duplicates Z: 17 39.083 2.045 1.229 0.941 1.000 0.875 CB 1.487 17 residues pruned to eliminate duplicates Z: 27 29.256 2.014 1.111 0.633 0.923 0.654 CB 1.291 27 residues pruned to eliminate duplicates Z: 39 33.570 1.969 0.789 0.640 1.000 0.816 CB 1.357 39 residues pruned to eliminate duplicates Z: 21 27.464 2.104 1.283 0.824 0.800 0.750 CB 1.207 21 residues pruned to eliminate duplicates Z: 10 10.912 1.826 0.750 0.372 0.889 0.667 CB 1.468 Z: 10 10.297 1.689 0.273 0.806 1.000 0.889 CB 1.222 11 residues pruned to eliminate duplicates Z: 26 25.250 1.995 1.066 0.604 0.960 0.680 CB 1.155 26 residues pruned to eliminate duplicates Z: 10 5.395 1.695 0.206 0.450 0.889 0.667 CB 1.042 Z: 6 3.976 1.865 -0.037 0.703 1.000 0.600 CB 0.822 6 residues pruned to eliminate duplicates Z: 61 38.993 2.013 0.882 0.644 0.883 0.733 CB 1.315 61 residues pruned to eliminate duplicates Z: 8 3.012 1.695 -0.203 0.535 1.000 0.714 N 0.815 Z: 56 51.478 2.084 1.049 0.659 0.964 0.636 CB 1.454 56 residues pruned to eliminate duplicates Z: 16 13.294 1.973 0.554 0.478 0.867 0.600 CB 1.321 16 residues pruned to eliminate duplicates Z: 10 9.560 1.940 0.635 0.407 0.889 0.556 CA 1.245 10 residues pruned to eliminate duplicates Z: 9 16.405 2.118 0.849 0.857 0.875 0.625 CB 1.247 9 residues pruned to eliminate duplicates Z: 12 17.848 2.156 0.894 0.774 0.727 0.545 CA 1.422 12 residues pruned to eliminate duplicates Z: 19 27.580 2.079 0.950 0.810 0.889 0.611 CB 1.377 19 residues pruned to eliminate duplicates Z: 18 19.861 1.800 0.582 0.885 0.941 0.647 CA 1.298 18 residues pruned to eliminate duplicates Z: 14 18.866 2.050 0.942 0.469 0.923 0.538 CA 1.470 14 residues pruned to eliminate duplicates Z: 8 3.374 1.547 -0.155 0.445 0.857 0.714 CB 1.205 Z: 17 15.799 1.747 0.536 0.809 0.938 0.688 CB 1.199 17 residues pruned to eliminate duplicates Z: 20 18.694 2.002 0.816 0.408 0.947 0.526 CB 1.371 20 residues pruned to eliminate duplicates Z: 16 23.399 1.839 0.699 0.945 1.000 0.933 CB 1.339 16 residues pruned to eliminate duplicates Z: 14 17.519 2.026 0.863 0.807 0.846 0.462 CB 1.165 14 residues pruned to eliminate duplicates Z: 45 38.093 2.085 0.932 0.614 0.909 0.636 CB 1.408 45 residues pruned to eliminate duplicates Z: 55 34.862 1.932 0.879 0.605 0.926 0.648 CB 1.277 50 residues pruned to eliminate duplicates Z: 7 3.898 1.558 0.641 0.246 0.833 0.333 CB 1.001 6 residues pruned to eliminate duplicates Z: 15 18.422 1.984 0.504 0.894 0.929 0.714 CA 1.274 15 residues pruned to eliminate duplicates Z: 12 15.350 1.716 0.727 0.807 1.000 0.818 CA 1.195 12 residues pruned to eliminate duplicates Z: 7 4.435 1.886 -0.165 0.510 0.833 0.333 CB 1.366 6 residues pruned to eliminate duplicates Z: 15 33.250 2.185 1.143 0.935 0.929 0.571 CB 1.425 15 residues pruned to eliminate duplicates Z: 19 22.423 1.892 1.088 0.656 0.778 0.556 CB 1.488 19 residues pruned to eliminate duplicates Z: 12 23.298 2.090 1.048 0.899 0.818 0.727 CB 1.434 12 residues pruned to eliminate duplicates Z: 39 36.842 2.077 1.006 0.571 0.921 0.763 CB 1.454 39 residues pruned to eliminate duplicates Z: 8 7.157 1.631 0.329 0.466 1.000 0.429 CB 1.292 8 residues pruned to eliminate duplicates Z: 13 16.912 1.968 0.888 0.895 1.000 0.500 CB 0.941 13 residues pruned to eliminate duplicates Z: 76 60.529 2.108 1.148 0.654 0.933 0.667 CB 1.434 76 residues pruned to eliminate duplicates Z: 10 16.942 2.016 0.382 0.888 1.000 0.556 CA 1.460 10 residues pruned to eliminate duplicates Z: 10 6.434 1.821 0.282 0.255 1.000 0.444 CA 1.218 10 residues pruned to eliminate duplicates Z: 14 32.262 1.922 1.524 0.850 0.923 0.615 CA 1.479 14 residues pruned to eliminate duplicates Z: 16 21.431 1.992 0.456 0.939 1.000 0.800 CA 1.326 16 residues pruned to eliminate duplicates Z: 7 10.884 1.861 0.926 0.637 1.000 0.667 CB 1.090 Z: 16 18.379 1.785 0.564 0.914 1.000 0.800 CA 1.202 16 residues pruned to eliminate duplicates Z: 33 39.451 2.134 1.173 0.636 0.938 0.688 CB 1.412 33 residues pruned to eliminate duplicates Z: 14 10.860 1.739 0.299 0.893 0.923 0.692 CB 1.037 14 residues pruned to eliminate duplicates Z: 9 25.929 2.099 1.248 0.901 1.000 0.750 CB 1.387 9 residues pruned to eliminate duplicates Z: 63 48.143 2.072 0.901 0.614 0.968 0.629 CB 1.441 63 residues pruned to eliminate duplicates Z: 14 32.542 2.168 1.111 0.872 0.923 0.615 CA 1.557 14 residues pruned to eliminate duplicates Z: 8 7.179 1.563 1.179 0.827 0.714 0.571 CB 0.840 8 residues pruned to eliminate duplicates Z: 16 41.746 2.257 1.326 0.923 1.000 0.800 CB 1.443 16 residues pruned to eliminate duplicates Z: 14 22.902 1.963 0.789 0.876 1.000 0.692 CB 1.314 14 residues pruned to eliminate duplicates Z: 78 48.367 2.102 0.787 0.601 0.922 0.610 CB 1.446 78 residues pruned to eliminate duplicates Z: 8 8.791 1.676 0.735 0.754 0.857 0.857 CB 1.063 8 residues pruned to eliminate duplicates Z: 17 21.207 2.054 0.800 0.785 0.875 0.438 CB 1.275 17 residues pruned to eliminate duplicates Z: 19 22.462 1.901 0.955 0.742 0.944 0.556 CB 1.214 19 residues pruned to eliminate duplicates Z: 19 22.435 2.019 0.814 0.545 0.944 0.722 CA 1.464 19 residues pruned to eliminate duplicates Z: 10 11.731 1.528 0.923 0.863 1.000 1.000 CA 0.976 10 residues pruned to eliminate duplicates Z: 15 24.885 1.993 1.038 0.907 0.929 0.714 CA 1.253 15 residues pruned to eliminate duplicates Z: 10 12.843 1.892 0.401 0.855 1.000 0.667 CB 1.192 10 residues pruned to eliminate duplicates Z: 6 3.612 1.518 0.343 0.360 0.800 0.400 N 1.151 Z: 31 23.786 1.952 0.643 0.556 0.900 0.600 CB 1.425 31 residues pruned to eliminate duplicates Z: 40 36.053 2.065 1.032 0.648 0.897 0.692 CB 1.335 40 residues pruned to eliminate duplicates Z: 14 25.441 2.112 0.587 0.947 1.000 0.923 CB 1.454 14 residues pruned to eliminate duplicates Z: 15 14.774 1.653 0.483 0.911 0.929 0.929 CA 1.229 15 residues pruned to eliminate duplicates Z: 16 38.158 2.184 1.349 0.894 1.000 0.600 CB 1.377 16 residues pruned to eliminate duplicates Z: 18 26.573 2.234 1.255 0.546 0.824 0.647 CB 1.485 18 residues pruned to eliminate duplicates Z: 43 30.385 1.987 0.664 0.644 0.929 0.643 CB 1.336 43 residues pruned to eliminate duplicates Z: 10 17.869 1.986 0.464 0.928 1.000 1.000 CA 1.435 10 residues pruned to eliminate duplicates Z: 70 45.133 1.994 0.917 0.612 0.928 0.652 CA 1.378 70 residues pruned to eliminate duplicates Z: 10 4.530 1.594 0.151 0.493 0.778 0.667 CB 1.066 9 residues pruned to eliminate duplicates Z: 18 19.011 1.816 0.627 0.841 0.941 0.765 CA 1.236 18 residues pruned to eliminate duplicates Z: 7 8.732 1.646 0.667 0.903 1.000 1.000 CB 0.926 Z: 14 16.781 1.678 0.489 0.890 1.000 0.538 CB 1.340 14 residues pruned to eliminate duplicates Z: 8 5.493 1.744 0.042 0.709 0.857 0.714 CB 1.103 Z: 6 2.412 1.406 0.197 0.636 1.000 0.800 N 0.564 Z: 14 18.064 1.748 0.774 0.909 1.000 0.769 CB 1.147 14 residues pruned to eliminate duplicates Z: 38 34.716 2.088 0.975 0.584 0.919 0.622 CB 1.389 38 residues pruned to eliminate duplicates Z: 20 28.239 1.936 1.080 0.761 0.947 0.789 CB 1.346 20 residues pruned to eliminate duplicates Z: 84 50.133 2.027 0.808 0.645 0.928 0.675 CB 1.413 84 residues pruned to eliminate duplicates Z: 31 46.226 2.195 1.256 0.690 0.967 0.667 CB 1.482 31 residues pruned to eliminate duplicates Z: 15 30.437 2.048 0.989 0.905 0.929 0.571 CA 1.531 15 residues pruned to eliminate duplicates Z: 52 47.455 2.100 1.100 0.640 0.922 0.647 CB 1.434 52 residues pruned to eliminate duplicates Z: 19 28.174 2.193 1.091 0.497 0.889 0.667 CA 1.634 19 residues pruned to eliminate duplicates Z: 7 7.698 1.568 0.629 0.552 1.000 0.667 CB 1.170 7 residues pruned to eliminate duplicates Z: 53 36.561 2.012 0.890 0.577 0.885 0.538 CB 1.400 53 residues pruned to eliminate duplicates Z: 16 28.720 1.904 0.955 0.913 1.000 0.533 CA 1.409 16 residues pruned to eliminate duplicates Z: 10 13.029 2.000 0.283 0.827 0.889 0.556 CB 1.435 10 residues pruned to eliminate duplicates Z: 16 42.820 2.253 1.530 0.946 1.000 0.733 CB 1.342 16 residues pruned to eliminate duplicates Z: 13 16.802 2.012 0.770 0.480 0.917 0.583 CB 1.516 13 residues pruned to eliminate duplicates Z: 16 25.426 1.965 0.743 0.897 1.000 0.467 CA 1.372 16 residues pruned to eliminate duplicates Z: 6 4.562 1.758 0.177 0.711 0.800 0.600 CA 1.018 6 residues pruned to eliminate duplicates Z: 14 18.313 1.905 0.909 0.804 0.923 0.692 CA 1.160 14 residues pruned to eliminate duplicates Z: 7 2.108 1.429 0.131 0.538 0.667 0.667 N 0.770 Z: 10 17.511 2.133 0.600 0.747 1.000 0.778 CA 1.373 10 residues pruned to eliminate duplicates Z: 12 5.478 1.514 0.317 0.416 0.818 0.545 CA 1.105 7 1.445 1.416 0.577 0.371 0.500 0.333 CB 0.606 ? Z: 19 36.024 2.369 0.996 0.581 1.000 0.667 CB 1.661 19 residues pruned to eliminate duplicates Z: 19 17.916 1.927 0.735 0.556 0.944 0.667 CB 1.267 19 residues pruned to eliminate duplicates Z: 19 19.436 1.967 1.100 0.431 0.889 0.611 CB 1.341 19 residues pruned to eliminate duplicates Z: 7 5.797 1.456 0.609 0.873 1.000 1.000 CB 0.736 7 residues pruned to eliminate duplicates Z: 14 13.803 1.763 0.360 0.937 1.000 1.000 CB 1.111 14 residues pruned to eliminate duplicates Z: 8 4.266 1.684 -0.017 0.415 0.857 0.571 CA 1.242 6 residues pruned to eliminate duplicates Z: 10 18.695 2.002 0.693 0.909 1.000 1.000 CB 1.305 9 residues pruned to eliminate duplicates Z: 119 60.255 2.035 0.865 0.625 0.941 0.602 CB 1.381 119 residues pruned to eliminate duplicates Z: 11 8.201 1.576 0.245 0.733 1.000 0.700 CB 1.072 19 residues pruned to eliminate duplicates Z: 18 16.338 1.767 0.632 0.820 0.882 0.647 CB 1.179 18 residues pruned to eliminate duplicates Z: 33 36.135 2.134 1.045 0.609 0.875 0.500 CB 1.508 33 residues pruned to eliminate duplicates Z: 60 42.278 2.070 0.747 0.587 0.966 0.661 CB 1.449 60 residues pruned to eliminate duplicates Z: 13 19.483 2.073 0.927 0.555 0.917 0.583 CB 1.456 19 residues pruned to eliminate duplicates Z: 16 24.847 1.964 0.979 0.605 1.000 0.733 CA 1.493 16 residues pruned to eliminate duplicates Z: 17 11.731 1.976 0.747 0.388 0.875 0.562 CB 1.094 17 residues pruned to eliminate duplicates Z: 10 14.594 1.586 0.862 0.862 1.000 0.778 CB 1.210 10 residues pruned to eliminate duplicates Z: 67 53.876 2.069 1.099 0.660 0.939 0.621 CB 1.402 67 residues pruned to eliminate duplicates Z: 69 57.264 2.206 1.117 0.578 0.897 0.632 CB 1.537 69 residues pruned to eliminate duplicates Z: 21 30.500 2.105 1.142 0.510 0.950 0.850 CB 1.577 21 residues pruned to eliminate duplicates Z: 6 3.434 1.697 0.547 0.489 0.600 0.400 CB 0.986 6 residues pruned to eliminate duplicates Z: 15 28.218 2.040 1.330 0.834 0.857 0.643 CA 1.387 15 residues pruned to eliminate duplicates Z: 10 3.805 1.699 0.156 0.208 0.778 0.333 CB 1.171 10 residues pruned to eliminate duplicates Z: 35 40.002 2.156 1.133 0.611 0.882 0.706 CB 1.521 35 residues pruned to eliminate duplicates Z: 11 3.924 1.421 0.523 0.521 0.600 0.500 CB 0.937 8 residues pruned to eliminate duplicates Z: 23 29.793 2.146 0.938 0.628 0.909 0.636 CB 1.489 23 residues pruned to eliminate duplicates Z: 16 31.610 1.999 1.058 0.916 1.000 0.733 CA 1.402 16 residues pruned to eliminate duplicates Z: 10 4.263 1.610 0.549 0.182 0.778 0.667 CB 1.074 10 residues pruned to eliminate duplicates Z: 6 3.849 1.569 0.965 0.433 0.600 0.400 CA 0.996 Z: 9 5.525 1.550 0.373 0.702 0.750 0.750 CB 1.018 9 residues pruned to eliminate duplicates Z: 14 34.835 2.206 1.341 0.935 0.923 0.769 CB 1.413 14 residues pruned to eliminate duplicates Z: 15 13.737 1.726 0.539 0.921 1.000 0.929 CB 0.973 15 residues pruned to eliminate duplicates Z: 16 29.189 2.061 0.922 0.927 1.000 0.667 CB 1.334 16 residues pruned to eliminate duplicates Z: 13 17.519 2.001 0.513 0.912 1.000 0.667 CA 1.183 13 residues pruned to eliminate duplicates Z: 6 3.710 1.369 0.016 0.856 1.000 0.800 CA 0.880 6 residues pruned to eliminate duplicates Z: 74 51.385 2.071 0.953 0.621 0.932 0.589 CB 1.424 74 residues pruned to eliminate duplicates Z: 14 24.328 2.057 0.543 0.915 1.000 0.769 CA 1.502 14 residues pruned to eliminate duplicates Z: 8 4.447 1.707 0.168 0.526 0.857 0.429 CB 0.959 Z: 18 26.205 2.092 0.850 0.718 0.941 0.588 CA 1.432 18 residues pruned to eliminate duplicates Z: 10 20.136 1.896 0.999 0.821 1.000 0.889 CA 1.341 10 residues pruned to eliminate duplicates Z: 31 33.096 2.082 1.181 0.569 0.933 0.667 CB 1.334 31 residues pruned to eliminate duplicates Z: 13 27.774 2.093 0.894 0.898 1.000 0.833 CA 1.447 13 residues pruned to eliminate duplicates Z: 17 16.845 1.772 0.721 0.683 0.875 0.688 CB 1.333 17 residues pruned to eliminate duplicates Z: 7 7.116 1.764 0.454 0.770 1.000 1.000 CB 0.892 7 residues pruned to eliminate duplicates Z: 8 7.406 1.666 0.075 0.846 1.000 0.714 CA 1.161 8 residues pruned to eliminate duplicates Z: 17 43.388 2.102 1.441 0.935 1.000 0.750 CB 1.473 17 residues pruned to eliminate duplicates Z: 14 26.824 2.100 1.002 0.876 0.846 0.615 CB 1.520 14 residues pruned to eliminate duplicates Z: 36 39.969 2.079 1.111 0.641 0.857 0.600 CB 1.574 36 residues pruned to eliminate duplicates Z: 16 21.155 2.084 0.916 0.527 1.000 0.733 CB 1.333 16 residues pruned to eliminate duplicates Z: 37 32.538 1.936 0.973 0.622 0.917 0.611 CB 1.381 37 residues pruned to eliminate duplicates Z: 15 6.614 1.637 0.510 0.448 0.929 0.571 CB 0.812 15 residues pruned to eliminate duplicates Z: 8 14.644 1.793 1.029 0.873 1.000 0.714 CB 1.108 8 residues pruned to eliminate duplicates Z: 10 4.069 1.482 0.247 0.271 0.778 0.556 N 1.224 Z: 16 15.945 1.698 0.510 0.886 0.933 0.533 CA 1.242 16 residues pruned to eliminate duplicates Z: 82 50.300 2.067 0.970 0.590 0.901 0.531 CB 1.398 82 residues pruned to eliminate duplicates Z: 36 34.123 1.959 1.037 0.673 0.886 0.571 CA 1.391 36 residues pruned to eliminate duplicates Z: 13 14.455 2.043 0.650 0.544 0.833 0.583 CB 1.422 13 residues pruned to eliminate duplicates Z: 14 16.179 1.724 0.532 0.926 1.000 0.923 CB 1.191 14 residues pruned to eliminate duplicates Z: 13 15.832 1.777 0.811 0.870 0.917 0.750 CB 1.131 13 residues pruned to eliminate duplicates Z: 11 5.190 1.620 0.170 0.481 0.800 0.500 CB 1.103 Z: 14 19.528 2.033 0.638 0.892 0.923 0.615 CA 1.266 14 residues pruned to eliminate duplicates Z: 18 33.467 1.960 1.172 0.925 1.000 0.588 CB 1.338 18 residues pruned to eliminate duplicates Z: 6 6.719 1.838 0.322 0.447 1.000 0.400 CB 1.305 6 residues pruned to eliminate duplicates Z: 10 12.088 1.758 0.731 0.772 0.889 0.778 CB 1.171 10 residues pruned to eliminate duplicates Z: 13 10.143 1.905 0.650 0.488 0.917 0.500 CB 1.028 13 residues pruned to eliminate duplicates Z: 10 11.121 2.004 0.564 0.481 0.778 0.778 CB 1.551 10 residues pruned to eliminate duplicates Z: 53 38.936 2.047 0.789 0.645 0.923 0.750 CB 1.396 53 residues pruned to eliminate duplicates Z: 24 26.835 2.051 0.830 0.584 0.913 0.696 CA 1.506 24 residues pruned to eliminate duplicates Z: 15 26.818 1.990 0.755 0.906 1.000 0.714 CA 1.460 15 residues pruned to eliminate duplicates Z: 32 13.102 1.801 0.578 0.298 0.806 0.516 CB 1.287 32 residues pruned to eliminate duplicates Z: 64 47.746 2.014 1.113 0.599 0.952 0.667 CB 1.351 64 residues pruned to eliminate duplicates Z: 15 17.567 1.866 0.419 0.879 0.929 0.857 CB 1.385 15 residues pruned to eliminate duplicates Z: 16 22.973 1.985 0.805 0.919 1.000 0.667 CA 1.166 16 residues pruned to eliminate duplicates Z: 9 7.671 1.671 0.284 0.654 0.875 0.875 CB 1.251 Z: 15 14.110 1.759 0.249 0.905 1.000 0.857 CB 1.222 15 residues pruned to eliminate duplicates Z: 6 4.388 1.501 -0.031 0.730 1.000 0.600 N 1.097 6 residues pruned to eliminate duplicates Z: 7 4.526 1.640 0.331 0.436 0.833 0.667 CB 1.086 Z: 8 6.554 1.848 0.646 0.382 0.714 0.429 CB 1.293 8 residues pruned to eliminate duplicates Z: 8 6.143 1.850 -0.099 0.636 1.000 0.714 CB 1.226 6 residues pruned to eliminate duplicates Z: 39 34.620 1.999 1.033 0.575 0.974 0.632 CB 1.320 39 residues pruned to eliminate duplicates Z: 12 14.686 1.967 0.620 0.660 0.909 0.636 CB 1.318 12 residues pruned to eliminate duplicates Z: 13 14.181 1.917 0.531 0.905 1.000 0.833 CB 0.992 13 residues pruned to eliminate duplicates Z: 8 5.903 1.350 0.236 0.769 1.000 0.857 CB 1.054 Z: 14 21.128 1.872 0.797 0.875 0.923 0.538 CB 1.373 14 residues pruned to eliminate duplicates Z: 17 34.705 2.046 1.060 0.925 0.938 0.625 CB 1.541 17 residues pruned to eliminate duplicates Z: 12 26.709 2.111 1.058 0.923 0.909 0.909 CB 1.433 12 residues pruned to eliminate duplicates Z: 16 13.599 1.735 0.721 0.819 0.800 0.400 CB 1.114 16 residues pruned to eliminate duplicates Z: 53 37.330 1.976 0.891 0.554 0.942 0.558 CB 1.395 53 residues pruned to eliminate duplicates Z: 13 7.248 1.491 0.410 0.442 0.917 0.583 CB 1.153 13 residues pruned to eliminate duplicates Z: 13 20.254 1.893 1.133 0.604 0.917 0.750 CB 1.431 13 residues pruned to eliminate duplicates Z: 7 7.540 1.936 0.572 0.407 0.833 0.500 CB 1.339 7 residues pruned to eliminate duplicates Z: 61 53.552 2.106 1.138 0.691 0.883 0.600 CB 1.459 61 residues pruned to eliminate duplicates Z: 65 49.508 2.054 0.795 0.675 0.953 0.703 CB 1.499 65 residues pruned to eliminate duplicates Z: 7 5.535 1.359 0.100 0.861 1.000 1.000 CA 1.111 7 residues pruned to eliminate duplicates Z: 68 62.078 2.184 0.981 0.688 0.985 0.731 CB 1.497 68 residues pruned to eliminate duplicates Z: 81 44.402 1.980 0.832 0.611 0.900 0.588 CB 1.369 81 residues pruned to eliminate duplicates Z: 14 11.193 1.788 0.829 0.353 0.846 0.462 CA 1.316 14 residues pruned to eliminate duplicates Z: 8 12.047 1.830 0.628 0.672 1.000 1.000 CA 1.303 Z: 20 16.580 1.959 0.842 0.396 0.895 0.526 CB 1.315 20 residues pruned to eliminate duplicates Z: 9 12.592 1.764 0.739 0.794 0.875 0.500 CB 1.282 9 residues pruned to eliminate duplicates Z: 12 7.935 1.795 0.484 0.441 0.909 0.636 CB 1.050 18 residues pruned to eliminate duplicates Z: 6 4.021 1.772 0.263 0.591 1.000 0.200 CB 0.737 6 residues pruned to eliminate duplicates Z: 14 17.862 1.828 0.702 0.912 1.000 0.846 CB 1.128 14 residues pruned to eliminate duplicates Z: 9 7.946 1.788 0.536 0.778 0.750 0.625 CB 1.067 9 residues pruned to eliminate duplicates Z: 15 25.072 2.017 1.069 0.910 0.929 0.857 CB 1.227 15 residues pruned to eliminate duplicates Z: 9 23.578 2.090 1.057 0.884 1.000 1.000 CB 1.402 9 residues pruned to eliminate duplicates Z: 7 4.610 1.633 0.804 0.555 0.833 0.667 CA 0.726 7 residues pruned to eliminate duplicates Z: 34 30.104 2.107 0.851 0.585 0.848 0.576 CA 1.459 34 residues pruned to eliminate duplicates Z: 19 28.514 2.000 0.838 0.785 1.000 0.889 CB 1.423 19 residues pruned to eliminate duplicates Z: 28 34.979 2.092 0.975 0.545 0.963 0.593 CB 1.620 28 residues pruned to eliminate duplicates Z: 8 2.496 1.558 0.014 0.441 0.714 0.429 CB 0.888 5 residues pruned to eliminate duplicates Z: 22 16.877 2.018 0.681 0.523 0.905 0.667 CB 1.173 22 residues pruned to eliminate duplicates Z: 12 13.578 1.777 0.692 0.666 1.000 0.727 CB 1.167 12 residues pruned to eliminate duplicates Z: 7 4.005 1.609 0.397 0.269 0.667 0.500 N 1.418 7 residues pruned to eliminate duplicates Z: 8 22.962 2.114 1.009 0.914 1.000 1.000 CA 1.445 8 residues pruned to eliminate duplicates Z: 16 15.551 1.976 0.820 0.436 0.800 0.533 CA 1.491 16 residues pruned to eliminate duplicates Z: 37 38.844 2.205 0.809 0.598 0.944 0.639 CB 1.566 37 residues pruned to eliminate duplicates Z: 8 2.160 1.526 0.308 0.205 0.571 0.286 CB 1.016 Z: 13 3.756 1.463 0.130 0.327 0.833 0.417 C 0.952 Z: 15 29.671 2.113 0.844 0.915 1.000 0.714 CB 1.438 15 residues pruned to eliminate duplicates Z: 8 4.008 1.725 0.417 0.313 0.714 0.571 N 1.067 8 residues pruned to eliminate duplicates Z: 59 40.871 2.177 0.780 0.583 0.914 0.672 CB 1.400 59 residues pruned to eliminate duplicates Z: 12 39.136 2.346 1.204 0.921 1.000 0.727 CB 1.606 12 residues pruned to eliminate duplicates Z: 7 8.368 1.915 0.166 0.763 0.833 0.500 CB 1.453 7 residues pruned to eliminate duplicates Z: 19 24.046 2.046 0.858 0.515 1.000 0.556 CB 1.469 19 residues pruned to eliminate duplicates Z: 16 17.120 1.887 0.803 0.567 0.933 0.600 CA 1.304 16 residues pruned to eliminate duplicates Z: 15 11.893 1.853 0.693 0.466 0.929 0.571 CB 1.130 15 residues pruned to eliminate duplicates Z: 17 11.617 1.989 0.593 0.460 0.750 0.438 CB 1.273 17 residues pruned to eliminate duplicates Z: 87 57.702 2.047 0.906 0.629 0.977 0.674 CB 1.446 89 residues pruned to eliminate duplicates 6 1.164 1.323 -0.003 0.305 0.800 0.400 N 0.613 ? Z: 29 28.301 2.055 1.129 0.524 0.929 0.607 CB 1.286 29 residues pruned to eliminate duplicates Z: 7 5.632 1.658 0.209 0.865 1.000 1.000 CB 0.840 7 residues pruned to eliminate duplicates Z: 6 3.996 1.715 0.359 0.300 0.800 0.600 CA 1.198 6 residues pruned to eliminate duplicates Z: 31 15.645 1.851 0.502 0.441 0.767 0.500 CB 1.425 31 residues pruned to eliminate duplicates Z: 14 21.371 1.922 0.727 0.892 1.000 0.846 CA 1.282 14 residues pruned to eliminate duplicates Z: 10 6.282 1.425 0.357 0.755 0.889 0.444 CB 0.970 8 residues pruned to eliminate duplicates Z: 13 17.107 1.814 0.650 0.937 1.000 0.667 CB 1.148 13 residues pruned to eliminate duplicates Z: 8 6.154 1.382 0.207 0.875 1.000 0.857 CA 1.014 9 residues pruned to eliminate duplicates Z: 10 13.218 1.806 0.670 0.830 0.889 0.778 CB 1.236 10 residues pruned to eliminate duplicates Z: 15 26.859 2.105 1.225 0.900 1.000 0.500 CB 1.095 15 residues pruned to eliminate duplicates Z: 27 22.254 1.968 0.972 0.571 0.808 0.308 CB 1.300 27 residues pruned to eliminate duplicates Z: 12 42.021 2.237 1.300 0.904 1.000 0.727 CB 1.754 12 residues pruned to eliminate duplicates Z: 10 6.815 1.617 0.297 0.482 0.889 0.556 CB 1.241 10 residues pruned to eliminate duplicates Z: 6 4.056 1.635 0.690 0.482 0.600 0.400 CB 1.114 6 residues pruned to eliminate duplicates Z: 8 19.610 2.121 1.184 0.856 1.000 0.857 CB 1.180 8 residues pruned to eliminate duplicates Z: 12 19.903 2.075 1.094 0.646 0.909 0.727 CB 1.326 12 residues pruned to eliminate duplicates Z: 17 19.449 1.740 0.668 0.840 1.000 0.812 CB 1.250 17 residues pruned to eliminate duplicates Z: 12 8.559 1.921 0.604 0.393 0.818 0.545 CB 1.146 12 residues pruned to eliminate duplicates Z: 25 33.128 2.108 1.144 0.621 0.875 0.625 CB 1.525 25 residues pruned to eliminate duplicates Z: 35 17.100 1.747 0.552 0.497 0.941 0.706 CB 1.153 29 residues pruned to eliminate duplicates Z: 13 8.554 1.761 0.755 0.330 0.917 0.417 CB 1.050 13 residues pruned to eliminate duplicates Z: 9 3.186 1.450 0.440 0.280 0.750 0.375 CB 0.922 21 residues pruned to eliminate duplicates Z: 67 46.944 2.208 0.935 0.590 0.879 0.576 CB 1.412 67 residues pruned to eliminate duplicates Z: 7 10.331 1.722 0.504 0.864 1.000 0.667 CA 1.194 7 residues pruned to eliminate duplicates Z: 9 9.968 1.826 0.810 0.739 0.875 0.875 CA 0.983 9 residues pruned to eliminate duplicates Z: 8 5.679 1.958 0.465 0.291 0.857 0.571 CB 1.104 8 residues pruned to eliminate duplicates Z: 8 3.889 1.460 0.201 0.663 1.000 0.571 CB 0.721 Z: 15 8.927 1.550 0.839 0.416 0.786 0.500 CB 1.164 10 residues pruned to eliminate duplicates Z: 8 17.229 2.070 0.708 0.888 1.000 1.000 CB 1.327 8 residues pruned to eliminate duplicates Z: 108 60.559 2.062 1.011 0.607 0.897 0.654 CB 1.422 108 residues pruned to eliminate duplicates Z: 29 21.145 1.995 0.816 0.427 0.893 0.571 CB 1.333 29 residues pruned to eliminate duplicates Z: 8 10.601 2.073 0.434 0.724 0.857 0.714 CB 1.286 8 residues pruned to eliminate duplicates Z: 48 41.262 2.088 1.064 0.568 0.872 0.638 CB 1.499 48 residues pruned to eliminate duplicates Z: 15 14.729 1.709 0.833 0.854 0.929 0.500 CB 0.999 15 residues pruned to eliminate duplicates Z: 85 43.943 2.025 0.758 0.613 0.905 0.667 CB 1.338 85 residues pruned to eliminate duplicates Z: 6 2.508 1.450 -0.008 0.607 0.600 0.600 C 1.175 Z: 7 9.269 1.823 0.482 0.810 0.833 0.500 CA 1.283 7 residues pruned to eliminate duplicates Z: 7 9.118 1.769 0.386 0.571 1.000 0.667 CA 1.418 7 residues pruned to eliminate duplicates Z: 10 4.107 1.651 0.326 0.364 1.000 0.667 CB 0.724 10 residues pruned to eliminate duplicates Z: 7 7.255 1.852 0.702 0.711 1.000 0.833 CB 0.776 7 residues pruned to eliminate duplicates Z: 46 36.337 2.032 0.915 0.609 0.956 0.600 CB 1.313 46 residues pruned to eliminate duplicates Z: 8 4.980 1.625 0.118 0.553 0.857 0.714 CB 1.147 Z: 9 9.753 1.842 0.771 0.729 0.875 0.625 CB 0.983 8 residues pruned to eliminate duplicates Z: 19 15.447 1.933 0.704 0.484 0.833 0.500 CB 1.348 19 residues pruned to eliminate duplicates Z: 84 60.204 2.106 0.983 0.624 0.964 0.614 CB 1.460 84 residues pruned to eliminate duplicates Z: 7 2.253 1.255 0.516 0.393 0.667 0.333 CA 0.812 Z: 63 50.273 2.068 1.102 0.617 0.952 0.629 CB 1.382 63 residues pruned to eliminate duplicates Z: 10 18.608 1.854 0.747 0.852 1.000 0.444 CB 1.417 10 residues pruned to eliminate duplicates Z: 16 37.351 2.080 1.136 0.920 1.000 0.667 CB 1.529 16 residues pruned to eliminate duplicates Z: 11 14.916 2.014 0.602 0.847 1.000 0.700 CB 1.085 11 residues pruned to eliminate duplicates Z: 14 27.317 2.045 1.232 0.905 0.923 0.462 CA 1.280 14 residues pruned to eliminate duplicates Z: 34 46.456 2.186 1.279 0.610 0.970 0.636 CB 1.507 34 residues pruned to eliminate duplicates Z: 7 2.842 1.526 0.214 0.504 0.667 0.500 CB 0.936 Z: 19 25.116 2.134 1.271 0.523 1.000 0.611 CB 1.194 19 residues pruned to eliminate duplicates Z: 33 39.178 2.182 1.095 0.630 0.906 0.594 CB 1.479 33 residues pruned to eliminate duplicates Z: 7 4.285 1.602 0.552 0.606 0.833 0.667 CB 0.764 7 residues pruned to eliminate duplicates Z: 9 3.494 1.549 0.223 0.434 0.875 0.625 CB 0.798 9 residues pruned to eliminate duplicates Z: 11 7.831 1.508 0.591 0.858 1.000 0.900 CB 0.760 11 residues pruned to eliminate duplicates Z: 41 36.698 2.078 1.058 0.552 0.875 0.625 CB 1.474 41 residues pruned to eliminate duplicates Z: 16 15.048 1.660 0.630 0.868 1.000 0.667 CB 1.049 16 residues pruned to eliminate duplicates Z: 10 11.707 1.878 0.364 0.577 0.889 0.667 CA 1.592 10 residues pruned to eliminate duplicates Z: 6 6.678 1.862 0.437 0.741 0.800 0.600 CA 1.124 6 residues pruned to eliminate duplicates Z: 6 3.733 1.854 0.462 0.351 0.600 0.400 CB 1.206 6 residues pruned to eliminate duplicates Z: 65 51.676 2.202 1.080 0.565 0.938 0.578 CB 1.413 65 residues pruned to eliminate duplicates Z: 8 15.576 1.815 0.908 0.773 1.000 1.000 CA 1.335 11 residues pruned to eliminate duplicates Z: 20 20.412 2.023 0.696 0.494 0.947 0.421 CB 1.449 20 residues pruned to eliminate duplicates Z: 17 13.393 1.817 0.367 0.573 1.000 0.875 CB 1.256 17 residues pruned to eliminate duplicates Z: 36 26.965 1.919 0.649 0.706 0.943 0.657 CB 1.266 36 residues pruned to eliminate duplicates Z: 41 27.252 2.027 0.797 0.611 0.950 0.700 CB 1.121 41 residues pruned to eliminate duplicates Z: 38 36.918 2.126 0.942 0.591 0.946 0.622 CB 1.424 38 residues pruned to eliminate duplicates Z: 14 11.934 1.917 0.755 0.513 0.769 0.615 CB 1.263 14 residues pruned to eliminate duplicates Z: 9 9.085 1.761 0.949 0.717 0.875 0.750 CA 0.878 9 residues pruned to eliminate duplicates Z: 6 3.940 1.490 0.701 0.288 0.800 0.600 C 1.103 5 residues pruned to eliminate duplicates Z: 24 25.531 2.205 0.893 0.597 0.913 0.522 CB 1.273 24 residues pruned to eliminate duplicates Z: 12 12.784 1.991 0.370 0.714 0.909 0.364 CB 1.281 12 residues pruned to eliminate duplicates Z: 9 14.776 1.714 0.880 0.835 1.000 0.625 CB 1.215 9 residues pruned to eliminate duplicates Z: 10 11.113 1.887 0.768 0.820 0.889 0.778 CB 0.946 10 residues pruned to eliminate duplicates Z: 15 15.105 1.716 0.901 0.853 0.929 0.714 CB 0.985 15 residues pruned to eliminate duplicates Z: 19 14.446 1.954 0.662 0.450 0.833 0.556 CB 1.324 15 residues pruned to eliminate duplicates Z: 15 6.234 1.701 0.477 0.351 0.786 0.500 CB 0.991 15 residues pruned to eliminate duplicates Z: 16 15.145 1.845 0.886 0.554 0.800 0.600 CB 1.332 16 residues pruned to eliminate duplicates Z: 60 54.390 2.168 1.114 0.601 0.932 0.593 CB 1.505 60 residues pruned to eliminate duplicates Z: 20 15.727 1.906 0.580 0.495 0.947 0.579 CB 1.270 20 residues pruned to eliminate duplicates Z: 12 12.538 1.938 0.426 0.596 1.000 0.545 CB 1.247 Z: 11 18.975 2.004 0.761 0.865 1.000 0.800 CB 1.245 11 residues pruned to eliminate duplicates Z: 7 9.409 1.745 0.259 0.838 1.000 1.000 CA 1.307 7 residues pruned to eliminate duplicates Z: 14 29.252 2.164 1.119 0.902 1.000 0.923 CA 1.262 14 residues pruned to eliminate duplicates Z: 35 21.846 1.966 0.659 0.567 0.882 0.559 CB 1.221 35 residues pruned to eliminate duplicates Z: 7 7.228 1.657 0.399 0.600 0.833 0.500 CB 1.389 Z: 14 20.755 1.736 0.807 0.925 1.000 0.769 CA 1.288 14 residues pruned to eliminate duplicates Z: 102 64.102 2.052 1.047 0.671 0.960 0.604 CB 1.351 102 residues pruned to eliminate duplicates Z: 7 8.282 1.577 0.662 0.859 1.000 0.333 CB 0.949 7 residues pruned to eliminate duplicates Z: 9 7.939 1.634 0.498 0.514 1.000 0.375 CB 1.132 9 residues pruned to eliminate duplicates Z: 15 26.084 2.042 0.736 0.947 1.000 0.929 CA 1.360 15 residues pruned to eliminate duplicates Z: 30 37.734 2.048 1.036 0.625 0.966 0.586 CB 1.547 30 residues pruned to eliminate duplicates Z: 9 8.903 1.701 0.548 0.757 0.875 0.750 CB 1.086 9 residues pruned to eliminate duplicates Z: 23 14.995 1.983 0.793 0.407 0.727 0.591 CB 1.363 23 residues pruned to eliminate duplicates Z: 6 8.814 1.848 0.638 0.653 1.000 0.600 CB 1.129 6 residues pruned to eliminate duplicates Z: 6 3.632 1.490 0.355 0.462 0.800 0.400 C 1.046 6 residues pruned to eliminate duplicates Z: 10 17.489 2.121 0.705 0.851 1.000 1.000 CB 1.193 10 residues pruned to eliminate duplicates Z: 35 35.141 2.090 0.856 0.715 0.941 0.765 CB 1.358 35 residues pruned to eliminate duplicates Z: 44 34.775 2.044 0.946 0.641 0.860 0.605 CB 1.357 44 residues pruned to eliminate duplicates Z: 23 11.919 1.734 0.558 0.470 0.818 0.545 CB 1.185 23 residues pruned to eliminate duplicates Z: 60 47.140 2.076 0.966 0.551 0.949 0.695 CB 1.508 60 residues pruned to eliminate duplicates Z: 11 4.375 1.601 0.524 0.315 0.600 0.500 O 1.160 Z: 11 17.024 2.054 0.792 0.836 1.000 0.900 CB 1.096 11 residues pruned to eliminate duplicates Z: 9 14.963 2.015 0.783 0.742 0.875 0.625 CA 1.355 9 residues pruned to eliminate duplicates Z: 12 3.361 1.349 0.156 0.374 0.727 0.545 N 1.023 Z: 24 21.759 1.959 0.638 0.519 1.000 0.696 CB 1.386 24 residues pruned to eliminate duplicates Z: 11 3.987 1.404 0.485 0.261 0.900 0.300 CB 0.883 11 residues pruned to eliminate duplicates Z: 20 24.114 2.103 0.901 0.669 0.842 0.632 CB 1.406 20 residues pruned to eliminate duplicates Z: 12 12.342 1.824 0.708 0.777 0.909 0.636 CB 1.029 12 residues pruned to eliminate duplicates Z: 29 33.974 2.157 1.013 0.582 0.929 0.679 CB 1.472 29 residues pruned to eliminate duplicates Z: 13 5.038 1.620 0.713 0.285 0.667 0.333 CB 1.002 13 residues pruned to eliminate duplicates Z: 9 11.144 1.717 0.418 0.801 1.000 0.750 CB 1.244 9 residues pruned to eliminate duplicates Z: 29 20.951 1.916 0.845 0.411 0.893 0.571 CA 1.376 29 residues pruned to eliminate duplicates Z: 28 18.654 2.024 0.776 0.515 0.852 0.519 CB 1.155 28 residues pruned to eliminate duplicates Z: 9 10.695 1.716 0.554 0.771 0.875 0.625 CB 1.275 9 residues pruned to eliminate duplicates Z: 14 16.360 1.807 0.756 0.910 0.923 0.923 CB 1.099 14 residues pruned to eliminate duplicates Z: 12 8.912 1.909 0.278 0.388 0.818 0.545 CB 1.516 12 residues pruned to eliminate duplicates Z: 22 16.215 1.894 0.831 0.451 0.810 0.476 CB 1.326 22 residues pruned to eliminate duplicates Z: 17 15.017 1.674 0.923 0.863 0.938 0.500 CB 0.912 17 residues pruned to eliminate duplicates Z: 54 53.838 2.159 1.036 0.606 0.962 0.698 CA 1.581 54 residues pruned to eliminate duplicates Z: 7 5.893 1.583 0.316 0.880 1.000 1.000 CB 0.836 7 residues pruned to eliminate duplicates Z: 7 9.874 1.887 0.995 0.524 0.833 0.833 CA 1.255 7 residues pruned to eliminate duplicates Z: 17 16.276 1.919 0.723 0.489 0.938 0.500 CB 1.327 17 residues pruned to eliminate duplicates Z: 6 2.215 1.677 -0.138 0.237 0.800 0.400 CB 1.161 6 residues pruned to eliminate duplicates Z: 60 54.175 2.242 1.089 0.626 0.949 0.644 CB 1.410 60 residues pruned to eliminate duplicates Z: 9 18.022 1.971 0.894 0.760 1.000 0.500 CA 1.355 9 residues pruned to eliminate duplicates Z: 22 15.897 1.876 0.637 0.372 0.905 0.619 CB 1.432 22 residues pruned to eliminate duplicates Z: 24 25.779 2.220 0.736 0.601 0.957 0.522 CB 1.325 24 residues pruned to eliminate duplicates Z: 8 4.847 1.396 0.383 0.581 0.857 0.714 N 1.024 Z: 8 2.681 1.578 -0.016 0.399 0.857 0.571 CB 0.846 7 residues pruned to eliminate duplicates Z: 15 13.888 1.882 0.301 0.878 0.929 0.714 CB 1.185 15 residues pruned to eliminate duplicates Z: 6 3.717 1.309 0.276 0.705 1.000 1.000 CB 0.826 Z: 70 51.606 2.054 1.134 0.618 0.870 0.478 CB 1.458 70 residues pruned to eliminate duplicates Z: 14 14.766 1.734 0.777 0.939 0.923 0.231 CB 1.001 14 residues pruned to eliminate duplicates Z: 13 37.531 2.203 1.120 0.943 1.000 0.667 CA 1.608 13 residues pruned to eliminate duplicates Z: 11 17.746 1.987 0.628 0.664 1.000 0.700 CB 1.491 11 residues pruned to eliminate duplicates Z: 10 20.424 2.112 0.755 0.925 1.000 0.667 CB 1.289 10 residues pruned to eliminate duplicates Z: 19 21.309 1.983 0.952 0.521 0.889 0.556 CA 1.430 19 residues pruned to eliminate duplicates Z: 64 53.154 2.073 0.989 0.683 0.952 0.698 CB 1.441 64 residues pruned to eliminate duplicates Z: 57 36.920 2.048 0.622 0.610 0.946 0.750 CB 1.414 57 residues pruned to eliminate duplicates Z: 13 12.935 1.925 0.517 0.913 1.000 1.000 CB 0.905 13 residues pruned to eliminate duplicates Z: 6 7.135 1.982 0.407 0.647 0.800 0.600 CA 1.246 6 residues pruned to eliminate duplicates Z: 8 4.739 1.699 0.065 0.786 0.714 0.571 CB 1.078 8 residues pruned to eliminate duplicates Z: 7 2.098 1.548 0.074 0.365 0.500 0.500 CB 1.191 Z: 43 20.268 1.940 0.551 0.448 0.905 0.548 CB 1.212 43 residues pruned to eliminate duplicates Z: 6 2.844 1.506 -0.137 0.671 1.000 1.000 CB 0.836 Z: 14 18.285 1.820 0.894 0.925 0.923 0.923 CB 1.118 14 residues pruned to eliminate duplicates Z: 27 26.768 2.039 0.913 0.578 0.923 0.692 CB 1.353 27 residues pruned to eliminate duplicates Z: 14 10.685 1.721 0.363 0.645 0.923 0.769 CA 1.196 14 residues pruned to eliminate duplicates Z: 9 12.686 2.046 0.479 0.699 0.875 0.625 CB 1.412 9 residues pruned to eliminate duplicates Z: 10 13.816 1.978 0.833 0.555 0.889 0.778 CB 1.354 10 residues pruned to eliminate duplicates Z: 29 42.472 2.095 1.227 0.627 1.000 0.643 CB 1.526 29 residues pruned to eliminate duplicates Z: 28 35.754 2.100 1.061 0.616 0.926 0.630 CB 1.538 28 residues pruned to eliminate duplicates Z: 27 25.435 2.044 0.879 0.569 0.885 0.615 CB 1.374 27 residues pruned to eliminate duplicates Z: 61 42.981 2.078 0.851 0.555 0.950 0.667 CB 1.439 61 residues pruned to eliminate duplicates Z: 14 18.811 1.889 0.485 0.894 1.000 0.692 CB 1.334 14 residues pruned to eliminate duplicates Z: 14 11.702 1.731 0.528 0.616 0.846 0.692 CA 1.300 14 residues pruned to eliminate duplicates Z: 6 3.008 1.319 0.730 0.389 0.800 0.400 CA 0.828 Z: 10 6.270 1.480 0.606 0.466 0.889 0.778 CB 1.024 7 residues pruned to eliminate duplicates Z: 6 2.469 1.433 0.166 0.447 0.800 0.600 CB 0.872 Z: 45 35.508 2.048 0.841 0.587 0.932 0.591 CB 1.402 45 residues pruned to eliminate duplicates Z: 24 11.795 1.806 0.821 0.323 0.783 0.522 CB 1.161 24 residues pruned to eliminate duplicates Z: 30 45.290 2.222 1.183 0.669 0.931 0.655 CA 1.594 30 residues pruned to eliminate duplicates Z: 10 19.184 2.030 1.028 0.843 1.000 0.667 CB 1.157 10 residues pruned to eliminate duplicates Z: 16 21.115 1.907 1.048 0.733 0.800 0.667 CB 1.415 16 residues pruned to eliminate duplicates Z: 15 20.929 1.848 0.691 0.900 0.929 0.857 CB 1.376 15 residues pruned to eliminate duplicates Z: 17 7.628 1.741 0.257 0.381 0.875 0.500 CB 1.131 17 residues pruned to eliminate duplicates Z: 8 6.394 1.604 0.226 0.836 1.000 0.857 CB 0.920 8 residues pruned to eliminate duplicates Z: 11 14.959 1.739 0.970 0.650 1.000 0.500 CB 1.201 11 residues pruned to eliminate duplicates Z: 17 37.284 2.030 1.242 0.917 1.000 0.812 CB 1.445 17 residues pruned to eliminate duplicates Z: 11 11.789 1.736 0.507 0.548 1.000 0.600 CB 1.359 11 residues pruned to eliminate duplicates Z: 7 3.224 1.379 0.442 0.761 0.500 0.333 CA 1.050 7 residues pruned to eliminate duplicates Z: 8 4.119 1.712 0.412 0.337 0.714 0.714 CB 1.078 8 residues pruned to eliminate duplicates Z: 6 2.800 1.424 0.518 0.299 0.600 0.400 C 1.208 Z: 21 16.980 1.821 0.663 0.554 0.950 0.650 CB 1.252 21 residues pruned to eliminate duplicates Z: 77 56.918 2.137 0.978 0.605 0.947 0.632 CB 1.475 77 residues pruned to eliminate duplicates Z: 14 22.042 2.090 0.957 0.834 0.769 0.615 CA 1.456 14 residues pruned to eliminate duplicates Z: 10 9.252 1.718 0.807 0.728 0.889 0.778 CA 0.910 10 residues pruned to eliminate duplicates Z: 32 43.612 2.143 1.280 0.668 0.968 0.548 CB 1.418 32 residues pruned to eliminate duplicates Z: 24 17.563 1.841 0.562 0.557 0.913 0.565 CB 1.320 24 residues pruned to eliminate duplicates Z: 9 3.900 1.751 -0.078 0.597 0.875 0.625 CB 0.890 9 residues pruned to eliminate duplicates Z: 10 11.419 1.937 0.503 0.564 0.889 0.778 CB 1.382 10 residues pruned to eliminate duplicates Z: 12 38.575 2.323 1.166 0.925 1.000 1.000 CA 1.622 12 residues pruned to eliminate duplicates Z: 49 39.222 2.076 0.876 0.589 0.938 0.562 CB 1.424 49 residues pruned to eliminate duplicates Z: 58 33.105 1.849 0.713 0.649 0.930 0.544 CB 1.295 58 residues pruned to eliminate duplicates Z: 9 3.009 1.484 0.190 0.308 0.750 0.375 CB 0.994 9 residues pruned to eliminate duplicates Z: 7 6.747 1.912 0.791 0.565 0.667 0.333 CB 1.133 7 residues pruned to eliminate duplicates Z: 7 9.827 1.716 0.801 0.711 0.833 0.500 C 1.286 7 residues pruned to eliminate duplicates Z: 57 46.906 2.023 1.033 0.661 0.929 0.643 CB 1.414 57 residues pruned to eliminate duplicates Z: 8 5.549 1.662 0.220 0.519 0.857 0.286 CB 1.184 Z: 6 5.740 1.980 0.955 0.650 0.600 0.200 CB 0.962 6 residues pruned to eliminate duplicates Z: 6 3.279 1.660 -0.172 0.667 0.800 0.400 N 1.143 Z: 9 6.943 1.704 0.685 0.298 1.000 0.250 CB 1.071 9 residues pruned to eliminate duplicates Z: 7 4.053 1.362 0.603 0.739 0.833 0.667 CA 0.734 7 residues pruned to eliminate duplicates Z: 91 56.196 2.018 0.970 0.629 0.944 0.544 CB 1.398 91 residues pruned to eliminate duplicates Z: 16 22.602 2.060 1.119 0.891 0.733 0.200 CB 1.310 16 residues pruned to eliminate duplicates Z: 47 38.445 2.043 0.822 0.646 0.913 0.652 CB 1.455 47 residues pruned to eliminate duplicates Z: 7 7.429 1.705 0.017 0.743 1.000 0.833 C 1.406 5 residues pruned to eliminate duplicates Z: 15 9.623 1.626 0.671 0.579 0.857 0.643 CB 1.024 15 residues pruned to eliminate duplicates Z: 9 3.400 1.397 0.458 0.228 0.750 0.250 N 1.081 Z: 6 6.419 1.858 0.367 0.566 1.000 0.600 CB 1.060 6 residues pruned to eliminate duplicates Z: 6 3.973 1.462 0.348 0.647 1.000 0.800 CB 0.786 Z: 16 16.053 1.886 0.481 0.627 1.000 0.800 CB 1.317 16 residues pruned to eliminate duplicates Z: 6 8.886 1.565 0.826 0.822 1.000 0.600 CB 1.052 6 residues pruned to eliminate duplicates Z: 15 38.379 2.015 1.344 0.926 1.000 0.786 CA 1.523 15 residues pruned to eliminate duplicates Z: 13 24.983 2.184 1.004 0.643 1.000 0.583 CA 1.441 13 residues pruned to eliminate duplicates Z: 19 27.119 2.058 1.027 0.655 0.889 0.722 CB 1.493 19 residues pruned to eliminate duplicates Z: 9 11.098 1.873 0.933 0.621 0.875 0.750 CB 1.105 9 residues pruned to eliminate duplicates Z: 56 46.477 2.088 1.007 0.631 0.909 0.564 CB 1.454 56 residues pruned to eliminate duplicates Z: 87 53.979 2.011 0.925 0.644 0.942 0.616 CB 1.395 87 residues pruned to eliminate duplicates Z: 15 28.621 1.994 1.133 0.921 0.929 0.714 CB 1.363 15 residues pruned to eliminate duplicates Z: 7 5.445 1.490 -0.057 0.831 1.000 0.833 CA 1.188 7 residues pruned to eliminate duplicates Z: 8 7.628 1.669 0.312 0.889 1.000 0.857 CB 0.948 7 residues pruned to eliminate duplicates Z: 16 3.175 1.441 0.353 0.153 0.600 0.467 CA 1.074 14 residues pruned to eliminate duplicates Z: 12 18.128 2.203 1.036 0.461 0.909 0.727 CB 1.395 12 residues pruned to eliminate duplicates Z: 54 47.207 2.187 1.094 0.604 0.830 0.623 CA 1.546 54 residues pruned to eliminate duplicates Z: 7 8.609 1.784 0.446 0.822 1.000 0.667 CA 1.031 7 residues pruned to eliminate duplicates Z: 15 23.994 2.034 0.870 0.937 0.929 0.857 CA 1.264 15 residues pruned to eliminate duplicates Z: 24 22.276 2.005 0.812 0.464 0.826 0.522 CB 1.605 24 residues pruned to eliminate duplicates Z: 7 3.278 1.370 0.725 0.354 0.667 0.667 CA 0.994 Z: 31 34.160 2.014 0.887 0.696 0.967 0.633 CA 1.420 31 residues pruned to eliminate duplicates Z: 7 5.275 1.648 0.195 0.412 1.000 0.833 CA 1.199 7 residues pruned to eliminate duplicates Z: 27 34.703 2.104 0.939 0.632 0.962 0.769 CB 1.532 27 residues pruned to eliminate duplicates Z: 6 3.526 1.606 1.129 0.359 0.600 0.400 CA 0.895 6 residues pruned to eliminate duplicates 6 1.826 1.246 0.591 0.297 0.800 0.600 N 0.646 ? Z: 16 7.824 1.593 0.397 0.308 0.800 0.467 CB 1.406 16 residues pruned to eliminate duplicates Z: 8 8.234 1.752 0.483 0.616 1.000 0.714 CB 1.074 7 residues pruned to eliminate duplicates Z: 56 49.685 2.074 0.909 0.695 0.982 0.727 CB 1.442 56 residues pruned to eliminate duplicates Z: 31 20.403 2.021 0.774 0.364 0.900 0.533 CB 1.336 31 residues pruned to eliminate duplicates Z: 10 13.170 1.887 0.510 0.566 1.000 0.556 CB 1.445 10 residues pruned to eliminate duplicates Z: 11 8.844 1.728 0.094 0.841 1.000 1.000 CB 1.103 11 residues pruned to eliminate duplicates Z: 34 19.356 1.937 0.625 0.469 0.818 0.515 CB 1.351 34 residues pruned to eliminate duplicates Z: 8 3.540 1.681 0.528 0.359 0.714 0.714 N 0.849 Z: 36 40.499 2.187 1.214 0.610 0.857 0.657 CB 1.486 36 residues pruned to eliminate duplicates Z: 8 4.770 1.415 0.505 0.499 1.000 0.714 N 0.848 5 residues pruned to eliminate duplicates Z: 13 16.859 1.972 0.795 0.929 1.000 0.833 CB 0.962 13 residues pruned to eliminate duplicates Z: 10 16.514 2.101 0.436 0.535 1.000 0.667 CA 1.762 10 residues pruned to eliminate duplicates Z: 6 13.746 1.988 0.831 0.814 1.000 1.000 CB 1.285 6 residues pruned to eliminate duplicates Z: 7 2.627 1.713 -0.303 0.541 1.000 0.667 CB 0.863 6 1.114 1.216 0.126 0.428 0.800 0.600 CB 0.490 ? Z: 16 6.647 1.521 0.365 0.400 0.800 0.400 CB 1.147 10 residues pruned to eliminate duplicates Z: 6 3.578 1.846 0.631 0.340 0.600 0.600 CB 1.054 6 residues pruned to eliminate duplicates Z: 57 28.269 1.822 0.745 0.583 0.857 0.643 CB 1.279 57 residues pruned to eliminate duplicates Z: 17 21.737 1.857 0.757 0.874 0.938 0.500 CA 1.293 17 residues pruned to eliminate duplicates Z: 16 23.313 2.020 0.777 0.684 1.000 0.800 CB 1.417 16 residues pruned to eliminate duplicates Z: 10 5.412 1.465 0.516 0.436 0.889 0.667 CB 0.976 6 residues pruned to eliminate duplicates Z: 9 6.123 1.330 0.545 0.632 0.875 0.625 N 1.064 9 residues pruned to eliminate duplicates Z: 15 23.711 1.848 0.824 0.901 0.929 0.357 CA 1.446 15 residues pruned to eliminate duplicates Z: 34 40.307 2.192 1.005 0.539 0.909 0.727 CA 1.690 34 residues pruned to eliminate duplicates Z: 12 21.413 1.967 1.215 0.673 0.909 0.818 CB 1.390 12 residues pruned to eliminate duplicates Z: 11 8.308 1.595 0.339 0.788 0.900 0.700 CB 1.061 11 residues pruned to eliminate duplicates Z: 13 10.767 1.962 0.745 0.321 0.917 0.500 CB 1.206 13 residues pruned to eliminate duplicates Z: 8 16.806 2.057 0.676 0.874 1.000 1.000 CA 1.341 8 residues pruned to eliminate duplicates Z: 60 46.948 2.047 1.160 0.605 0.932 0.729 CB 1.342 60 residues pruned to eliminate duplicates Z: 7 3.388 1.467 0.391 0.432 0.667 0.667 C 1.091 Z: 15 25.315 2.018 0.940 0.892 0.929 0.571 CB 1.337 15 residues pruned to eliminate duplicates Z: 8 2.303 1.239 0.010 0.400 0.857 0.286 N 0.902 Z: 16 14.044 1.836 0.771 0.432 0.933 0.467 CA 1.282 16 residues pruned to eliminate duplicates Z: 122 59.147 2.035 0.815 0.623 0.926 0.678 CB 1.400 123 residues pruned to eliminate duplicates Z: 9 9.061 1.647 0.557 0.822 0.875 0.750 CA 1.080 9 residues pruned to eliminate duplicates Z: 14 12.577 1.909 0.397 0.924 1.000 1.000 CB 0.919 14 residues pruned to eliminate duplicates Z: 9 14.345 2.150 0.670 0.827 0.750 0.625 CB 1.420 9 residues pruned to eliminate duplicates Z: 6 5.486 1.405 0.477 0.749 1.000 0.600 CB 0.946 Z: 7 14.280 2.036 1.081 0.549 1.000 0.667 CB 1.311 7 residues pruned to eliminate duplicates Z: 54 30.329 1.896 0.755 0.569 0.925 0.623 CB 1.267 54 residues pruned to eliminate duplicates Z: 8 9.524 1.717 0.967 0.567 0.857 0.714 CA 1.166 8 residues pruned to eliminate duplicates Z: 12 7.365 1.675 0.419 0.413 0.909 0.636 CB 1.126 12 residues pruned to eliminate duplicates Z: 14 16.024 1.806 0.653 0.886 1.000 0.615 CB 1.074 14 residues pruned to eliminate duplicates Z: 29 27.698 1.983 0.800 0.620 0.929 0.571 CB 1.409 29 residues pruned to eliminate duplicates Z: 14 11.038 1.706 0.132 0.911 1.000 0.923 CB 1.123 14 residues pruned to eliminate duplicates Z: 6 11.630 1.915 0.452 0.867 1.000 0.400 CB 1.368 6 residues pruned to eliminate duplicates Z: 10 11.229 1.694 0.349 0.886 1.000 0.667 CB 1.182 10 residues pruned to eliminate duplicates Z: 22 11.915 1.796 0.857 0.321 0.810 0.238 CB 1.172 22 residues pruned to eliminate duplicates Z: 13 5.736 1.532 0.419 0.420 0.833 0.750 CB 0.993 13 residues pruned to eliminate duplicates Z: 16 16.095 1.981 0.745 0.525 0.933 0.600 CB 1.257 16 residues pruned to eliminate duplicates Z: 43 44.297 2.086 1.029 0.654 0.976 0.595 CA 1.433 43 residues pruned to eliminate duplicates Z: 13 12.560 1.738 0.661 0.512 0.917 0.583 CB 1.354 13 residues pruned to eliminate duplicates Z: 6 7.088 1.607 0.764 0.661 1.000 0.800 CB 0.963 Z: 8 10.076 1.756 1.158 0.760 0.857 0.714 CB 0.931 8 residues pruned to eliminate duplicates Z: 12 16.688 2.067 0.790 0.610 0.909 0.636 CA 1.348 12 residues pruned to eliminate duplicates Z: 24 18.689 1.786 0.875 0.567 0.870 0.652 CB 1.254 24 residues pruned to eliminate duplicates Z: 6 2.730 1.428 0.572 0.404 0.600 0.600 C 1.003 Z: 8 3.817 1.318 -0.071 0.567 1.000 0.857 C 1.104 8 residues pruned to eliminate duplicates Z: 9 8.869 1.710 0.175 0.847 1.000 0.750 CB 1.158 9 residues pruned to eliminate duplicates Z: 53 52.493 2.195 1.138 0.607 0.923 0.712 CB 1.519 53 residues pruned to eliminate duplicates Z: 9 6.771 1.671 0.369 0.858 1.000 0.500 CB 0.771 9 residues pruned to eliminate duplicates Z: 15 22.334 1.970 0.754 0.924 1.000 0.857 CA 1.213 15 residues pruned to eliminate duplicates Z: 6 8.885 1.661 0.709 0.826 1.000 1.000 CB 1.056 6 residues pruned to eliminate duplicates Z: 7 2.118 1.323 0.287 0.420 0.833 0.500 CA 0.662 7 1.942 1.515 0.254 0.293 0.667 0.500 CB 0.788 ? Z: 7 3.098 1.570 0.757 0.083 0.667 0.167 C 1.179 7 residues pruned to eliminate duplicates Z: 28 17.312 1.803 0.644 0.572 0.852 0.519 CB 1.231 28 residues pruned to eliminate duplicates Z: 22 13.638 1.762 0.700 0.510 0.857 0.571 CB 1.148 22 residues pruned to eliminate duplicates Z: 10 6.752 1.671 0.406 0.353 0.889 0.444 CB 1.263 10 residues pruned to eliminate duplicates Z: 6 2.707 1.329 -0.007 0.790 0.800 0.600 CA 0.889 6 residues pruned to eliminate duplicates Z: 29 27.621 2.058 0.819 0.503 0.929 0.500 CB 1.497 29 residues pruned to eliminate duplicates Z: 19 13.589 1.802 0.479 0.470 0.944 0.667 CB 1.312 19 residues pruned to eliminate duplicates Z: 31 16.720 1.868 0.694 0.429 0.900 0.667 CB 1.153 33 residues pruned to eliminate duplicates Z: 8 4.647 1.475 0.336 0.516 0.857 0.571 CB 1.022 6 residues pruned to eliminate duplicates Z: 8 6.269 1.683 0.640 0.201 1.000 0.429 CA 1.225 Z: 100 49.953 2.034 0.833 0.584 0.899 0.576 CB 1.381 100 residues pruned to eliminate duplicates Z: 65 42.363 2.021 0.838 0.600 0.938 0.703 CB 1.382 65 residues pruned to eliminate duplicates Z: 30 25.281 1.839 0.734 0.731 0.931 0.793 CA 1.285 30 residues pruned to eliminate duplicates Z: 6 4.093 1.734 0.905 0.488 0.600 0.400 CB 0.935 Z: 6 2.952 1.483 0.163 0.614 1.000 0.600 CA 0.687 Z: 6 3.671 1.670 0.459 0.100 0.800 0.400 CB 1.404 6 residues pruned to eliminate duplicates 843 residues left after pruning, divided into chains as follows: A: 9 B: 7 C: 10 D: 6 E: 218 F: 112 G: 108 H: 8 I: 21 J: 9 K: 157 L: 178 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 36.79 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.478, Connect. = 0.735 for dens.mod. cycle 1 = 0.300, Contrast = 0.552, Connect. = 0.758 for dens.mod. cycle 2 = 0.300, Contrast = 0.665, Connect. = 0.788 for dens.mod. cycle 3 = 0.300, Contrast = 0.673, Connect. = 0.789 for dens.mod. cycle 4 = 0.300, Contrast = 0.685, Connect. = 0.791 for dens.mod. cycle 5 = 0.300, Contrast = 0.690, Connect. = 0.792 for dens.mod. cycle 6 = 0.300, Contrast = 0.696, Connect. = 0.793 for dens.mod. cycle 7 = 0.300, Contrast = 0.698, Connect. = 0.794 for dens.mod. cycle 8 = 0.300, Contrast = 0.702, Connect. = 0.795 for dens.mod. cycle 9 = 0.300, Contrast = 0.703, Connect. = 0.796 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 6577 peaks > 0.5 sigma used to seed fragment search Space for about 1274 unique residues taking solvent into account 1329 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 15 45.059 2.439 1.255 0.929 1.000 0.857 CB 1.532 B: 13 41.531 2.391 1.311 0.860 0.917 0.750 CB 1.740 C: 17 37.943 2.337 1.264 0.879 0.938 0.500 CB 1.386 17 residues pruned to eliminate duplicates D: 18 31.429 2.107 0.904 0.894 0.882 0.647 CB 1.545 E: 13 37.524 2.478 0.814 0.895 1.000 0.917 CA 1.727 13 residues pruned to eliminate duplicates F: 17 35.298 2.188 0.996 0.886 0.938 0.812 CB 1.555 18 residues pruned to eliminate duplicates G: 12 43.525 2.568 1.142 0.914 0.909 0.818 CB 1.855 13 residues pruned to eliminate duplicates H: 13 34.149 2.395 0.963 0.853 0.917 0.750 CA 1.691 13 residues pruned to eliminate duplicates I: 18 33.335 2.161 0.830 0.884 0.941 0.941 CB 1.568 J: 18 34.432 2.198 0.747 0.892 1.000 0.882 CB 1.562 18 residues pruned to eliminate duplicates K: 18 44.859 2.288 1.274 0.923 0.941 0.824 CB 1.562 16 residues pruned to eliminate duplicates L: 13 33.430 2.359 0.851 0.846 0.917 0.750 CA 1.792 M: 16 26.683 2.354 0.647 0.808 0.867 0.667 CB 1.567 N: 16 30.042 2.183 0.620 0.846 1.000 0.800 CA 1.629 O: 15 37.625 2.305 0.876 0.868 1.000 0.857 CB 1.700 16 residues pruned to eliminate duplicates P: 31 46.646 2.396 1.087 0.654 0.867 0.500 CB 1.703 Q: 16 45.067 2.426 1.079 0.909 1.000 0.667 CB 1.637 16 residues pruned to eliminate duplicates R: 15 30.697 2.120 0.785 0.847 1.000 0.714 CA 1.609 15 residues pruned to eliminate duplicates S: 18 39.753 2.302 1.081 0.921 0.941 0.706 CB 1.505 18 residues pruned to eliminate duplicates T: 13 45.244 2.394 1.248 0.907 0.917 0.917 CA 1.882 13 residues pruned to eliminate duplicates U: 13 13.491 1.940 0.430 0.697 0.833 0.583 CA 1.407 V: 14 41.134 2.223 1.216 0.934 1.000 0.923 CA 1.615 14 residues pruned to eliminate duplicates W: 13 48.719 2.496 1.167 0.903 1.000 0.750 CA 1.854 12 residues pruned to eliminate duplicates X: 13 33.940 2.333 1.135 0.842 0.833 0.750 CB 1.759 13 residues pruned to eliminate duplicates Y: 17 43.094 2.254 0.987 0.937 1.000 0.875 CB 1.674 17 residues pruned to eliminate duplicates Z: 14 27.209 2.242 0.660 0.899 0.846 0.846 CB 1.713 14 residues pruned to eliminate duplicates Z: 148 88.608 2.271 0.950 0.615 0.925 0.599 CB 1.601 44 residues pruned to eliminate duplicates Z: 85 73.602 2.305 1.060 0.646 0.929 0.714 CB 1.589 31 residues pruned to eliminate duplicates Z: 13 41.450 2.518 0.890 0.930 1.000 0.833 CA 1.757 13 residues pruned to eliminate duplicates Z: 14 38.979 2.372 0.976 0.902 1.000 0.923 CB 1.644 14 residues pruned to eliminate duplicates Z: 11 22.840 2.127 0.775 0.939 1.000 0.900 CB 1.329 Z: 155 90.709 2.311 0.951 0.559 0.942 0.643 CB 1.627 108 residues pruned to eliminate duplicates Z: 15 39.848 2.174 1.140 0.883 0.929 0.643 CB 1.781 15 residues pruned to eliminate duplicates Z: 13 38.274 2.224 1.057 0.913 1.000 0.833 CB 1.709 Z: 13 34.190 2.387 0.766 0.902 0.917 0.750 CA 1.822 13 residues pruned to eliminate duplicates Z: 17 40.266 2.219 0.974 0.927 1.000 0.938 CB 1.610 18 residues pruned to eliminate duplicates Z: 114 80.504 2.242 1.005 0.630 0.973 0.655 CB 1.532 118 residues pruned to eliminate duplicates Z: 84 68.854 2.204 0.862 0.649 0.964 0.566 CB 1.664 13 residues pruned to eliminate duplicates Z: 12 49.229 2.594 1.103 0.914 1.000 0.818 CA 1.925 12 residues pruned to eliminate duplicates Z: 10 15.943 2.202 0.237 0.820 1.000 0.667 CA 1.478 Z: 31 16.289 1.885 0.865 0.303 0.800 0.533 CB 1.318 19 residues pruned to eliminate duplicates Z: 46 49.724 2.188 1.027 0.678 0.933 0.533 CB 1.521 46 residues pruned to eliminate duplicates Z: 13 38.222 2.238 0.932 0.931 1.000 0.917 CA 1.783 13 residues pruned to eliminate duplicates Z: 10 22.932 2.104 1.044 0.776 1.000 0.667 CA 1.393 10 residues pruned to eliminate duplicates Z: 9 19.530 2.166 0.767 0.817 0.875 0.625 CB 1.566 9 residues pruned to eliminate duplicates Z: 18 41.572 2.355 1.077 0.885 0.941 0.882 CB 1.581 18 residues pruned to eliminate duplicates Z: 15 45.161 2.402 1.117 0.912 1.000 0.786 CA 1.681 Z: 15 22.936 2.090 0.673 0.890 0.929 0.786 CA 1.358 Z: 13 45.639 2.355 1.240 0.923 0.917 0.833 CA 1.914 14 residues pruned to eliminate duplicates Z: 15 32.406 2.255 0.845 0.895 1.000 0.857 CA 1.493 15 residues pruned to eliminate duplicates Z: 15 28.896 2.422 0.705 0.810 0.929 0.714 CA 1.537 15 residues pruned to eliminate duplicates Z: 14 43.351 2.367 1.230 0.944 1.000 0.923 CA 1.578 14 residues pruned to eliminate duplicates Z: 13 40.327 2.430 1.124 0.911 0.917 0.667 CA 1.744 13 residues pruned to eliminate duplicates Z: 9 21.166 2.269 0.537 0.841 1.000 1.000 CB 1.600 9 residues pruned to eliminate duplicates Z: 21 31.339 2.168 0.931 0.599 0.950 0.650 CB 1.604 18 residues pruned to eliminate duplicates Z: 36 20.183 2.120 0.718 0.315 0.714 0.486 CA 1.609 36 residues pruned to eliminate duplicates Z: 14 30.570 2.174 0.814 0.921 1.000 0.769 CB 1.513 14 residues pruned to eliminate duplicates Z: 81 75.245 2.301 1.104 0.654 0.925 0.675 CB 1.627 81 residues pruned to eliminate duplicates Z: 15 33.343 2.096 1.085 0.917 0.929 0.643 CB 1.550 15 residues pruned to eliminate duplicates Z: 58 56.583 2.411 0.990 0.578 0.912 0.667 CB 1.589 58 residues pruned to eliminate duplicates Z: 74 62.237 2.247 0.972 0.625 0.932 0.575 CB 1.569 72 residues pruned to eliminate duplicates Z: 15 29.936 2.454 0.582 0.823 0.929 0.714 CA 1.678 15 residues pruned to eliminate duplicates Z: 18 35.624 2.167 0.940 0.884 0.941 0.588 CB 1.578 18 residues pruned to eliminate duplicates Z: 19 27.036 2.236 1.013 0.517 0.889 0.556 CB 1.566 19 residues pruned to eliminate duplicates Z: 17 42.409 2.272 1.171 0.909 1.000 0.875 CB 1.525 17 residues pruned to eliminate duplicates Z: 10 28.246 2.248 0.892 0.920 1.000 0.778 CB 1.559 Z: 13 50.461 2.380 1.339 0.935 1.000 0.667 CA 1.823 13 residues pruned to eliminate duplicates Z: 13 40.835 2.474 0.962 0.901 1.000 0.917 CA 1.733 12 residues pruned to eliminate duplicates Z: 101 88.545 2.318 1.068 0.662 0.960 0.690 CB 1.655 31 residues pruned to eliminate duplicates Z: 16 32.004 2.379 0.827 0.822 0.933 0.733 CB 1.541 16 residues pruned to eliminate duplicates Z: 74 41.212 2.079 0.732 0.464 0.918 0.575 CB 1.514 10 residues pruned to eliminate duplicates Z: 31 16.453 1.956 0.659 0.312 0.800 0.500 CB 1.424 6 residues pruned to eliminate duplicates Z: 13 36.046 2.361 1.292 0.868 0.833 0.750 CB 1.687 13 residues pruned to eliminate duplicates Z: 184 93.957 2.301 0.959 0.570 0.929 0.650 CB 1.550 162 residues pruned to eliminate duplicates Z: 15 32.093 2.434 0.780 0.818 0.929 0.643 CB 1.618 15 residues pruned to eliminate duplicates Z: 121 84.857 2.292 0.995 0.631 0.942 0.633 CB 1.592 195 residues pruned to eliminate duplicates Z: 12 16.391 2.203 0.288 0.770 0.909 0.364 CA 1.509 12 residues pruned to eliminate duplicates Z: 16 35.752 2.083 1.249 0.915 0.933 0.467 CB 1.492 Z: 10 20.908 1.934 0.865 0.893 1.000 0.778 CB 1.386 Z: 11 20.255 2.056 0.817 0.913 1.000 0.900 CB 1.214 11 residues pruned to eliminate duplicates Z: 18 31.611 2.178 0.644 0.931 1.000 0.824 CA 1.497 18 residues pruned to eliminate duplicates Z: 16 46.875 2.357 1.285 0.917 1.000 0.933 CA 1.586 15 residues pruned to eliminate duplicates Z: 185 92.721 2.299 0.950 0.574 0.918 0.571 CB 1.545 185 residues pruned to eliminate duplicates Z: 14 34.919 2.199 1.047 0.887 1.000 0.615 CA 1.551 14 residues pruned to eliminate duplicates Z: 63 61.833 2.335 1.087 0.568 0.952 0.645 CB 1.586 63 residues pruned to eliminate duplicates Z: 14 34.525 2.211 0.842 0.922 0.923 0.615 CB 1.791 Z: 94 66.295 2.190 0.914 0.647 0.914 0.699 CB 1.564 30 residues pruned to eliminate duplicates Z: 14 38.575 2.307 1.300 0.900 0.923 0.846 CA 1.561 14 residues pruned to eliminate duplicates Z: 16 45.960 2.364 1.252 0.940 0.933 0.800 CA 1.658 16 residues pruned to eliminate duplicates Z: 12 37.160 2.447 0.899 0.886 0.909 0.818 CA 1.914 12 residues pruned to eliminate duplicates Z: 140 90.263 2.282 0.968 0.626 0.957 0.640 CB 1.583 140 residues pruned to eliminate duplicates Z: 29 34.605 2.295 0.871 0.476 0.964 0.464 CB 1.619 29 residues pruned to eliminate duplicates Z: 10 22.512 2.140 1.060 0.753 1.000 0.778 CA 1.358 10 residues pruned to eliminate duplicates Z: 14 22.019 2.123 0.586 0.892 0.923 0.615 CB 1.411 14 residues pruned to eliminate duplicates Z: 18 19.519 2.023 0.566 0.521 1.000 0.647 CB 1.463 Z: 91 68.014 2.203 0.917 0.629 0.922 0.667 CB 1.630 58 residues pruned to eliminate duplicates Z: 14 24.192 2.405 0.846 0.552 0.923 0.769 CB 1.556 14 residues pruned to eliminate duplicates Z: 13 35.476 2.271 0.918 0.919 1.000 0.917 CA 1.657 13 residues pruned to eliminate duplicates Z: 21 30.097 2.271 0.792 0.767 0.900 0.550 CB 1.451 21 residues pruned to eliminate duplicates Z: 16 48.133 2.356 1.323 0.941 1.000 0.800 CA 1.575 16 residues pruned to eliminate duplicates Z: 17 33.438 2.248 1.073 0.575 0.938 0.688 CB 1.780 17 residues pruned to eliminate duplicates Z: 15 47.204 2.414 1.165 0.945 1.000 1.000 CA 1.671 15 residues pruned to eliminate duplicates Z: 12 14.660 1.837 0.608 0.724 0.909 0.545 CA 1.344 12 residues pruned to eliminate duplicates Z: 17 46.872 2.310 1.216 0.908 1.000 0.812 CB 1.626 17 residues pruned to eliminate duplicates Z: 14 43.121 2.358 1.181 0.910 1.000 0.846 CA 1.648 14 residues pruned to eliminate duplicates Z: 16 42.258 2.270 1.268 0.914 1.000 0.800 CB 1.498 16 residues pruned to eliminate duplicates Z: 14 19.860 1.955 0.873 0.920 1.000 0.769 CB 1.059 14 residues pruned to eliminate duplicates Z: 13 32.170 2.198 0.852 0.885 1.000 0.833 CB 1.648 13 residues pruned to eliminate duplicates Z: 103 82.426 2.256 0.960 0.666 0.961 0.706 CB 1.648 103 residues pruned to eliminate duplicates Z: 11 18.537 1.929 0.937 0.768 0.900 0.600 CA 1.375 11 residues pruned to eliminate duplicates Z: 7 24.497 2.429 1.087 0.722 0.833 0.833 CA 1.937 7 residues pruned to eliminate duplicates Z: 15 32.544 2.195 1.209 0.915 0.857 0.643 CA 1.479 15 residues pruned to eliminate duplicates Z: 47 47.606 2.180 1.056 0.634 0.891 0.587 CB 1.549 47 residues pruned to eliminate duplicates Z: 85 74.412 2.279 1.044 0.624 0.940 0.560 CB 1.650 93 residues pruned to eliminate duplicates Z: 91 70.296 2.216 0.946 0.637 0.933 0.622 CB 1.618 92 residues pruned to eliminate duplicates Z: 83 69.631 2.217 0.940 0.670 0.939 0.683 CB 1.627 83 residues pruned to eliminate duplicates Z: 16 36.966 2.341 1.032 0.931 1.000 0.800 CB 1.402 16 residues pruned to eliminate duplicates Z: 18 29.487 2.347 0.803 0.651 0.882 0.471 CB 1.664 18 residues pruned to eliminate duplicates Z: 78 68.275 2.285 1.024 0.644 0.922 0.688 CB 1.595 78 residues pruned to eliminate duplicates Z: 13 35.552 2.387 1.396 0.832 0.750 0.750 CA 1.796 13 residues pruned to eliminate duplicates Z: 9 25.684 2.209 0.843 0.869 1.000 0.625 CA 1.629 9 residues pruned to eliminate duplicates Z: 140 77.818 2.211 0.823 0.627 0.921 0.691 CB 1.577 140 residues pruned to eliminate duplicates Z: 13 15.007 2.009 0.528 0.704 0.833 0.667 CB 1.407 13 residues pruned to eliminate duplicates Z: 16 43.366 2.378 1.117 0.936 0.933 0.800 CA 1.660 16 residues pruned to eliminate duplicates Z: 13 44.078 2.374 1.535 0.863 0.917 0.667 CB 1.692 13 residues pruned to eliminate duplicates Z: 13 19.219 2.090 0.547 0.723 0.833 0.583 CA 1.684 13 residues pruned to eliminate duplicates Z: 15 47.842 2.247 1.326 0.921 1.000 0.714 CB 1.721 15 residues pruned to eliminate duplicates Z: 12 37.878 2.370 0.964 0.923 1.000 0.909 CB 1.724 12 residues pruned to eliminate duplicates Z: 14 32.450 2.286 0.904 0.893 0.923 0.846 CA 1.607 14 residues pruned to eliminate duplicates Z: 14 27.584 2.407 0.463 0.916 1.000 0.846 CB 1.534 14 residues pruned to eliminate duplicates Z: 85 67.603 2.218 0.807 0.671 0.964 0.667 CB 1.630 85 residues pruned to eliminate duplicates Z: 31 43.245 2.321 1.018 0.558 0.933 0.567 CB 1.707 31 residues pruned to eliminate duplicates Z: 15 31.616 2.223 1.078 0.805 0.929 0.786 CA 1.509 15 residues pruned to eliminate duplicates Z: 65 53.417 2.173 0.918 0.617 0.938 0.641 CB 1.529 65 residues pruned to eliminate duplicates Z: 17 39.337 2.320 0.934 0.943 1.000 0.750 CB 1.519 17 residues pruned to eliminate duplicates Z: 17 30.651 2.290 0.773 0.914 0.938 0.875 CB 1.424 17 residues pruned to eliminate duplicates Z: 18 43.937 2.289 1.308 0.924 0.941 0.824 CB 1.506 18 residues pruned to eliminate duplicates Z: 13 38.226 2.271 0.993 0.924 1.000 0.833 CA 1.712 13 residues pruned to eliminate duplicates Z: 18 17.897 2.119 0.763 0.395 0.824 0.706 CA 1.576 18 residues pruned to eliminate duplicates Z: 25 24.059 2.079 0.759 0.505 0.917 0.458 CB 1.457 25 residues pruned to eliminate duplicates Z: 72 62.076 2.194 0.860 0.644 0.944 0.662 CB 1.672 72 residues pruned to eliminate duplicates Z: 11 25.091 2.117 0.803 0.922 1.000 0.800 CB 1.462 11 residues pruned to eliminate duplicates Z: 11 14.085 2.106 0.575 0.811 0.900 0.700 CB 1.138 11 residues pruned to eliminate duplicates Z: 9 26.108 2.206 0.965 0.909 1.000 0.875 CB 1.512 10 residues pruned to eliminate duplicates Z: 80 69.762 2.423 1.044 0.562 0.899 0.595 CB 1.661 80 residues pruned to eliminate duplicates Z: 15 29.900 2.181 1.008 0.905 0.857 0.643 CA 1.514 15 residues pruned to eliminate duplicates Z: 17 39.678 2.253 0.910 0.918 1.000 0.875 CB 1.625 17 residues pruned to eliminate duplicates Z: 13 34.744 2.428 0.802 0.875 1.000 0.833 CA 1.668 13 residues pruned to eliminate duplicates Z: 24 30.649 2.166 0.951 0.651 0.870 0.478 CB 1.511 24 residues pruned to eliminate duplicates Z: 15 29.744 2.168 0.882 0.875 0.929 0.714 CB 1.526 15 residues pruned to eliminate duplicates Z: 9 14.690 2.093 0.867 0.772 0.750 0.500 CA 1.393 9 residues pruned to eliminate duplicates Z: 12 52.169 2.577 1.300 0.920 1.000 0.909 CA 1.868 12 residues pruned to eliminate duplicates Z: 10 21.608 2.243 0.672 0.862 1.000 0.778 CB 1.410 10 residues pruned to eliminate duplicates Z: 15 38.640 2.249 1.063 0.891 0.929 0.786 CA 1.724 15 residues pruned to eliminate duplicates Z: 15 32.380 2.225 0.883 0.924 1.000 0.857 CA 1.451 15 residues pruned to eliminate duplicates Z: 14 36.849 2.252 1.042 0.942 1.000 0.923 CB 1.541 14 residues pruned to eliminate duplicates Z: 8 24.276 2.422 0.640 0.829 1.000 0.857 CB 1.738 8 residues pruned to eliminate duplicates Z: 100 79.967 2.323 1.007 0.623 0.929 0.626 CB 1.652 100 residues pruned to eliminate duplicates Z: 12 49.097 2.595 1.301 0.927 0.909 0.818 CA 1.911 12 residues pruned to eliminate duplicates Z: 102 70.346 2.345 0.933 0.560 0.881 0.594 CB 1.654 102 residues pruned to eliminate duplicates Z: 8 24.036 2.317 1.038 0.689 0.857 0.714 CB 1.888 8 residues pruned to eliminate duplicates Z: 16 27.565 2.025 0.865 0.906 0.933 0.600 CB 1.437 16 residues pruned to eliminate duplicates Z: 13 13.851 2.030 0.255 0.802 0.833 0.583 CB 1.447 13 residues pruned to eliminate duplicates Z: 71 66.091 2.317 1.075 0.626 0.871 0.643 CB 1.674 71 residues pruned to eliminate duplicates Z: 14 38.697 2.381 0.996 0.892 1.000 0.923 CA 1.622 14 residues pruned to eliminate duplicates Z: 13 33.263 2.341 1.090 0.872 0.833 0.833 CA 1.717 13 residues pruned to eliminate duplicates Z: 16 33.323 1.964 1.046 0.907 1.000 0.667 CA 1.522 16 residues pruned to eliminate duplicates Z: 10 22.230 2.026 0.886 0.881 1.000 0.667 CA 1.404 10 residues pruned to eliminate duplicates Z: 78 76.705 2.323 0.995 0.653 0.974 0.688 CB 1.679 78 residues pruned to eliminate duplicates Z: 22 19.776 2.153 0.791 0.529 0.810 0.667 CB 1.344 19 residues pruned to eliminate duplicates Z: 79 58.403 2.146 1.028 0.602 0.936 0.667 CB 1.474 79 residues pruned to eliminate duplicates Z: 7 5.389 1.822 0.507 0.524 0.833 0.667 CB 0.938 7 residues pruned to eliminate duplicates Z: 9 15.835 1.832 0.974 0.887 1.000 0.875 CB 1.116 9 residues pruned to eliminate duplicates Z: 92 63.407 2.290 0.864 0.535 0.912 0.593 CB 1.649 86 residues pruned to eliminate duplicates Z: 9 25.539 2.292 0.811 0.906 1.000 0.875 CB 1.547 9 residues pruned to eliminate duplicates Z: 11 15.418 1.852 0.857 0.654 0.900 0.600 CA 1.365 11 residues pruned to eliminate duplicates Z: 16 42.049 2.388 1.266 0.915 0.933 0.800 CB 1.519 16 residues pruned to eliminate duplicates Z: 17 23.565 2.050 0.993 0.510 0.938 0.500 CA 1.523 16 residues pruned to eliminate duplicates Z: 18 37.943 2.150 1.041 0.916 1.000 0.765 CA 1.481 18 residues pruned to eliminate duplicates Z: 34 25.201 2.155 0.629 0.434 0.909 0.576 CB 1.472 24 residues pruned to eliminate duplicates Z: 42 37.933 2.229 0.944 0.564 0.927 0.561 CB 1.386 42 residues pruned to eliminate duplicates Z: 18 39.271 2.351 1.237 0.836 0.941 0.647 CB 1.440 18 residues pruned to eliminate duplicates Z: 10 15.024 1.969 0.693 0.761 0.889 0.778 CA 1.340 10 residues pruned to eliminate duplicates Z: 49 36.205 2.201 0.851 0.586 0.875 0.708 CB 1.350 49 residues pruned to eliminate duplicates Z: 9 15.947 1.953 0.612 0.735 1.000 0.625 CB 1.449 9 residues pruned to eliminate duplicates Z: 8 17.420 2.292 0.552 0.642 1.000 0.857 CB 1.622 8 residues pruned to eliminate duplicates Z: 13 33.401 2.216 0.879 0.841 1.000 0.667 CB 1.727 13 residues pruned to eliminate duplicates Z: 10 18.488 2.141 0.750 0.752 1.000 0.667 CA 1.314 10 residues pruned to eliminate duplicates Z: 18 18.516 2.061 0.468 0.507 1.000 0.647 CB 1.474 29 residues pruned to eliminate duplicates Z: 165 92.771 2.271 0.936 0.579 0.939 0.640 CB 1.626 167 residues pruned to eliminate duplicates Z: 17 40.658 2.256 0.997 0.911 1.000 0.750 CB 1.599 17 residues pruned to eliminate duplicates Z: 16 42.525 2.234 1.210 0.917 1.000 0.733 CB 1.570 16 residues pruned to eliminate duplicates Z: 38 34.728 2.062 0.845 0.602 0.973 0.622 CB 1.399 38 residues pruned to eliminate duplicates Z: 10 18.464 1.956 0.652 0.903 1.000 0.667 CB 1.358 10 residues pruned to eliminate duplicates Z: 9 16.514 2.000 1.263 0.716 0.875 0.625 CB 1.212 4 residues pruned to eliminate duplicates Z: 10 19.618 2.066 0.951 0.727 1.000 0.667 CA 1.322 10 residues pruned to eliminate duplicates Z: 10 13.631 1.941 0.714 0.721 0.889 0.556 CA 1.258 10 residues pruned to eliminate duplicates Z: 14 21.779 2.313 0.506 0.871 0.846 0.846 CA 1.495 14 residues pruned to eliminate duplicates Z: 18 38.618 2.144 1.038 0.895 1.000 0.765 CB 1.537 18 residues pruned to eliminate duplicates Z: 9 5.195 1.882 0.349 0.335 0.625 0.375 CB 1.386 9 residues pruned to eliminate duplicates Z: 10 20.555 1.973 1.115 0.797 0.889 0.667 CA 1.424 10 residues pruned to eliminate duplicates Z: 7 7.706 1.863 0.165 0.737 1.000 0.500 CB 1.171 7 residues pruned to eliminate duplicates Z: 81 59.765 2.173 0.889 0.644 0.938 0.575 CB 1.518 81 residues pruned to eliminate duplicates Z: 11 17.018 1.904 0.739 0.818 0.900 0.700 CA 1.370 11 residues pruned to eliminate duplicates Z: 14 30.751 2.395 0.892 0.902 0.923 0.538 CB 1.454 14 residues pruned to eliminate duplicates Z: 124 79.493 2.259 0.919 0.623 0.943 0.618 CB 1.562 124 residues pruned to eliminate duplicates Z: 16 27.808 2.113 0.929 0.866 0.933 0.800 CA 1.381 16 residues pruned to eliminate duplicates Z: 16 41.213 2.288 1.136 0.928 0.933 0.600 CA 1.633 16 residues pruned to eliminate duplicates Z: 10 17.384 1.991 0.402 0.920 1.000 0.667 CB 1.462 10 residues pruned to eliminate duplicates Z: 18 22.820 2.246 0.974 0.415 0.824 0.529 CB 1.657 18 residues pruned to eliminate duplicates Z: 16 14.748 1.800 0.612 0.900 0.933 0.667 CB 1.004 16 residues pruned to eliminate duplicates Z: 60 68.429 2.308 1.045 0.674 0.949 0.678 CB 1.695 60 residues pruned to eliminate duplicates Z: 16 24.657 2.193 0.527 0.919 0.933 0.733 CA 1.436 16 residues pruned to eliminate duplicates Z: 12 19.700 1.976 0.605 0.867 1.000 0.818 CB 1.371 12 residues pruned to eliminate duplicates Z: 16 35.695 2.150 1.053 0.919 1.000 0.733 CA 1.472 16 residues pruned to eliminate duplicates Z: 47 31.781 2.204 0.731 0.471 0.804 0.543 CB 1.573 44 residues pruned to eliminate duplicates Z: 17 33.774 2.179 0.999 0.803 1.000 0.750 CA 1.488 17 residues pruned to eliminate duplicates Z: 17 41.391 2.167 1.105 0.894 1.000 0.625 CA 1.628 17 residues pruned to eliminate duplicates Z: 12 15.770 2.091 0.745 0.590 0.818 0.818 CB 1.461 12 residues pruned to eliminate duplicates Z: 12 36.342 2.376 0.841 0.916 1.000 0.909 CB 1.769 12 residues pruned to eliminate duplicates Z: 15 23.342 2.213 0.506 0.885 1.000 0.857 CA 1.352 15 residues pruned to eliminate duplicates Z: 10 21.252 1.925 0.822 0.844 1.000 0.778 CA 1.503 10 residues pruned to eliminate duplicates Z: 73 53.163 2.148 0.752 0.611 0.944 0.583 CB 1.587 73 residues pruned to eliminate duplicates Z: 90 62.316 2.187 0.934 0.610 0.921 0.629 CB 1.527 90 residues pruned to eliminate duplicates Z: 11 13.934 1.956 0.310 0.834 0.800 0.700 CA 1.611 11 residues pruned to eliminate duplicates Z: 14 25.384 2.361 0.726 0.918 0.846 0.769 CB 1.440 14 residues pruned to eliminate duplicates Z: 25 22.319 2.208 0.647 0.484 0.833 0.667 CB 1.527 25 residues pruned to eliminate duplicates Z: 16 35.810 2.088 1.081 0.938 1.000 0.867 CB 1.480 16 residues pruned to eliminate duplicates Z: 16 50.648 2.311 1.572 0.945 0.933 0.400 CB 1.631 16 residues pruned to eliminate duplicates Z: 13 35.961 2.371 1.283 0.831 0.833 0.833 CB 1.729 13 residues pruned to eliminate duplicates Z: 13 45.969 2.425 1.001 0.932 1.000 0.750 CA 1.909 13 residues pruned to eliminate duplicates Z: 11 17.589 1.904 0.825 0.791 0.900 0.500 CA 1.377 11 residues pruned to eliminate duplicates Z: 10 12.666 1.943 0.366 0.843 0.889 0.778 CB 1.332 10 residues pruned to eliminate duplicates Z: 82 61.442 2.213 0.996 0.593 0.914 0.630 CB 1.548 82 residues pruned to eliminate duplicates Z: 9 5.100 1.816 0.839 0.346 0.500 0.500 CB 1.276 Z: 34 29.658 2.200 0.836 0.421 0.909 0.697 CB 1.527 34 residues pruned to eliminate duplicates Z: 10 13.192 2.077 0.644 0.488 0.889 0.444 CB 1.467 10 residues pruned to eliminate duplicates Z: 28 21.793 2.047 0.828 0.425 0.852 0.481 CB 1.422 28 residues pruned to eliminate duplicates Z: 71 66.268 2.274 1.002 0.635 0.929 0.671 CB 1.652 71 residues pruned to eliminate duplicates Z: 129 86.550 2.339 1.027 0.611 0.898 0.617 CB 1.617 129 residues pruned to eliminate duplicates Z: 15 39.119 2.207 1.094 0.923 1.000 0.786 CB 1.589 15 residues pruned to eliminate duplicates Z: 17 10.277 1.745 0.553 0.307 0.875 0.438 CB 1.342 Z: 15 39.912 2.341 1.141 0.902 0.929 0.429 CB 1.635 15 residues pruned to eliminate duplicates Z: 14 23.858 1.907 0.835 0.830 0.923 0.385 CB 1.540 14 residues pruned to eliminate duplicates Z: 13 30.262 2.146 0.935 0.886 1.000 0.833 CB 1.517 13 residues pruned to eliminate duplicates Z: 14 30.467 2.222 0.859 0.876 1.000 0.769 CA 1.487 14 residues pruned to eliminate duplicates Z: 8 20.197 2.291 1.093 0.673 0.857 0.714 CB 1.584 8 residues pruned to eliminate duplicates Z: 88 70.453 2.281 0.988 0.613 0.931 0.655 CB 1.608 88 residues pruned to eliminate duplicates Z: 122 83.937 2.361 1.032 0.572 0.901 0.603 CB 1.647 122 residues pruned to eliminate duplicates Z: 22 34.941 2.103 1.164 0.742 0.905 0.571 CA 1.491 22 residues pruned to eliminate duplicates Z: 16 11.730 2.076 0.562 0.256 0.800 0.533 CA 1.546 16 residues pruned to eliminate duplicates Z: 10 18.599 2.246 0.389 0.876 1.000 0.889 CB 1.444 10 residues pruned to eliminate duplicates Z: 17 39.419 2.229 1.061 0.879 1.000 0.812 CB 1.556 17 residues pruned to eliminate duplicates Z: 9 27.019 2.327 0.840 0.915 1.000 0.875 CB 1.576 9 residues pruned to eliminate duplicates Z: 14 35.935 2.269 0.965 0.869 1.000 0.846 CA 1.633 14 residues pruned to eliminate duplicates Z: 13 45.023 2.484 1.061 0.925 1.000 0.833 CA 1.782 13 residues pruned to eliminate duplicates Z: 14 34.843 2.451 0.886 0.930 1.000 0.923 CB 1.462 14 residues pruned to eliminate duplicates Z: 32 54.925 2.344 1.214 0.686 0.935 0.710 CB 1.713 32 residues pruned to eliminate duplicates Z: 13 18.839 1.952 0.782 0.783 0.833 0.750 CA 1.462 13 residues pruned to eliminate duplicates Z: 13 34.026 2.174 0.891 0.905 1.000 0.833 CA 1.701 13 residues pruned to eliminate duplicates Z: 88 80.656 2.389 1.121 0.592 0.931 0.586 CB 1.678 88 residues pruned to eliminate duplicates Z: 15 36.814 2.280 1.213 0.926 1.000 0.786 CA 1.368 15 residues pruned to eliminate duplicates Z: 58 47.743 2.084 0.938 0.628 0.930 0.614 CB 1.493 58 residues pruned to eliminate duplicates Z: 16 27.506 2.031 0.776 0.907 1.000 0.733 CA 1.399 16 residues pruned to eliminate duplicates Z: 18 33.327 2.132 0.850 0.894 0.941 0.765 CB 1.562 18 residues pruned to eliminate duplicates Z: 15 32.005 2.235 0.819 0.879 1.000 0.571 CA 1.525 15 residues pruned to eliminate duplicates Z: 58 61.577 2.329 1.000 0.586 0.965 0.632 CB 1.671 58 residues pruned to eliminate duplicates Z: 115 83.301 2.240 0.976 0.650 0.947 0.667 CB 1.617 115 residues pruned to eliminate duplicates Z: 16 44.821 2.379 1.054 0.932 1.000 0.867 CB 1.654 16 residues pruned to eliminate duplicates Z: 15 35.487 2.335 0.775 0.925 1.000 0.500 CB 1.606 15 residues pruned to eliminate duplicates Z: 19 18.772 2.066 0.721 0.467 0.833 0.500 CA 1.543 19 residues pruned to eliminate duplicates Z: 59 53.431 2.359 0.935 0.593 0.897 0.638 CB 1.569 59 residues pruned to eliminate duplicates Z: 10 16.674 2.221 0.564 0.817 0.778 0.667 CB 1.561 10 residues pruned to eliminate duplicates Z: 204 96.038 2.302 0.919 0.571 0.911 0.631 CB 1.563 204 residues pruned to eliminate duplicates Z: 15 34.344 2.199 1.134 0.924 0.929 0.714 CA 1.479 15 residues pruned to eliminate duplicates Z: 13 33.603 2.340 0.849 0.854 0.917 0.667 CB 1.806 13 residues pruned to eliminate duplicates Z: 9 19.054 2.113 0.463 0.910 1.000 0.750 CB 1.546 9 residues pruned to eliminate duplicates Z: 17 39.282 2.246 1.049 0.911 1.000 0.750 CB 1.513 17 residues pruned to eliminate duplicates Z: 198 97.067 2.309 0.939 0.568 0.919 0.619 CB 1.573 196 residues pruned to eliminate duplicates Z: 14 27.209 2.115 1.078 0.934 0.846 0.462 CB 1.415 14 residues pruned to eliminate duplicates Z: 30 16.074 2.033 0.376 0.378 0.828 0.483 CB 1.468 30 residues pruned to eliminate duplicates Z: 16 24.229 2.133 0.597 0.900 1.000 0.933 CA 1.312 16 residues pruned to eliminate duplicates Z: 9 25.082 2.284 0.845 0.922 1.000 1.000 CB 1.480 9 residues pruned to eliminate duplicates Z: 9 16.464 2.091 1.032 0.746 0.750 0.500 CA 1.465 9 residues pruned to eliminate duplicates Z: 14 28.028 2.125 0.737 0.915 1.000 0.692 CB 1.489 14 residues pruned to eliminate duplicates Z: 10 18.641 2.137 0.448 0.880 1.000 0.556 CB 1.454 10 residues pruned to eliminate duplicates Z: 23 16.589 1.896 0.634 0.346 0.909 0.545 CB 1.484 23 residues pruned to eliminate duplicates Z: 15 43.088 2.390 1.309 0.940 1.000 0.714 CB 1.449 15 residues pruned to eliminate duplicates Z: 10 12.691 2.053 0.615 0.697 0.889 0.667 CA 1.200 10 residues pruned to eliminate duplicates Z: 84 77.082 2.273 1.076 0.644 0.940 0.627 CB 1.668 84 residues pruned to eliminate duplicates Z: 20 17.135 2.082 0.834 0.428 0.842 0.579 CB 1.317 18 residues pruned to eliminate duplicates Z: 71 79.642 2.352 1.251 0.659 0.929 0.629 CB 1.671 71 residues pruned to eliminate duplicates Z: 18 35.810 2.090 0.854 0.917 1.000 0.941 CB 1.581 18 residues pruned to eliminate duplicates Z: 29 18.045 2.028 0.742 0.453 0.750 0.464 CB 1.350 29 residues pruned to eliminate duplicates Z: 34 42.265 2.174 1.085 0.612 0.909 0.697 CB 1.605 34 residues pruned to eliminate duplicates Z: 13 15.219 1.913 0.556 0.722 0.917 0.667 CB 1.318 13 residues pruned to eliminate duplicates Z: 16 42.813 2.340 1.111 0.924 1.000 0.667 CB 1.571 16 residues pruned to eliminate duplicates Z: 14 25.801 2.370 0.600 0.915 0.923 0.769 CA 1.445 14 residues pruned to eliminate duplicates Z: 14 25.624 2.294 0.620 0.934 1.000 0.846 CB 1.334 14 residues pruned to eliminate duplicates Z: 11 16.311 1.929 0.628 0.703 1.000 0.500 CB 1.365 11 residues pruned to eliminate duplicates Z: 16 15.802 1.689 0.648 0.882 1.000 0.733 CB 1.061 16 residues pruned to eliminate duplicates Z: 75 65.638 2.205 1.000 0.661 0.946 0.649 CB 1.575 75 residues pruned to eliminate duplicates Z: 12 38.859 2.372 0.935 0.938 1.000 0.909 CB 1.775 12 residues pruned to eliminate duplicates Z: 14 42.172 2.450 1.228 0.925 1.000 0.692 CB 1.504 14 residues pruned to eliminate duplicates Z: 16 25.090 2.047 0.643 0.909 1.000 0.400 CB 1.367 16 residues pruned to eliminate duplicates Z: 90 67.350 2.261 0.968 0.596 0.921 0.629 CB 1.588 88 residues pruned to eliminate duplicates Z: 83 76.718 2.317 1.057 0.637 0.951 0.659 CB 1.643 89 residues pruned to eliminate duplicates Z: 16 42.494 2.343 0.966 0.945 0.933 0.800 CB 1.766 16 residues pruned to eliminate duplicates Z: 10 25.103 2.307 0.637 0.874 1.000 0.889 CB 1.613 10 residues pruned to eliminate duplicates Z: 17 39.126 2.270 0.870 0.933 0.938 0.812 CB 1.716 17 residues pruned to eliminate duplicates Z: 10 12.415 1.939 0.261 0.847 0.889 0.778 CB 1.414 10 residues pruned to eliminate duplicates Z: 11 18.079 1.736 1.200 0.799 1.000 0.700 CB 1.152 11 residues pruned to eliminate duplicates Z: 88 76.942 2.269 1.094 0.640 0.966 0.690 CB 1.578 88 residues pruned to eliminate duplicates Z: 80 68.199 2.384 0.975 0.569 0.924 0.633 CB 1.650 80 residues pruned to eliminate duplicates Z: 11 18.076 1.990 0.941 0.770 1.000 0.700 CB 1.165 11 residues pruned to eliminate duplicates Z: 9 8.537 2.021 0.986 0.405 0.625 0.375 CB 1.329 9 residues pruned to eliminate duplicates Z: 26 18.057 1.969 0.691 0.415 0.800 0.560 CA 1.482 26 residues pruned to eliminate duplicates Z: 112 67.054 2.190 0.896 0.593 0.928 0.622 CB 1.512 112 residues pruned to eliminate duplicates Z: 15 37.041 2.295 1.251 0.865 0.929 0.857 CA 1.512 15 residues pruned to eliminate duplicates Z: 24 22.652 2.089 0.914 0.399 0.913 0.609 CB 1.439 24 residues pruned to eliminate duplicates Z: 12 15.644 2.019 0.325 0.840 1.000 1.000 CB 1.316 12 residues pruned to eliminate duplicates Z: 18 34.046 2.136 0.805 0.888 1.000 0.882 CB 1.544 18 residues pruned to eliminate duplicates Z: 6 4.762 1.992 -0.326 0.706 1.000 0.600 CB 1.316 Z: 15 34.042 2.221 0.924 0.901 1.000 0.714 CA 1.519 15 residues pruned to eliminate duplicates Z: 15 32.578 2.050 1.126 0.865 0.929 0.714 CA 1.575 15 residues pruned to eliminate duplicates Z: 11 20.377 1.785 1.236 0.814 1.000 0.900 CA 1.228 11 residues pruned to eliminate duplicates Z: 84 62.995 2.180 0.939 0.614 0.916 0.614 CB 1.604 84 residues pruned to eliminate duplicates Z: 87 76.342 2.267 1.034 0.650 0.953 0.581 CB 1.627 87 residues pruned to eliminate duplicates Z: 29 43.251 2.389 1.002 0.617 0.929 0.607 CB 1.648 29 residues pruned to eliminate duplicates Z: 10 19.113 2.095 0.733 0.822 1.000 0.556 CA 1.327 10 residues pruned to eliminate duplicates Z: 165 92.368 2.260 0.959 0.586 0.927 0.659 CB 1.619 165 residues pruned to eliminate duplicates Z: 136 90.888 2.294 1.038 0.611 0.919 0.637 CB 1.640 136 residues pruned to eliminate duplicates Z: 15 27.465 2.250 0.852 0.926 0.857 0.429 CB 1.441 15 residues pruned to eliminate duplicates Z: 15 16.231 1.617 1.035 0.794 1.000 0.571 CB 1.019 15 residues pruned to eliminate duplicates Z: 8 6.675 1.668 0.846 0.535 0.857 0.571 CA 0.924 8 residues pruned to eliminate duplicates Z: 15 26.289 2.018 0.642 0.902 1.000 0.500 CB 1.513 15 residues pruned to eliminate duplicates Z: 15 41.714 2.380 1.012 0.929 1.000 0.929 CA 1.629 15 residues pruned to eliminate duplicates Z: 133 89.116 2.275 1.053 0.620 0.947 0.629 CB 1.566 133 residues pruned to eliminate duplicates Z: 7 9.763 1.818 0.243 0.849 1.000 0.667 CB 1.307 7 residues pruned to eliminate duplicates Z: 14 31.268 2.241 1.285 0.923 1.000 0.692 CB 1.190 14 residues pruned to eliminate duplicates Z: 10 23.800 2.054 0.994 0.808 1.000 0.667 CB 1.481 10 residues pruned to eliminate duplicates Z: 17 8.767 1.777 0.412 0.291 0.812 0.562 CB 1.359 16 residues pruned to eliminate duplicates Z: 10 14.496 2.168 0.425 0.750 0.889 0.556 CB 1.408 10 residues pruned to eliminate duplicates Z: 71 70.325 2.280 0.963 0.679 0.943 0.686 CA 1.689 71 residues pruned to eliminate duplicates Z: 17 44.387 2.290 1.309 0.897 0.938 0.688 CB 1.602 17 residues pruned to eliminate duplicates Z: 45 28.307 2.106 0.845 0.439 0.841 0.523 CB 1.391 45 residues pruned to eliminate duplicates Z: 9 18.737 2.085 0.707 0.810 1.000 0.875 CA 1.421 9 residues pruned to eliminate duplicates Z: 14 36.961 2.258 1.038 0.889 1.000 0.769 CA 1.603 14 residues pruned to eliminate duplicates Z: 69 59.279 2.227 0.916 0.601 0.971 0.647 CB 1.577 69 residues pruned to eliminate duplicates Z: 7 10.022 2.049 0.091 0.835 1.000 1.000 CA 1.371 7 residues pruned to eliminate duplicates Z: 18 23.882 2.187 0.835 0.489 0.882 0.529 CB 1.655 18 residues pruned to eliminate duplicates Z: 9 29.092 2.278 1.100 0.838 1.000 0.875 CA 1.607 9 residues pruned to eliminate duplicates Z: 14 26.136 2.214 0.891 0.926 1.000 0.769 CB 1.214 14 residues pruned to eliminate duplicates Z: 15 39.969 2.232 1.245 0.898 0.929 0.571 CA 1.641 15 residues pruned to eliminate duplicates Z: 60 48.511 2.191 0.968 0.591 0.898 0.678 CB 1.494 60 residues pruned to eliminate duplicates Z: 58 63.620 2.352 1.011 0.606 0.965 0.684 CB 1.670 58 residues pruned to eliminate duplicates Z: 16 21.352 1.947 0.725 0.884 0.867 0.733 CA 1.369 16 residues pruned to eliminate duplicates Z: 15 45.883 2.380 1.179 0.929 1.000 1.000 CA 1.654 15 residues pruned to eliminate duplicates Z: 89 64.757 2.211 0.805 0.624 0.966 0.682 CB 1.593 89 residues pruned to eliminate duplicates Z: 10 14.798 1.934 0.315 0.893 1.000 0.778 CB 1.392 10 residues pruned to eliminate duplicates Z: 13 19.544 1.892 0.398 0.901 1.000 0.833 CA 1.522 13 residues pruned to eliminate duplicates Z: 17 20.335 2.010 0.532 0.580 1.000 0.750 CB 1.529 17 residues pruned to eliminate duplicates Z: 74 64.812 2.240 0.904 0.669 0.932 0.699 CB 1.633 74 residues pruned to eliminate duplicates Z: 14 33.160 2.223 1.016 0.914 0.923 0.385 CB 1.572 14 residues pruned to eliminate duplicates Z: 17 27.604 2.334 0.929 0.783 0.875 0.562 CB 1.365 17 residues pruned to eliminate duplicates Z: 11 18.754 1.962 0.952 0.828 1.000 0.800 CB 1.166 11 residues pruned to eliminate duplicates Z: 114 72.725 2.356 0.907 0.549 0.929 0.646 CB 1.563 114 residues pruned to eliminate duplicates Z: 118 75.923 2.249 0.823 0.615 0.923 0.650 CB 1.662 118 residues pruned to eliminate duplicates Z: 11 12.592 1.708 0.450 0.767 0.900 0.600 CA 1.410 11 residues pruned to eliminate duplicates Z: 36 54.023 2.371 1.105 0.667 0.914 0.600 CA 1.714 36 residues pruned to eliminate duplicates Z: 11 13.921 1.739 0.590 0.811 1.000 0.800 CA 1.214 11 residues pruned to eliminate duplicates Z: 8 8.739 1.774 0.409 0.672 1.000 0.714 CB 1.127 8 residues pruned to eliminate duplicates Z: 72 56.110 2.165 0.837 0.621 0.958 0.676 CB 1.559 72 residues pruned to eliminate duplicates Z: 15 41.906 2.266 1.258 0.921 1.000 0.857 CB 1.541 15 residues pruned to eliminate duplicates Z: 16 26.799 2.151 0.609 0.920 1.000 0.800 CA 1.408 16 residues pruned to eliminate duplicates Z: 8 16.155 2.139 1.154 0.709 0.857 0.714 CB 1.279 8 residues pruned to eliminate duplicates Z: 15 28.445 2.238 0.901 0.932 1.000 0.571 CB 1.248 15 residues pruned to eliminate duplicates Z: 14 29.694 2.117 0.912 0.921 0.923 0.923 CB 1.551 14 residues pruned to eliminate duplicates Z: 17 27.033 1.904 0.690 0.917 1.000 0.688 CB 1.483 17 residues pruned to eliminate duplicates Z: 7 2.954 1.720 0.630 0.298 0.500 0.333 CB 1.078 7 residues pruned to eliminate duplicates Z: 15 23.577 2.061 0.498 0.907 0.929 0.786 CB 1.561 15 residues pruned to eliminate duplicates Z: 18 22.299 1.961 0.546 0.668 1.000 0.765 CB 1.527 26 residues pruned to eliminate duplicates Z: 10 18.317 2.035 1.068 0.603 0.889 0.889 CA 1.480 6 residues pruned to eliminate duplicates Z: 24 16.562 2.047 0.479 0.383 0.913 0.696 CB 1.415 24 residues pruned to eliminate duplicates Z: 10 14.666 1.968 0.679 0.846 0.889 0.556 CB 1.237 10 residues pruned to eliminate duplicates Z: 10 27.770 2.281 0.928 0.918 1.000 0.667 CB 1.484 10 residues pruned to eliminate duplicates Z: 16 21.163 2.040 0.330 0.922 1.000 0.800 CA 1.416 16 residues pruned to eliminate duplicates Z: 18 20.165 2.002 0.582 0.547 1.000 0.647 CB 1.474 19 residues pruned to eliminate duplicates Z: 122 84.567 2.313 1.015 0.612 0.926 0.661 CB 1.603 122 residues pruned to eliminate duplicates Z: 10 20.230 2.195 0.450 0.892 1.000 1.000 CB 1.523 10 residues pruned to eliminate duplicates Z: 15 26.199 2.087 1.126 0.754 0.857 0.643 CA 1.468 15 residues pruned to eliminate duplicates Z: 143 91.384 2.229 0.972 0.663 0.944 0.655 CB 1.591 285 residues pruned to eliminate duplicates Z: 15 22.219 2.053 0.268 0.920 1.000 0.857 CB 1.607 15 residues pruned to eliminate duplicates Z: 12 28.131 2.346 0.599 0.910 1.000 0.727 CB 1.604 Z: 80 69.331 2.285 1.110 0.604 0.924 0.595 CB 1.586 80 residues pruned to eliminate duplicates Z: 36 35.896 2.123 0.840 0.554 0.943 0.543 CB 1.563 36 residues pruned to eliminate duplicates Z: 8 13.730 2.341 0.601 0.831 0.714 0.714 CB 1.456 8 residues pruned to eliminate duplicates Z: 10 19.894 2.240 0.313 0.928 1.000 1.000 CB 1.579 10 residues pruned to eliminate duplicates Z: 91 79.203 2.335 1.013 0.669 0.911 0.656 CB 1.667 91 residues pruned to eliminate duplicates Z: 11 18.415 1.823 0.897 0.809 1.000 0.800 CB 1.286 11 residues pruned to eliminate duplicates Z: 11 15.684 1.835 0.536 0.933 1.000 0.900 CB 1.228 11 residues pruned to eliminate duplicates Z: 12 12.302 1.696 0.811 0.806 1.000 0.818 CB 0.924 12 residues pruned to eliminate duplicates Z: 117 84.985 2.240 0.972 0.646 0.957 0.586 CB 1.629 12 residues pruned to eliminate duplicates Z: 67 51.576 2.143 0.902 0.632 0.939 0.682 CB 1.465 67 residues pruned to eliminate duplicates Z: 73 69.904 2.313 0.931 0.663 0.944 0.694 CB 1.679 73 residues pruned to eliminate duplicates Z: 88 73.765 2.269 1.035 0.655 0.931 0.632 CB 1.594 88 residues pruned to eliminate duplicates Z: 11 23.545 2.109 1.022 0.938 1.000 0.600 CB 1.214 11 residues pruned to eliminate duplicates Z: 16 45.096 2.346 1.041 0.936 1.000 0.933 CA 1.694 16 residues pruned to eliminate duplicates Z: 10 15.843 2.091 0.616 0.717 0.889 0.667 CA 1.445 10 residues pruned to eliminate duplicates Z: 15 27.174 2.024 0.721 0.897 1.000 0.714 CB 1.493 15 residues pruned to eliminate duplicates Z: 13 19.642 2.207 0.714 0.895 0.917 0.667 CB 1.172 13 residues pruned to eliminate duplicates Z: 23 13.585 2.027 0.408 0.320 0.818 0.500 CB 1.513 23 residues pruned to eliminate duplicates Z: 14 22.102 2.191 0.427 0.903 0.923 0.692 CB 1.514 14 residues pruned to eliminate duplicates Z: 15 25.097 2.177 0.704 0.877 0.929 0.643 CA 1.414 15 residues pruned to eliminate duplicates Z: 11 12.117 1.942 0.929 0.566 0.800 0.600 CB 1.200 11 residues pruned to eliminate duplicates Z: 119 91.656 2.315 1.073 0.637 0.941 0.661 CB 1.643 119 residues pruned to eliminate duplicates Z: 9 5.199 1.769 0.267 0.445 0.750 0.500 CA 1.157 9 residues pruned to eliminate duplicates Z: 17 40.367 2.262 1.255 0.925 0.938 0.625 CB 1.481 17 residues pruned to eliminate duplicates Z: 11 17.777 1.893 0.919 0.797 0.900 0.700 CA 1.325 11 residues pruned to eliminate duplicates Z: 12 41.156 2.549 1.123 0.903 0.909 0.818 CA 1.797 12 residues pruned to eliminate duplicates Z: 13 41.110 2.229 1.118 0.923 1.000 0.667 CB 1.766 13 residues pruned to eliminate duplicates Z: 14 17.433 1.955 0.655 0.927 1.000 0.846 CB 1.047 14 residues pruned to eliminate duplicates Z: 14 13.644 2.055 0.557 0.524 0.846 0.769 CB 1.365 14 residues pruned to eliminate duplicates Z: 12 12.821 1.627 0.768 0.787 1.000 0.545 CB 1.044 12 residues pruned to eliminate duplicates Z: 16 23.938 2.085 0.653 0.899 0.933 0.933 CA 1.374 16 residues pruned to eliminate duplicates Z: 9 15.340 2.052 0.808 0.647 0.875 0.750 CB 1.457 10 residues pruned to eliminate duplicates Z: 10 21.396 2.258 0.371 0.918 1.000 1.000 CB 1.624 10 residues pruned to eliminate duplicates Z: 17 26.090 2.053 0.703 0.900 0.938 0.688 CA 1.421 17 residues pruned to eliminate duplicates Z: 11 23.058 2.156 0.745 0.876 1.000 0.900 CB 1.408 11 residues pruned to eliminate duplicates Z: 11 16.554 1.910 0.526 0.840 1.000 0.700 CB 1.340 11 residues pruned to eliminate duplicates Z: 6 7.471 1.995 0.454 0.584 0.800 0.600 CB 1.328 Z: 22 38.068 2.333 0.878 0.662 0.952 0.476 CB 1.713 22 residues pruned to eliminate duplicates Z: 60 37.930 2.178 0.695 0.478 0.881 0.610 CB 1.552 60 residues pruned to eliminate duplicates Z: 17 47.597 2.264 1.491 0.901 0.938 0.562 CB 1.607 17 residues pruned to eliminate duplicates Z: 7 3.889 1.953 -0.268 0.635 0.833 0.500 CB 1.174 Z: 82 56.573 2.294 0.916 0.536 0.926 0.617 CB 1.491 82 residues pruned to eliminate duplicates Z: 88 62.292 2.219 0.809 0.620 0.931 0.655 CB 1.595 88 residues pruned to eliminate duplicates Z: 18 27.137 2.014 0.800 0.839 0.941 0.765 CB 1.441 18 residues pruned to eliminate duplicates Z: 13 17.135 2.056 0.853 0.593 0.917 0.583 CB 1.296 13 residues pruned to eliminate duplicates Z: 16 30.438 2.084 0.813 0.889 1.000 0.733 CA 1.498 16 residues pruned to eliminate duplicates Z: 231 103.106 2.283 0.927 0.553 0.891 0.609 CB 1.647 309 residues pruned to eliminate duplicates Z: 15 12.861 1.810 0.124 0.919 1.000 0.857 CB 1.191 Z: 11 16.017 2.255 0.150 0.777 1.000 0.600 CB 1.531 Z: 17 8.659 1.812 0.401 0.220 0.875 0.625 CA 1.354 17 residues pruned to eliminate duplicates Z: 16 41.870 2.324 1.251 0.923 1.000 0.733 CB 1.452 16 residues pruned to eliminate duplicates Z: 12 31.661 2.293 1.395 0.604 1.000 0.818 CB 1.575 12 residues pruned to eliminate duplicates Z: 10 8.977 1.923 0.987 0.685 0.778 0.667 CB 0.850 Z: 22 36.410 2.310 1.047 0.651 0.905 0.762 CB 1.615 22 residues pruned to eliminate duplicates Z: 22 35.557 2.101 1.021 0.821 0.905 0.762 CB 1.530 22 residues pruned to eliminate duplicates Z: 47 26.070 2.154 0.393 0.499 0.935 0.674 CB 1.371 47 residues pruned to eliminate duplicates Z: 89 67.266 2.223 0.988 0.630 0.909 0.602 CB 1.580 99 residues pruned to eliminate duplicates Z: 90 56.965 2.182 0.883 0.610 0.921 0.618 CB 1.437 90 residues pruned to eliminate duplicates Z: 82 71.111 2.303 0.983 0.651 0.951 0.716 CB 1.582 82 residues pruned to eliminate duplicates Z: 10 19.954 2.031 0.833 0.789 1.000 0.556 CB 1.387 Z: 15 29.304 2.146 0.763 0.907 1.000 0.857 CA 1.471 Z: 18 34.326 2.129 0.810 0.891 1.000 0.765 CB 1.553 18 residues pruned to eliminate duplicates Z: 15 9.299 1.596 0.475 0.363 0.929 0.500 N 1.317 Z: 14 29.042 2.144 0.949 0.814 0.923 0.769 CA 1.589 14 residues pruned to eliminate duplicates Z: 16 12.190 1.742 0.186 0.895 0.933 0.867 CB 1.170 16 residues pruned to eliminate duplicates Z: 17 21.544 1.975 0.590 0.847 0.938 0.750 CA 1.358 17 residues pruned to eliminate duplicates Z: 10 14.898 2.032 0.463 0.897 0.889 0.889 CA 1.344 Z: 24 23.270 2.215 0.859 0.468 0.826 0.565 CB 1.474 Z: 19 42.305 2.374 1.324 0.818 1.000 0.667 CB 1.372 19 residues pruned to eliminate duplicates Z: 11 17.459 1.884 0.735 0.780 1.000 0.700 CA 1.320 11 residues pruned to eliminate duplicates Z: 10 12.101 1.811 0.289 0.780 0.889 0.778 CA 1.519 10 residues pruned to eliminate duplicates Z: 17 26.032 2.000 0.792 0.886 1.000 0.750 CA 1.311 15 residues pruned to eliminate duplicates Z: 10 13.942 1.904 1.093 0.766 0.889 0.667 CB 1.036 10 residues pruned to eliminate duplicates Z: 86 69.354 2.242 0.836 0.662 0.941 0.765 CB 1.672 86 residues pruned to eliminate duplicates Z: 17 23.826 1.975 0.608 0.908 1.000 0.812 CA 1.333 17 residues pruned to eliminate duplicates Z: 50 51.772 2.216 1.037 0.643 0.918 0.612 CB 1.561 50 residues pruned to eliminate duplicates Z: 122 76.184 2.296 0.971 0.545 0.884 0.653 CB 1.656 122 residues pruned to eliminate duplicates Z: 16 27.891 2.133 0.851 0.913 0.933 0.867 CA 1.383 16 residues pruned to eliminate duplicates Z: 63 58.088 2.312 0.900 0.593 0.903 0.677 CB 1.701 63 residues pruned to eliminate duplicates Z: 11 17.526 1.797 1.082 0.778 1.000 0.600 CA 1.159 11 residues pruned to eliminate duplicates Z: 8 8.476 1.706 0.951 0.468 1.000 0.714 CA 0.995 Z: 14 22.930 2.177 0.631 0.829 0.846 0.615 CA 1.593 14 residues pruned to eliminate duplicates Z: 18 51.359 2.301 1.564 0.935 1.000 0.471 CB 1.471 18 residues pruned to eliminate duplicates Z: 28 31.867 2.124 0.952 0.578 0.926 0.630 CB 1.482 28 residues pruned to eliminate duplicates Z: 10 15.916 1.934 1.005 0.778 0.889 0.778 CB 1.204 10 residues pruned to eliminate duplicates Z: 15 37.461 2.200 1.045 0.907 1.000 0.500 CA 1.581 17 residues pruned to eliminate duplicates Z: 46 45.414 2.199 0.862 0.645 0.911 0.644 CB 1.586 46 residues pruned to eliminate duplicates Z: 17 29.087 2.008 1.128 0.875 0.875 0.375 CA 1.415 17 residues pruned to eliminate duplicates Z: 6 5.376 1.953 -0.185 0.551 1.000 0.600 N 1.436 Z: 10 14.125 1.909 0.844 0.857 0.778 0.556 CB 1.267 10 residues pruned to eliminate duplicates Z: 60 59.372 2.416 1.037 0.570 0.915 0.576 CB 1.604 60 residues pruned to eliminate duplicates Z: 11 11.201 1.815 0.156 0.779 1.000 0.700 CA 1.320 10 residues pruned to eliminate duplicates Z: 6 3.905 1.780 0.636 0.645 0.600 0.600 CB 0.873 Z: 17 21.725 2.146 0.911 0.503 0.938 0.562 CB 1.409 Z: 6 12.325 1.834 0.811 0.856 1.000 0.600 CA 1.224 Z: 16 33.227 2.127 1.054 0.924 1.000 0.867 CA 1.380 15 residues pruned to eliminate duplicates Z: 11 24.231 2.110 1.155 0.680 0.900 0.800 CB 1.587 11 residues pruned to eliminate duplicates Z: 90 65.519 2.182 0.934 0.630 0.933 0.584 CB 1.562 90 residues pruned to eliminate duplicates Z: 55 43.977 2.098 0.844 0.629 0.889 0.593 CB 1.541 71 residues pruned to eliminate duplicates Z: 7 10.613 1.943 0.257 0.713 1.000 0.500 CB 1.463 Z: 71 54.931 2.174 0.783 0.620 0.957 0.643 CB 1.580 70 residues pruned to eliminate duplicates Z: 8 18.758 2.119 0.677 0.880 0.857 0.714 N 1.686 8 residues pruned to eliminate duplicates Z: 6 8.011 1.809 0.719 0.657 0.800 0.600 C 1.245 6 residues pruned to eliminate duplicates Z: 118 77.381 2.228 0.850 0.634 0.932 0.650 CB 1.642 118 residues pruned to eliminate duplicates Z: 16 51.688 2.332 1.697 0.943 1.000 0.600 CB 1.471 16 residues pruned to eliminate duplicates Z: 73 54.501 2.188 0.691 0.632 0.931 0.639 CB 1.648 71 residues pruned to eliminate duplicates Z: 11 17.565 2.169 0.342 0.832 0.900 0.700 CB 1.591 11 residues pruned to eliminate duplicates Z: 14 34.543 2.332 0.853 0.920 1.000 0.923 CB 1.562 14 residues pruned to eliminate duplicates Z: 147 84.809 2.192 0.887 0.634 0.952 0.623 CB 1.572 148 residues pruned to eliminate duplicates Z: 59 43.284 2.205 1.002 0.487 0.948 0.655 CB 1.375 59 residues pruned to eliminate duplicates 7 1.544 1.590 0.394 0.311 0.667 0.500 CB 0.526 ? Z: 14 41.079 2.340 1.124 0.929 1.000 1.000 CA 1.604 14 residues pruned to eliminate duplicates Z: 13 25.585 2.252 0.831 0.936 1.000 1.000 CB 1.248 Z: 33 46.070 2.307 1.107 0.586 0.875 0.656 CB 1.763 33 residues pruned to eliminate duplicates Z: 13 13.935 1.895 0.594 0.913 1.000 0.667 CB 0.942 13 residues pruned to eliminate duplicates Z: 17 23.775 1.923 0.775 0.867 1.000 0.438 CB 1.274 17 residues pruned to eliminate duplicates Z: 75 53.435 2.204 0.842 0.530 0.959 0.608 CB 1.548 75 residues pruned to eliminate duplicates Z: 12 32.121 2.314 0.815 0.889 1.000 0.818 CB 1.661 12 residues pruned to eliminate duplicates Z: 9 20.039 2.199 0.869 0.827 0.875 0.875 CA 1.485 9 residues pruned to eliminate duplicates Z: 74 71.587 2.285 0.964 0.669 0.945 0.685 CB 1.689 111 residues pruned to eliminate duplicates Z: 210 95.950 2.245 0.890 0.560 0.928 0.636 CB 1.589 210 residues pruned to eliminate duplicates Z: 7 2.133 1.465 0.721 0.248 0.667 0.500 CB 0.692 Z: 93 65.401 2.172 0.934 0.605 0.946 0.641 CB 1.553 93 residues pruned to eliminate duplicates Z: 14 27.385 2.114 0.565 0.930 1.000 1.000 CB 1.605 14 residues pruned to eliminate duplicates Z: 15 22.160 2.161 0.705 0.824 0.857 0.571 CB 1.416 15 residues pruned to eliminate duplicates Z: 18 21.399 1.938 0.580 0.864 0.941 0.765 CA 1.320 18 residues pruned to eliminate duplicates Z: 73 69.116 2.257 1.113 0.662 0.903 0.653 CB 1.628 73 residues pruned to eliminate duplicates Z: 71 62.411 2.247 0.881 0.661 0.929 0.671 CB 1.637 71 residues pruned to eliminate duplicates Z: 10 23.979 2.329 0.471 0.873 1.000 0.889 CB 1.700 11 residues pruned to eliminate duplicates Z: 18 26.501 2.057 0.883 0.833 0.824 0.588 CB 1.511 18 residues pruned to eliminate duplicates Z: 12 8.395 1.674 0.047 0.827 1.000 0.909 CB 1.088 12 residues pruned to eliminate duplicates Z: 21 17.867 2.117 0.601 0.397 0.850 0.500 CA 1.546 21 residues pruned to eliminate duplicates Z: 17 24.309 2.038 0.804 0.874 0.938 0.812 CA 1.284 17 residues pruned to eliminate duplicates Z: 15 12.993 1.893 0.355 0.848 0.929 0.714 CB 1.081 15 residues pruned to eliminate duplicates Z: 113 84.688 2.298 1.017 0.637 0.955 0.607 CB 1.589 113 residues pruned to eliminate duplicates Z: 144 95.241 2.308 0.968 0.644 0.937 0.699 CB 1.636 144 residues pruned to eliminate duplicates Z: 14 16.429 1.980 0.631 0.902 1.000 0.846 CB 1.006 14 residues pruned to eliminate duplicates Z: 15 16.987 1.922 0.660 0.815 0.929 0.643 CB 1.165 15 residues pruned to eliminate duplicates Z: 16 29.374 2.101 0.726 0.907 1.000 0.733 CA 1.486 Z: 6 4.673 1.741 0.231 0.672 0.800 0.600 CB 1.040 6 residues pruned to eliminate duplicates Z: 6 7.464 1.886 0.090 0.603 1.000 0.600 CB 1.472 Z: 198 99.821 2.308 0.998 0.566 0.919 0.604 CB 1.574 198 residues pruned to eliminate duplicates Z: 15 29.073 2.177 0.827 0.924 1.000 0.929 CA 1.372 15 residues pruned to eliminate duplicates Z: 20 41.460 2.305 1.260 0.816 0.895 0.632 CB 1.550 20 residues pruned to eliminate duplicates Z: 15 33.352 2.169 1.116 0.906 0.929 0.643 CB 1.488 15 residues pruned to eliminate duplicates Z: 107 86.495 2.300 1.083 0.651 0.943 0.651 CB 1.616 123 residues pruned to eliminate duplicates Z: 69 60.222 2.234 0.965 0.630 0.971 0.647 CB 1.518 69 residues pruned to eliminate duplicates Z: 15 33.480 2.186 1.019 0.928 0.929 0.929 CA 1.529 15 residues pruned to eliminate duplicates Z: 18 18.728 1.983 0.512 0.595 0.941 0.647 CB 1.470 18 residues pruned to eliminate duplicates Z: 65 55.653 2.220 0.999 0.625 0.922 0.562 CB 1.512 65 residues pruned to eliminate duplicates Z: 89 72.104 2.261 1.015 0.640 0.932 0.602 CB 1.588 89 residues pruned to eliminate duplicates Z: 9 15.115 1.822 0.953 0.841 0.875 0.625 CB 1.280 9 residues pruned to eliminate duplicates Z: 85 68.137 2.284 1.012 0.638 0.893 0.619 CB 1.592 85 residues pruned to eliminate duplicates Z: 88 58.044 2.150 0.883 0.574 0.920 0.632 CB 1.557 88 residues pruned to eliminate duplicates Z: 60 50.280 2.211 0.832 0.622 0.932 0.627 CB 1.545 Z: 7 18.340 2.085 0.482 0.880 1.000 1.000 CA 1.756 7 residues pruned to eliminate duplicates Z: 37 36.425 2.375 0.734 0.494 0.917 0.611 CB 1.618 37 residues pruned to eliminate duplicates Z: 23 33.424 2.182 1.011 0.700 0.864 0.455 CB 1.568 23 residues pruned to eliminate duplicates Z: 22 20.685 2.177 0.646 0.378 0.905 0.524 CB 1.586 22 residues pruned to eliminate duplicates Z: 6 5.175 1.927 -0.167 0.671 1.000 0.800 CB 1.231 Z: 26 21.897 2.183 0.785 0.448 0.840 0.480 CB 1.412 26 residues pruned to eliminate duplicates Z: 17 27.566 2.014 0.746 0.909 1.000 0.750 CA 1.391 17 residues pruned to eliminate duplicates Z: 16 25.395 2.071 0.815 0.916 0.867 0.533 CA 1.422 16 residues pruned to eliminate duplicates Z: 14 31.840 2.266 0.763 0.944 1.000 1.000 CB 1.531 14 residues pruned to eliminate duplicates Z: 11 12.149 1.710 0.731 0.762 1.000 0.900 CB 1.029 11 residues pruned to eliminate duplicates Z: 70 67.271 2.295 0.947 0.675 0.942 0.696 CB 1.638 70 residues pruned to eliminate duplicates Z: 34 28.768 2.110 0.799 0.518 0.848 0.636 CB 1.527 34 residues pruned to eliminate duplicates Z: 16 34.245 2.078 1.017 0.915 1.000 0.667 CA 1.490 16 residues pruned to eliminate duplicates Z: 6 7.165 1.452 0.880 0.799 0.800 0.400 CA 1.129 Z: 9 9.021 1.825 0.319 0.552 0.875 0.625 CB 1.439 9 residues pruned to eliminate duplicates Z: 10 7.834 1.708 0.129 0.707 0.889 0.778 CB 1.263 7 residues pruned to eliminate duplicates Z: 15 30.678 2.177 0.794 0.887 1.000 0.786 CA 1.513 15 residues pruned to eliminate duplicates Z: 8 7.570 1.833 0.451 0.699 0.714 0.714 CB 1.256 8 residues pruned to eliminate duplicates Z: 34 35.337 2.226 0.680 0.558 0.909 0.636 CB 1.710 34 residues pruned to eliminate duplicates Z: 16 21.955 2.079 0.625 0.785 1.000 0.733 CA 1.306 16 residues pruned to eliminate duplicates Z: 7 7.856 1.859 0.568 0.735 0.833 0.833 CA 1.069 7 residues pruned to eliminate duplicates Z: 88 70.386 2.251 1.010 0.641 0.908 0.644 CB 1.610 148 residues pruned to eliminate duplicates Z: 17 42.915 2.283 1.184 0.842 1.000 0.625 CB 1.603 17 residues pruned to eliminate duplicates Z: 20 20.454 2.144 0.867 0.376 0.842 0.579 CB 1.589 20 residues pruned to eliminate duplicates Z: 17 10.475 1.942 0.504 0.499 0.688 0.438 CB 1.305 10 residues pruned to eliminate duplicates Z: 7 8.912 1.816 0.849 0.643 0.667 0.667 CA 1.423 7 residues pruned to eliminate duplicates Z: 120 86.248 2.224 1.041 0.637 0.941 0.647 CB 1.628 120 residues pruned to eliminate duplicates Z: 91 78.713 2.372 1.013 0.593 0.933 0.578 CB 1.703 91 residues pruned to eliminate duplicates Z: 16 17.806 2.160 0.551 0.530 0.867 0.667 CB 1.538 16 residues pruned to eliminate duplicates Z: 8 12.673 1.985 0.354 0.821 0.857 0.714 CB 1.574 6 residues pruned to eliminate duplicates Z: 10 12.750 1.733 0.736 0.775 0.889 0.667 CA 1.246 10 residues pruned to eliminate duplicates Z: 15 49.071 2.441 1.396 0.938 1.000 0.714 CB 1.560 15 residues pruned to eliminate duplicates Z: 9 12.022 1.875 0.215 0.832 1.000 0.625 CB 1.401 9 residues pruned to eliminate duplicates Z: 160 74.743 2.135 0.754 0.588 0.937 0.597 CB 1.552 160 residues pruned to eliminate duplicates Z: 40 35.617 2.086 0.788 0.687 0.923 0.590 CB 1.395 40 residues pruned to eliminate duplicates Z: 10 15.773 1.927 0.572 0.877 0.889 0.778 CB 1.417 10 residues pruned to eliminate duplicates Z: 13 33.327 2.320 0.966 0.920 1.000 0.500 CB 1.486 13 residues pruned to eliminate duplicates Z: 36 20.371 2.106 0.533 0.398 0.829 0.514 CB 1.434 22 residues pruned to eliminate duplicates Z: 25 15.023 2.122 0.514 0.391 0.750 0.417 CB 1.429 25 residues pruned to eliminate duplicates Z: 23 25.826 2.280 0.799 0.538 0.864 0.591 CB 1.498 23 residues pruned to eliminate duplicates Z: 86 88.733 2.409 1.145 0.637 0.965 0.753 CB 1.698 86 residues pruned to eliminate duplicates Z: 68 69.044 2.320 0.962 0.673 0.955 0.672 CB 1.654 68 residues pruned to eliminate duplicates Z: 58 57.701 2.358 1.076 0.599 0.877 0.684 CB 1.620 58 residues pruned to eliminate duplicates Z: 34 48.272 2.321 1.060 0.642 0.939 0.667 CB 1.638 34 residues pruned to eliminate duplicates Z: 17 26.085 1.948 0.848 0.893 1.000 0.688 CB 1.300 17 residues pruned to eliminate duplicates Z: 206 90.604 2.293 0.949 0.536 0.898 0.541 CB 1.523 206 residues pruned to eliminate duplicates Z: 78 43.854 2.047 0.735 0.501 0.948 0.597 CB 1.483 78 residues pruned to eliminate duplicates Z: 14 28.766 2.231 0.418 0.897 1.000 0.923 CA 1.806 14 residues pruned to eliminate duplicates Z: 10 24.482 2.211 0.527 0.906 1.000 0.889 CB 1.719 10 residues pruned to eliminate duplicates Z: 10 14.667 2.027 0.837 0.803 0.889 0.444 CB 1.134 Z: 152 86.631 2.312 0.951 0.567 0.940 0.609 CB 1.557 152 residues pruned to eliminate duplicates Z: 144 77.464 2.207 0.787 0.615 0.937 0.566 CB 1.573 144 residues pruned to eliminate duplicates Z: 20 20.724 2.019 0.708 0.569 0.947 0.579 CB 1.361 20 residues pruned to eliminate duplicates Z: 132 90.322 2.278 1.027 0.628 0.969 0.664 CB 1.563 132 residues pruned to eliminate duplicates Z: 10 14.576 2.016 0.666 0.730 0.889 0.333 CB 1.323 Z: 9 20.447 2.042 1.081 0.829 1.000 0.500 CB 1.280 9 residues pruned to eliminate duplicates Z: 160 71.144 2.182 0.828 0.509 0.912 0.547 CB 1.537 160 residues pruned to eliminate duplicates Z: 10 21.213 2.003 0.685 0.934 1.000 0.667 CB 1.461 18 residues pruned to eliminate duplicates Z: 13 27.398 2.395 0.454 0.892 1.000 0.750 CA 1.632 13 residues pruned to eliminate duplicates Z: 14 21.401 2.084 0.438 0.927 1.000 1.000 CA 1.388 14 residues pruned to eliminate duplicates Z: 9 13.778 2.266 0.357 0.749 0.875 0.500 CB 1.448 9 residues pruned to eliminate duplicates Z: 10 15.890 1.850 0.812 0.879 1.000 0.333 CB 1.146 10 residues pruned to eliminate duplicates Z: 15 14.947 1.831 0.309 0.906 1.000 0.929 CB 1.186 15 residues pruned to eliminate duplicates Z: 16 28.217 2.171 0.957 0.611 0.933 0.600 CA 1.654 16 residues pruned to eliminate duplicates Z: 9 22.062 1.992 1.145 0.866 1.000 0.625 CB 1.336 9 residues pruned to eliminate duplicates Z: 14 21.493 2.221 0.539 0.943 1.000 0.923 CB 1.209 14 residues pruned to eliminate duplicates Z: 17 23.478 2.027 0.647 0.886 0.938 0.625 CB 1.354 Z: 120 86.210 2.308 1.040 0.642 0.950 0.647 CB 1.548 157 residues pruned to eliminate duplicates Z: 11 6.929 1.748 0.120 0.725 1.000 0.600 CB 0.914 11 residues pruned to eliminate duplicates Z: 38 39.077 2.304 0.909 0.551 0.919 0.622 CB 1.513 38 residues pruned to eliminate duplicates Z: 9 8.879 1.535 0.895 0.570 0.875 0.625 CA 1.153 9 residues pruned to eliminate duplicates Z: 17 42.024 2.260 1.127 0.910 0.938 0.750 CB 1.652 17 residues pruned to eliminate duplicates Z: 16 10.243 1.753 0.371 0.619 0.867 0.733 CB 1.135 4 residues pruned to eliminate duplicates Z: 7 4.332 1.662 -0.046 0.573 0.833 0.500 C 1.247 Z: 16 18.514 1.918 0.644 0.846 0.867 0.600 CB 1.299 16 residues pruned to eliminate duplicates Z: 24 27.176 2.181 0.845 0.586 0.783 0.478 CB 1.657 24 residues pruned to eliminate duplicates Z: 70 43.364 2.072 0.763 0.570 0.928 0.580 CB 1.440 70 residues pruned to eliminate duplicates Z: 117 85.821 2.294 1.061 0.635 0.940 0.638 CB 1.580 117 residues pruned to eliminate duplicates Z: 23 19.002 2.063 0.661 0.494 0.909 0.636 CB 1.309 23 residues pruned to eliminate duplicates Z: 83 73.756 2.293 1.066 0.655 0.902 0.622 CB 1.650 83 residues pruned to eliminate duplicates Z: 11 11.197 1.948 0.936 0.437 0.800 0.600 CB 1.252 11 residues pruned to eliminate duplicates Z: 7 3.844 1.838 0.238 0.490 0.667 0.500 CB 1.045 7 residues pruned to eliminate duplicates Z: 8 7.827 1.857 0.428 0.531 0.857 0.571 CA 1.262 8 residues pruned to eliminate duplicates Z: 15 29.499 2.012 0.883 0.929 1.000 0.786 CA 1.457 15 residues pruned to eliminate duplicates Z: 8 21.428 2.245 0.674 0.909 1.000 1.000 CB 1.530 8 residues pruned to eliminate duplicates Z: 64 60.284 2.231 1.040 0.627 0.937 0.635 CB 1.582 Z: 10 13.030 1.868 0.650 0.813 0.889 0.778 CB 1.207 10 residues pruned to eliminate duplicates Z: 10 2.598 1.664 -0.036 0.414 0.778 0.222 CB 0.760 Z: 67 57.344 2.393 0.990 0.555 0.864 0.621 CB 1.628 67 residues pruned to eliminate duplicates Z: 10 9.443 1.890 0.003 0.751 1.000 0.778 CB 1.328 10 residues pruned to eliminate duplicates Z: 19 21.046 2.120 0.895 0.414 0.889 0.611 CA 1.520 19 residues pruned to eliminate duplicates Z: 11 6.655 1.576 0.445 0.427 0.900 0.400 CB 1.107 Z: 12 11.087 2.142 0.593 0.338 0.727 0.364 CA 1.607 12 residues pruned to eliminate duplicates Z: 57 62.496 2.282 1.167 0.657 0.911 0.679 CB 1.603 57 residues pruned to eliminate duplicates Z: 90 56.786 2.110 0.909 0.580 0.910 0.663 CB 1.520 90 residues pruned to eliminate duplicates Z: 49 39.426 2.045 0.776 0.651 0.958 0.688 CB 1.421 49 residues pruned to eliminate duplicates Z: 20 15.726 1.851 0.541 0.410 1.000 0.474 CB 1.390 20 residues pruned to eliminate duplicates Z: 151 87.579 2.272 0.978 0.575 0.920 0.593 CB 1.609 215 residues pruned to eliminate duplicates Z: 9 5.390 1.477 0.002 0.764 1.000 0.750 CB 1.018 Z: 18 35.427 2.185 1.052 0.886 0.941 0.647 CB 1.469 18 residues pruned to eliminate duplicates Z: 13 14.902 1.858 0.193 0.893 1.000 0.833 CA 1.393 13 residues pruned to eliminate duplicates Z: 17 30.577 2.074 0.959 0.847 0.938 0.688 CA 1.490 Z: 13 19.251 1.958 0.577 0.913 1.000 0.833 CB 1.273 13 residues pruned to eliminate duplicates Z: 13 21.748 2.174 0.496 0.933 1.000 0.917 CA 1.347 13 residues pruned to eliminate duplicates Z: 10 6.102 1.342 0.306 0.761 1.000 0.556 CB 0.920 Z: 38 18.169 1.890 0.356 0.470 0.892 0.568 CB 1.347 38 residues pruned to eliminate duplicates Z: 10 6.020 1.366 0.185 0.863 1.000 0.778 CB 0.910 10 residues pruned to eliminate duplicates Z: 6 6.550 1.561 0.491 0.686 1.000 0.000 N 1.061 6 residues pruned to eliminate duplicates Z: 7 11.220 1.753 1.057 0.538 1.000 0.667 CB 1.224 7 residues pruned to eliminate duplicates Z: 15 33.005 2.224 0.798 0.930 1.000 0.929 CA 1.543 15 residues pruned to eliminate duplicates Z: 15 20.901 1.830 0.734 0.918 1.000 0.786 CB 1.242 15 residues pruned to eliminate duplicates Z: 14 25.744 2.231 0.699 0.916 1.000 0.923 CB 1.330 13 residues pruned to eliminate duplicates Z: 10 16.337 1.773 0.918 0.822 1.000 0.778 CA 1.211 10 residues pruned to eliminate duplicates Z: 11 17.671 1.819 1.046 0.782 0.900 0.500 CB 1.301 Z: 8 21.549 2.101 1.057 0.814 1.000 0.714 CB 1.434 Z: 14 17.831 1.959 0.655 0.916 1.000 0.846 CB 1.078 14 residues pruned to eliminate duplicates Z: 14 17.061 1.949 0.731 0.934 1.000 0.769 CB 0.978 14 residues pruned to eliminate duplicates Z: 15 32.755 2.197 0.997 0.923 0.929 0.929 CA 1.511 15 residues pruned to eliminate duplicates Z: 13 9.136 1.631 0.558 0.420 0.917 0.667 CB 1.231 Z: 9 8.360 1.444 0.597 0.905 1.000 0.750 CB 0.913 Z: 19 28.206 2.206 0.974 0.413 0.889 0.444 CB 1.880 19 residues pruned to eliminate duplicates Z: 23 21.862 2.056 0.596 0.454 0.909 0.500 CA 1.637 23 residues pruned to eliminate duplicates Z: 35 50.648 2.326 1.313 0.630 0.941 0.676 CB 1.518 35 residues pruned to eliminate duplicates Z: 17 18.288 1.964 0.704 0.505 0.938 0.500 CA 1.449 17 residues pruned to eliminate duplicates Z: 64 68.173 2.302 1.172 0.643 0.889 0.619 CB 1.690 64 residues pruned to eliminate duplicates Z: 15 25.479 2.030 0.777 0.916 0.929 0.714 CA 1.436 15 residues pruned to eliminate duplicates Z: 18 14.907 1.980 0.393 0.503 0.941 0.471 CB 1.388 31 residues pruned to eliminate duplicates Z: 54 70.337 2.383 1.183 0.642 0.962 0.623 CB 1.690 54 residues pruned to eliminate duplicates Z: 14 26.868 2.228 0.966 0.930 1.000 0.692 CB 1.190 14 residues pruned to eliminate duplicates Z: 14 31.729 2.113 1.053 0.922 1.000 0.615 CB 1.427 14 residues pruned to eliminate duplicates Z: 117 78.905 2.238 0.885 0.643 0.940 0.612 CB 1.617 117 residues pruned to eliminate duplicates Z: 20 28.410 2.170 0.945 0.698 0.842 0.632 CB 1.531 31 residues pruned to eliminate duplicates Z: 6 8.851 1.914 0.195 0.659 1.000 0.800 C 1.493 6 residues pruned to eliminate duplicates Z: 20 17.822 2.108 0.588 0.421 0.947 0.684 CB 1.399 20 residues pruned to eliminate duplicates Z: 15 33.155 2.203 0.992 0.928 1.000 0.786 CA 1.414 15 residues pruned to eliminate duplicates Z: 14 21.171 1.922 0.834 0.927 1.000 0.769 CB 1.167 14 residues pruned to eliminate duplicates Z: 140 80.100 2.204 0.838 0.637 0.928 0.647 CB 1.589 140 residues pruned to eliminate duplicates Z: 27 41.838 2.285 1.384 0.573 0.885 0.577 CB 1.586 27 residues pruned to eliminate duplicates Z: 157 80.586 2.170 0.843 0.590 0.962 0.635 CB 1.539 157 residues pruned to eliminate duplicates Z: 34 33.463 2.217 0.640 0.548 0.939 0.545 CB 1.627 34 residues pruned to eliminate duplicates Z: 53 55.941 2.173 1.006 0.694 0.942 0.596 CB 1.583 17 residues pruned to eliminate duplicates Z: 13 26.415 2.104 0.987 0.855 1.000 0.833 CB 1.347 13 residues pruned to eliminate duplicates Z: 14 14.631 1.852 0.314 0.906 1.000 0.769 CB 1.186 14 residues pruned to eliminate duplicates Z: 60 62.060 2.334 1.008 0.586 0.949 0.678 CB 1.672 60 residues pruned to eliminate duplicates Z: 7 4.541 1.395 -0.008 0.675 1.000 0.667 CA 1.141 Z: 83 55.562 2.373 0.799 0.487 0.878 0.610 CB 1.657 83 residues pruned to eliminate duplicates Z: 7 7.783 1.728 0.051 0.761 1.000 0.667 CB 1.388 7 residues pruned to eliminate duplicates Z: 8 3.643 1.809 -0.005 0.525 0.714 0.429 CB 1.045 7 residues pruned to eliminate duplicates Z: 14 29.502 2.115 0.931 0.829 0.923 0.692 CA 1.634 14 residues pruned to eliminate duplicates Z: 72 58.024 2.158 0.801 0.625 0.972 0.606 CB 1.621 72 residues pruned to eliminate duplicates Z: 139 84.220 2.263 0.959 0.601 0.920 0.638 CB 1.596 139 residues pruned to eliminate duplicates Z: 9 11.692 1.890 0.918 0.523 0.875 0.625 N 1.274 Z: 68 60.195 2.182 0.797 0.669 0.955 0.687 CA 1.680 69 residues pruned to eliminate duplicates Z: 15 21.926 1.955 1.011 0.625 0.929 0.643 CB 1.426 15 residues pruned to eliminate duplicates Z: 10 21.490 2.149 0.938 0.839 0.889 0.556 CB 1.445 10 residues pruned to eliminate duplicates Z: 15 24.633 2.258 0.701 0.781 0.929 0.214 CA 1.442 15 residues pruned to eliminate duplicates Z: 84 66.020 2.241 0.798 0.657 0.952 0.627 CB 1.634 84 residues pruned to eliminate duplicates Z: 97 69.111 2.261 0.951 0.579 0.906 0.615 CB 1.635 97 residues pruned to eliminate duplicates Z: 60 30.585 1.918 0.663 0.484 0.932 0.610 CB 1.362 60 residues pruned to eliminate duplicates Z: 14 19.412 2.124 0.951 0.901 1.000 0.538 CB 0.928 14 residues pruned to eliminate duplicates Z: 15 29.736 2.063 0.797 0.927 1.000 0.929 CB 1.502 15 residues pruned to eliminate duplicates Z: 6 4.844 1.520 0.645 0.636 0.800 0.800 CA 0.953 Z: 91 69.735 2.247 0.949 0.623 0.922 0.644 CB 1.620 152 residues pruned to eliminate duplicates Z: 117 85.243 2.263 0.931 0.636 0.948 0.586 CB 1.681 117 residues pruned to eliminate duplicates Z: 30 46.293 2.276 1.054 0.704 0.966 0.862 CB 1.582 30 residues pruned to eliminate duplicates Z: 9 15.607 2.112 0.716 0.672 1.000 0.750 CB 1.300 9 residues pruned to eliminate duplicates Z: 15 26.672 2.149 0.786 0.930 0.929 0.786 CA 1.398 15 residues pruned to eliminate duplicates Z: 10 20.111 1.979 0.958 0.811 1.000 0.778 CA 1.320 Z: 7 12.707 2.071 0.593 0.717 0.833 0.667 CA 1.552 7 residues pruned to eliminate duplicates Z: 15 18.680 2.072 0.439 0.940 1.000 0.857 CB 1.163 14 residues pruned to eliminate duplicates Z: 9 7.855 1.471 0.824 0.846 1.000 0.750 CB 0.769 8 residues pruned to eliminate duplicates Z: 8 8.296 1.531 0.616 0.898 1.000 1.000 CB 0.907 8 residues pruned to eliminate duplicates Z: 14 23.112 2.117 0.907 0.527 0.923 0.615 CA 1.675 14 residues pruned to eliminate duplicates Z: 16 11.034 2.113 0.641 0.368 0.667 0.400 CA 1.421 16 residues pruned to eliminate duplicates Z: 17 22.464 1.961 0.564 0.852 1.000 0.688 CB 1.354 17 residues pruned to eliminate duplicates Z: 38 39.452 2.211 0.966 0.664 0.946 0.649 CB 1.355 41 residues pruned to eliminate duplicates Z: 9 3.706 1.778 0.247 0.386 0.750 0.375 CB 0.889 9 residues pruned to eliminate duplicates Z: 10 16.521 1.974 0.875 0.801 1.000 0.667 CA 1.144 10 residues pruned to eliminate duplicates Z: 9 16.464 2.036 0.470 0.842 1.000 0.625 CA 1.450 9 residues pruned to eliminate duplicates Z: 29 37.505 2.294 1.218 0.508 0.821 0.500 CB 1.682 29 residues pruned to eliminate duplicates Z: 16 18.796 2.091 0.725 0.444 0.867 0.600 CB 1.645 16 residues pruned to eliminate duplicates Z: 63 42.552 2.059 0.783 0.626 0.935 0.500 CB 1.398 63 residues pruned to eliminate duplicates Z: 7 6.320 1.493 0.355 0.549 1.000 0.667 O 1.215 Z: 15 20.552 2.149 0.534 0.898 1.000 0.714 CB 1.193 15 residues pruned to eliminate duplicates Z: 8 8.326 1.802 0.239 0.487 1.000 0.714 CB 1.428 11 residues pruned to eliminate duplicates Z: 33 28.544 2.101 0.934 0.464 0.906 0.562 CB 1.422 33 residues pruned to eliminate duplicates Z: 16 43.602 2.372 1.345 0.923 1.000 0.800 CB 1.422 16 residues pruned to eliminate duplicates Z: 13 22.890 2.181 0.612 0.824 0.917 0.583 CA 1.549 13 residues pruned to eliminate duplicates Z: 75 39.290 2.081 0.673 0.508 0.892 0.554 CB 1.460 75 residues pruned to eliminate duplicates Z: 43 46.716 2.210 0.907 0.649 0.929 0.595 CB 1.603 10 residues pruned to eliminate duplicates Z: 9 5.800 1.423 0.189 0.868 1.000 0.875 CB 0.886 10 residues pruned to eliminate duplicates Z: 7 10.352 1.882 0.546 0.619 1.000 0.333 C 1.299 7 residues pruned to eliminate duplicates Z: 30 40.607 2.288 0.963 0.569 0.931 0.655 CB 1.687 30 residues pruned to eliminate duplicates Z: 35 46.762 2.266 1.190 0.651 0.912 0.588 CB 1.540 35 residues pruned to eliminate duplicates Z: 20 19.417 2.150 0.714 0.477 0.895 0.579 CB 1.383 20 residues pruned to eliminate duplicates Z: 86 78.647 2.392 1.060 0.606 0.929 0.647 CB 1.685 86 residues pruned to eliminate duplicates Z: 46 39.134 2.155 0.908 0.639 0.844 0.578 CB 1.474 46 residues pruned to eliminate duplicates Z: 14 35.483 2.171 1.128 0.928 1.000 0.769 CA 1.491 14 residues pruned to eliminate duplicates Z: 14 19.792 1.815 0.566 0.812 1.000 0.769 CA 1.473 14 residues pruned to eliminate duplicates Z: 88 72.248 2.249 1.087 0.634 0.920 0.701 CB 1.583 131 residues pruned to eliminate duplicates Z: 10 15.407 1.973 1.051 0.765 0.778 0.556 CA 1.290 Z: 118 77.408 2.245 0.892 0.629 0.923 0.667 CB 1.618 118 residues pruned to eliminate duplicates Z: 34 41.419 2.204 1.009 0.632 0.909 0.606 CB 1.583 34 residues pruned to eliminate duplicates Z: 7 7.955 1.746 0.686 0.730 0.833 0.500 CB 1.077 7 residues pruned to eliminate duplicates Z: 15 19.975 2.113 0.716 0.790 0.857 0.286 CB 1.332 15 residues pruned to eliminate duplicates Z: 142 83.746 2.205 0.907 0.643 0.950 0.681 CB 1.543 142 residues pruned to eliminate duplicates Z: 10 13.934 2.010 0.739 0.495 0.889 0.667 CB 1.503 10 residues pruned to eliminate duplicates Z: 39 39.297 2.175 0.890 0.510 0.974 0.500 CB 1.576 39 residues pruned to eliminate duplicates Z: 79 55.381 2.239 1.019 0.524 0.872 0.590 CB 1.553 79 residues pruned to eliminate duplicates Z: 29 40.418 2.257 0.968 0.663 0.929 0.857 CB 1.593 29 residues pruned to eliminate duplicates Z: 16 35.710 2.299 0.971 0.696 1.000 0.867 CB 1.701 16 residues pruned to eliminate duplicates Z: 88 75.431 2.281 1.006 0.618 0.954 0.609 CB 1.657 98 residues pruned to eliminate duplicates Z: 108 82.157 2.268 0.995 0.633 0.935 0.645 CB 1.658 108 residues pruned to eliminate duplicates Z: 14 36.021 2.223 1.099 0.938 1.000 0.846 CB 1.489 14 residues pruned to eliminate duplicates Z: 14 26.624 2.194 1.003 0.906 1.000 0.615 CB 1.195 14 residues pruned to eliminate duplicates Z: 60 58.961 2.379 1.178 0.604 0.881 0.661 CB 1.522 60 residues pruned to eliminate duplicates Z: 6 5.504 1.637 0.694 0.627 0.800 0.600 N 0.984 Z: 17 9.194 1.819 0.368 0.261 0.938 0.500 CB 1.295 17 residues pruned to eliminate duplicates Z: 8 7.427 1.502 0.548 0.857 1.000 0.571 CB 0.890 9 residues pruned to eliminate duplicates Z: 18 15.486 1.986 0.425 0.506 0.941 0.529 CB 1.402 18 residues pruned to eliminate duplicates Z: 9 24.268 2.548 0.706 0.659 1.000 0.875 CB 1.703 9 residues pruned to eliminate duplicates Z: 32 54.043 2.350 1.170 0.679 1.000 0.581 CB 1.614 32 residues pruned to eliminate duplicates Z: 9 6.723 1.690 0.487 0.513 0.750 0.750 CA 1.245 9 residues pruned to eliminate duplicates Z: 16 29.068 2.085 0.786 0.932 1.000 0.867 CA 1.408 16 residues pruned to eliminate duplicates Z: 10 8.325 1.837 0.363 0.668 0.889 0.778 CB 1.068 10 residues pruned to eliminate duplicates Z: 9 11.962 1.782 0.749 0.835 0.875 0.375 CA 1.162 9 residues pruned to eliminate duplicates Z: 81 77.141 2.390 1.025 0.585 0.938 0.650 CB 1.752 81 residues pruned to eliminate duplicates Z: 20 41.099 2.233 1.292 0.828 1.000 0.632 CB 1.388 20 residues pruned to eliminate duplicates Z: 15 16.312 2.063 0.776 0.582 0.786 0.643 CB 1.400 15 residues pruned to eliminate duplicates Z: 16 47.805 2.354 1.492 0.908 1.000 0.400 CB 1.494 16 residues pruned to eliminate duplicates Z: 131 93.743 2.275 1.098 0.638 0.946 0.608 CB 1.599 131 residues pruned to eliminate duplicates Z: 23 10.036 1.737 0.358 0.351 0.909 0.500 CB 1.172 23 residues pruned to eliminate duplicates Z: 11 7.355 1.916 0.790 0.194 0.600 0.400 CA 1.630 11 residues pruned to eliminate duplicates Z: 11 9.365 1.979 0.305 0.498 0.800 0.500 CA 1.436 11 residues pruned to eliminate duplicates Z: 134 88.740 2.296 0.965 0.618 0.925 0.677 CB 1.649 134 residues pruned to eliminate duplicates Z: 29 32.755 2.141 0.999 0.570 0.929 0.500 CB 1.456 29 residues pruned to eliminate duplicates Z: 12 19.339 1.974 0.887 0.572 0.909 0.636 CB 1.607 12 residues pruned to eliminate duplicates Z: 15 14.273 1.752 0.645 0.830 0.929 0.429 CB 1.071 15 residues pruned to eliminate duplicates Z: 8 17.042 2.055 0.904 0.780 0.857 0.286 CA 1.500 8 residues pruned to eliminate duplicates Z: 15 45.855 2.370 1.405 0.930 1.000 0.786 CB 1.503 15 residues pruned to eliminate duplicates Z: 6 6.037 1.610 0.681 0.875 1.000 1.000 CB 0.726 6 residues pruned to eliminate duplicates Z: 6 2.974 1.483 0.248 0.478 0.800 0.400 N 0.918 6 residues pruned to eliminate duplicates Z: 30 21.780 2.076 0.714 0.310 0.897 0.552 CB 1.566 30 residues pruned to eliminate duplicates Z: 14 32.919 2.168 1.295 0.844 0.846 0.462 CA 1.614 14 residues pruned to eliminate duplicates Z: 10 9.146 1.900 0.586 0.791 0.889 0.556 CB 0.882 10 residues pruned to eliminate duplicates Z: 11 31.843 2.340 0.922 0.922 1.000 1.000 CA 1.575 11 residues pruned to eliminate duplicates Z: 11 7.430 1.494 0.895 0.388 0.800 0.600 N 1.168 Z: 25 27.058 2.206 1.070 0.390 0.875 0.625 CB 1.553 25 residues pruned to eliminate duplicates Z: 59 63.003 2.382 1.097 0.580 0.897 0.621 CB 1.711 59 residues pruned to eliminate duplicates Z: 10 15.875 1.954 0.837 0.470 1.000 0.667 CB 1.520 10 residues pruned to eliminate duplicates Z: 63 33.023 2.065 0.655 0.453 0.855 0.532 CB 1.507 63 residues pruned to eliminate duplicates Z: 6 4.859 1.498 0.539 0.654 0.800 0.800 N 1.021 Z: 6 6.489 1.560 0.580 0.825 1.000 0.800 CA 0.888 Z: 9 6.924 1.600 0.404 0.739 0.875 0.500 CA 1.005 9 residues pruned to eliminate duplicates Z: 91 63.997 2.193 0.848 0.639 0.900 0.689 CB 1.625 91 residues pruned to eliminate duplicates Z: 27 39.586 2.304 1.024 0.580 0.923 0.654 CA 1.670 27 residues pruned to eliminate duplicates Z: 23 22.211 2.238 0.463 0.493 0.909 0.636 CB 1.602 23 residues pruned to eliminate duplicates Z: 6 7.929 1.929 0.465 0.797 0.800 0.800 CA 1.209 6 residues pruned to eliminate duplicates Z: 58 52.940 2.360 0.899 0.597 0.895 0.596 CB 1.593 58 residues pruned to eliminate duplicates Z: 12 26.842 2.264 0.612 0.878 1.000 0.636 CB 1.609 12 residues pruned to eliminate duplicates Z: 30 42.866 2.267 1.223 0.599 0.897 0.690 CB 1.603 30 residues pruned to eliminate duplicates Z: 11 6.142 1.703 0.307 0.399 0.700 0.600 C 1.387 8 residues pruned to eliminate duplicates Z: 10 18.884 2.063 0.822 0.757 1.000 0.667 CA 1.332 10 residues pruned to eliminate duplicates Z: 8 3.665 1.510 0.160 0.364 0.857 0.429 CB 1.068 6 1.785 1.509 0.006 0.300 0.800 0.600 CB 0.822 ? Z: 47 33.405 2.222 0.750 0.430 0.891 0.609 CB 1.528 47 residues pruned to eliminate duplicates Z: 7 5.772 1.937 -0.298 0.777 1.000 0.833 C 1.357 Z: 46 34.623 2.070 0.591 0.533 0.978 0.644 CB 1.551 46 residues pruned to eliminate duplicates Z: 7 4.172 1.568 0.715 0.243 0.833 0.333 CA 1.024 7 residues pruned to eliminate duplicates Z: 13 31.337 2.238 1.027 0.915 0.917 0.833 CA 1.537 13 residues pruned to eliminate duplicates Z: 156 79.887 2.177 0.808 0.593 0.948 0.658 CB 1.572 155 residues pruned to eliminate duplicates Z: 12 10.070 1.638 0.598 0.762 0.818 0.455 CB 1.123 12 residues pruned to eliminate duplicates Z: 54 48.773 2.116 0.845 0.677 0.925 0.604 CB 1.577 54 residues pruned to eliminate duplicates Z: 29 36.994 2.246 1.141 0.568 0.929 0.643 CB 1.466 29 residues pruned to eliminate duplicates Z: 24 34.443 2.365 0.821 0.607 0.913 0.652 CB 1.649 24 residues pruned to eliminate duplicates Z: 6 2.415 1.460 0.367 0.425 0.800 0.400 N 0.731 6 residues pruned to eliminate duplicates Z: 90 66.870 2.296 0.945 0.558 0.933 0.652 CB 1.609 90 residues pruned to eliminate duplicates Z: 25 24.305 2.167 0.684 0.625 0.792 0.708 CB 1.526 25 residues pruned to eliminate duplicates Z: 46 51.887 2.410 0.942 0.585 0.911 0.622 CB 1.672 46 residues pruned to eliminate duplicates Z: 12 8.329 1.622 0.698 0.548 0.909 0.545 CB 0.957 8 residues pruned to eliminate duplicates Z: 17 32.920 2.013 1.096 0.925 1.000 0.812 CB 1.368 17 residues pruned to eliminate duplicates Z: 6 4.320 1.583 0.064 0.641 1.000 1.000 CB 1.005 Z: 9 6.976 1.786 0.091 0.500 0.875 0.750 C 1.446 8 residues pruned to eliminate duplicates Z: 28 33.081 2.310 0.799 0.589 0.889 0.593 CB 1.583 28 residues pruned to eliminate duplicates Z: 37 24.013 1.896 0.672 0.573 0.861 0.639 CB 1.367 37 residues pruned to eliminate duplicates Z: 9 16.476 1.921 0.750 0.814 0.875 0.750 CB 1.507 9 residues pruned to eliminate duplicates Z: 13 20.222 1.920 0.655 0.933 1.000 0.917 CB 1.282 13 residues pruned to eliminate duplicates Z: 9 11.462 1.985 0.330 0.423 1.000 0.250 CB 1.663 9 residues pruned to eliminate duplicates Z: 8 9.724 1.900 0.064 0.800 1.000 0.714 CA 1.399 8 residues pruned to eliminate duplicates Z: 36 39.272 2.172 1.108 0.615 0.914 0.629 CB 1.422 36 residues pruned to eliminate duplicates Z: 11 12.570 1.970 0.790 0.539 0.800 0.700 CA 1.357 11 residues pruned to eliminate duplicates Z: 13 51.414 2.381 1.541 0.942 0.917 0.833 CA 1.856 13 residues pruned to eliminate duplicates Z: 50 50.325 2.283 1.054 0.593 0.857 0.735 CB 1.636 50 residues pruned to eliminate duplicates Z: 46 33.524 2.234 0.632 0.468 0.911 0.622 CB 1.554 46 residues pruned to eliminate duplicates Z: 21 22.231 2.085 0.839 0.579 0.850 0.400 CB 1.414 21 residues pruned to eliminate duplicates Z: 21 16.582 1.998 0.682 0.430 0.800 0.650 CB 1.483 21 residues pruned to eliminate duplicates Z: 12 5.602 1.582 0.346 0.449 0.727 0.636 CB 1.150 7 residues pruned to eliminate duplicates Z: 12 5.697 1.553 0.122 0.356 0.909 0.545 CB 1.266 8 residues pruned to eliminate duplicates Z: 10 13.685 1.765 0.700 0.789 1.000 0.889 CB 1.179 10 residues pruned to eliminate duplicates Z: 56 33.095 2.072 0.692 0.496 0.891 0.582 CB 1.435 56 residues pruned to eliminate duplicates Z: 10 11.924 1.841 0.299 0.857 1.000 0.778 CA 1.225 10 residues pruned to eliminate duplicates Z: 9 6.140 1.710 0.752 0.208 0.750 0.250 CA 1.363 9 residues pruned to eliminate duplicates Z: 15 28.999 2.070 0.746 0.927 1.000 0.857 CB 1.502 15 residues pruned to eliminate duplicates Z: 22 19.408 1.971 0.673 0.482 0.857 0.429 CB 1.526 22 residues pruned to eliminate duplicates Z: 23 31.972 2.261 0.841 0.607 0.864 0.409 CB 1.712 23 residues pruned to eliminate duplicates Z: 21 36.815 2.144 1.035 0.790 1.000 0.550 CA 1.462 21 residues pruned to eliminate duplicates Z: 46 35.434 2.230 0.752 0.476 0.956 0.622 CB 1.450 108 residues pruned to eliminate duplicates Z: 16 16.994 1.806 0.767 0.878 1.000 0.867 CB 0.998 16 residues pruned to eliminate duplicates Z: 10 21.827 2.086 0.916 0.875 0.889 0.778 CB 1.490 10 residues pruned to eliminate duplicates Z: 19 25.021 2.134 0.640 0.607 0.889 0.444 CA 1.712 19 residues pruned to eliminate duplicates Z: 8 7.875 1.688 0.653 0.474 0.857 0.714 CB 1.278 8 residues pruned to eliminate duplicates Z: 70 69.134 2.274 1.001 0.663 0.957 0.623 CB 1.644 70 residues pruned to eliminate duplicates Z: 6 6.665 1.838 0.342 0.835 0.800 0.800 CB 1.132 6 residues pruned to eliminate duplicates Z: 55 52.927 2.249 0.910 0.646 0.926 0.667 CB 1.580 55 residues pruned to eliminate duplicates Z: 50 51.581 2.204 0.929 0.602 1.000 0.673 CB 1.572 Z: 15 30.259 2.149 0.844 0.923 1.000 0.857 CA 1.434 15 residues pruned to eliminate duplicates Z: 45 53.100 2.172 1.015 0.680 0.977 0.682 CA 1.586 45 residues pruned to eliminate duplicates Z: 12 6.666 1.791 0.224 0.216 0.909 0.364 CB 1.409 12 residues pruned to eliminate duplicates Z: 50 55.544 2.358 1.091 0.627 0.898 0.735 CB 1.591 50 residues pruned to eliminate duplicates Z: 25 19.736 2.035 0.835 0.377 0.875 0.583 CB 1.406 25 residues pruned to eliminate duplicates Z: 16 33.269 2.141 1.009 0.908 0.933 0.733 CA 1.520 16 residues pruned to eliminate duplicates Z: 8 4.197 1.516 0.168 0.426 0.857 0.571 CB 1.129 Z: 49 53.370 2.390 1.057 0.576 0.896 0.688 CB 1.626 49 residues pruned to eliminate duplicates Z: 7 7.798 1.599 0.319 0.796 1.000 0.500 CB 1.165 7 residues pruned to eliminate duplicates Z: 10 8.521 1.725 -0.114 0.747 1.000 1.000 C 1.489 10 residues pruned to eliminate duplicates Z: 16 26.199 2.118 0.702 0.892 1.000 0.600 CA 1.349 16 residues pruned to eliminate duplicates Z: 10 10.286 1.856 0.238 0.762 1.000 0.667 CB 1.183 10 residues pruned to eliminate duplicates Z: 19 22.503 2.031 0.876 0.500 0.889 0.667 CA 1.566 19 residues pruned to eliminate duplicates Z: 28 34.237 2.128 1.039 0.537 0.963 0.593 CB 1.521 28 residues pruned to eliminate duplicates Z: 13 36.838 2.060 1.354 0.828 1.000 1.000 CB 1.652 13 residues pruned to eliminate duplicates Z: 55 51.522 2.230 0.981 0.632 0.907 0.667 CB 1.545 55 residues pruned to eliminate duplicates Z: 32 22.205 2.022 0.644 0.471 0.871 0.581 CB 1.419 32 residues pruned to eliminate duplicates Z: 9 18.047 2.060 0.717 0.839 1.000 0.750 CB 1.348 9 residues pruned to eliminate duplicates Z: 8 3.041 1.580 -0.148 0.534 0.714 0.429 N 1.156 Z: 14 10.247 1.745 0.513 0.377 0.923 0.769 CB 1.329 14 residues pruned to eliminate duplicates Z: 14 5.169 1.577 0.128 0.316 0.846 0.538 CB 1.167 14 residues pruned to eliminate duplicates Z: 43 52.864 2.275 0.999 0.667 0.976 0.643 CB 1.575 43 residues pruned to eliminate duplicates Z: 35 37.483 2.244 0.746 0.527 0.912 0.529 CA 1.751 35 residues pruned to eliminate duplicates Z: 7 2.352 1.462 0.609 0.323 0.667 0.500 CA 0.744 Z: 85 47.052 2.160 0.702 0.487 0.893 0.571 CB 1.585 85 residues pruned to eliminate duplicates Z: 6 4.233 1.351 0.340 0.629 0.800 0.800 CB 1.157 Z: 8 5.456 1.680 0.046 0.862 1.000 0.857 CB 0.861 7 residues pruned to eliminate duplicates Z: 27 22.881 2.146 0.708 0.469 0.885 0.692 CB 1.428 Z: 17 20.123 1.875 0.488 0.852 0.938 0.875 CB 1.423 17 residues pruned to eliminate duplicates Z: 9 8.081 1.688 0.427 0.900 1.000 0.750 CB 0.848 9 residues pruned to eliminate duplicates Z: 56 50.879 2.218 0.933 0.603 0.909 0.582 CB 1.595 56 residues pruned to eliminate duplicates Z: 18 17.791 2.127 0.550 0.448 0.882 0.706 CA 1.565 18 residues pruned to eliminate duplicates Z: 29 41.570 2.235 1.042 0.621 0.929 0.750 CB 1.653 29 residues pruned to eliminate duplicates Z: 31 32.707 2.212 0.870 0.517 0.967 0.633 CB 1.468 31 residues pruned to eliminate duplicates Z: 50 46.259 2.202 1.007 0.629 0.878 0.776 CB 1.510 50 residues pruned to eliminate duplicates Z: 8 3.621 1.247 0.394 0.435 1.000 0.571 CB 0.842 Z: 132 70.499 2.128 0.823 0.594 0.954 0.626 CB 1.522 132 residues pruned to eliminate duplicates Z: 14 14.017 1.951 0.838 0.541 0.769 0.462 CB 1.354 14 residues pruned to eliminate duplicates Z: 15 16.410 1.816 0.461 0.913 0.929 0.929 CB 1.260 15 residues pruned to eliminate duplicates Z: 92 60.486 2.181 0.858 0.595 0.934 0.582 CB 1.531 92 residues pruned to eliminate duplicates Z: 12 17.583 2.180 0.628 0.430 0.909 0.545 CA 1.768 12 residues pruned to eliminate duplicates Z: 8 6.473 1.566 0.461 0.749 0.857 0.429 CB 0.999 8 residues pruned to eliminate duplicates Z: 16 16.996 2.064 0.854 0.857 0.867 0.800 CB 0.975 Z: 6 3.000 1.377 0.162 0.598 0.800 0.800 N 0.955 Z: 12 7.174 1.570 0.358 0.601 0.818 0.455 CB 1.127 8 residues pruned to eliminate duplicates Z: 91 68.052 2.248 0.952 0.616 0.944 0.678 CB 1.551 91 residues pruned to eliminate duplicates Z: 14 18.567 2.157 0.721 0.355 0.923 0.615 CB 1.758 14 residues pruned to eliminate duplicates Z: 181 84.172 2.188 1.019 0.555 0.911 0.611 CB 1.478 190 residues pruned to eliminate duplicates Z: 17 24.156 1.893 0.573 0.896 1.000 0.750 CB 1.452 17 residues pruned to eliminate duplicates Z: 6 5.927 1.944 0.576 0.555 0.800 0.600 CB 1.026 Z: 14 37.762 2.217 1.278 0.939 1.000 0.462 CB 1.441 14 residues pruned to eliminate duplicates Z: 18 24.202 2.117 0.996 0.502 0.941 0.647 CB 1.474 18 residues pruned to eliminate duplicates Z: 10 4.208 1.368 -0.005 0.857 0.889 0.889 CB 0.854 10 residues pruned to eliminate duplicates Z: 27 24.977 2.160 0.812 0.480 0.885 0.654 CB 1.444 30 residues pruned to eliminate duplicates Z: 10 20.441 2.155 0.644 0.831 1.000 0.889 CA 1.445 10 residues pruned to eliminate duplicates Z: 32 33.622 2.300 0.923 0.532 0.871 0.516 CB 1.519 32 residues pruned to eliminate duplicates Z: 8 3.166 1.784 0.645 0.187 0.571 0.571 CA 1.039 8 residues pruned to eliminate duplicates Z: 49 22.942 1.909 0.465 0.467 0.896 0.583 CB 1.367 49 residues pruned to eliminate duplicates Z: 14 9.422 1.909 0.676 0.245 0.692 0.462 CB 1.584 14 residues pruned to eliminate duplicates Z: 13 45.183 2.315 1.379 0.913 1.000 0.917 CB 1.675 13 residues pruned to eliminate duplicates Z: 15 23.608 2.058 0.744 0.918 1.000 0.714 CB 1.240 15 residues pruned to eliminate duplicates Z: 47 48.215 2.175 1.078 0.597 0.891 0.609 CB 1.609 97 residues pruned to eliminate duplicates Z: 14 18.727 2.038 0.900 0.570 0.846 0.692 CB 1.481 14 residues pruned to eliminate duplicates Z: 63 49.928 2.098 0.876 0.685 0.952 0.645 CB 1.428 63 residues pruned to eliminate duplicates Z: 17 18.496 1.901 0.814 0.553 0.938 0.688 CA 1.359 17 residues pruned to eliminate duplicates Z: 6 2.940 1.313 0.420 0.753 0.800 0.400 CA 0.704 6 residues pruned to eliminate duplicates Z: 15 24.722 2.106 0.645 0.914 1.000 1.000 CA 1.348 15 residues pruned to eliminate duplicates Z: 24 18.329 2.105 0.758 0.460 0.739 0.565 CB 1.455 24 residues pruned to eliminate duplicates Z: 8 4.871 1.496 0.013 0.858 0.857 0.714 CB 1.044 8 residues pruned to eliminate duplicates Z: 9 4.018 1.673 0.062 0.364 0.875 0.625 CB 1.057 8 residues pruned to eliminate duplicates Z: 13 31.129 2.251 0.824 0.939 1.000 0.917 CA 1.521 13 residues pruned to eliminate duplicates Z: 15 12.122 1.826 0.255 0.650 0.929 0.643 CB 1.324 Z: 85 66.841 2.267 0.950 0.599 0.940 0.690 CB 1.597 85 residues pruned to eliminate duplicates Z: 23 35.955 2.407 0.896 0.627 0.909 0.682 CB 1.639 23 residues pruned to eliminate duplicates Z: 15 28.300 2.398 0.664 0.599 1.000 0.786 CB 1.725 15 residues pruned to eliminate duplicates Z: 7 6.745 1.949 0.472 0.577 0.667 0.333 CA 1.337 7 residues pruned to eliminate duplicates Z: 10 5.712 1.715 -0.138 0.597 0.889 0.556 CB 1.321 17 residues pruned to eliminate duplicates Z: 66 35.316 2.097 0.626 0.511 0.877 0.677 CB 1.449 66 residues pruned to eliminate duplicates Z: 18 17.423 2.188 0.593 0.320 1.000 0.647 CA 1.477 18 residues pruned to eliminate duplicates Z: 7 14.194 2.111 0.830 0.817 1.000 0.833 CA 1.140 7 residues pruned to eliminate duplicates Z: 10 7.797 1.629 0.112 0.888 1.000 0.778 CB 1.033 10 residues pruned to eliminate duplicates Z: 16 7.039 1.575 0.494 0.335 0.800 0.267 CB 1.156 11 residues pruned to eliminate duplicates Z: 33 38.098 2.309 1.021 0.600 0.906 0.531 CB 1.448 33 residues pruned to eliminate duplicates Z: 8 4.502 1.331 0.840 0.462 0.857 0.571 CB 0.842 Z: 16 41.239 2.356 1.174 0.930 0.933 0.600 CB 1.557 16 residues pruned to eliminate duplicates Z: 40 21.120 1.912 0.462 0.464 0.949 0.564 CB 1.323 40 residues pruned to eliminate duplicates Z: 46 39.710 2.199 0.958 0.509 0.889 0.511 CB 1.533 46 residues pruned to eliminate duplicates Z: 57 42.768 2.067 0.912 0.637 0.911 0.696 CB 1.396 57 residues pruned to eliminate duplicates Z: 7 9.038 2.265 0.512 0.373 0.667 0.500 CB 1.851 7 residues pruned to eliminate duplicates Z: 21 37.904 2.447 1.137 0.578 0.950 0.800 CB 1.583 21 residues pruned to eliminate duplicates Z: 15 34.497 2.180 0.996 0.913 1.000 0.857 CB 1.500 Z: 35 43.261 2.201 1.063 0.614 0.941 0.588 CB 1.559 35 residues pruned to eliminate duplicates Z: 73 69.892 2.423 0.958 0.607 0.931 0.667 CB 1.685 73 residues pruned to eliminate duplicates Z: 7 5.119 1.801 -0.219 0.639 1.000 0.667 O 1.305 6 residues pruned to eliminate duplicates Z: 6 2.318 1.185 0.518 0.348 1.000 0.400 N 0.679 6 residues pruned to eliminate duplicates Z: 6 7.205 1.826 -0.041 0.792 1.000 1.000 C 1.424 6 residues pruned to eliminate duplicates Z: 7 14.810 2.058 1.085 0.637 1.000 0.667 CA 1.239 7 residues pruned to eliminate duplicates Z: 60 40.404 2.029 0.819 0.634 0.915 0.593 CB 1.374 60 residues pruned to eliminate duplicates Z: 7 6.226 1.622 0.240 0.864 1.000 0.833 CB 0.927 7 residues pruned to eliminate duplicates Z: 87 73.505 2.288 0.981 0.642 0.930 0.651 CB 1.647 102 residues pruned to eliminate duplicates Z: 55 61.404 2.243 1.067 0.650 0.963 0.648 CB 1.627 55 residues pruned to eliminate duplicates Z: 48 26.772 2.032 0.522 0.496 0.851 0.638 CB 1.489 48 residues pruned to eliminate duplicates Z: 10 8.588 1.841 0.490 0.378 0.778 0.444 CB 1.528 10 residues pruned to eliminate duplicates Z: 51 53.508 2.135 0.927 0.693 0.980 0.780 CB 1.573 51 residues pruned to eliminate duplicates Z: 69 47.184 2.128 0.878 0.640 0.897 0.603 CB 1.400 69 residues pruned to eliminate duplicates Z: 11 15.463 2.123 0.416 0.767 0.900 0.700 CB 1.427 11 residues pruned to eliminate duplicates Z: 90 69.942 2.251 0.967 0.620 0.955 0.674 CB 1.566 90 residues pruned to eliminate duplicates 6 1.109 1.333 0.085 0.297 0.800 0.800 CB 0.538 ? Z: 6 2.525 1.303 0.112 0.295 1.000 0.600 C 0.980 6 residues pruned to eliminate duplicates Z: 113 73.472 2.263 1.005 0.601 0.893 0.527 CB 1.557 113 residues pruned to eliminate duplicates Z: 7 3.481 1.536 0.262 0.372 0.833 0.500 CB 1.009 7 residues pruned to eliminate duplicates Z: 6 4.773 1.393 0.742 0.656 0.800 0.800 CB 0.951 Z: 8 6.722 1.538 0.538 0.912 1.000 1.000 CB 0.761 8 residues pruned to eliminate duplicates Z: 15 14.155 1.841 0.530 0.872 0.929 0.857 CB 1.055 15 residues pruned to eliminate duplicates Z: 30 25.117 2.077 0.597 0.528 0.931 0.517 CB 1.470 30 residues pruned to eliminate duplicates Z: 21 34.699 2.313 1.088 0.587 0.900 0.450 CB 1.642 21 residues pruned to eliminate duplicates Z: 15 14.567 1.752 0.231 0.911 1.000 0.929 CA 1.279 15 residues pruned to eliminate duplicates Z: 12 5.372 1.833 0.331 0.203 0.727 0.364 CB 1.300 12 residues pruned to eliminate duplicates Z: 7 10.137 1.839 0.916 0.607 0.833 0.667 C 1.272 7 residues pruned to eliminate duplicates Z: 13 8.583 1.638 0.731 0.303 0.750 0.500 CA 1.451 Z: 7 2.557 1.461 -0.093 0.631 1.000 0.500 N 0.696 Z: 12 4.329 1.361 0.456 0.292 0.818 0.455 C 1.016 Z: 15 10.363 1.753 0.378 0.648 0.857 0.571 CB 1.165 15 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 13 11.301 1.987 0.297 0.609 0.833 0.667 CB 1.371 14 residues pruned to eliminate duplicates Z: 10 14.055 1.980 0.428 0.864 0.889 0.667 CB 1.367 10 residues pruned to eliminate duplicates Z: 17 12.768 1.779 0.628 0.500 0.812 0.375 CB 1.356 19 residues pruned to eliminate duplicates Z: 10 16.308 1.965 0.700 0.827 0.889 0.222 CB 1.380 10 residues pruned to eliminate duplicates Z: 16 13.137 1.947 0.632 0.506 0.867 0.400 CB 1.224 16 residues pruned to eliminate duplicates Z: 53 40.348 2.104 0.912 0.523 0.865 0.519 CB 1.571 53 residues pruned to eliminate duplicates Z: 21 21.935 1.910 0.726 0.588 0.950 0.650 CB 1.440 17 residues pruned to eliminate duplicates Z: 11 15.163 2.106 0.329 0.877 0.900 0.800 CB 1.382 11 residues pruned to eliminate duplicates Z: 31 14.932 2.085 0.443 0.373 0.767 0.467 CB 1.354 31 residues pruned to eliminate duplicates Z: 15 20.489 2.120 0.792 0.514 0.857 0.429 CB 1.658 15 residues pruned to eliminate duplicates Z: 14 18.391 2.162 0.691 0.554 0.923 0.615 CB 1.433 14 residues pruned to eliminate duplicates Z: 12 17.351 2.244 0.665 0.636 0.818 0.455 CB 1.506 12 residues pruned to eliminate duplicates Z: 13 18.883 2.096 0.767 0.602 0.917 0.667 CB 1.457 13 residues pruned to eliminate duplicates Z: 16 18.706 2.030 0.739 0.484 1.000 0.467 CB 1.390 16 residues pruned to eliminate duplicates Z: 25 18.756 1.852 0.669 0.465 0.958 0.458 CB 1.339 25 residues pruned to eliminate duplicates Z: 8 5.315 1.502 0.210 0.722 0.857 0.571 CB 1.056 7 residues pruned to eliminate duplicates Z: 9 5.606 1.441 0.388 0.846 0.875 0.875 CB 0.841 9 residues pruned to eliminate duplicates Z: 8 5.072 1.496 0.037 0.821 1.000 0.714 CB 0.936 8 residues pruned to eliminate duplicates Z: 8 5.068 1.835 0.369 0.311 0.714 0.286 CB 1.316 8 residues pruned to eliminate duplicates Z: 24 14.678 2.117 0.515 0.427 0.739 0.391 CB 1.392 24 residues pruned to eliminate duplicates Z: 12 8.265 2.024 0.596 0.314 0.727 0.273 CB 1.304 12 residues pruned to eliminate duplicates Z: 6 3.959 1.569 0.438 0.453 0.800 0.400 CA 1.030 Z: 6 7.647 1.805 0.575 0.455 1.000 1.000 CA 1.259 Z: 9 15.514 2.343 0.833 0.675 0.750 0.500 CB 1.449 Z: 14 18.054 1.967 0.875 0.712 0.923 0.538 CB 1.214 Z: 12 13.256 2.001 0.785 0.639 0.727 0.545 CB 1.350 12 residues pruned to eliminate duplicates Z: 21 19.732 2.077 0.673 0.526 0.800 0.600 CB 1.547 21 residues pruned to eliminate duplicates Z: 65 38.867 2.129 0.603 0.475 0.922 0.594 CB 1.584 65 residues pruned to eliminate duplicates Z: 74 38.715 2.149 0.670 0.450 0.877 0.644 CB 1.516 74 residues pruned to eliminate duplicates Z: 20 22.061 2.137 0.875 0.457 0.895 0.579 CB 1.476 20 residues pruned to eliminate duplicates Z: 36 23.054 2.108 0.712 0.373 0.857 0.629 CB 1.444 36 residues pruned to eliminate duplicates Z: 37 34.752 2.186 0.786 0.580 0.889 0.750 CB 1.546 37 residues pruned to eliminate duplicates Z: 51 30.569 2.066 0.495 0.530 0.880 0.620 CB 1.545 51 residues pruned to eliminate duplicates Z: 24 20.246 2.002 0.628 0.524 0.913 0.522 CB 1.385 24 residues pruned to eliminate duplicates Z: 67 40.181 2.131 0.741 0.449 0.909 0.591 CB 1.545 67 residues pruned to eliminate duplicates Z: 63 33.703 2.081 0.604 0.522 0.855 0.661 CB 1.468 63 residues pruned to eliminate duplicates Z: 46 35.260 2.149 0.653 0.568 0.889 0.689 CB 1.558 46 residues pruned to eliminate duplicates Z: 74 39.693 2.091 0.717 0.469 0.904 0.616 CB 1.478 74 residues pruned to eliminate duplicates Z: 33 27.612 2.118 0.819 0.453 0.906 0.688 CB 1.467 33 residues pruned to eliminate duplicates Z: 45 35.407 2.143 0.620 0.567 0.955 0.682 CB 1.509 45 residues pruned to eliminate duplicates Z: 64 36.266 2.079 0.662 0.485 0.937 0.571 CB 1.433 64 residues pruned to eliminate duplicates Z: 196 92.968 2.252 0.811 0.587 0.923 0.651 CB 1.626 196 residues pruned to eliminate duplicates Z: 138 70.329 2.250 0.741 0.553 0.898 0.657 CB 1.622 138 residues pruned to eliminate duplicates Z: 47 28.941 2.125 0.526 0.516 0.913 0.587 CB 1.418 47 residues pruned to eliminate duplicates Z: 100 45.656 2.120 0.611 0.505 0.909 0.606 CB 1.471 100 residues pruned to eliminate duplicates Z: 20 19.231 2.034 0.402 0.707 0.947 0.684 CB 1.353 20 residues pruned to eliminate duplicates Z: 62 35.647 2.102 0.639 0.525 0.885 0.689 CB 1.460 62 residues pruned to eliminate duplicates Z: 39 24.715 2.063 0.526 0.536 0.921 0.632 CB 1.334 39 residues pruned to eliminate duplicates Z: 52 31.126 2.088 0.592 0.486 0.902 0.686 CB 1.474 52 residues pruned to eliminate duplicates Z: 97 49.229 2.142 0.671 0.506 0.917 0.594 CB 1.523 97 residues pruned to eliminate duplicates Z: 37 34.642 2.141 0.705 0.626 0.944 0.694 CB 1.487 37 residues pruned to eliminate duplicates Z: 59 30.919 2.073 0.646 0.443 0.862 0.569 CB 1.464 59 residues pruned to eliminate duplicates Z: 36 34.186 2.140 0.693 0.637 0.943 0.600 CB 1.487 36 residues pruned to eliminate duplicates Z: 158 79.255 2.238 0.837 0.577 0.904 0.650 CB 1.579 158 residues pruned to eliminate duplicates Z: 203 89.891 2.228 0.895 0.560 0.916 0.629 CB 1.543 203 residues pruned to eliminate duplicates Z: 198 95.690 2.247 0.913 0.571 0.929 0.629 CB 1.595 198 residues pruned to eliminate duplicates Z: 75 41.885 2.127 0.717 0.491 0.892 0.568 CB 1.508 75 residues pruned to eliminate duplicates Z: 105 57.064 2.189 0.780 0.533 0.894 0.596 CB 1.554 105 residues pruned to eliminate duplicates Z: 29 16.980 2.063 0.661 0.282 0.786 0.536 CB 1.525 29 residues pruned to eliminate duplicates Z: 30 20.849 2.074 0.704 0.327 0.862 0.448 CB 1.537 30 residues pruned to eliminate duplicates Z: 101 63.051 2.282 0.833 0.527 0.890 0.620 CB 1.650 101 residues pruned to eliminate duplicates Z: 64 33.421 2.074 0.671 0.470 0.873 0.508 CB 1.434 64 residues pruned to eliminate duplicates Z: 158 86.582 2.269 0.906 0.564 0.924 0.631 CB 1.625 158 residues pruned to eliminate duplicates Z: 65 29.965 2.007 0.625 0.444 0.844 0.562 CB 1.442 65 residues pruned to eliminate duplicates Z: 68 37.576 2.097 0.621 0.462 0.925 0.597 CB 1.517 68 residues pruned to eliminate duplicates Z: 38 22.790 2.076 0.552 0.323 0.946 0.514 CB 1.493 38 residues pruned to eliminate duplicates Z: 195 90.960 2.250 0.888 0.567 0.918 0.562 CB 1.570 195 residues pruned to eliminate duplicates Z: 31 20.714 2.015 0.627 0.319 0.967 0.500 CB 1.458 31 residues pruned to eliminate duplicates Z: 68 29.248 2.019 0.647 0.352 0.896 0.537 CB 1.409 68 residues pruned to eliminate duplicates Z: 97 39.698 2.076 0.717 0.394 0.896 0.500 CB 1.419 97 residues pruned to eliminate duplicates Z: 36 21.516 2.109 0.454 0.317 0.914 0.486 CB 1.587 36 residues pruned to eliminate duplicates Z: 63 35.277 2.077 0.681 0.473 0.919 0.597 CB 1.434 63 residues pruned to eliminate duplicates Z: 173 86.007 2.240 0.894 0.571 0.919 0.610 CB 1.571 173 residues pruned to eliminate duplicates Z: 76 40.179 2.120 0.694 0.442 0.920 0.600 CB 1.490 76 residues pruned to eliminate duplicates Z: 148 73.677 2.234 0.811 0.526 0.918 0.612 CB 1.594 148 residues pruned to eliminate duplicates Z: 27 21.319 1.977 0.489 0.370 1.000 0.577 CA 1.633 27 residues pruned to eliminate duplicates Z: 156 92.781 2.288 0.944 0.587 0.942 0.639 CB 1.637 156 residues pruned to eliminate duplicates Z: 29 22.797 2.078 0.789 0.352 0.893 0.536 CB 1.524 29 residues pruned to eliminate duplicates Z: 93 48.931 2.155 0.703 0.495 0.902 0.609 CB 1.548 93 residues pruned to eliminate duplicates Z: 71 51.697 2.281 0.804 0.536 0.886 0.629 CB 1.636 71 residues pruned to eliminate duplicates Z: 13 10.022 1.962 0.573 0.275 0.833 0.583 CB 1.451 13 residues pruned to eliminate duplicates Z: 159 77.232 2.227 0.830 0.545 0.886 0.608 CB 1.628 159 residues pruned to eliminate duplicates Z: 16 12.354 2.096 0.536 0.250 0.800 0.467 CB 1.652 16 residues pruned to eliminate duplicates Z: 81 40.261 2.157 0.687 0.433 0.875 0.550 CB 1.515 81 residues pruned to eliminate duplicates Z: 74 51.187 2.245 0.814 0.497 0.932 0.534 CB 1.584 74 residues pruned to eliminate duplicates Z: 17 16.236 2.131 0.590 0.331 0.875 0.438 CB 1.647 17 residues pruned to eliminate duplicates Z: 205 96.593 2.236 0.869 0.591 0.946 0.569 CB 1.568 205 residues pruned to eliminate duplicates Z: 133 90.139 2.307 0.969 0.631 0.947 0.629 CB 1.612 133 residues pruned to eliminate duplicates Z: 65 56.740 2.311 0.807 0.572 0.984 0.641 CB 1.609 65 residues pruned to eliminate duplicates Z: 141 86.125 2.285 0.935 0.601 0.907 0.636 CB 1.648 141 residues pruned to eliminate duplicates Z: 121 75.700 2.267 0.915 0.578 0.917 0.617 CB 1.611 121 residues pruned to eliminate duplicates Z: 79 68.486 2.343 0.897 0.599 0.949 0.641 CB 1.674 79 residues pruned to eliminate duplicates Z: 128 86.986 2.313 0.929 0.638 0.929 0.693 CB 1.635 128 residues pruned to eliminate duplicates Z: 102 74.902 2.304 0.924 0.568 0.950 0.653 CB 1.657 102 residues pruned to eliminate duplicates Z: 81 65.355 2.299 0.988 0.593 0.900 0.637 CB 1.625 81 residues pruned to eliminate duplicates Z: 183 93.301 2.250 0.929 0.591 0.912 0.599 CB 1.601 183 residues pruned to eliminate duplicates Z: 151 86.196 2.275 0.945 0.600 0.900 0.647 CB 1.606 151 residues pruned to eliminate duplicates Z: 88 54.619 2.217 0.809 0.504 0.954 0.563 CB 1.525 88 residues pruned to eliminate duplicates Z: 143 96.373 2.305 1.024 0.631 0.958 0.669 CB 1.600 143 residues pruned to eliminate duplicates Z: 135 81.552 2.303 0.899 0.595 0.918 0.634 CB 1.603 135 residues pruned to eliminate duplicates Z: 129 86.152 2.293 0.959 0.628 0.922 0.648 CB 1.630 129 residues pruned to eliminate duplicates Z: 172 83.426 2.230 0.888 0.546 0.918 0.655 CB 1.578 201 residues pruned to eliminate duplicates Z: 13 28.681 2.219 0.832 0.926 1.000 0.750 CA 1.428 13 residues pruned to eliminate duplicates Z: 155 90.337 2.264 0.968 0.589 0.929 0.610 CB 1.616 155 residues pruned to eliminate duplicates Z: 143 94.207 2.296 0.983 0.603 0.958 0.648 CB 1.643 143 residues pruned to eliminate duplicates Z: 74 49.348 2.210 0.893 0.505 0.890 0.603 CB 1.543 74 residues pruned to eliminate duplicates Z: 59 51.828 2.244 0.877 0.579 0.948 0.672 CB 1.579 59 residues pruned to eliminate duplicates Z: 83 55.484 2.226 0.788 0.523 0.927 0.610 CB 1.625 83 residues pruned to eliminate duplicates Z: 138 90.990 2.277 0.983 0.619 0.956 0.664 CB 1.608 138 residues pruned to eliminate duplicates Z: 53 61.721 2.379 0.994 0.605 0.962 0.635 CB 1.698 53 residues pruned to eliminate duplicates Z: 113 90.131 2.335 1.046 0.630 0.938 0.589 CB 1.683 113 residues pruned to eliminate duplicates Z: 7 4.322 1.867 0.875 0.323 0.833 0.333 CB 0.735 7 residues pruned to eliminate duplicates Z: 119 85.986 2.304 0.978 0.635 0.941 0.636 CB 1.626 119 residues pruned to eliminate duplicates Z: 53 58.893 2.346 1.062 0.582 0.923 0.596 CB 1.691 53 residues pruned to eliminate duplicates Z: 36 38.550 2.199 0.963 0.568 0.943 0.600 CB 1.500 36 residues pruned to eliminate duplicates Z: 108 85.888 2.309 1.066 0.630 0.935 0.664 CB 1.647 108 residues pruned to eliminate duplicates Z: 135 68.091 2.178 0.830 0.519 0.948 0.619 CB 1.528 135 residues pruned to eliminate duplicates Z: 58 45.771 2.228 0.943 0.501 0.912 0.474 CB 1.533 58 residues pruned to eliminate duplicates Z: 114 89.040 2.320 1.072 0.628 0.938 0.593 CB 1.646 114 residues pruned to eliminate duplicates Z: 137 94.850 2.310 0.983 0.627 0.949 0.647 CB 1.660 137 residues pruned to eliminate duplicates Z: 150 90.842 2.283 1.018 0.582 0.940 0.604 CB 1.589 150 residues pruned to eliminate duplicates Z: 90 63.719 2.265 0.931 0.536 0.921 0.607 CB 1.618 90 residues pruned to eliminate duplicates Z: 48 56.835 2.378 0.951 0.583 0.957 0.553 CB 1.723 48 residues pruned to eliminate duplicates Z: 35 46.292 2.332 1.058 0.579 0.912 0.706 CB 1.681 35 residues pruned to eliminate duplicates Z: 102 89.215 2.320 1.161 0.655 0.931 0.663 CB 1.647 102 residues pruned to eliminate duplicates Z: 71 73.509 2.345 1.098 0.644 0.914 0.643 CB 1.708 71 residues pruned to eliminate duplicates Z: 109 84.095 2.321 1.020 0.636 0.944 0.639 CB 1.609 109 residues pruned to eliminate duplicates Z: 54 57.682 2.346 1.066 0.583 0.906 0.642 CB 1.667 54 residues pruned to eliminate duplicates Z: 115 86.414 2.311 1.056 0.631 0.930 0.684 CB 1.619 115 residues pruned to eliminate duplicates Z: 134 65.873 2.206 0.812 0.514 0.917 0.602 CB 1.536 134 residues pruned to eliminate duplicates Z: 119 89.793 2.322 0.983 0.645 0.949 0.678 CB 1.652 119 residues pruned to eliminate duplicates Z: 90 64.410 2.311 0.883 0.547 0.910 0.640 CB 1.647 90 residues pruned to eliminate duplicates Z: 53 60.365 2.367 1.081 0.606 0.904 0.577 CB 1.700 53 residues pruned to eliminate duplicates Z: 120 88.277 2.305 1.046 0.643 0.950 0.639 CB 1.581 120 residues pruned to eliminate duplicates Z: 64 73.473 2.373 1.133 0.636 0.952 0.635 CB 1.690 64 residues pruned to eliminate duplicates Z: 54 60.277 2.354 1.124 0.596 0.906 0.604 CB 1.668 54 residues pruned to eliminate duplicates Z: 55 59.989 2.339 1.135 0.600 0.907 0.648 CB 1.638 55 residues pruned to eliminate duplicates Z: 58 59.302 2.320 0.980 0.596 0.930 0.684 CB 1.678 58 residues pruned to eliminate duplicates Z: 52 66.411 2.393 1.205 0.633 0.902 0.667 CB 1.724 52 residues pruned to eliminate duplicates Z: 115 88.346 2.296 1.061 0.627 0.956 0.588 CB 1.622 115 residues pruned to eliminate duplicates Z: 54 63.136 2.380 1.144 0.612 0.925 0.623 CB 1.654 54 residues pruned to eliminate duplicates Z: 143 96.310 2.302 1.042 0.629 0.944 0.648 CB 1.613 143 residues pruned to eliminate duplicates Z: 53 63.713 2.369 1.139 0.604 0.962 0.577 CB 1.643 53 residues pruned to eliminate duplicates Z: 53 65.016 2.379 1.125 0.606 0.962 0.577 CB 1.676 53 residues pruned to eliminate duplicates Z: 54 60.179 2.364 1.142 0.613 0.906 0.547 CB 1.620 54 residues pruned to eliminate duplicates Z: 111 86.913 2.285 1.044 0.645 0.927 0.636 CB 1.672 111 residues pruned to eliminate duplicates Z: 39 59.713 2.334 1.176 0.681 0.921 0.605 CB 1.754 39 residues pruned to eliminate duplicates Z: 22 36.447 2.352 1.070 0.596 0.905 0.667 CA 1.647 22 residues pruned to eliminate duplicates Z: 71 72.994 2.294 1.126 0.660 0.914 0.600 CB 1.687 71 residues pruned to eliminate duplicates Z: 56 41.722 2.164 0.798 0.479 0.891 0.582 CB 1.658 56 residues pruned to eliminate duplicates Z: 76 64.703 2.269 0.970 0.624 0.907 0.680 CB 1.641 76 residues pruned to eliminate duplicates Z: 73 74.449 2.282 1.065 0.674 0.931 0.639 CB 1.704 73 residues pruned to eliminate duplicates Z: 72 69.943 2.257 1.073 0.664 0.944 0.662 CB 1.615 72 residues pruned to eliminate duplicates Z: 83 65.033 2.251 0.956 0.617 0.902 0.634 CB 1.618 83 residues pruned to eliminate duplicates Z: 162 92.607 2.246 1.006 0.588 0.944 0.627 CB 1.577 162 residues pruned to eliminate duplicates Z: 88 72.607 2.270 0.996 0.633 0.931 0.644 CB 1.628 88 residues pruned to eliminate duplicates Z: 85 63.602 2.217 0.852 0.613 0.929 0.595 CB 1.635 85 residues pruned to eliminate duplicates Z: 84 72.027 2.281 1.053 0.652 0.916 0.590 CB 1.601 84 residues pruned to eliminate duplicates Z: 89 71.240 2.254 1.005 0.648 0.909 0.557 CB 1.609 89 residues pruned to eliminate duplicates Z: 32 55.330 2.338 1.148 0.684 0.935 0.645 CB 1.787 32 residues pruned to eliminate duplicates Z: 33 51.996 2.330 1.203 0.640 0.875 0.719 CB 1.796 33 residues pruned to eliminate duplicates Z: 118 90.940 2.305 1.102 0.644 0.957 0.684 CB 1.584 118 residues pruned to eliminate duplicates Z: 132 86.329 2.298 1.015 0.616 0.916 0.656 CB 1.594 132 residues pruned to eliminate duplicates Z: 82 78.292 2.301 1.081 0.668 0.963 0.617 CB 1.616 82 residues pruned to eliminate duplicates Z: 67 60.029 2.253 1.038 0.623 0.939 0.606 CB 1.526 67 residues pruned to eliminate duplicates Z: 86 63.286 2.263 0.925 0.613 0.918 0.612 CB 1.542 86 residues pruned to eliminate duplicates Z: 75 68.412 2.262 1.002 0.647 0.959 0.595 CB 1.596 75 residues pruned to eliminate duplicates Z: 88 69.980 2.284 0.971 0.637 0.920 0.632 CB 1.594 88 residues pruned to eliminate duplicates Z: 153 93.494 2.297 0.961 0.587 0.961 0.592 CB 1.612 153 residues pruned to eliminate duplicates Z: 115 81.270 2.289 1.033 0.604 0.921 0.544 CB 1.609 115 residues pruned to eliminate duplicates Z: 85 61.207 2.217 0.898 0.594 0.917 0.643 CB 1.583 85 residues pruned to eliminate duplicates Z: 201 96.042 2.226 0.914 0.584 0.935 0.665 CB 1.573 201 residues pruned to eliminate duplicates Z: 70 61.564 2.223 0.878 0.647 0.986 0.667 CB 1.571 70 residues pruned to eliminate duplicates Z: 78 69.086 2.260 1.014 0.620 0.948 0.623 CB 1.629 78 residues pruned to eliminate duplicates Z: 69 58.869 2.226 0.903 0.653 0.956 0.662 CB 1.530 69 residues pruned to eliminate duplicates Z: 82 77.594 2.293 1.016 0.656 0.975 0.654 CB 1.654 82 residues pruned to eliminate duplicates Z: 67 59.883 2.257 0.877 0.660 0.924 0.636 CB 1.622 67 residues pruned to eliminate duplicates Z: 77 71.805 2.281 1.040 0.632 0.947 0.684 CB 1.651 77 residues pruned to eliminate duplicates Z: 115 88.216 2.325 1.083 0.623 0.939 0.632 CB 1.618 115 residues pruned to eliminate duplicates Z: 70 71.699 2.306 1.063 0.653 0.942 0.652 CB 1.671 70 residues pruned to eliminate duplicates Z: 82 75.013 2.309 0.998 0.638 0.963 0.605 CB 1.649 82 residues pruned to eliminate duplicates Z: 60 54.741 2.229 0.904 0.663 0.932 0.508 CB 1.550 Z: 17 24.435 2.020 0.773 0.846 0.938 0.688 CA 1.352 17 residues pruned to eliminate duplicates Z: 102 88.605 2.317 1.176 0.631 0.950 0.614 CB 1.626 102 residues pruned to eliminate duplicates Z: 78 66.492 2.266 1.008 0.602 0.922 0.597 CB 1.638 138 residues pruned to eliminate duplicates Z: 70 56.673 2.237 0.972 0.603 0.899 0.623 CB 1.560 70 residues pruned to eliminate duplicates Z: 154 86.774 2.250 1.003 0.560 0.922 0.614 CB 1.593 154 residues pruned to eliminate duplicates Z: 117 87.756 2.296 1.065 0.621 0.948 0.534 CB 1.616 117 residues pruned to eliminate duplicates Z: 95 73.257 2.218 1.019 0.607 0.957 0.596 CB 1.592 95 residues pruned to eliminate duplicates Z: 72 59.101 2.198 0.972 0.618 0.930 0.662 CB 1.557 72 residues pruned to eliminate duplicates Z: 118 93.475 2.316 1.120 0.631 0.949 0.641 CB 1.640 118 residues pruned to eliminate duplicates Z: 49 47.314 2.196 0.944 0.583 0.938 0.562 CB 1.576 Z: 17 32.040 2.047 1.128 0.887 0.938 0.812 CA 1.414 6 residues pruned to eliminate duplicates Z: 16 33.488 2.172 0.954 0.878 1.000 0.667 CA 1.479 16 residues pruned to eliminate duplicates Z: 88 70.307 2.277 0.957 0.645 0.931 0.632 CB 1.587 148 residues pruned to eliminate duplicates Z: 120 88.304 2.312 1.053 0.630 0.950 0.639 CB 1.590 120 residues pruned to eliminate duplicates Z: 197 93.885 2.226 0.925 0.571 0.939 0.602 CB 1.556 197 residues pruned to eliminate duplicates Z: 59 52.271 2.191 1.005 0.593 0.931 0.621 CB 1.535 Z: 9 26.784 2.339 0.964 0.820 1.000 0.625 CB 1.562 9 residues pruned to eliminate duplicates Z: 76 69.587 2.241 1.061 0.640 0.947 0.600 CB 1.612 135 residues pruned to eliminate duplicates Z: 89 74.559 2.274 1.013 0.628 0.943 0.614 CB 1.632 89 residues pruned to eliminate duplicates Z: 114 95.490 2.329 1.160 0.633 0.973 0.584 CB 1.620 114 residues pruned to eliminate duplicates Z: 85 70.010 2.270 1.020 0.631 0.929 0.619 CB 1.587 85 residues pruned to eliminate duplicates Z: 78 60.406 2.254 0.901 0.604 0.896 0.597 CB 1.625 78 residues pruned to eliminate duplicates Z: 120 85.130 2.302 1.035 0.619 0.941 0.605 CB 1.583 120 residues pruned to eliminate duplicates Z: 117 89.711 2.292 1.149 0.617 0.957 0.603 CB 1.581 117 residues pruned to eliminate duplicates Z: 83 63.423 2.239 0.888 0.591 0.951 0.634 CB 1.596 83 residues pruned to eliminate duplicates Z: 84 71.406 2.286 1.030 0.607 0.928 0.614 CB 1.645 84 residues pruned to eliminate duplicates Z: 11 18.665 2.035 1.150 0.378 1.000 0.600 CB 1.537 Z: 7 6.626 1.530 1.261 0.295 1.000 0.667 CB 0.983 7 residues pruned to eliminate duplicates Z: 6 7.205 1.473 1.511 0.363 0.800 0.400 CA 1.261 6 residues pruned to eliminate duplicates Z: 6 8.121 1.669 1.618 0.402 1.000 0.600 CB 0.921 Z: 6 4.314 1.327 0.915 0.471 0.800 0.400 N 0.977 Z: 6 5.080 1.840 0.664 0.396 1.000 0.600 CA 0.827 Z: 11 17.531 2.132 0.412 0.832 0.900 0.700 CB 1.535 5 residues pruned to eliminate duplicates Z: 12 14.753 1.934 0.403 0.847 0.909 0.727 CB 1.339 11 residues pruned to eliminate duplicates Z: 11 17.694 2.126 0.451 0.880 0.900 0.900 CB 1.461 11 residues pruned to eliminate duplicates Z: 18 19.342 2.097 0.769 0.427 0.824 0.647 CA 1.656 18 residues pruned to eliminate duplicates Z: 19 19.807 2.203 0.507 0.513 0.944 0.722 CB 1.470 20 residues pruned to eliminate duplicates Z: 10 23.594 2.304 0.499 0.882 1.000 0.778 CB 1.647 10 residues pruned to eliminate duplicates Z: 18 19.725 2.161 0.450 0.486 0.941 0.471 CB 1.645 18 residues pruned to eliminate duplicates Z: 10 25.857 2.304 0.659 0.893 1.000 0.667 CB 1.619 10 residues pruned to eliminate duplicates Z: 13 20.640 2.146 0.726 0.723 1.000 0.583 CB 1.315 13 residues pruned to eliminate duplicates Z: 15 21.643 2.230 0.698 0.502 0.929 0.571 CB 1.641 15 residues pruned to eliminate duplicates Z: 6 6.511 1.482 0.943 0.417 1.000 0.800 O 1.102 4 residues pruned to eliminate duplicates Z: 6 3.650 1.626 0.578 0.431 0.800 0.400 CA 0.854 5 residues pruned to eliminate duplicates Z: 15 16.295 2.219 0.461 0.599 0.786 0.500 CB 1.556 14 residues pruned to eliminate duplicates Z: 13 14.615 2.138 0.210 0.803 0.833 0.667 CB 1.502 13 residues pruned to eliminate duplicates Z: 49 27.921 2.163 0.652 0.426 0.812 0.562 CB 1.499 52 residues pruned to eliminate duplicates Z: 11 20.106 2.170 0.494 0.849 0.900 0.700 CB 1.615 11 residues pruned to eliminate duplicates Z: 46 28.735 2.214 0.564 0.462 0.822 0.489 CB 1.564 46 residues pruned to eliminate duplicates Z: 13 12.741 2.073 0.580 0.538 0.750 0.417 CB 1.443 13 residues pruned to eliminate duplicates Z: 7 7.129 2.321 -0.185 0.867 0.667 0.667 CB 1.689 7 residues pruned to eliminate duplicates Z: 9 16.372 2.318 0.477 0.738 0.875 0.625 CB 1.561 9 residues pruned to eliminate duplicates Z: 58 34.198 2.191 0.802 0.441 0.877 0.614 CB 1.391 58 residues pruned to eliminate duplicates Z: 30 26.202 2.147 0.569 0.611 0.966 0.759 CB 1.347 30 residues pruned to eliminate duplicates Z: 51 32.334 2.210 0.709 0.525 0.840 0.660 CB 1.405 48 residues pruned to eliminate duplicates Z: 6 2.835 1.887 -0.014 0.462 0.800 0.400 CB 0.885 6 residues pruned to eliminate duplicates Z: 17 15.025 2.046 0.667 0.440 0.875 0.688 CB 1.339 17 residues pruned to eliminate duplicates Z: 19 15.281 2.000 0.680 0.353 0.833 0.556 CB 1.508 19 residues pruned to eliminate duplicates Z: 15 18.380 2.176 0.702 0.452 0.929 0.643 CB 1.501 15 residues pruned to eliminate duplicates Z: 68 42.765 2.202 0.803 0.490 0.881 0.552 CB 1.510 131 residues pruned to eliminate duplicates Z: 69 41.562 2.249 0.743 0.458 0.897 0.603 CB 1.497 69 residues pruned to eliminate duplicates Z: 32 33.187 2.211 0.857 0.617 1.000 0.677 CB 1.299 Z: 18 31.590 2.114 1.097 0.811 1.000 0.412 CB 1.319 21 residues pruned to eliminate duplicates Z: 15 31.245 2.236 1.145 0.919 1.000 0.714 CB 1.227 15 residues pruned to eliminate duplicates Z: 13 28.703 2.239 1.106 0.920 1.000 0.833 CB 1.237 13 residues pruned to eliminate duplicates Z: 72 49.449 2.277 0.903 0.496 0.915 0.634 CB 1.486 101 residues pruned to eliminate duplicates Z: 38 32.595 2.167 0.811 0.614 0.919 0.676 CB 1.333 Z: 15 29.017 2.095 1.146 0.894 1.000 0.571 CB 1.238 15 residues pruned to eliminate duplicates Z: 46 33.386 2.211 0.759 0.529 0.911 0.622 CB 1.364 84 residues pruned to eliminate duplicates Z: 55 37.404 2.207 0.762 0.522 0.907 0.648 CB 1.412 55 residues pruned to eliminate duplicates Z: 62 42.884 2.276 0.859 0.497 0.885 0.623 CB 1.470 62 residues pruned to eliminate duplicates Z: 70 37.064 2.193 0.790 0.459 0.841 0.565 CB 1.409 70 residues pruned to eliminate duplicates Z: 100 55.498 2.260 0.849 0.529 0.899 0.576 CB 1.443 100 residues pruned to eliminate duplicates Z: 64 43.002 2.219 0.871 0.496 0.905 0.524 CB 1.448 64 residues pruned to eliminate duplicates Z: 118 70.548 2.337 0.930 0.519 0.932 0.667 CB 1.523 118 residues pruned to eliminate duplicates Z: 80 50.841 2.313 0.855 0.497 0.899 0.658 CB 1.487 80 residues pruned to eliminate duplicates Z: 121 65.253 2.300 0.886 0.531 0.883 0.625 CB 1.509 121 residues pruned to eliminate duplicates Z: 63 35.293 2.168 0.837 0.457 0.887 0.613 CB 1.325 63 residues pruned to eliminate duplicates Z: 43 31.439 2.184 0.774 0.548 0.905 0.500 CB 1.321 Z: 6 2.540 1.809 -0.030 0.302 0.600 0.400 CA 1.346 6 residues pruned to eliminate duplicates Z: 169 94.843 2.321 0.960 0.590 0.905 0.649 CB 1.632 212 residues pruned to eliminate duplicates Z: 30 26.812 2.308 0.716 0.330 0.931 0.586 CA 1.626 30 residues pruned to eliminate duplicates Z: 65 46.283 2.270 0.828 0.514 0.922 0.656 CB 1.491 65 residues pruned to eliminate duplicates Z: 128 67.327 2.286 0.897 0.529 0.890 0.638 CB 1.504 128 residues pruned to eliminate duplicates Z: 62 46.031 2.259 0.870 0.490 0.951 0.541 CB 1.482 62 residues pruned to eliminate duplicates Z: 153 88.092 2.349 0.929 0.574 0.895 0.678 CB 1.641 153 residues pruned to eliminate duplicates Z: 26 22.312 2.167 0.717 0.303 0.920 0.560 CB 1.623 26 residues pruned to eliminate duplicates Z: 66 39.232 2.196 0.799 0.454 0.908 0.631 CB 1.422 66 residues pruned to eliminate duplicates Z: 211 96.125 2.309 0.911 0.569 0.895 0.610 CB 1.571 211 residues pruned to eliminate duplicates Z: 114 75.214 2.376 0.960 0.532 0.894 0.655 CB 1.646 114 residues pruned to eliminate duplicates Z: 66 44.065 2.235 0.851 0.499 0.892 0.569 CB 1.481 66 residues pruned to eliminate duplicates Z: 62 44.665 2.233 0.883 0.530 0.918 0.721 CB 1.439 62 residues pruned to eliminate duplicates Z: 224 102.649 2.327 0.938 0.572 0.910 0.637 CB 1.562 224 residues pruned to eliminate duplicates Z: 207 96.327 2.308 0.957 0.565 0.888 0.617 CB 1.570 207 residues pruned to eliminate duplicates Z: 90 50.206 2.221 0.775 0.524 0.921 0.584 CB 1.430 90 residues pruned to eliminate duplicates Z: 66 41.620 2.221 0.785 0.488 0.908 0.538 CB 1.452 66 residues pruned to eliminate duplicates Z: 129 83.335 2.350 1.011 0.568 0.906 0.586 CB 1.611 129 residues pruned to eliminate duplicates Z: 122 69.135 2.301 0.856 0.542 0.909 0.612 CB 1.553 122 residues pruned to eliminate duplicates Z: 63 45.541 2.238 0.825 0.489 0.935 0.581 CB 1.530 63 residues pruned to eliminate duplicates Z: 197 93.361 2.315 0.917 0.572 0.893 0.602 CB 1.569 197 residues pruned to eliminate duplicates Z: 19 17.198 2.144 0.720 0.330 0.833 0.556 CB 1.590 19 residues pruned to eliminate duplicates Z: 99 68.995 2.384 0.919 0.533 0.888 0.551 CB 1.661 99 residues pruned to eliminate duplicates Z: 89 58.543 2.373 0.855 0.504 0.875 0.568 CB 1.613 89 residues pruned to eliminate duplicates Z: 195 93.645 2.319 0.911 0.566 0.892 0.639 CB 1.596 195 residues pruned to eliminate duplicates Z: 146 89.700 2.322 1.010 0.596 0.903 0.628 CB 1.611 146 residues pruned to eliminate duplicates Z: 153 90.738 2.319 1.017 0.564 0.908 0.605 CB 1.629 153 residues pruned to eliminate duplicates Z: 24 31.476 2.396 0.739 0.609 0.913 0.609 CA 1.556 24 residues pruned to eliminate duplicates Z: 31 27.217 2.187 0.724 0.543 0.867 0.633 CA 1.459 31 residues pruned to eliminate duplicates Z: 59 63.440 2.432 1.059 0.589 0.931 0.638 CB 1.641 59 residues pruned to eliminate duplicates Z: 62 58.910 2.410 1.033 0.582 0.869 0.672 CB 1.638 62 residues pruned to eliminate duplicates Z: 68 57.457 2.356 0.952 0.535 0.940 0.567 CB 1.568 68 residues pruned to eliminate duplicates Z: 223 105.041 2.329 0.951 0.577 0.923 0.640 CB 1.559 223 residues pruned to eliminate duplicates Z: 121 67.588 2.321 0.954 0.507 0.883 0.542 CB 1.530 121 residues pruned to eliminate duplicates Z: 126 89.828 2.350 1.010 0.611 0.936 0.608 CB 1.637 126 residues pruned to eliminate duplicates Z: 68 61.296 2.405 1.007 0.557 0.910 0.612 CB 1.612 68 residues pruned to eliminate duplicates Z: 31 29.685 2.195 0.830 0.544 0.867 0.433 CB 1.490 31 residues pruned to eliminate duplicates Z: 143 86.323 2.326 1.015 0.565 0.923 0.620 CB 1.573 143 residues pruned to eliminate duplicates Z: 218 96.796 2.306 0.908 0.568 0.899 0.599 CB 1.555 218 residues pruned to eliminate duplicates Z: 70 54.802 2.383 0.940 0.549 0.870 0.594 CB 1.564 70 residues pruned to eliminate duplicates Z: 82 67.046 2.371 1.006 0.547 0.926 0.642 CB 1.616 82 residues pruned to eliminate duplicates Z: 124 82.841 2.336 0.947 0.627 0.911 0.618 CB 1.600 124 residues pruned to eliminate duplicates Z: 140 97.323 2.355 1.052 0.621 0.928 0.662 CB 1.642 140 residues pruned to eliminate duplicates Z: 63 59.441 2.390 1.035 0.566 0.887 0.597 CB 1.641 63 residues pruned to eliminate duplicates Z: 75 46.399 2.254 0.809 0.501 0.878 0.581 CB 1.505 75 residues pruned to eliminate duplicates Z: 28 29.541 2.346 0.779 0.539 0.852 0.593 CB 1.539 28 residues pruned to eliminate duplicates Z: 90 72.426 2.401 0.938 0.585 0.921 0.618 CB 1.650 90 residues pruned to eliminate duplicates Z: 27 37.801 2.399 1.112 0.549 0.885 0.615 CB 1.577 27 residues pruned to eliminate duplicates Z: 60 53.381 2.360 0.951 0.567 0.898 0.576 CB 1.574 60 residues pruned to eliminate duplicates Z: 107 63.113 2.303 0.888 0.536 0.925 0.557 CB 1.472 107 residues pruned to eliminate duplicates Z: 26 41.125 2.371 1.265 0.560 0.920 0.680 CB 1.570 26 residues pruned to eliminate duplicates Z: 67 59.796 2.388 1.014 0.541 0.955 0.636 CB 1.540 67 residues pruned to eliminate duplicates Z: 108 83.241 2.355 1.041 0.623 0.916 0.729 CB 1.627 108 residues pruned to eliminate duplicates Z: 26 39.472 2.404 1.034 0.573 0.960 0.680 CB 1.567 26 residues pruned to eliminate duplicates Z: 61 52.389 2.335 0.978 0.535 0.933 0.550 CB 1.516 61 residues pruned to eliminate duplicates Z: 59 58.284 2.383 0.917 0.574 0.966 0.603 CB 1.616 59 residues pruned to eliminate duplicates Z: 59 54.359 2.401 0.926 0.559 0.931 0.534 CB 1.565 59 residues pruned to eliminate duplicates Z: 28 35.859 2.290 1.058 0.549 0.889 0.630 CB 1.569 28 residues pruned to eliminate duplicates Z: 121 77.848 2.340 0.938 0.547 0.933 0.583 CB 1.605 121 residues pruned to eliminate duplicates Z: 61 56.550 2.415 0.955 0.574 0.900 0.633 CB 1.600 61 residues pruned to eliminate duplicates Z: 131 77.631 2.320 1.032 0.544 0.923 0.608 CB 1.499 131 residues pruned to eliminate duplicates Z: 60 57.196 2.382 1.023 0.556 0.932 0.593 CB 1.570 60 residues pruned to eliminate duplicates Z: 27 36.793 2.357 1.022 0.561 0.923 0.615 CB 1.546 27 residues pruned to eliminate duplicates Z: 27 42.680 2.324 1.180 0.571 0.962 0.538 CB 1.605 27 residues pruned to eliminate duplicates Z: 142 62.940 2.245 0.874 0.488 0.887 0.596 CB 1.438 142 residues pruned to eliminate duplicates Z: 126 64.221 2.282 0.945 0.494 0.888 0.536 CB 1.467 126 residues pruned to eliminate duplicates Z: 109 88.863 2.350 1.098 0.638 0.944 0.611 CB 1.614 109 residues pruned to eliminate duplicates Z: 28 38.250 2.260 1.240 0.550 0.926 0.407 CB 1.496 28 residues pruned to eliminate duplicates Z: 158 81.712 2.310 0.965 0.526 0.930 0.586 CB 1.506 158 residues pruned to eliminate duplicates Z: 27 41.863 2.315 1.236 0.550 0.962 0.577 CB 1.571 27 residues pruned to eliminate duplicates Z: 121 68.990 2.319 0.936 0.527 0.892 0.500 CB 1.531 121 residues pruned to eliminate duplicates Z: 31 45.093 2.429 0.995 0.601 0.900 0.633 CB 1.715 31 residues pruned to eliminate duplicates Z: 27 48.870 2.420 1.118 0.640 0.923 0.731 CB 1.777 27 residues pruned to eliminate duplicates Z: 82 76.530 2.311 1.001 0.664 0.975 0.654 CB 1.619 82 residues pruned to eliminate duplicates Z: 82 76.899 2.313 1.064 0.671 0.951 0.691 CB 1.608 82 residues pruned to eliminate duplicates Z: 20 33.368 2.503 0.999 0.646 0.842 0.526 CB 1.585 20 residues pruned to eliminate duplicates Z: 84 69.184 2.302 0.983 0.658 0.916 0.602 CB 1.569 84 residues pruned to eliminate duplicates Z: 83 71.654 2.306 1.015 0.655 0.915 0.585 CB 1.613 83 residues pruned to eliminate duplicates Z: 21 28.175 2.252 0.889 0.583 0.900 0.450 CB 1.520 21 residues pruned to eliminate duplicates Z: 86 69.606 2.283 1.004 0.638 0.918 0.565 CB 1.580 86 residues pruned to eliminate duplicates Z: 69 58.697 2.366 1.067 0.605 0.897 0.500 CB 1.468 69 residues pruned to eliminate duplicates Z: 35 36.447 2.228 1.013 0.589 0.824 0.441 CB 1.554 35 residues pruned to eliminate duplicates Z: 68 61.826 2.264 0.953 0.661 0.925 0.672 CB 1.590 68 residues pruned to eliminate duplicates Z: 68 58.529 2.267 0.866 0.631 0.955 0.657 CB 1.564 68 residues pruned to eliminate duplicates Z: 71 72.157 2.299 1.052 0.667 0.929 0.643 CA 1.686 71 residues pruned to eliminate duplicates Z: 32 49.406 2.377 1.118 0.626 0.903 0.742 CB 1.732 32 residues pruned to eliminate duplicates Z: 56 57.050 2.238 1.009 0.650 0.909 0.673 CB 1.637 56 residues pruned to eliminate duplicates Z: 28 51.564 2.397 1.190 0.638 0.963 0.630 CB 1.724 28 residues pruned to eliminate duplicates Z: 83 72.462 2.297 1.129 0.643 0.902 0.646 CB 1.586 83 residues pruned to eliminate duplicates Z: 70 75.705 2.328 1.121 0.686 0.928 0.696 CB 1.677 70 residues pruned to eliminate duplicates Z: 70 71.861 2.311 1.127 0.671 0.913 0.623 CB 1.647 70 residues pruned to eliminate duplicates Z: 76 68.837 2.305 1.007 0.631 0.920 0.653 CB 1.651 76 residues pruned to eliminate duplicates Z: 39 55.587 2.352 1.198 0.669 0.895 0.553 CB 1.668 39 residues pruned to eliminate duplicates Z: 85 75.506 2.306 1.061 0.648 0.940 0.607 CB 1.605 85 residues pruned to eliminate duplicates Z: 70 64.553 2.291 0.963 0.650 0.899 0.580 CB 1.672 70 residues pruned to eliminate duplicates Z: 70 65.375 2.300 0.983 0.647 0.913 0.638 CB 1.648 70 residues pruned to eliminate duplicates Z: 71 62.696 2.280 0.962 0.647 0.871 0.643 CB 1.676 71 residues pruned to eliminate duplicates Z: 83 74.756 2.311 1.055 0.660 0.939 0.659 CB 1.596 83 residues pruned to eliminate duplicates Z: 72 52.178 2.231 0.892 0.611 0.873 0.606 CB 1.511 72 residues pruned to eliminate duplicates Z: 83 77.696 2.306 1.031 0.655 0.963 0.646 CB 1.647 83 residues pruned to eliminate duplicates Z: 67 60.915 2.248 1.003 0.612 0.939 0.712 CB 1.595 67 residues pruned to eliminate duplicates Z: 72 62.351 2.285 1.003 0.634 0.887 0.606 CB 1.607 72 residues pruned to eliminate duplicates Z: 71 60.341 2.243 0.974 0.615 0.886 0.686 CB 1.650 71 residues pruned to eliminate duplicates Z: 75 68.793 2.309 1.001 0.643 0.932 0.689 CB 1.624 75 residues pruned to eliminate duplicates Z: 84 67.755 2.290 0.957 0.627 0.940 0.639 CB 1.566 84 residues pruned to eliminate duplicates Z: 70 75.552 2.316 1.083 0.673 0.957 0.580 CB 1.681 70 residues pruned to eliminate duplicates Z: 43 53.392 2.218 1.094 0.671 0.929 0.762 CA 1.631 43 residues pruned to eliminate duplicates Z: 79 67.438 2.286 1.028 0.615 0.910 0.628 CB 1.624 79 residues pruned to eliminate duplicates Z: 88 71.891 2.296 0.991 0.611 0.931 0.690 CB 1.631 88 residues pruned to eliminate duplicates Z: 52 55.013 2.218 0.939 0.657 0.941 0.706 CB 1.645 52 residues pruned to eliminate duplicates Z: 51 50.299 2.199 0.941 0.597 0.940 0.700 CB 1.615 51 residues pruned to eliminate duplicates Z: 77 69.841 2.291 1.003 0.615 0.934 0.711 CA 1.676 77 residues pruned to eliminate duplicates Z: 33 38.744 2.200 0.943 0.668 0.875 0.719 CA 1.568 33 residues pruned to eliminate duplicates Z: 84 74.517 2.314 1.050 0.646 0.952 0.602 CB 1.580 84 residues pruned to eliminate duplicates Z: 39 35.842 2.157 0.773 0.630 0.842 0.684 CB 1.598 39 residues pruned to eliminate duplicates Z: 67 68.364 2.270 1.086 0.647 0.939 0.636 CB 1.649 67 residues pruned to eliminate duplicates Z: 50 53.720 2.200 0.950 0.624 0.980 0.633 CA 1.625 50 residues pruned to eliminate duplicates Z: 69 60.435 2.252 0.969 0.625 0.956 0.691 CB 1.537 69 residues pruned to eliminate duplicates Z: 69 45.728 2.139 0.883 0.584 0.868 0.544 CB 1.463 69 residues pruned to eliminate duplicates Z: 84 70.752 2.296 0.975 0.656 0.940 0.711 CB 1.577 84 residues pruned to eliminate duplicates Z: 86 69.297 2.274 0.994 0.639 0.941 0.718 CB 1.546 86 residues pruned to eliminate duplicates Z: 85 69.430 2.282 0.890 0.644 0.976 0.643 CB 1.572 85 residues pruned to eliminate duplicates Z: 83 74.955 2.320 0.997 0.664 0.976 0.671 CB 1.572 83 residues pruned to eliminate duplicates Z: 97 68.412 2.288 0.915 0.601 0.917 0.729 CB 1.579 78 residues pruned to eliminate duplicates Z: 9 25.749 2.261 0.958 0.807 1.000 0.750 CA 1.573 9 residues pruned to eliminate duplicates Z: 101 67.379 2.227 0.948 0.581 0.910 0.640 CB 1.579 101 residues pruned to eliminate duplicates Z: 63 60.922 2.226 0.959 0.612 0.968 0.710 CA 1.649 63 residues pruned to eliminate duplicates Z: 81 73.716 2.307 1.034 0.635 0.963 0.688 CB 1.608 81 residues pruned to eliminate duplicates Z: 37 30.989 2.218 0.819 0.487 0.861 0.556 CB 1.506 37 residues pruned to eliminate duplicates Z: 74 62.739 2.262 0.898 0.616 0.932 0.644 CB 1.646 74 residues pruned to eliminate duplicates Z: 62 48.567 2.168 0.787 0.584 0.934 0.754 CB 1.584 62 residues pruned to eliminate duplicates Z: 63 58.850 2.200 0.992 0.586 0.952 0.613 CB 1.650 63 residues pruned to eliminate duplicates Z: 81 64.645 2.266 1.010 0.598 0.938 0.650 CB 1.542 81 residues pruned to eliminate duplicates Z: 72 56.620 2.178 0.932 0.614 0.944 0.648 CB 1.520 72 residues pruned to eliminate duplicates Z: 44 45.836 2.249 0.907 0.605 0.907 0.651 CB 1.627 44 residues pruned to eliminate duplicates Z: 79 62.803 2.275 0.983 0.592 0.923 0.603 CB 1.563 79 residues pruned to eliminate duplicates Z: 30 32.718 2.249 1.055 0.496 0.897 0.621 CB 1.472 30 residues pruned to eliminate duplicates Z: 74 54.834 2.176 0.935 0.546 0.918 0.658 CB 1.587 74 residues pruned to eliminate duplicates Z: 16 22.574 2.228 1.111 0.478 0.867 0.600 CB 1.461 16 residues pruned to eliminate duplicates Z: 14 15.150 2.106 0.681 0.452 0.923 0.615 CB 1.350 14 residues pruned to eliminate duplicates Z: 73 53.054 2.207 0.902 0.555 0.903 0.667 CB 1.564 73 residues pruned to eliminate duplicates Z: 31 34.235 2.257 1.052 0.507 0.900 0.633 CB 1.490 31 residues pruned to eliminate duplicates Z: 55 53.472 2.218 0.946 0.650 0.944 0.685 CB 1.552 55 residues pruned to eliminate duplicates Z: 14 14.363 2.106 0.890 0.357 0.923 0.462 CB 1.265 14 residues pruned to eliminate duplicates Z: 29 32.950 2.278 0.981 0.443 0.929 0.536 CB 1.576 29 residues pruned to eliminate duplicates Z: 15 20.687 2.187 0.921 0.496 1.000 0.571 CB 1.322 15 residues pruned to eliminate duplicates Z: 83 73.886 2.301 1.074 0.640 0.939 0.610 CB 1.597 83 residues pruned to eliminate duplicates Z: 110 71.184 2.264 0.927 0.572 0.917 0.642 CB 1.589 110 residues pruned to eliminate duplicates Z: 14 22.177 2.144 1.230 0.503 0.846 0.692 CB 1.515 14 residues pruned to eliminate duplicates Z: 110 77.918 2.300 0.976 0.584 0.936 0.615 CB 1.619 78 residues pruned to eliminate duplicates Z: 9 6.376 1.444 0.529 0.880 1.000 0.875 CB 0.740 9 residues pruned to eliminate duplicates Z: 9 7.675 1.470 0.492 0.883 1.000 0.875 CB 0.895 9 residues pruned to eliminate duplicates Z: 9 7.549 1.439 0.499 0.862 1.000 0.875 CB 0.909 9 residues pruned to eliminate duplicates Z: 9 7.911 1.432 0.482 0.878 1.000 0.750 CB 0.956 9 residues pruned to eliminate duplicates Z: 9 5.531 1.457 0.630 0.758 0.875 0.375 CB 0.748 9 residues pruned to eliminate duplicates Z: 15 5.818 1.318 0.416 0.625 0.929 0.643 CB 0.798 15 residues pruned to eliminate duplicates Z: 15 7.565 1.619 0.185 0.523 0.929 0.643 CB 1.109 8 residues pruned to eliminate duplicates Z: 10 9.781 1.760 0.281 0.805 1.000 0.778 CB 1.109 12 residues pruned to eliminate duplicates Z: 12 7.954 1.679 0.260 0.712 0.909 0.636 CB 1.029 12 residues pruned to eliminate duplicates Z: 16 3.277 1.478 0.152 0.174 0.733 0.000 CB 1.006 16 residues pruned to eliminate duplicates Z: 14 9.193 1.651 0.434 0.551 1.000 0.615 CB 1.025 14 residues pruned to eliminate duplicates Z: 18 8.377 1.635 0.286 0.490 0.882 0.647 CB 1.106 19 residues pruned to eliminate duplicates Z: 6 7.358 1.773 0.417 0.470 1.000 0.800 CA 1.350 6 residues pruned to eliminate duplicates Z: 17 9.821 1.710 0.361 0.323 1.000 0.625 CB 1.281 17 residues pruned to eliminate duplicates Z: 12 10.257 1.759 0.654 0.390 0.909 0.727 CB 1.313 12 residues pruned to eliminate duplicates Z: 37 17.585 1.812 0.360 0.502 0.944 0.556 CB 1.256 37 residues pruned to eliminate duplicates Z: 154 77.364 2.180 0.765 0.604 0.935 0.673 CB 1.575 154 residues pruned to eliminate duplicates Z: 157 77.104 2.157 0.838 0.589 0.923 0.641 CB 1.548 157 residues pruned to eliminate duplicates Z: 72 56.787 2.216 0.825 0.634 0.944 0.620 CB 1.557 72 residues pruned to eliminate duplicates Z: 138 79.780 2.212 0.881 0.618 0.927 0.657 CB 1.581 138 residues pruned to eliminate duplicates Z: 145 80.180 2.199 0.822 0.619 0.938 0.701 CB 1.590 145 residues pruned to eliminate duplicates Z: 154 78.451 2.174 0.775 0.605 0.954 0.634 CB 1.559 154 residues pruned to eliminate duplicates Z: 77 56.132 2.162 0.903 0.582 0.974 0.553 CB 1.486 77 residues pruned to eliminate duplicates Z: 145 80.014 2.199 0.811 0.618 0.951 0.618 CB 1.574 145 residues pruned to eliminate duplicates Z: 132 82.556 2.217 0.916 0.623 0.954 0.702 CB 1.584 132 residues pruned to eliminate duplicates Z: 101 56.837 2.137 0.782 0.548 0.950 0.600 CB 1.499 101 residues pruned to eliminate duplicates Z: 140 81.817 2.218 0.855 0.629 0.942 0.712 CB 1.585 140 residues pruned to eliminate duplicates Z: 61 45.028 2.183 0.759 0.578 0.917 0.600 CB 1.531 61 residues pruned to eliminate duplicates Z: 159 77.500 2.167 0.834 0.588 0.918 0.646 CB 1.554 159 residues pruned to eliminate duplicates Z: 25 21.234 1.991 0.504 0.585 1.000 0.667 CB 1.333 25 residues pruned to eliminate duplicates Z: 25 22.222 2.016 0.576 0.570 1.000 0.750 CB 1.334 25 residues pruned to eliminate duplicates Z: 155 75.077 2.168 0.742 0.590 0.935 0.649 CB 1.571 155 residues pruned to eliminate duplicates Z: 148 80.428 2.201 0.816 0.613 0.939 0.633 CB 1.588 148 residues pruned to eliminate duplicates Z: 143 80.338 2.213 0.804 0.613 0.951 0.613 CB 1.596 143 residues pruned to eliminate duplicates Z: 130 80.710 2.224 0.855 0.621 0.953 0.628 CB 1.611 130 residues pruned to eliminate duplicates Z: 29 20.317 2.015 0.494 0.573 0.857 0.679 CB 1.386 29 residues pruned to eliminate duplicates Z: 153 80.545 2.190 0.765 0.606 0.954 0.691 CB 1.603 153 residues pruned to eliminate duplicates Z: 146 85.142 2.214 0.866 0.630 0.959 0.614 CB 1.581 146 residues pruned to eliminate duplicates Z: 72 57.455 2.203 0.813 0.621 0.986 0.648 CB 1.544 72 residues pruned to eliminate duplicates Z: 154 78.525 2.176 0.815 0.582 0.948 0.575 CB 1.567 154 residues pruned to eliminate duplicates Z: 119 78.204 2.224 0.905 0.621 0.932 0.636 CB 1.626 119 residues pruned to eliminate duplicates Z: 117 82.290 2.258 0.906 0.637 0.940 0.647 CB 1.662 117 residues pruned to eliminate duplicates Z: 87 51.061 2.127 0.773 0.569 0.919 0.570 CB 1.487 87 residues pruned to eliminate duplicates Z: 35 43.394 2.258 0.953 0.608 0.941 0.559 CB 1.619 35 residues pruned to eliminate duplicates Z: 107 83.295 2.266 1.034 0.655 0.934 0.632 CB 1.627 107 residues pruned to eliminate duplicates Z: 153 81.364 2.186 0.856 0.602 0.941 0.605 CB 1.569 153 residues pruned to eliminate duplicates Z: 96 77.745 2.271 0.960 0.666 0.947 0.684 CB 1.623 96 residues pruned to eliminate duplicates Z: 138 76.535 2.186 0.828 0.610 0.927 0.642 CB 1.591 138 residues pruned to eliminate duplicates Z: 121 78.715 2.237 0.922 0.635 0.908 0.642 CB 1.621 121 residues pruned to eliminate duplicates Z: 120 76.091 2.231 0.894 0.629 0.916 0.647 CB 1.597 120 residues pruned to eliminate duplicates Z: 158 74.265 2.162 0.762 0.587 0.930 0.624 CB 1.540 158 residues pruned to eliminate duplicates Z: 120 77.726 2.247 0.866 0.631 0.916 0.630 CB 1.641 120 residues pruned to eliminate duplicates Z: 118 86.687 2.257 0.959 0.642 0.957 0.675 CB 1.657 118 residues pruned to eliminate duplicates Z: 49 53.173 2.267 1.029 0.666 0.896 0.646 CB 1.598 49 residues pruned to eliminate duplicates Z: 62 47.437 2.172 0.833 0.588 0.918 0.623 CB 1.527 62 residues pruned to eliminate duplicates Z: 35 41.868 2.242 1.026 0.609 0.882 0.618 CB 1.615 35 residues pruned to eliminate duplicates Z: 56 45.731 2.198 0.805 0.584 0.927 0.618 CB 1.546 56 residues pruned to eliminate duplicates Z: 142 82.227 2.217 0.866 0.625 0.936 0.638 CB 1.590 142 residues pruned to eliminate duplicates Z: 111 66.643 2.129 0.926 0.592 0.945 0.655 CB 1.502 111 residues pruned to eliminate duplicates Z: 123 73.592 2.196 0.872 0.610 0.918 0.574 CB 1.590 123 residues pruned to eliminate duplicates Z: 119 84.614 2.249 0.976 0.639 0.932 0.619 CB 1.651 119 residues pruned to eliminate duplicates Z: 117 83.552 2.239 0.947 0.631 0.957 0.595 CB 1.644 117 residues pruned to eliminate duplicates Z: 119 85.688 2.249 0.989 0.649 0.941 0.653 CB 1.631 119 residues pruned to eliminate duplicates Z: 27 26.638 2.075 1.110 0.478 0.846 0.423 CB 1.442 27 residues pruned to eliminate duplicates Z: 115 84.547 2.259 0.984 0.648 0.939 0.605 CB 1.640 115 residues pruned to eliminate duplicates Z: 28 35.623 2.214 0.967 0.534 0.926 0.407 CA 1.644 28 residues pruned to eliminate duplicates Z: 143 83.003 2.202 0.890 0.614 0.937 0.676 CB 1.605 143 residues pruned to eliminate duplicates Z: 115 87.837 2.256 0.984 0.651 0.965 0.632 CB 1.655 115 residues pruned to eliminate duplicates Z: 74 41.756 2.048 0.792 0.524 0.918 0.507 CB 1.416 74 residues pruned to eliminate duplicates Z: 49 59.893 2.293 1.094 0.645 0.958 0.604 CB 1.640 49 residues pruned to eliminate duplicates Z: 72 47.813 2.113 0.798 0.536 0.958 0.634 CB 1.506 72 residues pruned to eliminate duplicates Z: 109 85.127 2.259 1.022 0.652 0.935 0.602 CB 1.664 112 residues pruned to eliminate duplicates Z: 6 3.238 1.823 0.309 0.277 0.800 0.200 CB 0.977 6 residues pruned to eliminate duplicates Z: 87 63.044 2.223 0.779 0.643 0.930 0.674 CB 1.617 87 residues pruned to eliminate duplicates Z: 86 71.289 2.244 0.921 0.672 0.941 0.682 CB 1.627 86 residues pruned to eliminate duplicates Z: 85 64.364 2.237 0.848 0.634 0.917 0.643 CB 1.634 85 residues pruned to eliminate duplicates Z: 84 69.910 2.239 0.917 0.658 0.940 0.627 CB 1.643 84 residues pruned to eliminate duplicates Z: 85 67.930 2.236 0.905 0.643 0.940 0.667 CB 1.620 85 residues pruned to eliminate duplicates Z: 120 82.494 2.245 0.931 0.642 0.941 0.681 CB 1.623 120 residues pruned to eliminate duplicates Z: 85 62.875 2.233 0.728 0.653 0.964 0.655 CB 1.600 85 residues pruned to eliminate duplicates Z: 158 77.509 2.143 0.851 0.590 0.924 0.586 CB 1.549 158 residues pruned to eliminate duplicates Z: 92 66.581 2.211 0.830 0.632 0.934 0.637 CB 1.632 92 residues pruned to eliminate duplicates Z: 106 58.852 2.110 0.787 0.562 0.933 0.590 CB 1.536 106 residues pruned to eliminate duplicates Z: 117 80.616 2.247 0.984 0.617 0.914 0.569 CB 1.645 117 residues pruned to eliminate duplicates Z: 84 70.673 2.227 0.909 0.653 0.976 0.639 CB 1.621 84 residues pruned to eliminate duplicates Z: 140 85.215 2.222 0.867 0.639 0.957 0.669 CB 1.599 140 residues pruned to eliminate duplicates Z: 116 88.098 2.248 1.031 0.660 0.957 0.600 CB 1.622 116 residues pruned to eliminate duplicates Z: 83 66.582 2.216 0.872 0.665 0.963 0.646 CB 1.580 83 residues pruned to eliminate duplicates Z: 86 67.602 2.230 0.801 0.654 0.965 0.659 CB 1.640 86 residues pruned to eliminate duplicates Z: 86 65.436 2.233 0.836 0.643 0.929 0.659 CB 1.630 86 residues pruned to eliminate duplicates Z: 87 73.721 2.249 0.902 0.658 0.977 0.640 CB 1.643 84 residues pruned to eliminate duplicates Z: 6 3.942 1.861 0.485 0.357 0.600 0.400 CB 1.240 6 residues pruned to eliminate duplicates Z: 144 80.362 2.187 0.806 0.623 0.972 0.664 CB 1.558 144 residues pruned to eliminate duplicates Z: 91 67.049 2.203 0.876 0.632 0.933 0.678 CB 1.618 91 residues pruned to eliminate duplicates Z: 73 55.650 2.192 0.840 0.605 0.903 0.597 CB 1.630 73 residues pruned to eliminate duplicates Z: 117 80.814 2.220 1.002 0.606 0.940 0.655 CB 1.625 117 residues pruned to eliminate duplicates Z: 85 62.680 2.204 0.818 0.634 0.929 0.655 CB 1.621 85 residues pruned to eliminate duplicates Z: 87 68.557 2.229 0.888 0.620 0.942 0.686 CB 1.665 87 residues pruned to eliminate duplicates Z: 78 64.476 2.209 0.887 0.636 0.948 0.675 CB 1.636 78 residues pruned to eliminate duplicates Z: 83 72.716 2.228 0.934 0.638 0.988 0.707 CB 1.659 83 residues pruned to eliminate duplicates Z: 82 72.227 2.256 0.971 0.647 0.951 0.667 CB 1.655 82 residues pruned to eliminate duplicates Z: 143 84.391 2.208 0.893 0.611 0.958 0.613 CB 1.592 143 residues pruned to eliminate duplicates Z: 118 78.821 2.227 0.904 0.631 0.940 0.658 CB 1.617 118 residues pruned to eliminate duplicates Z: 119 82.926 2.254 0.939 0.630 0.941 0.653 CB 1.644 119 residues pruned to eliminate duplicates Z: 88 69.074 2.225 0.859 0.653 0.954 0.724 CB 1.627 88 residues pruned to eliminate duplicates Z: 87 68.967 2.209 0.878 0.650 0.965 0.686 CB 1.615 87 residues pruned to eliminate duplicates Z: 74 55.052 2.166 0.795 0.595 0.932 0.671 CB 1.625 74 residues pruned to eliminate duplicates Z: 157 80.555 2.156 0.838 0.591 0.962 0.654 CB 1.551 157 residues pruned to eliminate duplicates Z: 87 67.945 2.228 0.813 0.644 0.953 0.698 CB 1.662 87 residues pruned to eliminate duplicates Z: 85 64.616 2.218 0.817 0.646 0.940 0.702 CB 1.623 85 residues pruned to eliminate duplicates Z: 49 49.786 2.206 0.766 0.695 0.938 0.708 CB 1.647 49 residues pruned to eliminate duplicates Z: 81 68.165 2.247 0.893 0.662 0.938 0.713 CB 1.645 81 residues pruned to eliminate duplicates Z: 85 68.442 2.236 0.879 0.646 0.976 0.690 CB 1.589 85 residues pruned to eliminate duplicates Z: 88 64.131 2.205 0.897 0.616 0.920 0.517 CB 1.601 88 residues pruned to eliminate duplicates Z: 86 65.865 2.205 0.891 0.622 0.929 0.612 CB 1.643 86 residues pruned to eliminate duplicates Z: 121 77.679 2.221 0.876 0.628 0.933 0.658 CB 1.617 121 residues pruned to eliminate duplicates Z: 115 82.052 2.258 0.935 0.619 0.956 0.623 CB 1.643 115 residues pruned to eliminate duplicates Z: 67 46.624 2.110 0.854 0.577 0.879 0.561 CB 1.550 67 residues pruned to eliminate duplicates Z: 84 68.256 2.199 0.853 0.636 0.976 0.663 CB 1.659 84 residues pruned to eliminate duplicates Z: 76 67.030 2.224 0.934 0.641 0.973 0.667 CB 1.621 76 residues pruned to eliminate duplicates Z: 75 58.916 2.171 0.853 0.635 0.932 0.743 CB 1.608 75 residues pruned to eliminate duplicates Z: 49 45.585 2.143 0.818 0.607 0.958 0.521 CB 1.592 49 residues pruned to eliminate duplicates Z: 73 67.164 2.250 0.917 0.676 0.958 0.639 CB 1.629 73 residues pruned to eliminate duplicates Z: 139 84.139 2.221 0.926 0.636 0.928 0.659 CB 1.589 139 residues pruned to eliminate duplicates Z: 46 48.692 2.197 0.890 0.641 0.911 0.600 CB 1.682 46 residues pruned to eliminate duplicates Z: 61 55.174 2.194 0.818 0.611 0.967 0.633 CB 1.663 61 residues pruned to eliminate duplicates Z: 78 66.820 2.217 0.990 0.636 0.948 0.701 CB 1.602 78 residues pruned to eliminate duplicates Z: 86 66.146 2.232 0.812 0.639 0.953 0.694 CB 1.634 86 residues pruned to eliminate duplicates Z: 119 86.645 2.247 0.988 0.634 0.958 0.653 CB 1.644 119 residues pruned to eliminate duplicates Z: 88 70.321 2.223 0.947 0.647 0.943 0.701 CB 1.612 88 residues pruned to eliminate duplicates Z: 71 60.394 2.162 0.905 0.608 0.971 0.657 CB 1.628 71 residues pruned to eliminate duplicates Z: 71 57.856 2.194 0.777 0.627 0.957 0.671 CB 1.644 71 residues pruned to eliminate duplicates Z: 19 27.794 2.316 0.889 0.526 0.833 0.667 CB 1.751 19 residues pruned to eliminate duplicates Z: 85 70.322 2.215 0.881 0.659 0.976 0.726 CB 1.628 85 residues pruned to eliminate duplicates Z: 83 72.358 2.238 1.006 0.655 0.939 0.695 CB 1.641 83 residues pruned to eliminate duplicates Z: 107 84.193 2.256 1.046 0.637 0.962 0.660 CB 1.619 107 residues pruned to eliminate duplicates Z: 87 70.425 2.237 0.891 0.648 0.942 0.709 CB 1.661 87 residues pruned to eliminate duplicates Z: 83 70.242 2.242 0.925 0.645 0.951 0.646 CB 1.651 83 residues pruned to eliminate duplicates Z: 87 75.444 2.235 1.002 0.651 0.965 0.674 CB 1.637 87 residues pruned to eliminate duplicates Z: 118 85.928 2.231 0.981 0.622 0.983 0.650 CB 1.629 118 residues pruned to eliminate duplicates Z: 119 88.983 2.239 1.025 0.647 0.975 0.636 CB 1.616 119 residues pruned to eliminate duplicates Z: 52 49.110 2.163 0.822 0.607 0.961 0.529 CB 1.641 52 residues pruned to eliminate duplicates Z: 11 10.386 1.866 0.789 0.342 0.800 0.500 CA 1.461 11 residues pruned to eliminate duplicates Z: 18 19.772 2.111 0.568 0.486 0.941 0.412 CA 1.561 18 residues pruned to eliminate duplicates Z: 13 25.234 2.213 1.002 0.500 0.917 0.583 CB 1.793 13 residues pruned to eliminate duplicates Z: 15 15.115 2.029 0.778 0.444 0.786 0.429 CB 1.509 15 residues pruned to eliminate duplicates Z: 73 63.658 2.203 0.945 0.613 0.958 0.597 CB 1.641 73 residues pruned to eliminate duplicates Z: 19 18.595 2.065 0.573 0.447 0.944 0.500 CA 1.509 19 residues pruned to eliminate duplicates Z: 12 26.086 2.290 0.839 0.550 1.000 0.636 CB 1.778 12 residues pruned to eliminate duplicates Z: 16 18.018 2.080 0.692 0.489 0.867 0.600 CA 1.542 16 residues pruned to eliminate duplicates Z: 85 69.662 2.230 0.977 0.643 0.917 0.738 CB 1.646 85 residues pruned to eliminate duplicates Z: 16 17.208 2.094 0.710 0.477 0.800 0.667 CA 1.588 16 residues pruned to eliminate duplicates Z: 14 18.446 2.170 0.675 0.489 0.846 0.538 CB 1.681 14 residues pruned to eliminate duplicates Z: 15 20.108 2.132 0.806 0.532 0.857 0.643 CA 1.578 15 residues pruned to eliminate duplicates Z: 16 19.978 2.084 0.785 0.477 0.867 0.533 CB 1.638 16 residues pruned to eliminate duplicates Z: 87 72.288 2.227 0.941 0.662 0.953 0.616 CB 1.627 88 residues pruned to eliminate duplicates Z: 9 10.288 1.943 -0.097 0.859 1.000 0.875 CB 1.526 9 residues pruned to eliminate duplicates Z: 19 20.392 1.984 0.549 0.556 0.944 0.667 CB 1.568 19 residues pruned to eliminate duplicates Z: 10 11.435 1.896 0.200 0.774 1.000 0.889 CB 1.315 10 residues pruned to eliminate duplicates Z: 18 18.778 1.998 0.464 0.560 0.941 0.647 CB 1.560 18 residues pruned to eliminate duplicates Z: 18 19.576 2.013 0.584 0.563 0.941 0.706 CB 1.487 18 residues pruned to eliminate duplicates Z: 18 18.342 2.011 0.533 0.541 0.941 0.647 CB 1.473 18 residues pruned to eliminate duplicates Z: 19 18.517 1.946 0.572 0.535 0.944 0.556 CB 1.459 19 residues pruned to eliminate duplicates Z: 17 21.539 2.086 0.620 0.540 1.000 0.750 CB 1.532 17 residues pruned to eliminate duplicates Z: 18 19.602 1.964 0.580 0.524 1.000 0.647 CA 1.496 18 residues pruned to eliminate duplicates Z: 17 22.350 2.076 0.543 0.597 1.000 0.812 CB 1.590 17 residues pruned to eliminate duplicates Z: 18 20.071 2.044 0.511 0.524 1.000 0.765 CB 1.539 18 residues pruned to eliminate duplicates Z: 18 19.941 2.054 0.512 0.524 1.000 0.824 CB 1.520 18 residues pruned to eliminate duplicates Z: 19 18.216 1.990 0.390 0.542 1.000 0.778 CB 1.490 19 residues pruned to eliminate duplicates Z: 17 21.693 2.039 0.518 0.602 1.000 0.812 CB 1.590 17 residues pruned to eliminate duplicates Z: 37 28.553 2.074 0.722 0.416 0.917 0.583 CB 1.587 37 residues pruned to eliminate duplicates Z: 37 27.519 2.103 0.685 0.389 0.917 0.639 CB 1.588 39 residues pruned to eliminate duplicates Z: 7 8.191 2.164 0.525 0.454 0.833 0.500 CA 1.275 7 residues pruned to eliminate duplicates Z: 115 76.359 2.293 1.021 0.556 0.895 0.596 CB 1.634 115 residues pruned to eliminate duplicates Z: 76 62.790 2.299 0.997 0.537 0.920 0.653 CB 1.654 76 residues pruned to eliminate duplicates Z: 25 18.916 2.102 0.607 0.385 0.833 0.542 CB 1.549 25 residues pruned to eliminate duplicates Z: 24 22.076 2.155 0.588 0.422 0.870 0.565 CB 1.678 24 residues pruned to eliminate duplicates Z: 21 17.031 2.071 0.804 0.318 0.850 0.600 CA 1.466 21 residues pruned to eliminate duplicates Z: 37 24.500 2.076 0.651 0.390 0.889 0.500 CB 1.507 37 residues pruned to eliminate duplicates Z: 7 6.334 1.804 0.984 0.256 0.833 0.333 N 1.147 7 residues pruned to eliminate duplicates Z: 66 58.324 2.242 1.080 0.545 0.923 0.600 CB 1.608 66 residues pruned to eliminate duplicates Z: 66 53.836 2.272 0.907 0.539 0.908 0.677 CB 1.635 66 residues pruned to eliminate duplicates Z: 18 21.018 2.233 0.828 0.329 0.941 0.529 CA 1.599 18 residues pruned to eliminate duplicates Z: 67 58.498 2.293 0.953 0.542 0.939 0.636 CB 1.644 67 residues pruned to eliminate duplicates Z: 113 72.746 2.274 1.013 0.537 0.902 0.580 CB 1.606 113 residues pruned to eliminate duplicates Z: 26 21.261 2.049 0.904 0.439 0.880 0.680 CB 1.320 26 residues pruned to eliminate duplicates Z: 67 60.121 2.329 1.009 0.569 0.894 0.621 CB 1.654 67 residues pruned to eliminate duplicates Z: 59 67.849 2.373 1.076 0.592 0.966 0.638 CB 1.715 59 residues pruned to eliminate duplicates Z: 25 34.273 2.321 0.828 0.618 0.917 0.625 CB 1.609 25 residues pruned to eliminate duplicates Z: 27 29.073 2.267 0.889 0.500 0.846 0.500 CB 1.574 27 residues pruned to eliminate duplicates Z: 30 41.989 2.334 1.039 0.571 0.931 0.724 CB 1.644 30 residues pruned to eliminate duplicates Z: 24 39.573 2.382 1.010 0.569 0.957 0.652 CA 1.685 24 residues pruned to eliminate duplicates Z: 25 34.686 2.364 0.911 0.564 0.875 0.667 CB 1.683 25 residues pruned to eliminate duplicates Z: 60 63.284 2.354 1.065 0.585 0.915 0.712 CB 1.708 60 residues pruned to eliminate duplicates Z: 145 87.603 2.285 0.929 0.597 0.931 0.646 CB 1.622 145 residues pruned to eliminate duplicates Z: 88 72.133 2.358 1.020 0.590 0.885 0.667 CB 1.683 88 residues pruned to eliminate duplicates Z: 61 61.591 2.358 0.975 0.590 0.933 0.683 CB 1.678 61 residues pruned to eliminate duplicates Z: 77 65.318 2.315 1.040 0.544 0.921 0.711 CB 1.650 77 residues pruned to eliminate duplicates Z: 88 79.363 2.400 1.027 0.601 0.908 0.701 CB 1.749 88 residues pruned to eliminate duplicates Z: 41 40.276 2.318 0.941 0.478 0.925 0.625 CB 1.565 41 residues pruned to eliminate duplicates Z: 62 63.510 2.335 1.038 0.591 0.918 0.656 CB 1.706 62 residues pruned to eliminate duplicates Z: 94 77.864 2.362 0.977 0.620 0.925 0.624 CB 1.669 94 residues pruned to eliminate duplicates Z: 87 78.842 2.390 1.058 0.601 0.919 0.628 CB 1.709 87 residues pruned to eliminate duplicates Z: 58 62.244 2.352 1.024 0.593 0.947 0.614 CB 1.673 58 residues pruned to eliminate duplicates Z: 132 87.107 2.283 0.976 0.618 0.939 0.656 CB 1.607 132 residues pruned to eliminate duplicates Z: 47 34.818 2.155 0.845 0.449 0.870 0.413 CB 1.565 47 residues pruned to eliminate duplicates Z: 95 82.028 2.373 1.029 0.589 0.926 0.585 CB 1.744 95 residues pruned to eliminate duplicates Z: 102 77.562 2.311 0.981 0.619 0.941 0.584 CB 1.602 102 residues pruned to eliminate duplicates Z: 96 82.867 2.359 1.056 0.617 0.926 0.621 CB 1.694 96 residues pruned to eliminate duplicates Z: 82 57.967 2.237 0.941 0.516 0.926 0.617 CB 1.577 82 residues pruned to eliminate duplicates Z: 59 62.768 2.331 1.105 0.592 0.931 0.603 CB 1.652 59 residues pruned to eliminate duplicates Z: 61 55.478 2.319 0.994 0.561 0.883 0.650 CB 1.653 61 residues pruned to eliminate duplicates Z: 59 61.656 2.329 1.023 0.608 0.931 0.621 CB 1.666 59 residues pruned to eliminate duplicates Z: 34 45.176 2.270 1.123 0.634 0.909 0.667 CB 1.582 34 residues pruned to eliminate duplicates Z: 77 61.376 2.293 1.002 0.539 0.921 0.618 CB 1.603 77 residues pruned to eliminate duplicates Z: 77 58.118 2.272 0.976 0.502 0.908 0.618 CB 1.632 77 residues pruned to eliminate duplicates Z: 63 62.494 2.348 1.052 0.568 0.935 0.629 CB 1.649 63 residues pruned to eliminate duplicates Z: 93 78.855 2.378 1.039 0.582 0.924 0.620 CB 1.695 93 residues pruned to eliminate duplicates Z: 58 65.065 2.363 1.077 0.588 0.965 0.702 CB 1.673 58 residues pruned to eliminate duplicates Z: 57 65.458 2.352 1.039 0.603 0.964 0.750 CB 1.715 57 residues pruned to eliminate duplicates Z: 77 65.121 2.314 0.991 0.546 0.934 0.684 CB 1.660 77 residues pruned to eliminate duplicates Z: 94 63.185 2.231 0.936 0.522 0.914 0.634 CB 1.625 94 residues pruned to eliminate duplicates Z: 57 62.483 2.375 1.028 0.617 0.929 0.750 CB 1.671 57 residues pruned to eliminate duplicates Z: 37 41.939 2.284 0.992 0.576 0.861 0.694 CB 1.658 37 residues pruned to eliminate duplicates Z: 59 58.994 2.330 1.049 0.575 0.914 0.586 CB 1.651 59 residues pruned to eliminate duplicates Z: 28 39.243 2.276 1.049 0.609 0.889 0.778 CB 1.643 28 residues pruned to eliminate duplicates Z: 57 60.984 2.353 1.075 0.613 0.929 0.679 CB 1.615 57 residues pruned to eliminate duplicates Z: 59 62.242 2.351 1.131 0.590 0.914 0.655 CB 1.638 59 residues pruned to eliminate duplicates Z: 58 61.485 2.360 1.073 0.584 0.912 0.684 CB 1.683 58 residues pruned to eliminate duplicates Z: 86 77.299 2.396 1.049 0.599 0.918 0.729 CB 1.693 86 residues pruned to eliminate duplicates Z: 52 46.949 2.189 1.077 0.528 0.882 0.647 CB 1.594 52 residues pruned to eliminate duplicates Z: 101 82.112 2.319 1.033 0.622 0.950 0.640 CB 1.635 101 residues pruned to eliminate duplicates Z: 60 61.934 2.360 1.082 0.566 0.915 0.610 CB 1.682 60 residues pruned to eliminate duplicates Z: 74 57.452 2.275 0.986 0.534 0.877 0.658 CB 1.643 74 residues pruned to eliminate duplicates Z: 130 85.944 2.281 0.991 0.615 0.930 0.659 CB 1.606 130 residues pruned to eliminate duplicates Z: 104 76.718 2.287 1.066 0.592 0.922 0.612 CB 1.588 104 residues pruned to eliminate duplicates Z: 119 77.799 2.270 1.051 0.574 0.915 0.627 CB 1.566 119 residues pruned to eliminate duplicates Z: 38 46.677 2.272 1.222 0.571 0.865 0.649 CB 1.640 38 residues pruned to eliminate duplicates Z: 28 33.874 2.143 1.157 0.529 0.889 0.593 CB 1.542 28 residues pruned to eliminate duplicates Z: 79 63.468 2.255 0.971 0.625 0.897 0.603 CB 1.602 79 residues pruned to eliminate duplicates Z: 101 80.580 2.320 1.067 0.618 0.920 0.590 CB 1.634 101 residues pruned to eliminate duplicates Z: 142 84.871 2.263 0.964 0.604 0.922 0.624 CB 1.579 142 residues pruned to eliminate duplicates Z: 93 81.433 2.367 1.034 0.627 0.924 0.587 CB 1.694 93 residues pruned to eliminate duplicates Z: 90 75.974 2.380 1.048 0.596 0.910 0.596 CB 1.656 90 residues pruned to eliminate duplicates Z: 19 25.862 2.185 0.998 0.642 0.778 0.556 CA 1.572 19 residues pruned to eliminate duplicates Z: 97 84.374 2.343 1.064 0.609 0.958 0.604 CB 1.675 97 residues pruned to eliminate duplicates Z: 101 76.891 2.306 1.030 0.610 0.920 0.680 CB 1.609 101 residues pruned to eliminate duplicates Z: 91 63.583 2.191 0.906 0.624 0.944 0.622 CB 1.512 91 residues pruned to eliminate duplicates Z: 34 47.833 2.320 0.897 0.654 0.939 0.636 CA 1.745 34 residues pruned to eliminate duplicates Z: 38 54.301 2.363 1.029 0.681 0.919 0.622 CA 1.716 38 residues pruned to eliminate duplicates Z: 179 89.797 2.232 0.896 0.585 0.944 0.702 CB 1.553 179 residues pruned to eliminate duplicates Z: 48 48.056 2.191 0.982 0.613 0.915 0.574 CB 1.586 48 residues pruned to eliminate duplicates Z: 101 81.984 2.321 1.063 0.620 0.940 0.620 CB 1.627 101 residues pruned to eliminate duplicates Z: 35 48.609 2.374 1.017 0.604 0.882 0.618 CB 1.788 35 residues pruned to eliminate duplicates Z: 90 78.307 2.394 1.074 0.593 0.899 0.640 CB 1.701 90 residues pruned to eliminate duplicates Z: 32 51.330 2.453 1.027 0.640 0.903 0.742 CA 1.801 32 residues pruned to eliminate duplicates Z: 95 82.743 2.345 1.118 0.627 0.936 0.574 CB 1.630 95 residues pruned to eliminate duplicates Z: 126 85.997 2.291 0.977 0.633 0.928 0.624 CB 1.615 126 residues pruned to eliminate duplicates Z: 48 44.346 2.169 0.882 0.614 0.936 0.702 CB 1.520 48 residues pruned to eliminate duplicates Z: 107 79.455 2.240 1.034 0.642 0.953 0.623 CB 1.557 107 residues pruned to eliminate duplicates Z: 114 73.503 2.221 0.950 0.634 0.929 0.628 CB 1.516 114 residues pruned to eliminate duplicates Z: 89 81.211 2.378 1.140 0.575 0.932 0.659 CB 1.698 89 residues pruned to eliminate duplicates Z: 25 26.891 2.114 0.935 0.603 0.875 0.583 CB 1.391 25 residues pruned to eliminate duplicates Z: 85 64.289 2.237 0.903 0.655 0.929 0.595 CB 1.537 85 residues pruned to eliminate duplicates Z: 122 78.763 2.248 0.918 0.641 0.934 0.686 CB 1.559 122 residues pruned to eliminate duplicates Z: 24 32.926 2.163 1.027 0.652 0.913 0.696 CB 1.488 24 residues pruned to eliminate duplicates Z: 38 52.812 2.364 1.031 0.699 0.892 0.649 CB 1.692 38 residues pruned to eliminate duplicates Z: 87 83.612 2.408 1.067 0.618 0.930 0.605 CB 1.741 87 residues pruned to eliminate duplicates Z: 119 80.114 2.282 1.030 0.583 0.924 0.602 CB 1.592 119 residues pruned to eliminate duplicates Z: 93 83.349 2.372 1.068 0.628 0.924 0.630 CB 1.700 93 residues pruned to eliminate duplicates Z: 143 94.568 2.282 1.048 0.616 0.951 0.613 CB 1.601 143 residues pruned to eliminate duplicates Z: 89 71.217 2.212 0.985 0.646 0.955 0.614 CB 1.581 89 residues pruned to eliminate duplicates Z: 37 50.227 2.221 1.194 0.654 0.889 0.611 CB 1.675 37 residues pruned to eliminate duplicates Z: 79 72.166 2.243 1.228 0.642 0.936 0.667 CB 1.530 79 residues pruned to eliminate duplicates Z: 69 58.785 2.186 0.870 0.677 0.956 0.662 CB 1.550 69 residues pruned to eliminate duplicates Z: 160 91.528 2.242 1.009 0.601 0.943 0.648 CB 1.552 160 residues pruned to eliminate duplicates Z: 121 84.269 2.258 1.009 0.622 0.950 0.633 CB 1.592 121 residues pruned to eliminate duplicates Z: 83 64.495 2.209 0.957 0.645 0.951 0.659 CB 1.513 83 residues pruned to eliminate duplicates Z: 89 70.900 2.216 0.955 0.649 0.966 0.648 CB 1.572 89 residues pruned to eliminate duplicates Z: 117 85.539 2.256 0.991 0.638 0.983 0.690 CB 1.581 117 residues pruned to eliminate duplicates Z: 71 63.306 2.197 0.985 0.658 0.943 0.671 CB 1.589 71 residues pruned to eliminate duplicates Z: 88 65.054 2.223 0.890 0.623 0.954 0.563 CB 1.549 88 residues pruned to eliminate duplicates Z: 13 5.327 1.466 0.134 0.452 1.000 0.500 CB 0.972 13 residues pruned to eliminate duplicates Z: 143 94.336 2.289 1.065 0.626 0.930 0.627 CB 1.600 143 residues pruned to eliminate duplicates Z: 142 87.171 2.270 1.005 0.610 0.922 0.610 CB 1.577 142 residues pruned to eliminate duplicates Z: 57 48.984 2.072 0.987 0.650 0.982 0.661 CB 1.407 57 residues pruned to eliminate duplicates Z: 144 97.149 2.292 1.025 0.621 0.965 0.622 CB 1.617 144 residues pruned to eliminate duplicates Z: 36 32.228 2.011 0.796 0.666 0.971 0.629 CB 1.332 36 residues pruned to eliminate duplicates Z: 134 87.763 2.272 1.050 0.620 0.940 0.639 CB 1.553 134 residues pruned to eliminate duplicates Z: 43 37.309 2.132 0.700 0.654 0.976 0.643 CB 1.410 43 residues pruned to eliminate duplicates Z: 47 36.127 2.103 0.740 0.614 0.978 0.609 CB 1.335 47 residues pruned to eliminate duplicates Z: 82 66.149 2.191 0.965 0.656 0.963 0.691 CB 1.534 82 residues pruned to eliminate duplicates Z: 48 40.381 2.159 0.758 0.642 0.936 0.660 CB 1.452 48 residues pruned to eliminate duplicates Z: 90 62.454 2.189 0.883 0.626 0.933 0.663 CB 1.529 90 residues pruned to eliminate duplicates Z: 49 34.981 1.958 0.790 0.621 0.979 0.542 CB 1.312 49 residues pruned to eliminate duplicates Z: 52 33.986 2.057 0.678 0.606 0.941 0.549 CB 1.325 52 residues pruned to eliminate duplicates Z: 88 63.869 2.214 0.944 0.608 0.920 0.529 CB 1.562 88 residues pruned to eliminate duplicates Z: 125 88.461 2.283 1.043 0.639 0.944 0.597 CB 1.585 125 residues pruned to eliminate duplicates Z: 54 33.872 2.007 0.735 0.570 0.887 0.566 CB 1.408 54 residues pruned to eliminate duplicates Z: 89 61.975 2.178 0.918 0.614 0.932 0.614 CB 1.524 89 residues pruned to eliminate duplicates Z: 125 88.661 2.281 1.079 0.643 0.927 0.653 CB 1.583 125 residues pruned to eliminate duplicates Z: 166 93.086 2.273 0.968 0.598 0.933 0.648 CB 1.581 166 residues pruned to eliminate duplicates Z: 51 37.198 2.092 0.759 0.612 0.900 0.620 CB 1.429 51 residues pruned to eliminate duplicates Z: 88 65.959 2.198 0.973 0.619 0.943 0.598 CB 1.546 88 residues pruned to eliminate duplicates Z: 36 34.615 2.200 0.789 0.502 0.914 0.543 CB 1.623 36 residues pruned to eliminate duplicates Z: 72 50.345 2.116 0.860 0.630 0.944 0.549 CB 1.424 72 residues pruned to eliminate duplicates Z: 114 82.945 2.248 1.037 0.637 0.965 0.646 CB 1.553 114 residues pruned to eliminate duplicates Z: 96 72.865 2.224 1.033 0.639 0.926 0.674 CB 1.567 96 residues pruned to eliminate duplicates Z: 89 66.757 2.203 0.988 0.641 0.932 0.625 CB 1.528 89 residues pruned to eliminate duplicates Z: 96 57.468 2.132 0.909 0.583 0.916 0.537 CB 1.460 60 residues pruned to eliminate duplicates Z: 6 9.929 1.861 1.239 0.371 1.000 0.600 CA 1.223 6 residues pruned to eliminate duplicates Z: 29 18.322 1.720 0.890 0.494 0.857 0.429 CB 1.250 29 residues pruned to eliminate duplicates Z: 122 79.330 2.217 1.036 0.626 0.942 0.628 CB 1.506 122 residues pruned to eliminate duplicates Z: 42 44.859 2.151 0.908 0.694 0.976 0.829 CB 1.466 42 residues pruned to eliminate duplicates Z: 121 73.103 2.225 0.930 0.589 0.917 0.658 CB 1.557 121 residues pruned to eliminate duplicates Z: 45 41.652 2.106 0.855 0.646 0.977 0.591 CB 1.435 45 residues pruned to eliminate duplicates Z: 47 36.870 2.128 0.736 0.560 0.935 0.630 CB 1.485 47 residues pruned to eliminate duplicates Z: 20 30.177 2.192 0.937 0.532 0.895 0.632 CB 1.766 20 residues pruned to eliminate duplicates Z: 49 45.751 2.148 0.867 0.646 0.958 0.625 CB 1.499 49 residues pruned to eliminate duplicates Z: 87 60.720 2.166 0.949 0.595 0.930 0.663 CB 1.523 87 residues pruned to eliminate duplicates Z: 95 67.413 2.203 0.976 0.606 0.936 0.638 CB 1.542 95 residues pruned to eliminate duplicates Z: 10 18.215 2.187 0.878 0.668 0.778 0.667 CB 1.627 10 residues pruned to eliminate duplicates Z: 12 17.675 2.006 0.991 0.521 0.818 0.545 CB 1.597 12 residues pruned to eliminate duplicates Z: 13 13.187 1.983 0.748 0.483 0.833 0.500 CB 1.342 13 residues pruned to eliminate duplicates Z: 23 14.091 1.873 0.683 0.333 0.773 0.545 CB 1.481 23 residues pruned to eliminate duplicates Z: 135 79.109 2.188 1.002 0.585 0.925 0.590 CB 1.554 135 residues pruned to eliminate duplicates 722 residues left after pruning, divided into chains as follows: A: 16 B: 8 C: 11 D: 323 E: 10 F: 22 G: 154 H: 178 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 32.52 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.497, Connect. = 0.728 for dens.mod. cycle 1 = 0.300, Contrast = 0.572, Connect. = 0.756 for dens.mod. cycle 2 = 0.300, Contrast = 0.674, Connect. = 0.786 for dens.mod. cycle 3 = 0.300, Contrast = 0.679, Connect. = 0.787 for dens.mod. cycle 4 = 0.300, Contrast = 0.690, Connect. = 0.789 for dens.mod. cycle 5 = 0.300, Contrast = 0.693, Connect. = 0.791 for dens.mod. cycle 6 = 0.300, Contrast = 0.698, Connect. = 0.792 for dens.mod. cycle 7 = 0.300, Contrast = 0.700, Connect. = 0.793 for dens.mod. cycle 8 = 0.300, Contrast = 0.703, Connect. = 0.794 for dens.mod. cycle 9 = 0.300, Contrast = 0.703, Connect. = 0.795 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 6653 peaks > 0.5 sigma used to seed fragment search Space for about 1274 unique residues taking solvent into account 1334 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 13 43.909 2.437 1.063 0.893 1.000 0.667 CA 1.809 B: 18 39.188 2.278 1.144 0.885 0.941 0.706 CB 1.493 C: 14 32.124 2.349 0.839 0.865 0.923 0.846 CA 1.637 D: 18 48.645 2.265 1.498 0.925 1.000 0.706 CB 1.464 19 residues pruned to eliminate duplicates E: 13 36.150 2.352 0.835 0.884 1.000 0.750 CA 1.747 13 residues pruned to eliminate duplicates F: 13 36.440 2.446 0.982 0.888 0.917 0.667 CB 1.706 G: 13 44.962 2.430 1.059 0.873 1.000 0.833 CA 1.890 13 residues pruned to eliminate duplicates H: 14 40.945 2.347 1.212 0.870 1.000 0.846 CA 1.596 14 residues pruned to eliminate duplicates I: 14 28.891 2.456 0.619 0.903 0.923 0.692 CB 1.556 J: 18 35.093 2.284 1.258 0.552 0.882 0.647 CB 1.777 K: 14 38.988 2.323 0.749 0.928 1.000 0.769 CB 1.864 14 residues pruned to eliminate duplicates L: 16 35.864 2.417 0.650 0.941 1.000 0.867 CB 1.611 16 residues pruned to eliminate duplicates M: 15 37.839 2.325 0.953 0.877 1.000 0.714 CA 1.618 N: 14 37.181 2.270 0.895 0.893 1.000 0.769 CA 1.721 14 residues pruned to eliminate duplicates O: 16 47.853 2.372 1.223 0.945 0.933 0.867 CB 1.737 P: 13 42.489 2.398 1.115 0.900 0.917 0.667 CA 1.884 13 residues pruned to eliminate duplicates Q: 14 40.412 2.318 0.942 0.919 1.000 0.923 CA 1.754 13 residues pruned to eliminate duplicates R: 12 40.912 2.607 0.772 0.889 1.000 0.818 CA 1.922 12 residues pruned to eliminate duplicates S: 18 35.535 2.161 1.058 0.880 0.882 0.647 CB 1.592 18 residues pruned to eliminate duplicates T: 13 29.439 2.234 0.760 0.850 0.917 0.750 CB 1.746 U: 13 33.275 2.325 0.811 0.891 1.000 0.917 CA 1.641 13 residues pruned to eliminate duplicates V: 18 42.821 2.187 1.004 0.939 1.000 0.941 CA 1.646 W: 15 36.993 2.253 1.154 0.840 0.929 0.786 CA 1.638 15 residues pruned to eliminate duplicates X: 13 39.328 2.379 0.966 0.855 1.000 0.750 CA 1.791 14 residues pruned to eliminate duplicates Y: 12 38.506 2.458 1.120 0.884 0.818 0.818 CA 1.968 12 residues pruned to eliminate duplicates Z: 59 63.582 2.382 0.983 0.584 0.931 0.672 CB 1.750 31 residues pruned to eliminate duplicates Z: 10 25.576 2.352 0.604 0.925 1.000 0.889 CB 1.585 Z: 17 37.940 2.282 0.811 0.919 1.000 0.750 CB 1.618 17 residues pruned to eliminate duplicates Z: 82 65.688 2.345 0.862 0.601 0.926 0.531 CB 1.639 32 residues pruned to eliminate duplicates Z: 16 35.147 2.403 0.896 0.808 0.933 0.667 CA 1.632 14 residues pruned to eliminate duplicates Z: 16 35.691 2.402 1.000 0.793 0.867 0.467 CA 1.711 16 residues pruned to eliminate duplicates Z: 154 92.013 2.363 0.935 0.574 0.902 0.608 CB 1.679 102 residues pruned to eliminate duplicates Z: 13 44.960 2.536 0.875 0.922 1.000 0.667 CA 1.920 13 residues pruned to eliminate duplicates Z: 13 29.190 2.450 0.743 0.919 0.917 0.917 CA 1.517 13 residues pruned to eliminate duplicates Z: 54 37.652 2.156 0.901 0.498 0.925 0.585 CB 1.368 28 residues pruned to eliminate duplicates Z: 13 34.263 2.348 1.026 0.850 0.833 0.750 CA 1.848 13 residues pruned to eliminate duplicates Z: 12 38.566 2.445 0.870 0.933 1.000 0.909 CB 1.775 13 residues pruned to eliminate duplicates Z: 17 39.072 2.333 0.922 0.778 1.000 0.812 CA 1.704 17 residues pruned to eliminate duplicates Z: 13 38.259 2.320 0.907 0.919 1.000 0.917 CA 1.759 12 residues pruned to eliminate duplicates Z: 101 73.190 2.252 0.863 0.637 0.950 0.650 CB 1.616 13 residues pruned to eliminate duplicates Z: 77 63.137 2.233 0.978 0.629 0.908 0.632 CB 1.599 18 residues pruned to eliminate duplicates Z: 14 29.891 2.460 0.788 0.912 0.846 0.615 CB 1.577 14 residues pruned to eliminate duplicates Z: 14 35.441 2.322 1.116 0.845 0.923 0.615 CA 1.611 14 residues pruned to eliminate duplicates Z: 13 43.476 2.515 0.856 0.916 1.000 0.833 CA 1.898 13 residues pruned to eliminate duplicates Z: 17 43.252 2.277 1.098 0.918 0.938 0.750 CB 1.703 17 residues pruned to eliminate duplicates Z: 10 19.456 2.090 0.762 0.791 1.000 0.889 CA 1.364 10 residues pruned to eliminate duplicates Z: 83 76.687 2.365 0.986 0.663 0.951 0.573 CB 1.630 84 residues pruned to eliminate duplicates Z: 17 37.888 2.326 0.987 0.872 0.938 0.688 CA 1.594 17 residues pruned to eliminate duplicates Z: 16 42.291 2.368 1.150 0.937 1.000 0.867 CB 1.493 16 residues pruned to eliminate duplicates Z: 12 34.996 2.573 0.756 0.906 0.909 0.909 CA 1.827 12 residues pruned to eliminate duplicates Z: 83 70.680 2.261 0.857 0.650 0.963 0.671 CB 1.678 64 residues pruned to eliminate duplicates Z: 13 47.580 2.366 1.512 0.893 1.000 0.583 CA 1.659 13 residues pruned to eliminate duplicates Z: 13 42.489 2.486 1.063 0.895 1.000 0.667 CA 1.714 13 residues pruned to eliminate duplicates Z: 17 31.664 2.088 1.140 0.893 0.938 0.500 CB 1.356 17 residues pruned to eliminate duplicates Z: 33 44.934 2.373 0.990 0.605 0.875 0.500 CB 1.740 33 residues pruned to eliminate duplicates Z: 9 16.845 2.207 0.210 0.868 1.000 1.000 CA 1.629 9 residues pruned to eliminate duplicates Z: 15 34.268 2.364 0.652 0.927 0.929 0.786 CB 1.769 15 residues pruned to eliminate duplicates Z: 87 78.249 2.361 0.980 0.633 0.953 0.709 CB 1.671 82 residues pruned to eliminate duplicates Z: 60 53.606 2.216 0.872 0.616 0.949 0.746 CB 1.588 60 residues pruned to eliminate duplicates Z: 13 36.857 2.501 1.092 0.887 0.833 0.833 CA 1.761 14 residues pruned to eliminate duplicates Z: 140 92.110 2.400 0.974 0.583 0.885 0.604 CB 1.721 140 residues pruned to eliminate duplicates Z: 13 43.030 2.400 1.364 0.865 0.917 0.583 CA 1.751 13 residues pruned to eliminate duplicates Z: 13 37.292 2.538 0.788 0.929 1.000 0.917 CA 1.660 13 residues pruned to eliminate duplicates Z: 93 75.592 2.426 0.975 0.577 0.880 0.663 CB 1.734 93 residues pruned to eliminate duplicates Z: 58 67.625 2.402 1.022 0.603 0.982 0.596 CB 1.701 58 residues pruned to eliminate duplicates Z: 17 43.299 2.288 1.291 0.847 0.938 0.750 CB 1.635 18 residues pruned to eliminate duplicates Z: 13 40.278 2.377 0.930 0.873 1.000 0.583 CB 1.846 12 residues pruned to eliminate duplicates Z: 16 52.425 2.399 1.242 0.934 1.000 0.667 CA 1.755 16 residues pruned to eliminate duplicates Z: 13 34.761 2.343 0.764 0.887 1.000 0.750 CA 1.750 13 residues pruned to eliminate duplicates Z: 13 44.702 2.281 1.125 0.940 1.000 0.833 CB 1.849 13 residues pruned to eliminate duplicates Z: 11 17.764 2.058 0.717 0.689 0.900 0.500 CA 1.485 11 residues pruned to eliminate duplicates Z: 17 46.939 2.295 1.199 0.924 1.000 0.812 CB 1.633 17 residues pruned to eliminate duplicates Z: 32 42.269 2.346 0.947 0.523 0.935 0.613 CB 1.736 22 residues pruned to eliminate duplicates Z: 43 49.302 2.257 0.994 0.653 0.905 0.595 CB 1.621 43 residues pruned to eliminate duplicates Z: 14 36.656 2.258 1.205 0.867 0.923 0.385 CA 1.618 14 residues pruned to eliminate duplicates Z: 13 25.169 2.500 0.437 0.907 0.917 0.667 CA 1.569 13 residues pruned to eliminate duplicates Z: 215 91.133 2.192 0.866 0.573 0.930 0.636 CB 1.528 30 residues pruned to eliminate duplicates Z: 13 35.593 2.429 0.957 0.925 1.000 1.000 CB 1.517 13 residues pruned to eliminate duplicates Z: 12 30.786 2.315 0.579 0.906 1.000 0.818 CB 1.807 12 residues pruned to eliminate duplicates Z: 14 34.618 2.275 0.841 0.876 0.923 0.462 CB 1.805 14 residues pruned to eliminate duplicates Z: 10 20.136 2.260 0.354 0.874 1.000 0.889 CB 1.596 10 residues pruned to eliminate duplicates Z: 14 29.242 2.169 0.948 0.912 0.923 0.692 CB 1.473 14 residues pruned to eliminate duplicates Z: 13 44.987 2.535 0.989 0.935 0.917 0.833 CA 1.958 13 residues pruned to eliminate duplicates Z: 16 37.611 2.277 1.155 0.888 0.867 0.867 CA 1.645 16 residues pruned to eliminate duplicates Z: 69 60.282 2.206 0.944 0.616 0.941 0.632 CB 1.624 69 residues pruned to eliminate duplicates Z: 14 32.378 2.410 0.880 0.916 0.923 0.462 CB 1.517 14 residues pruned to eliminate duplicates Z: 13 38.308 2.477 0.797 0.884 1.000 0.917 CA 1.795 13 residues pruned to eliminate duplicates Z: 15 41.425 2.395 0.961 0.938 0.929 0.857 CB 1.765 15 residues pruned to eliminate duplicates Z: 12 44.816 2.620 1.079 0.927 0.909 0.818 CB 1.912 12 residues pruned to eliminate duplicates Z: 15 34.037 2.187 1.130 0.890 1.000 0.857 CA 1.405 15 residues pruned to eliminate duplicates Z: 17 39.056 2.275 0.852 0.922 1.000 0.562 CA 1.629 17 residues pruned to eliminate duplicates Z: 14 40.335 2.321 0.903 0.917 1.000 0.846 CA 1.788 14 residues pruned to eliminate duplicates Z: 72 58.828 2.214 0.800 0.625 0.930 0.648 CB 1.674 72 residues pruned to eliminate duplicates Z: 9 17.648 2.221 0.808 0.762 0.750 0.625 CA 1.642 9 residues pruned to eliminate duplicates Z: 142 90.808 2.314 0.959 0.619 0.929 0.617 CB 1.623 130 residues pruned to eliminate duplicates Z: 35 38.903 2.320 0.900 0.571 0.912 0.647 CB 1.549 35 residues pruned to eliminate duplicates Z: 34 22.390 1.945 0.585 0.486 0.939 0.576 CB 1.365 Z: 116 81.790 2.289 0.821 0.629 0.957 0.661 CB 1.695 117 residues pruned to eliminate duplicates Z: 17 41.726 2.257 1.007 0.925 1.000 0.875 CA 1.616 17 residues pruned to eliminate duplicates Z: 16 51.404 2.382 1.329 0.923 1.000 0.800 CB 1.681 16 residues pruned to eliminate duplicates Z: 12 31.296 2.420 0.503 0.920 1.000 0.909 CB 1.828 12 residues pruned to eliminate duplicates Z: 9 20.021 2.175 0.425 0.900 1.000 0.875 CB 1.632 Z: 15 25.142 2.085 0.537 0.929 1.000 0.714 CA 1.467 15 residues pruned to eliminate duplicates Z: 60 68.227 2.382 1.074 0.581 0.949 0.661 CB 1.751 60 residues pruned to eliminate duplicates Z: 157 99.804 2.398 0.953 0.587 0.917 0.628 CB 1.713 157 residues pruned to eliminate duplicates Z: 69 65.075 2.236 0.867 0.633 0.971 0.632 CB 1.720 69 residues pruned to eliminate duplicates Z: 81 38.521 2.142 0.794 0.444 0.863 0.525 CB 1.377 63 residues pruned to eliminate duplicates Z: 17 50.560 2.387 1.286 0.939 1.000 0.750 CB 1.610 17 residues pruned to eliminate duplicates Z: 17 45.174 2.262 1.114 0.921 1.000 0.812 CB 1.663 17 residues pruned to eliminate duplicates Z: 17 39.031 2.286 0.899 0.912 0.938 0.938 CB 1.698 17 residues pruned to eliminate duplicates Z: 14 34.880 2.308 0.867 0.913 0.923 0.615 CA 1.721 14 residues pruned to eliminate duplicates Z: 10 20.936 2.101 0.873 0.726 1.000 0.667 CA 1.446 10 residues pruned to eliminate duplicates Z: 14 35.107 2.337 0.706 0.879 1.000 0.692 CA 1.770 14 residues pruned to eliminate duplicates Z: 14 44.740 2.367 1.100 0.905 0.923 0.692 CA 1.926 14 residues pruned to eliminate duplicates Z: 17 47.955 2.270 1.172 0.936 1.000 0.750 CB 1.693 17 residues pruned to eliminate duplicates Z: 144 96.747 2.316 1.048 0.604 0.958 0.664 CB 1.614 144 residues pruned to eliminate duplicates Z: 15 37.422 2.259 1.083 0.918 1.000 0.786 CA 1.499 15 residues pruned to eliminate duplicates Z: 18 44.423 2.241 1.157 0.925 0.941 0.706 CA 1.662 18 residues pruned to eliminate duplicates Z: 15 33.393 2.216 0.951 0.925 0.929 0.929 CA 1.560 15 residues pruned to eliminate duplicates Z: 16 44.331 2.372 1.080 0.938 1.000 0.933 CB 1.614 16 residues pruned to eliminate duplicates Z: 108 90.526 2.397 1.031 0.631 0.935 0.673 CB 1.701 108 residues pruned to eliminate duplicates Z: 88 69.972 2.254 0.979 0.639 0.943 0.644 CB 1.567 88 residues pruned to eliminate duplicates Z: 17 39.251 2.253 0.990 0.920 0.938 0.875 CA 1.644 17 residues pruned to eliminate duplicates Z: 16 47.423 2.351 1.308 0.916 1.000 0.800 CB 1.593 16 residues pruned to eliminate duplicates Z: 66 53.114 2.150 0.876 0.662 0.954 0.569 CB 1.474 66 residues pruned to eliminate duplicates Z: 11 14.725 2.199 0.614 0.888 0.900 0.900 CB 1.050 10 residues pruned to eliminate duplicates Z: 146 93.836 2.288 1.006 0.616 0.931 0.662 CB 1.634 146 residues pruned to eliminate duplicates Z: 31 53.024 2.414 0.940 0.651 1.000 0.533 CB 1.796 31 residues pruned to eliminate duplicates Z: 86 68.832 2.227 0.842 0.649 0.965 0.647 CB 1.642 86 residues pruned to eliminate duplicates Z: 16 39.439 2.145 0.954 0.914 1.000 0.800 CB 1.718 16 residues pruned to eliminate duplicates Z: 17 48.861 2.355 1.243 0.942 1.000 0.938 CB 1.603 17 residues pruned to eliminate duplicates Z: 13 37.387 2.562 0.673 0.925 1.000 0.917 CA 1.767 13 residues pruned to eliminate duplicates Z: 33 24.391 2.177 0.696 0.446 0.812 0.594 CB 1.519 33 residues pruned to eliminate duplicates Z: 13 39.690 2.539 0.938 0.923 0.833 0.833 CA 1.963 13 residues pruned to eliminate duplicates Z: 15 40.775 2.328 1.030 0.876 1.000 0.857 CA 1.676 15 residues pruned to eliminate duplicates Z: 26 21.921 2.055 0.696 0.326 0.960 0.560 CA 1.588 26 residues pruned to eliminate duplicates Z: 12 20.096 2.207 0.496 0.795 0.909 0.818 CA 1.559 12 residues pruned to eliminate duplicates Z: 150 83.947 2.219 0.886 0.603 0.933 0.631 CB 1.598 119 residues pruned to eliminate duplicates Z: 88 65.859 2.217 0.830 0.650 0.920 0.598 CB 1.646 88 residues pruned to eliminate duplicates Z: 16 28.939 2.365 0.689 0.781 0.933 0.733 CB 1.565 16 residues pruned to eliminate duplicates Z: 14 21.152 2.049 0.735 0.926 1.000 0.923 CB 1.158 14 residues pruned to eliminate duplicates Z: 11 15.041 1.890 0.543 0.715 1.000 0.500 CA 1.343 11 residues pruned to eliminate duplicates Z: 14 34.631 2.456 0.898 0.935 0.923 0.769 CB 1.555 14 residues pruned to eliminate duplicates Z: 225 98.451 2.297 0.972 0.556 0.893 0.598 CB 1.540 95 residues pruned to eliminate duplicates Z: 15 45.079 2.401 1.231 0.940 1.000 0.714 CB 1.562 15 residues pruned to eliminate duplicates Z: 16 53.001 2.352 1.367 0.929 1.000 0.933 CA 1.721 16 residues pruned to eliminate duplicates Z: 10 18.664 2.072 0.923 0.684 1.000 0.667 CA 1.319 10 residues pruned to eliminate duplicates Z: 151 94.739 2.376 0.946 0.605 0.913 0.627 CB 1.658 151 residues pruned to eliminate duplicates Z: 17 22.849 2.261 0.573 0.781 0.812 0.688 CA 1.544 17 residues pruned to eliminate duplicates Z: 14 25.197 2.426 0.426 0.902 0.923 0.769 CB 1.560 14 residues pruned to eliminate duplicates Z: 58 63.714 2.377 0.979 0.591 0.947 0.649 CB 1.736 58 residues pruned to eliminate duplicates Z: 153 80.935 2.193 0.855 0.608 0.947 0.605 CB 1.538 153 residues pruned to eliminate duplicates Z: 18 41.304 2.172 1.075 0.870 1.000 0.882 CA 1.622 18 residues pruned to eliminate duplicates Z: 15 30.217 2.207 0.902 0.897 0.929 0.500 CA 1.482 15 residues pruned to eliminate duplicates Z: 17 36.752 2.232 0.794 0.931 1.000 1.000 CB 1.603 17 residues pruned to eliminate duplicates Z: 12 14.098 1.903 0.426 0.829 0.818 0.455 CA 1.440 12 residues pruned to eliminate duplicates Z: 15 39.090 2.410 1.218 0.937 0.929 0.786 CB 1.465 15 residues pruned to eliminate duplicates Z: 16 36.035 2.159 1.039 0.923 1.000 0.667 CA 1.486 16 residues pruned to eliminate duplicates Z: 16 32.380 2.161 0.837 0.922 1.000 0.867 CA 1.481 16 residues pruned to eliminate duplicates Z: 9 14.804 2.089 0.453 0.591 1.000 0.750 CB 1.580 9 residues pruned to eliminate duplicates Z: 10 20.394 2.142 1.075 0.738 0.889 0.667 CA 1.390 10 residues pruned to eliminate duplicates Z: 10 15.782 2.290 0.833 0.341 1.000 0.778 CA 1.491 10 residues pruned to eliminate duplicates Z: 17 42.149 2.221 1.165 0.926 1.000 0.938 CB 1.537 17 residues pruned to eliminate duplicates Z: 16 47.261 2.364 1.443 0.913 0.933 0.733 CB 1.603 16 residues pruned to eliminate duplicates Z: 23 17.117 2.088 0.490 0.291 0.955 0.409 CB 1.554 17 residues pruned to eliminate duplicates Z: 14 34.081 2.473 0.852 0.928 0.923 0.615 CB 1.566 14 residues pruned to eliminate duplicates Z: 91 65.915 2.261 0.922 0.627 0.911 0.644 CB 1.557 91 residues pruned to eliminate duplicates Z: 11 17.052 1.736 0.827 0.870 1.000 0.800 CB 1.241 11 residues pruned to eliminate duplicates Z: 20 19.922 2.233 0.749 0.566 0.842 0.579 CB 1.304 20 residues pruned to eliminate duplicates Z: 9 23.836 2.387 0.745 0.897 1.000 0.875 CB 1.449 9 residues pruned to eliminate duplicates Z: 12 38.608 2.455 1.077 0.932 0.909 0.909 CB 1.753 12 residues pruned to eliminate duplicates Z: 10 19.846 2.142 0.729 0.769 1.000 0.778 CA 1.407 10 residues pruned to eliminate duplicates Z: 9 15.599 2.192 0.658 0.714 0.875 0.750 CB 1.428 9 residues pruned to eliminate duplicates Z: 14 23.541 2.227 0.864 0.859 0.769 0.615 CA 1.505 14 residues pruned to eliminate duplicates Z: 10 18.065 2.291 0.230 0.846 1.000 0.889 CA 1.588 10 residues pruned to eliminate duplicates Z: 45 37.531 2.084 0.835 0.621 0.955 0.636 CB 1.384 50 residues pruned to eliminate duplicates Z: 16 34.186 2.117 1.091 0.883 1.000 0.933 CA 1.442 16 residues pruned to eliminate duplicates Z: 11 20.623 2.176 0.873 0.686 0.900 0.700 CB 1.499 11 residues pruned to eliminate duplicates Z: 15 43.614 2.438 1.010 0.949 1.000 0.857 CB 1.642 15 residues pruned to eliminate duplicates Z: 14 8.800 1.919 0.564 0.271 0.769 0.538 CA 1.370 14 residues pruned to eliminate duplicates Z: 6 7.264 1.694 0.529 0.649 0.800 0.400 C 1.364 6 residues pruned to eliminate duplicates Z: 8 25.685 2.373 0.752 0.807 1.000 0.714 CA 1.787 8 residues pruned to eliminate duplicates Z: 15 20.105 2.381 0.686 0.548 0.786 0.571 CB 1.625 15 residues pruned to eliminate duplicates Z: 12 16.544 2.053 0.516 0.752 0.909 0.909 CB 1.408 12 residues pruned to eliminate duplicates Z: 18 33.816 2.150 0.802 0.909 1.000 0.882 CB 1.503 18 residues pruned to eliminate duplicates Z: 19 24.483 1.977 1.216 0.649 0.889 0.611 CA 1.290 19 residues pruned to eliminate duplicates Z: 17 44.776 2.314 1.109 0.896 1.000 0.750 CB 1.643 17 residues pruned to eliminate duplicates Z: 89 65.532 2.269 0.814 0.637 0.943 0.625 CB 1.584 89 residues pruned to eliminate duplicates Z: 130 88.525 2.323 0.957 0.626 0.922 0.558 CB 1.651 130 residues pruned to eliminate duplicates Z: 14 32.004 2.142 0.977 0.948 1.000 0.692 CA 1.448 14 residues pruned to eliminate duplicates Z: 12 16.610 2.231 0.859 0.304 1.000 0.636 CB 1.502 12 residues pruned to eliminate duplicates Z: 8 12.136 1.925 0.323 0.751 1.000 0.857 C 1.441 8 residues pruned to eliminate duplicates Z: 17 27.919 1.988 0.799 0.857 0.938 0.625 CB 1.533 17 residues pruned to eliminate duplicates Z: 18 17.713 2.041 0.807 0.421 0.941 0.529 CB 1.343 18 residues pruned to eliminate duplicates Z: 95 68.368 2.214 0.850 0.627 0.957 0.660 CB 1.595 95 residues pruned to eliminate duplicates Z: 10 27.835 2.342 0.764 0.892 1.000 0.778 CA 1.613 11 residues pruned to eliminate duplicates Z: 61 40.502 2.123 0.704 0.465 0.967 0.550 CB 1.549 61 residues pruned to eliminate duplicates Z: 10 21.196 1.939 0.860 0.805 1.000 0.889 CB 1.501 10 residues pruned to eliminate duplicates Z: 119 77.712 2.268 0.841 0.631 0.915 0.644 CB 1.656 119 residues pruned to eliminate duplicates Z: 16 33.757 2.199 0.894 0.937 1.000 0.867 CA 1.457 16 residues pruned to eliminate duplicates Z: 15 42.974 2.418 1.236 0.933 1.000 0.857 CB 1.483 15 residues pruned to eliminate duplicates Z: 62 68.153 2.376 1.104 0.658 0.918 0.672 CB 1.642 62 residues pruned to eliminate duplicates Z: 82 62.212 2.279 0.844 0.621 0.926 0.642 CB 1.585 82 residues pruned to eliminate duplicates Z: 66 54.975 2.270 0.946 0.545 0.923 0.523 CB 1.600 66 residues pruned to eliminate duplicates Z: 83 69.129 2.363 0.921 0.572 0.915 0.695 CB 1.714 83 residues pruned to eliminate duplicates Z: 15 36.818 2.238 0.998 0.932 1.000 0.786 CB 1.537 15 residues pruned to eliminate duplicates Z: 13 37.475 2.400 1.232 0.932 1.000 0.750 CA 1.410 13 residues pruned to eliminate duplicates Z: 88 72.173 2.292 0.980 0.648 0.943 0.598 CB 1.576 88 residues pruned to eliminate duplicates Z: 13 48.735 2.566 1.087 0.939 1.000 0.667 CA 1.826 13 residues pruned to eliminate duplicates Z: 11 13.816 1.869 0.515 0.879 0.900 0.800 CB 1.244 11 residues pruned to eliminate duplicates Z: 31 52.696 2.455 1.110 0.648 0.933 0.667 CB 1.734 31 residues pruned to eliminate duplicates Z: 41 31.835 2.121 0.595 0.545 0.950 0.675 CB 1.500 41 residues pruned to eliminate duplicates Z: 74 38.388 2.071 0.580 0.508 0.890 0.644 CB 1.530 74 residues pruned to eliminate duplicates Z: 11 18.073 1.868 0.872 0.920 0.900 0.700 CB 1.279 9 residues pruned to eliminate duplicates Z: 14 11.755 1.943 0.560 0.535 0.846 0.769 CB 1.228 14 residues pruned to eliminate duplicates Z: 85 55.350 2.119 0.912 0.591 0.940 0.560 CB 1.452 85 residues pruned to eliminate duplicates Z: 11 17.992 2.219 0.819 0.901 0.900 0.800 CB 1.118 11 residues pruned to eliminate duplicates Z: 15 23.113 2.087 0.437 0.895 0.929 0.714 CB 1.591 15 residues pruned to eliminate duplicates Z: 17 37.760 2.248 0.859 0.913 1.000 0.750 CA 1.598 17 residues pruned to eliminate duplicates Z: 18 38.524 2.248 1.100 0.846 0.941 0.588 CB 1.563 18 residues pruned to eliminate duplicates Z: 8 17.976 2.103 0.654 0.836 1.000 1.000 CB 1.462 8 residues pruned to eliminate duplicates Z: 162 82.365 2.267 0.903 0.563 0.901 0.602 CB 1.572 162 residues pruned to eliminate duplicates Z: 10 22.460 2.000 1.160 0.887 0.889 0.667 CB 1.405 10 residues pruned to eliminate duplicates Z: 15 26.819 2.203 0.967 0.879 0.857 0.214 CB 1.400 15 residues pruned to eliminate duplicates Z: 16 27.205 2.089 0.477 0.887 1.000 0.733 CA 1.642 16 residues pruned to eliminate duplicates Z: 17 12.419 1.768 0.985 0.560 0.938 0.500 CB 0.891 12 residues pruned to eliminate duplicates Z: 116 89.071 2.283 0.998 0.653 0.948 0.678 CB 1.667 116 residues pruned to eliminate duplicates Z: 7 6.647 1.769 0.674 0.577 0.833 0.667 CA 1.021 Z: 97 74.445 2.203 1.062 0.649 0.938 0.646 CB 1.553 97 residues pruned to eliminate duplicates Z: 11 16.057 2.116 0.440 0.749 0.800 0.600 CB 1.667 11 residues pruned to eliminate duplicates Z: 16 23.900 1.994 0.727 0.873 0.933 0.600 CB 1.398 16 residues pruned to eliminate duplicates Z: 11 20.513 2.403 0.598 0.467 1.000 0.800 CA 1.746 11 residues pruned to eliminate duplicates Z: 13 38.728 2.497 0.791 0.892 1.000 0.833 CA 1.795 13 residues pruned to eliminate duplicates Z: 15 28.583 2.321 0.625 0.921 1.000 0.929 CB 1.426 Z: 9 23.337 2.333 1.043 0.733 0.875 0.625 CB 1.605 9 residues pruned to eliminate duplicates Z: 15 29.105 2.227 0.959 0.835 0.929 0.571 CA 1.438 30 residues pruned to eliminate duplicates Z: 10 18.082 2.223 0.670 0.869 0.889 0.667 CB 1.335 10 residues pruned to eliminate duplicates Z: 118 85.959 2.264 0.896 0.641 0.966 0.658 CB 1.679 118 residues pruned to eliminate duplicates Z: 7 17.768 2.059 0.580 0.790 1.000 0.833 CA 1.728 Z: 19 18.475 2.041 0.639 0.513 0.833 0.556 CA 1.542 19 residues pruned to eliminate duplicates Z: 17 44.778 2.274 1.098 0.931 1.000 0.688 CA 1.640 17 residues pruned to eliminate duplicates Z: 71 42.955 2.045 0.878 0.623 0.900 0.614 CB 1.322 71 residues pruned to eliminate duplicates Z: 14 35.683 2.075 1.332 0.876 1.000 0.462 CA 1.486 14 residues pruned to eliminate duplicates Z: 16 27.413 2.379 0.698 0.781 0.933 0.667 CA 1.466 16 residues pruned to eliminate duplicates Z: 15 21.117 1.862 0.751 0.841 1.000 0.500 CB 1.291 15 residues pruned to eliminate duplicates Z: 48 36.628 2.042 0.920 0.597 0.936 0.638 CB 1.327 48 residues pruned to eliminate duplicates Z: 14 22.767 2.179 0.473 0.904 0.923 0.769 CB 1.518 14 residues pruned to eliminate duplicates Z: 20 16.256 2.138 0.667 0.305 0.842 0.474 CB 1.543 20 residues pruned to eliminate duplicates Z: 17 32.358 2.228 0.949 0.846 0.875 0.812 CB 1.581 17 residues pruned to eliminate duplicates Z: 92 62.113 2.280 0.899 0.522 0.912 0.593 CB 1.614 87 residues pruned to eliminate duplicates Z: 10 16.793 2.042 0.527 0.865 0.889 0.889 CB 1.480 10 residues pruned to eliminate duplicates Z: 78 62.529 2.278 1.078 0.547 0.883 0.610 CB 1.629 88 residues pruned to eliminate duplicates Z: 17 42.027 2.319 1.019 0.889 0.938 0.500 CA 1.723 17 residues pruned to eliminate duplicates Z: 19 13.116 2.032 0.462 0.270 0.944 0.500 CB 1.431 19 residues pruned to eliminate duplicates Z: 169 93.466 2.265 0.981 0.584 0.935 0.583 CB 1.586 169 residues pruned to eliminate duplicates Z: 17 45.478 2.326 1.139 0.922 1.000 0.750 CB 1.608 17 residues pruned to eliminate duplicates Z: 24 18.292 2.047 0.741 0.450 0.783 0.522 CB 1.439 24 residues pruned to eliminate duplicates Z: 50 42.273 2.153 0.949 0.623 0.878 0.571 CB 1.460 50 residues pruned to eliminate duplicates Z: 14 3.989 1.563 0.549 0.280 0.769 0.385 CB 0.761 Z: 37 27.601 2.254 0.930 0.422 0.722 0.444 CB 1.589 37 residues pruned to eliminate duplicates Z: 10 17.096 2.002 0.447 0.911 0.889 0.889 CB 1.569 10 residues pruned to eliminate duplicates Z: 17 37.753 2.269 0.935 0.886 0.938 0.562 CB 1.655 17 residues pruned to eliminate duplicates Z: 16 36.305 2.448 0.923 0.791 1.000 0.800 CA 1.542 16 residues pruned to eliminate duplicates Z: 14 17.362 2.022 0.692 0.641 0.923 0.769 CB 1.336 14 residues pruned to eliminate duplicates Z: 15 32.981 2.235 0.869 0.911 1.000 0.643 CA 1.495 15 residues pruned to eliminate duplicates Z: 33 40.091 2.361 0.965 0.567 0.844 0.719 CA 1.696 30 residues pruned to eliminate duplicates Z: 12 26.922 2.077 0.682 0.940 1.000 0.909 CB 1.614 12 residues pruned to eliminate duplicates Z: 21 18.236 1.846 0.532 0.527 0.950 0.550 CB 1.477 18 residues pruned to eliminate duplicates Z: 14 20.758 1.990 0.691 0.937 1.000 0.846 CB 1.191 14 residues pruned to eliminate duplicates Z: 12 14.454 1.767 0.805 0.836 0.909 0.727 CB 1.126 12 residues pruned to eliminate duplicates Z: 35 52.339 2.372 1.160 0.655 0.912 0.706 CB 1.663 35 residues pruned to eliminate duplicates Z: 17 43.045 2.275 1.270 0.928 0.938 0.938 CB 1.556 17 residues pruned to eliminate duplicates Z: 9 9.241 1.851 0.627 0.773 0.875 0.625 CB 0.974 9 residues pruned to eliminate duplicates Z: 16 45.064 2.363 1.026 0.940 1.000 0.867 CA 1.688 16 residues pruned to eliminate duplicates Z: 127 86.963 2.385 0.926 0.600 0.897 0.603 CB 1.710 88 residues pruned to eliminate duplicates Z: 9 13.014 1.987 0.558 0.880 0.875 0.875 CB 1.231 9 residues pruned to eliminate duplicates Z: 32 36.230 2.241 0.922 0.566 0.935 0.548 CB 1.515 32 residues pruned to eliminate duplicates Z: 11 17.223 2.070 0.723 0.653 0.900 0.700 CA 1.472 11 residues pruned to eliminate duplicates Z: 9 14.045 1.993 0.378 0.911 1.000 1.000 CB 1.282 9 residues pruned to eliminate duplicates Z: 15 29.203 2.083 0.631 0.873 1.000 0.786 CA 1.673 15 residues pruned to eliminate duplicates Z: 29 44.093 2.278 1.010 0.599 0.929 0.679 CB 1.783 29 residues pruned to eliminate duplicates Z: 10 16.015 1.995 0.766 0.922 1.000 0.778 CB 1.065 10 residues pruned to eliminate duplicates Z: 15 25.676 2.106 0.704 0.919 0.929 0.643 CA 1.451 15 residues pruned to eliminate duplicates Z: 15 31.460 2.093 0.719 0.927 1.000 0.786 CB 1.637 15 residues pruned to eliminate duplicates Z: 16 46.266 2.345 1.141 0.932 0.933 0.867 CA 1.781 16 residues pruned to eliminate duplicates Z: 16 43.867 2.377 1.261 0.943 0.933 0.867 CB 1.565 16 residues pruned to eliminate duplicates Z: 143 97.072 2.333 1.035 0.645 0.951 0.648 CB 1.577 143 residues pruned to eliminate duplicates Z: 83 77.233 2.355 0.953 0.654 0.951 0.659 CB 1.689 69 residues pruned to eliminate duplicates Z: 67 64.708 2.433 1.047 0.557 0.894 0.576 CB 1.693 67 residues pruned to eliminate duplicates Z: 15 27.846 2.102 0.542 0.901 1.000 0.857 CB 1.639 15 residues pruned to eliminate duplicates Z: 15 26.076 2.087 0.748 0.916 0.857 0.429 CB 1.574 15 residues pruned to eliminate duplicates Z: 153 79.059 2.189 0.832 0.600 0.921 0.664 CB 1.579 153 residues pruned to eliminate duplicates Z: 13 10.349 1.869 0.274 0.728 0.750 0.667 CB 1.363 13 residues pruned to eliminate duplicates Z: 14 33.720 2.127 1.025 0.869 0.923 0.615 CB 1.718 14 residues pruned to eliminate duplicates Z: 15 34.934 2.206 0.942 0.921 1.000 0.857 CA 1.533 15 residues pruned to eliminate duplicates Z: 17 41.028 2.333 1.078 0.890 0.938 0.562 CB 1.624 17 residues pruned to eliminate duplicates Z: 14 26.953 2.160 0.445 0.906 1.000 0.769 CB 1.703 14 residues pruned to eliminate duplicates Z: 15 30.937 2.330 1.064 0.922 0.714 0.357 CB 1.693 15 residues pruned to eliminate duplicates Z: 14 32.225 2.298 1.138 0.892 0.846 0.692 CA 1.545 14 residues pruned to eliminate duplicates Z: 16 33.102 2.200 1.057 0.901 0.933 0.800 CA 1.444 16 residues pruned to eliminate duplicates Z: 8 12.212 1.843 0.456 0.876 0.857 0.714 CB 1.458 8 residues pruned to eliminate duplicates Z: 14 31.926 2.248 0.976 0.861 0.923 0.769 CA 1.587 14 residues pruned to eliminate duplicates Z: 10 26.404 2.360 0.590 0.901 1.000 1.000 CB 1.675 Z: 7 12.287 1.851 0.853 0.538 1.000 0.500 CA 1.409 7 residues pruned to eliminate duplicates Z: 16 44.640 2.362 1.128 0.902 1.000 0.467 CB 1.635 16 residues pruned to eliminate duplicates Z: 138 86.823 2.235 0.876 0.617 0.956 0.620 CB 1.656 138 residues pruned to eliminate duplicates Z: 76 54.103 2.160 0.848 0.622 0.907 0.600 CB 1.539 76 residues pruned to eliminate duplicates Z: 17 49.387 2.302 1.350 0.933 0.938 0.812 CB 1.698 17 residues pruned to eliminate duplicates Z: 11 14.444 1.773 0.631 0.783 1.000 0.900 CA 1.231 11 residues pruned to eliminate duplicates Z: 66 44.347 2.133 0.670 0.512 0.969 0.738 CB 1.575 66 residues pruned to eliminate duplicates Z: 17 33.389 2.221 0.930 0.910 0.875 0.375 CB 1.578 17 residues pruned to eliminate duplicates Z: 17 49.088 2.266 1.390 0.932 0.938 0.500 CA 1.688 17 residues pruned to eliminate duplicates Z: 65 64.700 2.352 0.987 0.691 0.875 0.625 CB 1.660 65 residues pruned to eliminate duplicates Z: 33 44.175 2.333 1.006 0.534 0.938 0.719 CB 1.721 30 residues pruned to eliminate duplicates Z: 11 41.185 2.501 0.974 0.892 1.000 0.600 CA 1.896 11 residues pruned to eliminate duplicates Z: 10 24.468 2.357 0.439 0.914 1.000 1.000 CB 1.701 10 residues pruned to eliminate duplicates Z: 9 13.441 1.975 0.488 0.845 0.875 0.875 CB 1.374 9 residues pruned to eliminate duplicates Z: 9 27.000 2.241 1.001 0.826 1.000 0.625 CA 1.606 9 residues pruned to eliminate duplicates Z: 44 30.873 1.966 0.864 0.653 0.930 0.605 CB 1.198 44 residues pruned to eliminate duplicates Z: 12 10.828 1.717 0.629 0.804 0.909 0.727 CB 0.984 12 residues pruned to eliminate duplicates Z: 10 28.399 2.265 0.832 0.914 1.000 0.889 CA 1.613 10 residues pruned to eliminate duplicates Z: 18 19.496 2.126 0.597 0.306 1.000 0.529 CA 1.729 18 residues pruned to eliminate duplicates Z: 84 72.398 2.260 0.881 0.657 0.964 0.663 CB 1.677 84 residues pruned to eliminate duplicates Z: 6 5.059 1.955 -0.260 0.743 1.000 0.800 N 1.259 Z: 10 21.746 1.967 0.850 0.910 1.000 0.889 CB 1.413 10 residues pruned to eliminate duplicates Z: 25 23.951 2.088 0.916 0.388 0.917 0.667 CB 1.502 25 residues pruned to eliminate duplicates Z: 12 8.530 1.701 0.458 0.702 0.818 0.636 CB 1.055 12 residues pruned to eliminate duplicates Z: 14 17.563 2.288 0.765 0.471 0.846 0.538 CB 1.468 14 residues pruned to eliminate duplicates Z: 13 32.457 2.161 1.304 0.898 0.833 0.250 CA 1.616 13 residues pruned to eliminate duplicates Z: 58 45.870 2.249 0.929 0.511 0.877 0.579 CB 1.580 58 residues pruned to eliminate duplicates Z: 14 20.895 2.010 0.715 0.924 1.000 0.692 CB 1.180 14 residues pruned to eliminate duplicates Z: 11 11.639 2.020 0.799 0.415 0.900 0.500 CB 1.230 11 residues pruned to eliminate duplicates Z: 50 43.540 2.190 0.799 0.644 0.918 0.755 CB 1.503 50 residues pruned to eliminate duplicates Z: 16 49.574 2.429 1.289 0.938 1.000 0.800 CB 1.601 16 residues pruned to eliminate duplicates Z: 9 22.441 2.407 0.399 0.904 1.000 0.875 CB 1.678 10 residues pruned to eliminate duplicates Z: 15 33.001 2.252 0.843 0.910 1.000 0.571 CA 1.507 15 residues pruned to eliminate duplicates Z: 10 13.913 1.974 0.575 0.859 1.000 1.000 CB 1.098 10 residues pruned to eliminate duplicates Z: 72 68.065 2.301 0.978 0.656 0.915 0.676 CB 1.677 72 residues pruned to eliminate duplicates Z: 24 22.340 2.130 0.874 0.450 0.826 0.522 CB 1.487 24 residues pruned to eliminate duplicates Z: 10 17.851 1.944 0.833 0.914 1.000 0.889 CB 1.181 10 residues pruned to eliminate duplicates Z: 115 81.733 2.274 0.936 0.625 0.921 0.640 CB 1.677 115 residues pruned to eliminate duplicates Z: 12 35.089 2.480 0.675 0.929 1.000 1.000 CA 1.782 12 residues pruned to eliminate duplicates Z: 11 17.845 1.848 0.708 0.909 1.000 0.600 CB 1.268 11 residues pruned to eliminate duplicates Z: 11 17.026 1.948 0.752 0.810 0.900 0.600 CA 1.338 11 residues pruned to eliminate duplicates Z: 17 55.190 2.415 1.504 0.941 1.000 0.750 CB 1.584 17 residues pruned to eliminate duplicates Z: 12 12.820 2.085 0.848 0.365 0.727 0.636 CB 1.595 12 residues pruned to eliminate duplicates Z: 86 68.003 2.239 0.812 0.656 0.953 0.600 CB 1.651 86 residues pruned to eliminate duplicates Z: 6 4.544 1.749 -0.214 0.770 1.000 0.800 CB 1.165 6 residues pruned to eliminate duplicates Z: 14 41.700 2.485 1.134 0.923 1.000 0.692 CB 1.533 14 residues pruned to eliminate duplicates Z: 10 19.370 2.057 0.907 0.761 1.000 0.778 CA 1.306 10 residues pruned to eliminate duplicates Z: 63 46.742 2.239 0.842 0.527 0.871 0.597 CB 1.609 63 residues pruned to eliminate duplicates Z: 87 79.488 2.346 0.992 0.647 0.965 0.686 CB 1.657 86 residues pruned to eliminate duplicates Z: 13 29.961 2.190 0.801 0.872 0.917 0.833 CA 1.744 13 residues pruned to eliminate duplicates Z: 18 36.625 2.332 1.478 0.811 0.882 0.588 CB 1.329 18 residues pruned to eliminate duplicates Z: 12 32.829 2.402 0.703 0.893 1.000 0.818 CB 1.737 12 residues pruned to eliminate duplicates Z: 15 34.620 2.242 1.004 0.933 0.929 0.786 CA 1.547 15 residues pruned to eliminate duplicates Z: 28 17.845 2.032 0.600 0.491 0.815 0.593 CB 1.309 28 residues pruned to eliminate duplicates Z: 10 20.888 2.038 0.860 0.892 1.000 0.889 CB 1.320 10 residues pruned to eliminate duplicates Z: 14 13.665 2.006 0.737 0.422 0.923 0.769 CB 1.278 14 residues pruned to eliminate duplicates Z: 14 24.427 2.301 0.944 0.535 0.846 0.615 CA 1.730 14 residues pruned to eliminate duplicates Z: 25 18.470 1.902 0.844 0.593 0.875 0.542 CB 1.124 25 residues pruned to eliminate duplicates Z: 16 47.257 2.390 1.082 0.912 1.000 0.933 CA 1.737 16 residues pruned to eliminate duplicates Z: 10 15.999 1.995 0.869 0.730 0.889 0.667 CA 1.308 Z: 14 20.660 2.261 0.420 0.851 0.923 0.769 CA 1.431 14 residues pruned to eliminate duplicates Z: 16 39.033 2.323 1.092 0.908 0.933 0.600 CB 1.578 16 residues pruned to eliminate duplicates Z: 14 14.787 1.873 0.345 0.872 0.923 0.769 CB 1.285 14 residues pruned to eliminate duplicates Z: 56 64.896 2.437 1.079 0.627 0.909 0.545 CB 1.686 56 residues pruned to eliminate duplicates Z: 17 26.875 1.992 0.811 0.881 0.875 0.750 CB 1.541 17 residues pruned to eliminate duplicates Z: 85 77.141 2.239 1.008 0.648 1.000 0.667 CB 1.631 85 residues pruned to eliminate duplicates Z: 13 26.529 2.170 1.273 0.568 0.917 0.667 CB 1.587 19 residues pruned to eliminate duplicates Z: 14 14.292 1.636 0.787 0.688 0.846 0.538 CA 1.349 14 residues pruned to eliminate duplicates Z: 18 31.624 2.162 1.100 0.839 0.824 0.412 CB 1.531 18 residues pruned to eliminate duplicates Z: 14 36.616 2.360 0.976 0.910 1.000 0.923 CA 1.545 14 residues pruned to eliminate duplicates Z: 13 20.192 1.988 0.509 0.925 1.000 0.667 CB 1.363 13 residues pruned to eliminate duplicates Z: 23 17.563 2.121 0.568 0.395 0.818 0.455 CB 1.537 23 residues pruned to eliminate duplicates Z: 17 31.996 2.268 0.616 0.929 1.000 0.875 CB 1.527 17 residues pruned to eliminate duplicates Z: 15 13.525 1.763 0.202 0.920 1.000 0.929 CA 1.201 15 residues pruned to eliminate duplicates Z: 14 34.752 2.257 1.067 0.915 0.923 0.692 CB 1.581 14 residues pruned to eliminate duplicates Z: 23 21.809 2.100 0.765 0.505 0.818 0.500 CB 1.524 23 residues pruned to eliminate duplicates Z: 10 13.492 1.897 0.421 0.808 1.000 0.889 CB 1.275 10 residues pruned to eliminate duplicates Z: 42 30.695 2.038 0.680 0.537 0.927 0.634 CA 1.456 42 residues pruned to eliminate duplicates Z: 18 35.412 2.164 0.832 0.913 1.000 0.882 CB 1.534 18 residues pruned to eliminate duplicates Z: 16 36.328 2.174 0.901 0.842 1.000 0.600 CB 1.690 16 residues pruned to eliminate duplicates Z: 15 33.283 2.228 0.874 0.908 1.000 0.714 CA 1.514 15 residues pruned to eliminate duplicates Z: 80 63.347 2.300 0.832 0.604 0.975 0.582 CB 1.572 80 residues pruned to eliminate duplicates Z: 16 26.048 2.155 0.727 0.916 0.867 0.667 CA 1.473 16 residues pruned to eliminate duplicates Z: 83 74.021 2.281 0.867 0.669 0.963 0.634 CB 1.705 83 residues pruned to eliminate duplicates Z: 12 6.074 1.697 0.068 0.580 0.909 0.545 CB 1.029 Z: 15 12.776 1.657 1.049 0.674 0.857 0.429 CB 0.999 15 residues pruned to eliminate duplicates Z: 54 40.389 2.086 0.830 0.624 0.925 0.679 CB 1.398 54 residues pruned to eliminate duplicates Z: 85 72.891 2.401 0.971 0.608 0.917 0.619 CB 1.654 85 residues pruned to eliminate duplicates Z: 7 5.032 1.677 0.051 0.775 1.000 1.000 CB 0.914 7 residues pruned to eliminate duplicates Z: 118 79.661 2.257 0.920 0.620 0.915 0.598 CB 1.659 118 residues pruned to eliminate duplicates Z: 15 32.354 2.192 0.829 0.909 1.000 0.429 CA 1.532 15 residues pruned to eliminate duplicates Z: 8 3.228 1.836 0.056 0.460 0.571 0.571 CB 1.147 8 residues pruned to eliminate duplicates Z: 44 49.581 2.170 0.886 0.694 0.930 0.721 CB 1.663 44 residues pruned to eliminate duplicates Z: 60 66.748 2.403 1.058 0.600 0.966 0.610 CB 1.654 60 residues pruned to eliminate duplicates Z: 16 9.556 1.884 0.531 0.416 0.800 0.533 CA 1.168 16 residues pruned to eliminate duplicates Z: 12 28.999 2.399 0.525 0.897 1.000 0.727 CB 1.711 12 residues pruned to eliminate duplicates Z: 15 25.973 2.101 0.528 0.918 1.000 0.786 CB 1.524 15 residues pruned to eliminate duplicates Z: 17 38.845 2.284 0.765 0.921 1.000 0.812 CA 1.696 17 residues pruned to eliminate duplicates Z: 17 41.110 2.345 1.447 0.897 0.875 0.625 CB 1.466 17 residues pruned to eliminate duplicates Z: 16 26.618 2.158 0.619 0.919 1.000 0.800 CA 1.386 16 residues pruned to eliminate duplicates Z: 15 25.357 2.133 0.886 0.903 0.929 0.643 CA 1.293 15 residues pruned to eliminate duplicates Z: 17 27.441 2.088 0.844 0.903 0.938 0.688 CA 1.355 17 residues pruned to eliminate duplicates Z: 11 6.362 1.875 0.148 0.516 0.800 0.500 CB 1.149 Z: 18 29.239 1.958 0.894 0.912 1.000 0.765 CA 1.355 18 residues pruned to eliminate duplicates Z: 11 13.066 1.939 0.449 0.783 0.800 0.400 CB 1.433 11 residues pruned to eliminate duplicates Z: 45 54.011 2.360 1.198 0.524 0.909 0.636 CB 1.686 45 residues pruned to eliminate duplicates Z: 9 12.443 1.852 0.882 0.674 0.875 0.625 CB 1.229 3 residues pruned to eliminate duplicates Z: 15 18.897 2.000 0.670 0.924 1.000 0.857 CB 1.061 15 residues pruned to eliminate duplicates Z: 16 20.731 1.879 0.825 0.879 0.933 0.800 CB 1.212 16 residues pruned to eliminate duplicates Z: 98 46.193 2.162 0.752 0.471 0.897 0.598 CB 1.421 98 residues pruned to eliminate duplicates Z: 23 26.677 2.186 0.706 0.512 0.909 0.455 CB 1.659 23 residues pruned to eliminate duplicates Z: 12 17.045 1.834 0.783 0.772 1.000 0.636 CA 1.236 12 residues pruned to eliminate duplicates Z: 38 22.076 2.086 0.557 0.416 0.838 0.541 CA 1.457 34 residues pruned to eliminate duplicates Z: 171 79.731 2.247 0.801 0.542 0.918 0.629 CB 1.581 171 residues pruned to eliminate duplicates Z: 15 27.461 2.229 0.876 0.896 0.857 0.643 CA 1.467 15 residues pruned to eliminate duplicates Z: 73 58.125 2.174 1.082 0.594 0.931 0.583 CB 1.486 73 residues pruned to eliminate duplicates Z: 13 17.241 1.790 0.836 0.721 0.917 0.667 CA 1.353 13 residues pruned to eliminate duplicates Z: 134 85.897 2.220 0.952 0.649 0.947 0.654 CB 1.580 134 residues pruned to eliminate duplicates Z: 14 28.027 2.188 0.631 0.883 0.923 0.385 CB 1.706 14 residues pruned to eliminate duplicates Z: 21 16.630 2.036 0.553 0.478 0.850 0.500 CB 1.414 21 residues pruned to eliminate duplicates Z: 33 46.702 2.412 1.109 0.627 0.875 0.594 CA 1.646 33 residues pruned to eliminate duplicates Z: 142 72.596 2.197 0.838 0.569 0.929 0.574 CB 1.525 142 residues pruned to eliminate duplicates Z: 10 22.847 2.322 0.450 0.850 1.000 0.889 CA 1.676 9 residues pruned to eliminate duplicates Z: 13 27.767 2.248 0.773 0.790 0.917 0.750 CA 1.701 13 residues pruned to eliminate duplicates Z: 12 15.085 2.129 0.642 0.496 0.909 0.636 CA 1.437 12 residues pruned to eliminate duplicates Z: 15 40.903 2.158 1.121 0.930 1.000 0.571 CB 1.670 15 residues pruned to eliminate duplicates Z: 6 5.857 1.763 0.079 0.488 1.000 0.600 CB 1.393 Z: 7 9.925 1.938 0.177 0.643 1.000 0.833 CA 1.554 7 residues pruned to eliminate duplicates Z: 11 16.419 1.905 0.827 0.769 0.900 0.600 CB 1.307 11 residues pruned to eliminate duplicates Z: 155 95.361 2.376 0.976 0.562 0.903 0.623 CB 1.708 155 residues pruned to eliminate duplicates Z: 17 21.872 1.961 0.599 0.872 0.875 0.688 CB 1.453 17 residues pruned to eliminate duplicates Z: 75 62.912 2.198 0.839 0.638 0.946 0.703 CA 1.681 75 residues pruned to eliminate duplicates Z: 10 4.952 1.793 -0.065 0.588 0.889 0.556 CB 1.018 Z: 11 13.141 2.034 0.242 0.822 0.900 0.700 CA 1.383 11 residues pruned to eliminate duplicates Z: 13 36.936 2.319 1.315 0.846 0.833 0.500 CB 1.771 13 residues pruned to eliminate duplicates Z: 33 26.212 2.118 0.730 0.405 0.875 0.344 CB 1.597 33 residues pruned to eliminate duplicates Z: 18 23.166 1.991 0.580 0.617 1.000 0.588 CB 1.600 18 residues pruned to eliminate duplicates Z: 16 17.364 1.908 1.043 0.862 0.933 0.533 CB 0.905 16 residues pruned to eliminate duplicates Z: 11 11.485 1.870 0.270 0.731 1.000 0.500 CB 1.243 11 residues pruned to eliminate duplicates Z: 83 68.227 2.278 0.762 0.665 0.951 0.598 CB 1.695 83 residues pruned to eliminate duplicates Z: 136 76.345 2.214 0.919 0.603 0.919 0.593 CB 1.526 136 residues pruned to eliminate duplicates Z: 17 33.591 2.091 0.988 0.909 1.000 0.750 CA 1.434 17 residues pruned to eliminate duplicates Z: 134 76.342 2.205 0.804 0.607 0.947 0.632 CB 1.587 131 residues pruned to eliminate duplicates Z: 16 17.489 2.227 0.681 0.512 0.800 0.400 CB 1.490 16 residues pruned to eliminate duplicates Z: 66 55.908 2.298 0.987 0.546 0.892 0.615 CB 1.628 66 residues pruned to eliminate duplicates Z: 12 13.646 1.697 1.215 0.758 0.818 0.636 CB 1.064 12 residues pruned to eliminate duplicates Z: 11 11.354 1.906 0.440 0.855 1.000 0.800 CB 0.965 11 residues pruned to eliminate duplicates Z: 10 13.343 1.824 0.435 0.825 0.889 0.667 CB 1.443 10 residues pruned to eliminate duplicates Z: 64 45.684 2.082 0.770 0.623 0.968 0.667 CB 1.435 64 residues pruned to eliminate duplicates Z: 77 49.348 2.101 0.877 0.599 0.882 0.632 CB 1.482 77 residues pruned to eliminate duplicates Z: 17 19.102 1.828 1.024 0.937 1.000 0.625 CB 0.898 17 residues pruned to eliminate duplicates Z: 10 12.641 1.754 0.706 0.811 0.889 0.778 CA 1.209 10 residues pruned to eliminate duplicates Z: 6 4.154 1.681 0.202 0.587 0.800 0.600 CB 1.057 Z: 22 17.472 2.053 0.515 0.453 0.857 0.429 CB 1.500 22 residues pruned to eliminate duplicates Z: 22 16.022 1.927 0.664 0.488 0.810 0.381 CB 1.363 22 residues pruned to eliminate duplicates Z: 10 14.005 1.708 0.731 0.820 0.889 0.667 CA 1.346 10 residues pruned to eliminate duplicates Z: 16 29.588 2.165 0.732 0.906 1.000 0.733 CA 1.449 16 residues pruned to eliminate duplicates Z: 15 16.162 1.988 0.364 0.761 0.929 0.643 CB 1.361 15 residues pruned to eliminate duplicates Z: 10 18.751 2.006 0.701 0.872 0.889 0.667 CB 1.502 10 residues pruned to eliminate duplicates Z: 9 18.149 2.188 0.824 0.710 0.875 0.875 CB 1.519 6 1.960 1.441 0.327 0.287 0.800 0.400 CB 0.727 ? Z: 11 4.012 1.714 -0.247 0.620 0.800 0.400 CB 1.097 11 residues pruned to eliminate duplicates Z: 60 53.174 2.274 0.848 0.568 0.949 0.678 CB 1.626 60 residues pruned to eliminate duplicates Z: 17 22.076 2.032 0.635 0.577 1.000 0.750 CB 1.542 17 residues pruned to eliminate duplicates Z: 10 13.252 1.628 1.210 0.866 0.778 0.556 CB 1.155 10 residues pruned to eliminate duplicates Z: 84 74.229 2.344 0.964 0.652 0.940 0.639 CB 1.635 84 residues pruned to eliminate duplicates Z: 9 20.347 2.212 0.472 0.836 1.000 0.875 CA 1.654 Z: 16 16.771 2.131 0.600 0.467 0.867 0.800 CB 1.515 16 residues pruned to eliminate duplicates Z: 24 29.743 2.275 0.892 0.598 0.870 0.522 CB 1.509 24 residues pruned to eliminate duplicates Z: 80 59.477 2.126 1.055 0.640 0.949 0.608 CB 1.415 80 residues pruned to eliminate duplicates Z: 13 16.061 2.091 0.875 0.448 0.917 0.333 CB 1.361 13 residues pruned to eliminate duplicates Z: 8 10.353 1.853 1.168 0.583 0.857 0.714 CB 1.050 8 residues pruned to eliminate duplicates Z: 18 12.650 1.933 0.666 0.454 0.706 0.588 CB 1.415 18 residues pruned to eliminate duplicates Z: 10 16.462 1.797 0.838 0.785 1.000 0.556 CB 1.293 10 residues pruned to eliminate duplicates Z: 14 17.338 2.014 0.424 0.924 1.000 1.000 CB 1.177 14 residues pruned to eliminate duplicates Z: 71 60.312 2.231 0.830 0.635 0.971 0.629 CB 1.602 71 residues pruned to eliminate duplicates Z: 13 9.255 1.997 0.328 0.478 0.833 0.667 CB 1.236 13 residues pruned to eliminate duplicates Z: 14 17.122 1.904 0.240 0.905 1.000 0.846 CB 1.432 14 residues pruned to eliminate duplicates Z: 49 25.672 1.975 0.626 0.407 0.896 0.542 CB 1.420 214 residues pruned to eliminate duplicates Z: 83 81.097 2.473 1.067 0.611 0.915 0.659 CB 1.723 83 residues pruned to eliminate duplicates Z: 11 19.071 1.911 0.679 0.911 1.000 0.800 CB 1.332 11 residues pruned to eliminate duplicates Z: 15 16.741 1.874 0.690 0.890 1.000 0.857 CB 1.017 Z: 113 69.614 2.310 0.901 0.540 0.929 0.589 CB 1.551 113 residues pruned to eliminate duplicates Z: 18 23.141 2.062 0.966 0.556 0.941 0.647 CB 1.393 18 residues pruned to eliminate duplicates Z: 22 11.590 1.921 0.379 0.395 0.857 0.381 CB 1.244 22 residues pruned to eliminate duplicates Z: 17 18.646 1.919 0.357 0.870 0.938 0.812 CB 1.394 17 residues pruned to eliminate duplicates Z: 82 70.256 2.295 0.915 0.652 0.914 0.630 CB 1.688 82 residues pruned to eliminate duplicates Z: 20 35.217 2.313 0.621 0.668 1.000 0.789 CB 1.845 Z: 46 52.619 2.270 0.891 0.647 0.956 0.533 CB 1.667 46 residues pruned to eliminate duplicates Z: 15 21.907 1.896 0.926 0.902 0.929 0.786 CB 1.231 15 residues pruned to eliminate duplicates Z: 59 62.305 2.448 1.063 0.581 0.897 0.517 CB 1.671 59 residues pruned to eliminate duplicates Z: 20 18.128 1.996 0.835 0.393 0.895 0.632 CB 1.421 Z: 74 41.778 2.166 0.749 0.461 0.918 0.521 CB 1.464 74 residues pruned to eliminate duplicates Z: 32 34.381 2.199 0.888 0.579 0.903 0.613 CB 1.526 32 residues pruned to eliminate duplicates Z: 16 19.749 2.154 0.532 0.478 0.933 0.533 CA 1.692 16 residues pruned to eliminate duplicates Z: 86 79.936 2.355 1.098 0.647 0.918 0.659 CB 1.667 86 residues pruned to eliminate duplicates Z: 16 16.354 1.993 1.160 0.434 0.867 0.533 CB 1.212 16 residues pruned to eliminate duplicates Z: 60 64.086 2.380 1.061 0.585 0.932 0.610 CB 1.682 20 residues pruned to eliminate duplicates Z: 8 6.686 1.919 -0.030 0.664 0.857 0.429 CB 1.362 7 residues pruned to eliminate duplicates Z: 33 42.765 2.332 0.805 0.593 0.969 0.562 CB 1.696 33 residues pruned to eliminate duplicates Z: 9 5.814 2.014 -0.158 0.541 0.875 0.750 CB 1.330 7 residues pruned to eliminate duplicates Z: 20 17.601 2.037 0.453 0.651 0.842 0.789 CB 1.408 20 residues pruned to eliminate duplicates Z: 9 9.328 1.538 0.618 0.861 1.000 0.750 CB 0.973 Z: 17 36.912 2.167 1.194 0.872 1.000 0.438 CB 1.414 17 residues pruned to eliminate duplicates Z: 11 38.597 2.630 0.810 0.892 1.000 0.400 CB 1.843 11 residues pruned to eliminate duplicates Z: 13 16.317 1.977 0.360 0.928 0.917 0.917 CB 1.338 13 residues pruned to eliminate duplicates Z: 25 39.451 2.272 1.024 0.643 0.958 0.458 CB 1.598 25 residues pruned to eliminate duplicates Z: 6 4.113 1.455 0.166 0.445 1.000 0.800 C 1.148 Z: 11 11.586 1.862 0.230 0.720 0.900 0.400 CB 1.457 11 residues pruned to eliminate duplicates Z: 15 27.347 2.122 0.677 0.903 0.929 0.714 CB 1.576 15 residues pruned to eliminate duplicates Z: 8 13.728 2.033 0.824 0.542 0.857 0.714 CA 1.567 3 residues pruned to eliminate duplicates Z: 137 81.434 2.211 0.916 0.636 0.926 0.618 CB 1.566 137 residues pruned to eliminate duplicates Z: 9 6.575 1.685 0.289 0.502 0.875 0.500 CB 1.221 Z: 87 86.504 2.428 1.016 0.624 0.965 0.651 CB 1.756 59 residues pruned to eliminate duplicates Z: 15 30.271 2.236 1.025 0.920 0.857 0.786 CA 1.468 15 residues pruned to eliminate duplicates Z: 13 10.034 1.816 0.459 0.703 0.667 0.250 CA 1.363 13 residues pruned to eliminate duplicates Z: 16 21.784 1.812 0.987 0.897 1.000 0.733 CB 1.118 16 residues pruned to eliminate duplicates Z: 31 40.466 2.263 0.770 0.576 0.967 0.533 CA 1.774 31 residues pruned to eliminate duplicates Z: 12 33.020 2.389 0.791 0.917 1.000 0.636 CB 1.642 12 residues pruned to eliminate duplicates Z: 8 3.156 1.766 -0.179 0.454 0.714 0.286 CB 1.208 7 residues pruned to eliminate duplicates Z: 10 13.073 1.594 0.775 0.762 0.889 0.556 N 1.373 10 residues pruned to eliminate duplicates Z: 16 22.590 2.133 0.448 0.899 1.000 0.867 CA 1.350 16 residues pruned to eliminate duplicates Z: 8 6.562 1.981 -0.326 0.827 1.000 0.714 CB 1.400 Z: 15 15.635 1.636 0.629 0.772 0.929 0.500 CA 1.328 15 residues pruned to eliminate duplicates Z: 81 63.803 2.169 0.977 0.645 0.963 0.650 CB 1.509 81 residues pruned to eliminate duplicates Z: 146 83.025 2.231 0.787 0.619 0.945 0.634 CB 1.636 146 residues pruned to eliminate duplicates Z: 104 58.547 2.143 0.754 0.563 0.951 0.641 CB 1.518 104 residues pruned to eliminate duplicates Z: 45 21.834 1.945 0.482 0.480 0.864 0.545 CB 1.349 45 residues pruned to eliminate duplicates Z: 13 27.771 2.291 0.802 0.912 0.917 0.667 CB 1.500 13 residues pruned to eliminate duplicates Z: 11 15.588 1.867 0.689 0.865 0.900 0.700 CB 1.272 11 residues pruned to eliminate duplicates Z: 17 53.335 2.415 1.476 0.926 1.000 0.375 CB 1.565 17 residues pruned to eliminate duplicates Z: 14 15.829 2.004 0.595 0.915 0.923 0.846 CB 1.051 14 residues pruned to eliminate duplicates Z: 18 25.497 1.952 0.741 0.910 0.941 0.824 CA 1.371 18 residues pruned to eliminate duplicates Z: 17 19.288 1.927 0.305 0.864 0.938 0.875 CA 1.501 17 residues pruned to eliminate duplicates Z: 15 21.649 1.880 0.704 0.864 1.000 0.786 CB 1.324 15 residues pruned to eliminate duplicates Z: 13 12.896 1.855 0.601 0.812 0.833 0.750 CB 1.146 13 residues pruned to eliminate duplicates Z: 9 22.188 2.136 0.704 0.915 1.000 0.875 CB 1.524 10 residues pruned to eliminate duplicates Z: 152 80.949 2.190 0.827 0.598 0.927 0.656 CB 1.617 152 residues pruned to eliminate duplicates Z: 13 21.055 2.007 0.562 0.901 1.000 0.917 CB 1.385 13 residues pruned to eliminate duplicates Z: 12 12.073 1.789 0.881 0.371 0.909 0.364 CB 1.366 12 residues pruned to eliminate duplicates Z: 9 21.746 2.143 0.708 0.922 1.000 0.875 CB 1.478 9 residues pruned to eliminate duplicates Z: 15 17.048 1.917 0.664 0.885 0.929 0.786 CB 1.111 15 residues pruned to eliminate duplicates Z: 151 82.780 2.214 0.968 0.605 0.940 0.653 CB 1.493 151 residues pruned to eliminate duplicates Z: 9 10.602 1.841 0.219 0.915 1.000 1.000 CB 1.180 Z: 89 86.878 2.422 1.142 0.618 0.932 0.614 CB 1.713 89 residues pruned to eliminate duplicates Z: 6 2.384 1.371 0.432 0.565 0.800 0.400 CA 0.637 Z: 13 22.054 2.230 0.429 0.809 0.833 0.667 CA 1.832 13 residues pruned to eliminate duplicates Z: 9 11.775 1.684 0.716 0.837 0.875 0.750 CB 1.232 Z: 16 47.280 2.338 1.553 0.911 0.933 0.667 CB 1.552 16 residues pruned to eliminate duplicates Z: 13 37.147 2.325 1.085 0.899 0.917 0.833 CA 1.725 13 residues pruned to eliminate duplicates Z: 21 10.576 1.605 0.383 0.545 0.900 0.400 CB 1.133 9 residues pruned to eliminate duplicates Z: 89 60.067 2.119 1.035 0.624 0.932 0.614 CB 1.417 89 residues pruned to eliminate duplicates Z: 10 15.211 1.680 0.993 0.816 1.000 0.889 CA 1.151 10 residues pruned to eliminate duplicates Z: 10 20.263 1.973 0.949 0.826 1.000 0.667 CB 1.325 10 residues pruned to eliminate duplicates Z: 14 18.441 2.003 0.785 0.923 1.000 0.769 CB 1.005 14 residues pruned to eliminate duplicates Z: 8 5.163 1.822 0.179 0.454 0.714 0.429 CB 1.333 10 residues pruned to eliminate duplicates Z: 7 5.694 1.404 0.789 0.609 0.833 0.667 CB 1.001 Z: 69 59.808 2.190 0.795 0.669 0.941 0.603 CB 1.677 69 residues pruned to eliminate duplicates Z: 10 9.800 1.709 0.920 0.513 0.889 0.444 CA 1.106 Z: 17 19.304 1.980 0.240 0.870 1.000 0.562 CB 1.435 17 residues pruned to eliminate duplicates Z: 6 7.599 1.630 0.670 0.849 1.000 0.400 CB 0.926 6 residues pruned to eliminate duplicates Z: 15 21.234 1.892 0.717 0.900 1.000 0.786 CB 1.247 15 residues pruned to eliminate duplicates Z: 108 72.077 2.203 1.031 0.631 0.925 0.626 CB 1.489 108 residues pruned to eliminate duplicates Z: 9 19.429 2.238 0.762 0.786 0.875 0.625 CA 1.548 Z: 8 8.599 1.572 0.369 0.841 1.000 0.571 CB 1.126 8 residues pruned to eliminate duplicates Z: 10 8.871 1.509 0.174 0.886 1.000 0.778 CA 1.204 10 residues pruned to eliminate duplicates Z: 10 17.865 1.954 0.669 0.900 1.000 0.667 CB 1.304 10 residues pruned to eliminate duplicates Z: 10 13.959 1.757 0.963 0.759 0.889 0.556 CA 1.205 9 residues pruned to eliminate duplicates Z: 6 5.421 1.616 0.990 0.437 1.000 0.400 CB 0.804 6 residues pruned to eliminate duplicates Z: 9 7.812 1.539 0.528 0.881 0.875 0.750 CB 0.972 9 residues pruned to eliminate duplicates Z: 26 19.805 1.979 0.594 0.577 0.840 0.640 CB 1.388 26 residues pruned to eliminate duplicates Z: 106 65.169 2.291 0.894 0.476 0.933 0.581 CB 1.609 106 residues pruned to eliminate duplicates Z: 84 67.762 2.357 0.871 0.653 0.892 0.590 CB 1.640 84 residues pruned to eliminate duplicates Z: 97 65.302 2.264 0.967 0.562 0.896 0.552 CB 1.573 100 residues pruned to eliminate duplicates Z: 16 30.671 2.074 0.906 0.940 1.000 0.667 CA 1.391 16 residues pruned to eliminate duplicates Z: 67 62.875 2.232 0.959 0.645 0.955 0.667 CB 1.620 67 residues pruned to eliminate duplicates Z: 54 27.217 1.959 0.517 0.492 0.906 0.585 CB 1.400 54 residues pruned to eliminate duplicates Z: 56 47.817 2.132 0.906 0.632 0.964 0.636 CB 1.454 56 residues pruned to eliminate duplicates Z: 7 2.624 1.597 0.115 0.481 0.833 0.500 CB 0.736 Z: 15 30.103 2.163 0.894 0.912 0.929 0.786 CB 1.498 15 residues pruned to eliminate duplicates Z: 34 44.044 2.266 0.995 0.636 0.909 0.697 CB 1.643 34 residues pruned to eliminate duplicates Z: 15 21.728 1.846 0.847 0.894 1.000 0.714 CB 1.222 15 residues pruned to eliminate duplicates Z: 8 3.524 1.597 -0.124 0.399 1.000 0.429 CB 1.059 Z: 11 18.319 1.849 0.782 0.890 0.900 0.900 CA 1.405 10 residues pruned to eliminate duplicates Z: 109 92.091 2.395 1.110 0.631 0.935 0.685 CB 1.658 109 residues pruned to eliminate duplicates Z: 33 50.777 2.273 1.087 0.676 1.000 0.656 CB 1.609 33 residues pruned to eliminate duplicates Z: 15 40.616 2.299 1.034 0.904 1.000 0.786 CA 1.653 15 residues pruned to eliminate duplicates Z: 15 22.500 1.919 0.906 0.922 0.929 0.571 CB 1.244 15 residues pruned to eliminate duplicates Z: 7 5.634 1.894 -0.254 0.480 1.000 0.667 N 1.661 7 residues pruned to eliminate duplicates Z: 84 54.556 2.091 0.939 0.618 0.928 0.614 CB 1.424 84 residues pruned to eliminate duplicates Z: 85 70.831 2.329 0.921 0.671 0.929 0.690 CB 1.589 85 residues pruned to eliminate duplicates Z: 82 53.506 2.107 0.981 0.597 0.901 0.568 CB 1.440 82 residues pruned to eliminate duplicates Z: 155 84.356 2.203 0.841 0.594 0.955 0.636 CB 1.604 155 residues pruned to eliminate duplicates Z: 29 39.408 2.232 1.087 0.588 0.929 0.607 CB 1.583 29 residues pruned to eliminate duplicates Z: 111 80.336 2.279 0.922 0.624 0.936 0.618 CB 1.662 111 residues pruned to eliminate duplicates Z: 31 23.660 2.130 0.739 0.469 0.900 0.667 CB 1.338 31 residues pruned to eliminate duplicates Z: 59 68.108 2.392 1.140 0.601 0.931 0.621 CB 1.704 59 residues pruned to eliminate duplicates Z: 22 21.037 1.974 1.053 0.354 0.905 0.476 CA 1.466 24 residues pruned to eliminate duplicates Z: 6 3.654 1.917 -0.339 0.609 0.800 0.800 CB 1.454 6 residues pruned to eliminate duplicates Z: 42 52.337 2.165 0.952 0.705 1.000 0.780 CA 1.605 42 residues pruned to eliminate duplicates Z: 14 20.844 1.995 0.962 0.937 1.000 0.769 CB 1.028 14 residues pruned to eliminate duplicates Z: 36 44.117 2.427 0.818 0.586 0.971 0.771 CB 1.602 36 residues pruned to eliminate duplicates Z: 107 78.656 2.270 0.958 0.635 0.906 0.613 CB 1.672 107 residues pruned to eliminate duplicates Z: 34 33.301 2.031 0.765 0.672 0.939 0.667 CA 1.469 34 residues pruned to eliminate duplicates Z: 8 7.556 1.552 1.101 0.539 0.714 0.571 CB 1.180 8 residues pruned to eliminate duplicates Z: 6 5.985 1.766 0.189 0.764 1.000 1.000 CB 1.009 6 residues pruned to eliminate duplicates Z: 24 19.552 2.114 0.680 0.493 0.870 0.696 CB 1.329 24 residues pruned to eliminate duplicates Z: 93 63.887 2.228 0.922 0.585 0.935 0.620 CB 1.534 59 residues pruned to eliminate duplicates Z: 18 7.798 1.750 0.294 0.265 0.824 0.529 CA 1.327 18 residues pruned to eliminate duplicates Z: 8 9.164 1.794 0.811 0.573 0.857 0.714 CB 1.159 8 residues pruned to eliminate duplicates Z: 26 31.214 2.140 1.052 0.520 0.920 0.720 CB 1.514 26 residues pruned to eliminate duplicates Z: 58 54.874 2.347 0.842 0.586 0.930 0.614 CB 1.665 58 residues pruned to eliminate duplicates Z: 61 65.504 2.367 0.985 0.638 0.933 0.733 CB 1.695 61 residues pruned to eliminate duplicates Z: 20 15.014 1.932 0.469 0.553 0.895 0.526 CB 1.287 20 residues pruned to eliminate duplicates Z: 12 24.557 2.168 0.867 0.652 0.909 0.636 CA 1.747 12 residues pruned to eliminate duplicates Z: 22 21.803 2.148 0.842 0.443 0.857 0.667 CB 1.489 22 residues pruned to eliminate duplicates Z: 13 18.728 2.024 0.545 0.925 1.000 0.917 CB 1.213 13 residues pruned to eliminate duplicates Z: 14 11.146 1.776 0.119 0.839 1.000 0.923 CB 1.162 14 residues pruned to eliminate duplicates Z: 8 7.020 1.720 0.075 0.856 1.000 0.714 CB 1.059 8 residues pruned to eliminate duplicates Z: 78 55.113 2.120 0.937 0.649 0.935 0.662 CB 1.423 78 residues pruned to eliminate duplicates Z: 10 7.392 1.726 0.096 0.798 1.000 0.556 CB 1.004 10 residues pruned to eliminate duplicates Z: 19 27.414 2.232 0.945 0.532 0.889 0.611 CA 1.622 19 residues pruned to eliminate duplicates Z: 72 55.749 2.126 0.886 0.644 0.958 0.620 CB 1.505 72 residues pruned to eliminate duplicates Z: 10 11.841 1.913 0.198 0.772 1.000 0.667 CB 1.354 10 residues pruned to eliminate duplicates Z: 115 82.747 2.396 0.992 0.553 0.921 0.658 CB 1.675 115 residues pruned to eliminate duplicates Z: 8 11.900 1.676 0.650 0.873 1.000 0.857 CB 1.185 8 residues pruned to eliminate duplicates Z: 8 8.146 1.726 0.129 0.732 0.857 0.714 C 1.497 Z: 15 35.764 2.212 1.013 0.936 1.000 0.714 CB 1.495 15 residues pruned to eliminate duplicates Z: 7 8.616 2.196 0.267 0.320 0.833 0.333 CB 1.849 7 residues pruned to eliminate duplicates Z: 14 14.752 2.004 0.599 0.515 0.923 0.615 CB 1.363 14 residues pruned to eliminate duplicates Z: 12 10.010 1.726 0.057 0.797 1.000 0.636 CB 1.276 12 residues pruned to eliminate duplicates Z: 13 12.525 1.721 0.338 0.756 1.000 0.333 CA 1.250 13 residues pruned to eliminate duplicates Z: 14 53.230 2.456 1.442 0.940 1.000 0.923 CB 1.708 14 residues pruned to eliminate duplicates Z: 25 59.663 2.569 1.228 0.688 1.000 0.792 CB 1.790 25 residues pruned to eliminate duplicates Z: 8 9.544 1.814 0.261 0.904 1.000 1.000 CB 1.123 8 residues pruned to eliminate duplicates Z: 7 7.455 1.475 0.489 0.891 1.000 0.833 CB 0.996 6 residues pruned to eliminate duplicates Z: 9 6.626 1.574 0.642 0.657 0.750 0.750 CB 1.045 9 residues pruned to eliminate duplicates Z: 18 28.086 2.082 1.101 0.548 1.000 0.765 CB 1.486 18 residues pruned to eliminate duplicates Z: 6 6.177 1.639 0.898 0.477 1.000 0.600 CB 0.908 Z: 13 15.200 1.971 0.364 0.680 0.917 0.750 CB 1.509 13 residues pruned to eliminate duplicates Z: 16 23.786 2.024 0.398 0.897 1.000 0.800 CB 1.553 16 residues pruned to eliminate duplicates Z: 15 31.899 2.078 1.057 0.896 0.929 0.429 CB 1.539 15 residues pruned to eliminate duplicates Z: 16 30.502 2.323 0.935 0.768 0.867 0.533 CA 1.595 16 residues pruned to eliminate duplicates Z: 7 6.459 1.808 -0.163 0.763 1.000 0.833 CB 1.380 7 residues pruned to eliminate duplicates Z: 10 6.803 1.667 0.520 0.496 0.667 0.556 CB 1.348 10 residues pruned to eliminate duplicates Z: 12 23.190 1.916 0.771 0.908 1.000 0.545 CA 1.463 12 residues pruned to eliminate duplicates Z: 16 19.945 2.015 0.866 0.489 0.933 0.800 CB 1.484 16 residues pruned to eliminate duplicates Z: 8 10.105 1.822 0.229 0.888 1.000 1.000 CB 1.228 8 residues pruned to eliminate duplicates Z: 8 16.188 1.878 0.756 0.884 1.000 0.714 CB 1.341 8 residues pruned to eliminate duplicates Z: 67 72.917 2.373 1.248 0.581 0.924 0.606 CB 1.684 67 residues pruned to eliminate duplicates Z: 17 18.664 1.767 0.615 0.874 1.000 0.688 CB 1.191 17 residues pruned to eliminate duplicates Z: 19 13.795 1.939 0.641 0.324 0.889 0.556 CA 1.396 19 residues pruned to eliminate duplicates Z: 6 10.713 2.023 0.526 0.669 1.000 0.200 CB 1.327 Z: 33 23.583 2.153 0.628 0.440 0.906 0.625 CB 1.396 33 residues pruned to eliminate duplicates Z: 76 69.791 2.205 0.994 0.670 0.947 0.680 CB 1.655 76 residues pruned to eliminate duplicates Z: 19 14.119 1.934 0.606 0.449 0.833 0.556 CB 1.355 19 residues pruned to eliminate duplicates Z: 25 14.963 1.961 0.421 0.464 0.833 0.542 CB 1.365 25 residues pruned to eliminate duplicates Z: 53 68.612 2.408 1.061 0.669 0.942 0.712 CB 1.740 53 residues pruned to eliminate duplicates Z: 9 11.951 2.006 0.653 0.442 1.000 0.625 CA 1.354 9 residues pruned to eliminate duplicates Z: 34 43.470 2.325 0.975 0.648 0.939 0.636 CB 1.529 34 residues pruned to eliminate duplicates Z: 6 4.109 1.982 -0.383 0.560 1.000 0.400 CB 1.417 Z: 6 8.554 1.893 0.414 0.811 0.800 0.400 CA 1.362 Z: 9 22.247 2.203 0.851 0.851 0.875 0.875 CB 1.632 9 residues pruned to eliminate duplicates Z: 7 10.594 1.668 0.400 0.862 1.000 0.833 CB 1.359 8 residues pruned to eliminate duplicates Z: 11 10.092 1.805 0.234 0.709 0.900 0.600 CB 1.316 11 residues pruned to eliminate duplicates Z: 17 43.648 2.298 1.133 0.899 0.938 0.625 CB 1.698 17 residues pruned to eliminate duplicates Z: 8 15.250 2.087 0.526 0.873 0.857 0.714 CA 1.538 8 residues pruned to eliminate duplicates Z: 117 85.015 2.281 0.968 0.633 0.931 0.621 CB 1.667 117 residues pruned to eliminate duplicates Z: 10 18.283 1.917 0.701 0.841 1.000 0.556 CA 1.394 10 residues pruned to eliminate duplicates Z: 14 15.980 1.981 0.442 0.816 0.846 0.769 CB 1.393 14 residues pruned to eliminate duplicates Z: 36 16.796 1.852 0.516 0.341 0.829 0.543 CB 1.451 36 residues pruned to eliminate duplicates Z: 21 16.989 2.037 0.824 0.362 0.850 0.500 CB 1.396 21 residues pruned to eliminate duplicates Z: 50 47.438 2.187 0.989 0.613 0.898 0.673 CB 1.559 50 residues pruned to eliminate duplicates Z: 91 64.637 2.208 0.910 0.617 0.956 0.667 CB 1.514 91 residues pruned to eliminate duplicates Z: 102 68.720 2.209 0.949 0.617 0.921 0.584 CB 1.544 102 residues pruned to eliminate duplicates Z: 16 20.532 1.853 0.705 0.899 1.000 0.733 CB 1.199 16 residues pruned to eliminate duplicates Z: 9 4.526 1.873 0.170 0.223 0.750 0.375 C 1.346 Z: 33 41.785 2.298 1.098 0.598 0.938 0.625 CB 1.489 33 residues pruned to eliminate duplicates Z: 21 42.048 2.508 1.145 0.723 0.900 0.400 CB 1.588 21 residues pruned to eliminate duplicates Z: 16 16.553 1.828 0.707 0.911 1.000 0.867 CB 0.971 16 residues pruned to eliminate duplicates Z: 49 43.402 2.184 0.817 0.625 0.979 0.646 CB 1.434 49 residues pruned to eliminate duplicates Z: 14 21.119 2.015 0.898 0.919 1.000 0.769 CB 1.079 14 residues pruned to eliminate duplicates Z: 14 25.149 1.916 1.163 0.925 1.000 0.923 CB 1.181 14 residues pruned to eliminate duplicates Z: 27 26.718 2.366 0.802 0.385 0.885 0.615 CB 1.569 27 residues pruned to eliminate duplicates Z: 57 38.949 1.972 0.874 0.650 0.911 0.607 CB 1.345 57 residues pruned to eliminate duplicates Z: 56 36.841 2.159 0.845 0.483 0.855 0.564 CB 1.485 56 residues pruned to eliminate duplicates Z: 70 54.005 2.179 0.845 0.628 0.942 0.594 CB 1.522 70 residues pruned to eliminate duplicates Z: 60 62.729 2.415 1.051 0.580 0.932 0.593 CB 1.638 60 residues pruned to eliminate duplicates Z: 7 2.250 1.719 0.351 0.148 0.667 0.500 CB 0.916 Z: 8 16.044 1.882 0.639 0.883 1.000 1.000 CA 1.422 8 residues pruned to eliminate duplicates Z: 19 16.070 1.956 0.814 0.485 0.889 0.667 CB 1.219 19 residues pruned to eliminate duplicates Z: 134 81.227 2.238 0.863 0.633 0.932 0.632 CB 1.599 134 residues pruned to eliminate duplicates Z: 22 19.569 2.171 0.603 0.512 0.952 0.667 CB 1.273 22 residues pruned to eliminate duplicates Z: 13 35.780 2.342 1.116 0.878 0.917 0.833 CA 1.650 13 residues pruned to eliminate duplicates Z: 71 67.274 2.332 1.025 0.577 0.943 0.614 CB 1.678 71 residues pruned to eliminate duplicates Z: 16 32.050 2.176 0.964 0.917 0.933 0.800 CA 1.464 16 residues pruned to eliminate duplicates Z: 7 3.925 2.067 0.239 0.369 0.833 0.667 CB 0.864 7 residues pruned to eliminate duplicates Z: 15 23.574 1.897 0.945 0.915 1.000 0.786 CB 1.207 15 residues pruned to eliminate duplicates Z: 85 63.893 2.130 1.021 0.654 0.964 0.643 CB 1.454 85 residues pruned to eliminate duplicates Z: 10 15.985 1.980 0.537 0.894 1.000 0.667 CB 1.255 10 residues pruned to eliminate duplicates Z: 8 3.957 1.613 -0.173 0.836 1.000 0.714 CB 0.839 8 residues pruned to eliminate duplicates Z: 132 89.454 2.312 0.956 0.613 0.939 0.634 CB 1.654 132 residues pruned to eliminate duplicates Z: 10 16.965 2.037 0.543 0.858 0.889 0.889 CB 1.490 10 residues pruned to eliminate duplicates Z: 20 19.008 2.220 0.701 0.524 0.842 0.579 CB 1.339 20 residues pruned to eliminate duplicates Z: 8 2.306 1.453 0.115 0.217 0.714 0.286 N 1.050 Z: 8 14.394 1.885 0.685 0.773 0.857 0.429 CA 1.570 8 residues pruned to eliminate duplicates Z: 6 2.350 1.345 0.551 0.425 0.600 0.600 CB 0.908 Z: 15 37.836 2.198 1.026 0.919 1.000 0.929 CB 1.600 15 residues pruned to eliminate duplicates Z: 69 60.234 2.235 0.751 0.666 0.941 0.632 CB 1.701 69 residues pruned to eliminate duplicates Z: 19 32.272 2.369 0.931 0.549 0.944 0.722 CA 1.679 19 residues pruned to eliminate duplicates Z: 17 22.018 1.937 0.488 0.879 1.000 0.625 CB 1.385 17 residues pruned to eliminate duplicates Z: 14 32.221 2.375 0.925 0.949 0.923 0.692 CB 1.461 14 residues pruned to eliminate duplicates Z: 18 30.596 2.153 0.957 0.612 0.941 0.824 CA 1.682 18 residues pruned to eliminate duplicates Z: 41 30.759 2.105 0.679 0.505 0.925 0.600 CB 1.480 41 residues pruned to eliminate duplicates Z: 6 4.669 1.465 0.802 0.494 0.800 0.600 CB 0.994 6 residues pruned to eliminate duplicates Z: 20 12.205 1.834 0.512 0.389 0.789 0.579 CB 1.439 20 residues pruned to eliminate duplicates Z: 9 7.705 1.491 0.217 0.859 0.875 0.500 CA 1.262 9 residues pruned to eliminate duplicates Z: 11 23.939 2.016 0.698 0.923 1.000 0.800 CB 1.554 11 residues pruned to eliminate duplicates Z: 16 20.281 1.855 0.701 0.905 1.000 0.733 CB 1.181 16 residues pruned to eliminate duplicates Z: 14 19.474 1.881 0.823 0.915 0.923 0.846 CB 1.206 14 residues pruned to eliminate duplicates Z: 13 18.083 2.022 0.478 0.787 1.000 0.833 CA 1.357 13 residues pruned to eliminate duplicates Z: 16 33.154 2.258 0.820 0.884 1.000 0.667 CA 1.505 16 residues pruned to eliminate duplicates Z: 8 2.353 1.423 -0.040 0.615 0.857 0.286 CB 0.681 Z: 149 82.385 2.277 0.787 0.594 0.912 0.642 CB 1.667 149 residues pruned to eliminate duplicates Z: 7 8.572 1.794 0.492 0.777 0.833 0.833 CB 1.229 7 residues pruned to eliminate duplicates Z: 72 61.119 2.259 0.958 0.655 0.901 0.718 CB 1.575 72 residues pruned to eliminate duplicates Z: 15 15.365 1.901 0.606 0.883 1.000 0.786 CB 0.973 15 residues pruned to eliminate duplicates Z: 14 17.610 1.916 0.596 0.850 0.923 0.615 CB 1.282 14 residues pruned to eliminate duplicates Z: 9 4.654 1.506 -0.295 0.839 1.000 0.750 CB 1.158 8 residues pruned to eliminate duplicates Z: 45 53.231 2.306 1.059 0.592 0.909 0.614 CB 1.703 45 residues pruned to eliminate duplicates Z: 14 20.685 1.930 0.941 0.926 0.923 0.692 CB 1.163 14 residues pruned to eliminate duplicates Z: 14 13.487 1.825 0.244 0.904 0.923 0.923 CB 1.271 14 residues pruned to eliminate duplicates Z: 12 6.938 1.917 0.435 0.200 0.818 0.545 CB 1.328 12 residues pruned to eliminate duplicates Z: 100 85.350 2.349 1.066 0.637 0.949 0.657 CB 1.638 100 residues pruned to eliminate duplicates Z: 6 5.644 2.077 -0.246 0.816 1.000 0.800 CB 1.225 6 residues pruned to eliminate duplicates Z: 15 31.212 2.228 0.907 0.930 0.929 0.929 CA 1.478 15 residues pruned to eliminate duplicates Z: 9 12.767 2.108 0.560 0.823 0.875 0.625 CA 1.185 9 residues pruned to eliminate duplicates Z: 26 16.224 2.099 0.774 0.432 0.760 0.560 CB 1.230 26 residues pruned to eliminate duplicates Z: 151 69.589 2.181 0.808 0.538 0.913 0.587 CB 1.519 157 residues pruned to eliminate duplicates Z: 10 14.721 2.025 0.716 0.772 0.889 0.889 CA 1.249 10 residues pruned to eliminate duplicates Z: 14 51.161 2.384 1.247 0.915 1.000 0.769 CA 1.872 Z: 51 38.253 2.090 0.685 0.607 0.900 0.540 CB 1.541 51 residues pruned to eliminate duplicates Z: 6 8.520 1.834 0.474 0.614 1.000 1.000 CB 1.265 6 residues pruned to eliminate duplicates Z: 15 44.352 2.397 1.032 0.939 1.000 0.857 CA 1.690 15 residues pruned to eliminate duplicates Z: 11 8.662 2.037 0.451 0.370 0.800 0.500 CB 1.332 11 residues pruned to eliminate duplicates Z: 11 18.602 2.097 0.695 0.674 1.000 0.700 CB 1.410 11 residues pruned to eliminate duplicates Z: 7 6.035 1.611 0.104 0.692 1.000 0.833 CA 1.162 Z: 113 75.015 2.389 0.939 0.509 0.884 0.562 CB 1.715 113 residues pruned to eliminate duplicates Z: 110 86.717 2.354 1.022 0.626 0.917 0.642 CB 1.690 110 residues pruned to eliminate duplicates Z: 7 7.363 1.860 0.054 0.727 0.833 0.500 O 1.501 7 residues pruned to eliminate duplicates Z: 30 32.986 2.311 0.780 0.564 0.897 0.586 CB 1.561 30 residues pruned to eliminate duplicates Z: 85 80.715 2.388 1.060 0.582 0.952 0.655 CB 1.738 85 residues pruned to eliminate duplicates Z: 59 60.380 2.409 0.993 0.586 0.931 0.603 CB 1.634 59 residues pruned to eliminate duplicates Z: 23 19.452 2.213 0.672 0.320 0.909 0.545 CA 1.504 23 residues pruned to eliminate duplicates Z: 12 8.942 1.712 0.169 0.733 0.909 0.545 CB 1.202 12 residues pruned to eliminate duplicates Z: 60 52.312 2.103 0.969 0.666 0.949 0.678 CB 1.487 60 residues pruned to eliminate duplicates Z: 65 36.915 2.128 0.678 0.472 0.875 0.609 CB 1.520 65 residues pruned to eliminate duplicates Z: 40 24.771 2.069 0.745 0.309 0.872 0.590 CB 1.557 40 residues pruned to eliminate duplicates Z: 7 6.915 1.810 0.116 0.675 0.833 0.667 C 1.428 7 residues pruned to eliminate duplicates Z: 13 32.842 2.427 0.861 0.886 1.000 0.917 CA 1.515 13 residues pruned to eliminate duplicates Z: 47 25.652 1.996 0.653 0.520 0.913 0.652 CB 1.231 47 residues pruned to eliminate duplicates Z: 36 43.050 2.332 1.059 0.584 0.886 0.714 CA 1.579 36 residues pruned to eliminate duplicates Z: 60 62.295 2.364 1.060 0.620 0.898 0.678 CB 1.655 60 residues pruned to eliminate duplicates Z: 16 41.943 2.278 1.094 0.931 0.933 0.800 CA 1.700 16 residues pruned to eliminate duplicates Z: 14 29.518 2.307 1.086 0.560 1.000 0.846 CB 1.604 14 residues pruned to eliminate duplicates Z: 121 78.417 2.249 0.837 0.626 0.942 0.608 CB 1.634 121 residues pruned to eliminate duplicates Z: 19 10.177 1.809 0.383 0.397 0.778 0.500 CB 1.374 7 residues pruned to eliminate duplicates Z: 56 59.166 2.341 0.914 0.592 0.945 0.709 CB 1.723 56 residues pruned to eliminate duplicates Z: 25 30.983 2.227 0.807 0.527 0.958 0.542 CB 1.597 25 residues pruned to eliminate duplicates Z: 19 17.086 1.905 0.394 0.808 1.000 0.889 CB 1.160 19 residues pruned to eliminate duplicates Z: 9 20.868 2.043 0.949 0.855 1.000 0.750 CB 1.367 Z: 24 24.782 2.215 0.741 0.453 0.913 0.435 CB 1.540 24 residues pruned to eliminate duplicates Z: 140 85.535 2.244 0.888 0.615 0.942 0.640 CB 1.629 140 residues pruned to eliminate duplicates Z: 21 21.683 2.119 1.068 0.504 0.850 0.600 CB 1.297 21 residues pruned to eliminate duplicates Z: 10 8.968 1.448 0.433 0.872 1.000 0.667 CB 1.050 10 residues pruned to eliminate duplicates Z: 70 38.589 2.011 0.813 0.574 0.928 0.623 CB 1.279 70 residues pruned to eliminate duplicates Z: 89 60.443 2.119 0.956 0.614 0.955 0.670 CB 1.462 89 residues pruned to eliminate duplicates Z: 24 14.653 1.914 0.667 0.293 0.870 0.522 CB 1.389 24 residues pruned to eliminate duplicates Z: 73 38.241 2.230 0.760 0.420 0.833 0.500 CB 1.498 73 residues pruned to eliminate duplicates Z: 11 23.568 2.106 0.958 0.890 0.900 0.800 CB 1.444 11 residues pruned to eliminate duplicates Z: 50 33.618 2.132 0.868 0.422 0.857 0.490 CB 1.526 50 residues pruned to eliminate duplicates Z: 16 14.434 1.986 0.698 0.495 0.800 0.600 CA 1.388 16 residues pruned to eliminate duplicates Z: 116 84.772 2.269 0.983 0.638 0.939 0.617 CB 1.644 116 residues pruned to eliminate duplicates Z: 8 3.417 1.495 0.344 0.315 0.714 0.571 O 1.105 8 residues pruned to eliminate duplicates Z: 9 11.373 1.858 0.304 0.914 1.000 0.750 CB 1.174 9 residues pruned to eliminate duplicates Z: 10 15.139 1.744 1.032 0.848 0.889 0.889 CA 1.188 10 residues pruned to eliminate duplicates Z: 7 6.327 1.515 0.550 0.568 0.833 0.667 CB 1.236 Z: 51 47.983 2.247 0.950 0.562 0.860 0.500 CB 1.696 51 residues pruned to eliminate duplicates Z: 10 16.713 2.081 0.418 0.823 1.000 0.556 CA 1.427 10 residues pruned to eliminate duplicates Z: 46 35.525 2.103 0.834 0.496 0.911 0.578 CB 1.513 46 residues pruned to eliminate duplicates Z: 44 33.211 2.067 0.683 0.631 0.930 0.535 CB 1.383 44 residues pruned to eliminate duplicates Z: 6 3.419 1.393 0.101 0.379 1.000 0.600 CB 1.134 6 residues pruned to eliminate duplicates Z: 8 15.539 2.157 0.466 0.787 1.000 0.571 CA 1.443 8 residues pruned to eliminate duplicates Z: 9 7.529 1.597 0.546 0.753 0.875 0.750 CB 0.984 9 residues pruned to eliminate duplicates Z: 52 52.286 2.326 0.899 0.579 0.922 0.627 CB 1.667 52 residues pruned to eliminate duplicates Z: 45 33.688 1.991 0.756 0.624 0.977 0.636 CB 1.323 45 residues pruned to eliminate duplicates Z: 87 71.560 2.273 0.910 0.638 0.942 0.628 CB 1.658 87 residues pruned to eliminate duplicates Z: 91 80.551 2.439 1.050 0.589 0.933 0.622 CB 1.670 91 residues pruned to eliminate duplicates Z: 14 15.359 1.988 0.575 0.879 0.923 0.846 CB 1.069 14 residues pruned to eliminate duplicates Z: 93 83.713 2.371 1.065 0.656 0.935 0.598 CB 1.650 93 residues pruned to eliminate duplicates Z: 24 11.210 1.836 0.743 0.322 0.739 0.391 CB 1.202 24 residues pruned to eliminate duplicates Z: 24 33.858 2.333 0.807 0.554 0.913 0.652 CB 1.740 24 residues pruned to eliminate duplicates Z: 73 39.055 1.995 0.927 0.598 0.875 0.597 CB 1.246 73 residues pruned to eliminate duplicates Z: 13 11.291 1.793 0.420 0.774 0.833 0.583 CA 1.206 13 residues pruned to eliminate duplicates Z: 14 20.812 2.071 1.175 0.493 0.923 0.769 CB 1.399 14 residues pruned to eliminate duplicates Z: 7 11.255 2.023 0.527 0.818 1.000 1.000 CB 1.128 7 residues pruned to eliminate duplicates Z: 112 84.495 2.297 1.071 0.634 0.937 0.604 CB 1.586 112 residues pruned to eliminate duplicates Z: 10 16.080 2.038 0.460 0.910 1.000 1.000 CB 1.278 10 residues pruned to eliminate duplicates Z: 34 33.533 2.184 0.637 0.559 0.939 0.545 CA 1.641 31 residues pruned to eliminate duplicates Z: 6 2.468 1.765 -0.124 0.523 1.000 0.600 CB 0.698 Z: 84 75.645 2.349 0.960 0.657 0.940 0.687 CB 1.659 84 residues pruned to eliminate duplicates Z: 56 61.063 2.400 1.004 0.621 0.909 0.709 CB 1.680 56 residues pruned to eliminate duplicates Z: 11 13.721 1.810 0.691 0.550 1.000 0.900 CB 1.350 11 residues pruned to eliminate duplicates Z: 6 8.285 1.871 0.212 0.773 1.000 0.800 CB 1.283 Z: 9 7.923 1.647 0.222 0.728 1.000 0.625 CB 1.133 9 residues pruned to eliminate duplicates Z: 101 81.005 2.351 0.979 0.641 0.930 0.630 CB 1.640 101 residues pruned to eliminate duplicates Z: 16 24.676 1.876 0.871 0.918 1.000 0.933 CB 1.281 16 residues pruned to eliminate duplicates Z: 9 5.161 1.637 0.091 0.734 0.750 0.500 CB 1.104 9 residues pruned to eliminate duplicates Z: 50 34.185 2.029 0.754 0.593 0.959 0.633 CB 1.309 50 residues pruned to eliminate duplicates Z: 10 7.800 1.720 0.466 0.888 1.000 1.000 CB 0.743 10 residues pruned to eliminate duplicates Z: 7 6.871 1.745 0.040 0.804 1.000 0.833 CB 1.186 7 residues pruned to eliminate duplicates Z: 35 40.084 2.268 0.778 0.552 0.912 0.529 CB 1.778 35 residues pruned to eliminate duplicates Z: 28 22.485 2.160 0.644 0.341 0.889 0.630 CB 1.629 28 residues pruned to eliminate duplicates Z: 12 17.273 2.005 0.639 0.592 0.909 0.545 CB 1.597 12 residues pruned to eliminate duplicates Z: 9 2.558 1.673 0.300 0.355 0.375 0.250 N 1.297 9 residues pruned to eliminate duplicates Z: 67 63.375 2.239 1.120 0.618 0.924 0.621 CB 1.591 67 residues pruned to eliminate duplicates Z: 35 17.009 1.953 0.603 0.351 0.853 0.500 CB 1.283 35 residues pruned to eliminate duplicates Z: 10 14.109 1.746 0.564 0.831 1.000 0.889 CA 1.294 10 residues pruned to eliminate duplicates Z: 6 9.976 2.017 0.385 0.422 1.000 1.000 C 1.732 6 residues pruned to eliminate duplicates Z: 6 4.951 1.446 0.430 0.686 1.000 0.400 C 0.903 Z: 10 17.066 2.004 0.592 0.866 1.000 1.000 CA 1.305 10 residues pruned to eliminate duplicates Z: 14 14.683 1.822 0.650 0.695 1.000 0.692 CB 1.134 14 residues pruned to eliminate duplicates Z: 62 56.404 2.239 1.048 0.594 0.934 0.541 CB 1.541 62 residues pruned to eliminate duplicates Z: 13 2.721 1.442 0.416 0.207 0.750 0.417 CB 0.725 Z: 22 38.775 2.305 0.998 0.675 0.857 0.524 CB 1.824 22 residues pruned to eliminate duplicates Z: 9 9.260 1.787 0.620 0.467 1.000 0.500 CA 1.170 9 residues pruned to eliminate duplicates Z: 10 10.017 1.716 0.297 0.906 1.000 0.667 CB 1.067 10 residues pruned to eliminate duplicates Z: 100 75.692 2.241 1.132 0.625 0.909 0.626 CB 1.557 100 residues pruned to eliminate duplicates Z: 15 24.747 1.919 0.927 0.893 1.000 0.714 CB 1.284 15 residues pruned to eliminate duplicates Z: 17 18.738 1.727 0.777 0.879 1.000 0.812 CA 1.106 17 residues pruned to eliminate duplicates Z: 25 21.687 2.152 1.008 0.496 0.833 0.417 CB 1.234 25 residues pruned to eliminate duplicates Z: 20 19.550 2.069 0.800 0.508 0.895 0.632 CB 1.335 20 residues pruned to eliminate duplicates Z: 9 5.083 1.495 0.401 0.443 0.875 0.625 CB 1.040 Z: 80 33.832 2.044 0.801 0.439 0.835 0.481 CB 1.318 80 residues pruned to eliminate duplicates Z: 9 7.316 1.694 0.376 0.487 0.875 0.500 CA 1.285 11 residues pruned to eliminate duplicates Z: 7 9.828 1.805 0.653 0.786 0.833 0.667 CA 1.254 7 residues pruned to eliminate duplicates Z: 11 8.387 1.475 0.245 0.778 1.000 0.700 CB 1.130 11 residues pruned to eliminate duplicates Z: 81 68.947 2.330 0.972 0.618 0.925 0.650 CB 1.623 81 residues pruned to eliminate duplicates Z: 57 37.210 2.146 0.849 0.513 0.929 0.625 CB 1.333 57 residues pruned to eliminate duplicates Z: 17 20.698 2.023 0.461 0.809 0.875 0.812 CA 1.529 17 residues pruned to eliminate duplicates Z: 12 15.242 1.807 1.047 0.845 0.909 0.636 CB 1.016 12 residues pruned to eliminate duplicates Z: 7 4.901 1.542 0.523 0.400 0.833 0.333 CB 1.136 Z: 73 63.320 2.185 0.937 0.649 0.958 0.694 CB 1.601 73 residues pruned to eliminate duplicates Z: 15 17.745 1.894 0.533 0.892 0.929 0.786 CB 1.263 15 residues pruned to eliminate duplicates Z: 42 35.724 2.263 0.871 0.520 0.805 0.561 CB 1.605 42 residues pruned to eliminate duplicates Z: 10 8.996 1.725 0.521 0.897 1.000 0.778 CB 0.818 9 residues pruned to eliminate duplicates Z: 18 15.062 1.948 0.699 0.427 0.824 0.529 CA 1.446 63 residues pruned to eliminate duplicates Z: 10 3.452 1.615 0.326 0.225 0.667 0.556 CA 1.112 Z: 22 33.402 2.310 0.824 0.615 0.952 0.619 CB 1.629 22 residues pruned to eliminate duplicates Z: 9 8.614 1.748 0.370 0.430 1.000 0.375 CB 1.367 15 residues pruned to eliminate duplicates Z: 10 12.050 1.770 0.668 0.817 0.889 0.778 CA 1.162 10 residues pruned to eliminate duplicates Z: 15 25.184 1.924 0.946 0.930 1.000 0.714 CB 1.258 15 residues pruned to eliminate duplicates Z: 84 64.921 2.251 0.851 0.629 0.916 0.639 CB 1.654 84 residues pruned to eliminate duplicates Z: 13 14.421 2.064 0.436 0.544 0.917 0.583 CB 1.469 13 residues pruned to eliminate duplicates Z: 52 46.732 2.168 0.849 0.611 0.941 0.627 CB 1.562 52 residues pruned to eliminate duplicates Z: 7 2.939 1.654 0.119 0.519 1.000 0.667 CB 0.637 6 residues pruned to eliminate duplicates Z: 17 20.695 1.926 0.372 0.903 1.000 0.688 CB 1.395 17 residues pruned to eliminate duplicates Z: 14 22.807 2.043 0.775 0.935 1.000 0.923 CB 1.215 14 residues pruned to eliminate duplicates Z: 16 32.329 2.053 0.981 0.892 0.933 0.533 CA 1.580 16 residues pruned to eliminate duplicates Z: 81 82.444 2.431 1.134 0.601 0.938 0.600 CB 1.720 81 residues pruned to eliminate duplicates Z: 14 5.453 1.805 0.067 0.492 0.923 0.615 CB 0.858 7 residues pruned to eliminate duplicates Z: 40 29.467 2.178 0.604 0.472 0.923 0.744 CB 1.506 40 residues pruned to eliminate duplicates Z: 27 27.165 2.229 0.942 0.416 0.923 0.538 CA 1.456 27 residues pruned to eliminate duplicates Z: 17 30.633 1.926 0.812 0.928 1.000 0.688 CB 1.536 17 residues pruned to eliminate duplicates Z: 8 8.239 1.894 0.046 0.755 0.857 0.714 CB 1.461 7 residues pruned to eliminate duplicates Z: 17 21.092 2.267 0.764 0.486 0.812 0.625 CB 1.646 17 residues pruned to eliminate duplicates Z: 81 60.284 2.342 1.032 0.535 0.850 0.625 CB 1.611 81 residues pruned to eliminate duplicates Z: 25 25.964 2.128 0.549 0.613 0.958 0.667 CA 1.508 25 residues pruned to eliminate duplicates Z: 8 11.853 1.611 0.883 0.816 1.000 0.714 CA 1.123 Z: 108 77.029 2.264 0.919 0.624 0.944 0.673 CB 1.616 108 residues pruned to eliminate duplicates Z: 8 7.823 1.809 0.529 0.199 1.000 0.571 CB 1.531 8 residues pruned to eliminate duplicates Z: 145 79.932 2.217 0.785 0.617 0.931 0.611 CB 1.619 145 residues pruned to eliminate duplicates Z: 17 29.648 2.019 1.107 0.895 0.938 0.750 CB 1.333 17 residues pruned to eliminate duplicates Z: 10 15.346 1.667 0.767 0.823 1.000 0.778 CA 1.313 10 residues pruned to eliminate duplicates Z: 15 4.512 1.726 0.085 0.361 0.714 0.429 CB 1.047 15 residues pruned to eliminate duplicates Z: 18 16.010 2.017 0.656 0.467 1.000 0.882 CB 1.201 18 residues pruned to eliminate duplicates Z: 14 34.730 2.281 1.028 0.887 0.923 0.769 CA 1.627 14 residues pruned to eliminate duplicates Z: 84 75.916 2.246 1.035 0.654 0.952 0.542 CB 1.660 84 residues pruned to eliminate duplicates Z: 8 6.858 1.912 0.240 0.328 1.000 0.714 CB 1.321 8 residues pruned to eliminate duplicates Z: 20 10.142 1.752 0.416 0.403 0.842 0.316 CB 1.233 20 residues pruned to eliminate duplicates Z: 16 18.397 2.107 0.668 0.507 0.933 0.733 CB 1.438 16 residues pruned to eliminate duplicates Z: 79 57.125 2.268 0.825 0.580 0.910 0.615 CB 1.589 79 residues pruned to eliminate duplicates Z: 10 5.522 1.319 0.901 0.358 0.889 0.444 CB 0.963 Z: 60 38.387 2.160 0.701 0.507 0.881 0.644 CB 1.532 60 residues pruned to eliminate duplicates Z: 18 10.778 1.645 0.258 0.498 0.882 0.647 CA 1.434 18 residues pruned to eliminate duplicates Z: 12 6.591 1.604 0.480 0.447 0.818 0.636 CB 1.080 11 residues pruned to eliminate duplicates Z: 7 2.840 1.487 0.010 0.557 1.000 0.667 CB 0.730 Z: 100 55.813 2.098 0.745 0.542 0.949 0.586 CB 1.548 100 residues pruned to eliminate duplicates Z: 7 3.280 1.911 0.127 0.248 0.667 0.500 CA 1.246 7 residues pruned to eliminate duplicates Z: 9 6.168 1.635 1.130 0.416 0.750 0.500 CB 0.912 6 residues pruned to eliminate duplicates Z: 49 36.484 2.024 0.835 0.585 0.958 0.500 CB 1.363 49 residues pruned to eliminate duplicates Z: 15 6.089 1.476 0.335 0.325 0.857 0.643 CB 1.168 15 residues pruned to eliminate duplicates Z: 22 32.699 2.284 0.791 0.613 0.952 0.619 CB 1.646 22 residues pruned to eliminate duplicates Z: 33 28.634 2.173 0.541 0.551 0.875 0.625 CB 1.644 33 residues pruned to eliminate duplicates Z: 13 23.065 1.992 0.950 0.919 1.000 0.833 CB 1.208 13 residues pruned to eliminate duplicates Z: 158 83.073 2.200 0.963 0.580 0.924 0.599 CB 1.538 158 residues pruned to eliminate duplicates Z: 88 72.182 2.229 0.964 0.670 0.943 0.644 CB 1.603 88 residues pruned to eliminate duplicates Z: 61 55.298 2.225 0.869 0.647 0.933 0.683 CB 1.603 61 residues pruned to eliminate duplicates Z: 114 71.056 2.171 0.964 0.622 0.947 0.628 CB 1.476 114 residues pruned to eliminate duplicates Z: 14 17.367 1.987 0.641 0.883 1.000 0.846 CB 1.068 14 residues pruned to eliminate duplicates Z: 9 4.291 1.613 0.409 0.192 0.875 0.375 N 1.102 16 residues pruned to eliminate duplicates Z: 9 13.300 1.863 0.859 0.766 0.875 0.500 CB 1.225 9 residues pruned to eliminate duplicates Z: 14 18.533 1.969 0.689 0.910 1.000 0.846 CB 1.096 14 residues pruned to eliminate duplicates Z: 8 9.203 1.770 0.312 0.893 1.000 1.000 CB 1.076 8 residues pruned to eliminate duplicates Z: 15 9.292 1.900 0.424 0.312 0.857 0.429 CB 1.319 15 residues pruned to eliminate duplicates Z: 10 8.535 1.747 0.113 0.903 1.000 0.889 CB 1.043 10 residues pruned to eliminate duplicates Z: 11 3.293 1.657 0.001 0.385 0.700 0.500 CB 1.013 Z: 14 21.784 2.225 0.757 0.565 0.923 0.538 CA 1.572 13 residues pruned to eliminate duplicates Z: 51 46.240 2.345 0.902 0.499 0.900 0.560 CB 1.631 51 residues pruned to eliminate duplicates Z: 156 81.511 2.200 0.790 0.590 0.955 0.606 CB 1.596 154 residues pruned to eliminate duplicates Z: 6 2.239 1.490 0.643 0.504 0.600 0.600 CB 0.679 Z: 13 17.548 2.176 0.826 0.489 0.917 0.500 CB 1.406 13 residues pruned to eliminate duplicates Z: 14 26.678 2.189 0.918 0.858 0.846 0.692 CB 1.534 14 residues pruned to eliminate duplicates Z: 14 41.259 2.441 1.216 0.928 0.923 0.692 CA 1.605 14 residues pruned to eliminate duplicates Z: 15 17.836 1.893 0.793 0.853 0.929 0.786 CB 1.118 15 residues pruned to eliminate duplicates Z: 60 35.412 2.028 0.727 0.581 0.915 0.576 CB 1.329 60 residues pruned to eliminate duplicates Z: 20 18.132 2.068 0.490 0.482 0.947 0.579 CB 1.451 20 residues pruned to eliminate duplicates Z: 7 5.055 1.674 0.478 0.715 0.833 0.500 CB 0.824 7 residues pruned to eliminate duplicates Z: 24 15.866 1.997 0.516 0.491 0.826 0.565 CB 1.335 24 residues pruned to eliminate duplicates Z: 46 38.680 2.157 0.787 0.645 0.933 0.622 CB 1.400 46 residues pruned to eliminate duplicates Z: 15 10.768 2.029 0.573 0.413 0.929 0.357 CB 1.064 15 residues pruned to eliminate duplicates Z: 79 59.178 2.142 0.984 0.647 0.923 0.641 CB 1.490 79 residues pruned to eliminate duplicates Z: 7 4.366 1.778 0.083 0.397 0.833 0.500 CB 1.239 5 residues pruned to eliminate duplicates Z: 33 22.512 1.985 0.482 0.519 0.938 0.656 CB 1.416 33 residues pruned to eliminate duplicates Z: 52 53.061 2.297 0.921 0.603 0.961 0.647 CB 1.588 52 residues pruned to eliminate duplicates 8 1.096 1.426 0.013 0.278 0.429 0.286 N 0.861 ? Z: 15 13.113 1.969 0.254 0.878 1.000 0.857 CB 1.030 15 residues pruned to eliminate duplicates Z: 130 66.676 2.127 0.838 0.563 0.922 0.581 CB 1.532 130 residues pruned to eliminate duplicates Z: 8 3.464 1.560 0.241 0.335 0.857 0.429 CB 0.945 Z: 7 3.038 1.697 -0.371 0.550 0.833 0.500 N 1.327 7 residues pruned to eliminate duplicates Z: 8 3.165 1.490 0.080 0.369 0.714 0.571 C 1.197 Z: 46 56.764 2.387 1.052 0.605 0.911 0.600 CB 1.716 46 residues pruned to eliminate duplicates Z: 12 14.868 2.216 0.458 0.568 0.909 0.636 CA 1.429 12 residues pruned to eliminate duplicates Z: 14 29.991 2.118 0.792 0.924 1.000 1.000 CB 1.538 14 residues pruned to eliminate duplicates Z: 9 9.369 1.725 0.368 0.847 1.000 0.625 CB 1.042 9 residues pruned to eliminate duplicates Z: 15 15.704 1.850 0.404 0.854 1.000 0.857 CA 1.194 15 residues pruned to eliminate duplicates Z: 7 6.302 1.631 0.141 0.750 0.833 0.833 CB 1.327 7 residues pruned to eliminate duplicates 6 1.765 0.972 0.032 0.660 1.000 0.800 N 0.678 ? Z: 10 7.163 1.653 0.148 0.462 1.000 0.444 CA 1.307 10 residues pruned to eliminate duplicates Z: 33 38.112 2.266 0.828 0.616 0.938 0.656 CB 1.555 33 residues pruned to eliminate duplicates Z: 13 18.126 1.877 0.612 0.889 0.917 0.833 CB 1.359 13 residues pruned to eliminate duplicates Z: 71 56.662 2.209 0.863 0.627 0.957 0.600 CB 1.526 71 residues pruned to eliminate duplicates Z: 13 11.208 1.992 0.677 0.299 0.833 0.417 CA 1.456 13 residues pruned to eliminate duplicates Z: 12 6.193 1.610 0.312 0.747 0.818 0.636 CB 0.867 7 1.546 1.375 -0.016 0.614 0.833 0.667 CB 0.503 ? Z: 12 8.934 1.653 0.598 0.574 0.727 0.545 CB 1.305 20 residues pruned to eliminate duplicates Z: 28 17.457 2.031 0.555 0.395 0.926 0.333 CB 1.283 28 residues pruned to eliminate duplicates Z: 7 9.818 1.744 0.549 0.825 0.833 0.500 CB 1.344 7 residues pruned to eliminate duplicates Z: 28 32.887 2.266 0.969 0.565 0.852 0.667 CB 1.564 28 residues pruned to eliminate duplicates Z: 16 16.194 1.954 0.717 0.509 0.800 0.600 CB 1.544 16 residues pruned to eliminate duplicates Z: 15 22.424 1.896 0.821 0.884 1.000 0.714 CB 1.254 15 residues pruned to eliminate duplicates Z: 14 21.219 2.023 0.793 0.934 1.000 0.846 CB 1.131 14 residues pruned to eliminate duplicates Z: 6 2.084 1.325 -0.017 0.300 1.000 0.400 C 0.895 Z: 18 8.268 1.637 0.408 0.479 0.824 0.529 CB 1.079 10 residues pruned to eliminate duplicates Z: 9 10.061 2.049 0.332 0.810 0.875 0.625 CB 1.138 9 residues pruned to eliminate duplicates Z: 32 45.208 2.238 0.991 0.706 0.968 0.742 CB 1.562 32 residues pruned to eliminate duplicates Z: 8 7.943 1.652 0.544 0.650 0.857 0.429 C 1.194 8 residues pruned to eliminate duplicates Z: 15 19.414 2.171 0.877 0.562 0.857 0.643 CB 1.399 15 residues pruned to eliminate duplicates Z: 9 3.265 1.673 0.188 0.305 0.750 0.500 CB 0.962 Z: 124 81.797 2.274 0.982 0.614 0.927 0.610 CB 1.584 124 residues pruned to eliminate duplicates Z: 20 13.198 2.018 0.425 0.428 0.842 0.474 CB 1.348 20 residues pruned to eliminate duplicates Z: 9 4.022 1.619 0.482 0.299 0.625 0.250 CB 1.187 Z: 8 4.054 1.477 0.612 0.218 0.857 0.429 CB 1.045 8 residues pruned to eliminate duplicates Z: 8 4.972 1.868 -0.375 0.858 1.000 1.000 CB 1.185 7 residues pruned to eliminate duplicates Z: 16 11.017 1.930 0.348 0.553 0.867 0.667 CB 1.198 16 residues pruned to eliminate duplicates Z: 27 48.937 2.449 1.247 0.581 0.923 0.615 CB 1.747 27 residues pruned to eliminate duplicates Z: 15 12.052 1.881 0.302 0.595 0.857 0.500 N 1.402 15 residues pruned to eliminate duplicates Z: 9 6.089 1.702 0.481 0.737 1.000 0.625 CB 0.690 Z: 10 14.624 1.970 0.718 0.864 0.889 0.778 CB 1.188 10 residues pruned to eliminate duplicates Z: 21 21.625 1.987 0.767 0.698 0.950 0.700 CB 1.211 21 residues pruned to eliminate duplicates Z: 59 54.110 2.309 0.884 0.598 0.931 0.655 CB 1.598 59 residues pruned to eliminate duplicates Z: 32 37.562 2.232 0.735 0.721 0.871 0.677 CA 1.638 32 residues pruned to eliminate duplicates Z: 50 54.198 2.152 0.939 0.673 1.000 0.592 CB 1.582 50 residues pruned to eliminate duplicates Z: 126 90.886 2.293 1.092 0.653 0.920 0.624 CB 1.598 126 residues pruned to eliminate duplicates Z: 11 15.225 1.915 0.875 0.790 0.800 0.700 CB 1.299 11 residues pruned to eliminate duplicates Z: 6 2.822 1.226 1.055 0.520 1.000 0.400 C 0.491 Z: 17 28.914 2.150 1.186 0.696 0.875 0.750 CB 1.470 17 residues pruned to eliminate duplicates Z: 15 22.714 1.900 0.807 0.885 1.000 0.857 CB 1.276 15 residues pruned to eliminate duplicates Z: 16 21.896 2.073 0.554 0.548 1.000 0.467 CA 1.675 16 residues pruned to eliminate duplicates Z: 15 19.899 1.964 0.892 0.692 0.857 0.643 CB 1.402 15 residues pruned to eliminate duplicates Z: 7 4.607 1.432 0.884 0.451 0.667 0.667 CB 1.100 8 residues pruned to eliminate duplicates Z: 7 3.255 1.467 0.059 0.452 1.000 0.667 CB 0.898 Z: 27 25.795 2.174 0.718 0.441 0.923 0.538 CA 1.559 27 residues pruned to eliminate duplicates Z: 15 7.480 1.626 0.046 0.430 0.929 0.286 CB 1.361 13 residues pruned to eliminate duplicates Z: 44 36.365 2.220 0.882 0.567 0.814 0.605 CB 1.528 44 residues pruned to eliminate duplicates 6 1.888 1.506 0.208 0.416 0.600 0.400 CB 0.844 ? Z: 27 38.181 2.243 1.128 0.556 0.923 0.462 CB 1.610 27 residues pruned to eliminate duplicates Z: 85 66.303 2.242 0.883 0.633 0.929 0.571 CB 1.628 85 residues pruned to eliminate duplicates Z: 10 5.934 1.571 -0.050 0.660 0.889 0.556 N 1.285 Z: 8 10.524 1.963 0.708 0.816 0.857 0.857 CA 1.052 8 residues pruned to eliminate duplicates Z: 95 68.073 2.228 0.942 0.594 0.915 0.564 CB 1.622 95 residues pruned to eliminate duplicates Z: 7 2.674 1.379 0.045 0.401 1.000 0.667 C 0.840 Z: 16 28.397 2.179 1.241 0.559 0.933 0.733 CB 1.519 16 residues pruned to eliminate duplicates Z: 7 9.547 1.785 0.385 0.877 1.000 0.667 CB 1.145 8 residues pruned to eliminate duplicates Z: 10 27.315 2.367 0.691 0.876 1.000 0.778 CB 1.652 10 residues pruned to eliminate duplicates Z: 6 2.817 1.573 0.165 0.205 0.800 0.400 N 1.219 6 residues pruned to eliminate duplicates Z: 6 4.410 1.842 0.127 0.466 0.800 0.200 CB 1.229 22 residues pruned to eliminate duplicates Z: 8 5.114 1.760 0.071 0.591 0.857 0.571 CB 1.097 Z: 22 28.819 2.278 1.083 0.573 0.810 0.571 CB 1.526 22 residues pruned to eliminate duplicates Z: 16 29.424 2.233 0.922 0.926 0.933 0.600 CB 1.330 16 residues pruned to eliminate duplicates Z: 16 32.314 2.295 1.024 0.837 0.800 0.467 CA 1.679 16 residues pruned to eliminate duplicates Z: 30 34.874 2.127 0.826 0.712 0.931 0.690 CB 1.478 30 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 9 19.599 2.150 0.325 0.914 1.000 0.750 CB 1.720 10 residues pruned to eliminate duplicates Z: 10 15.515 1.977 0.708 0.878 0.778 0.556 CB 1.429 10 residues pruned to eliminate duplicates Z: 11 16.580 1.935 0.592 0.895 0.900 0.600 CB 1.356 11 residues pruned to eliminate duplicates Z: 17 16.018 2.061 0.440 0.449 0.938 0.438 CB 1.516 17 residues pruned to eliminate duplicates Z: 18 18.210 1.996 0.593 0.550 0.882 0.647 CB 1.500 22 residues pruned to eliminate duplicates Z: 9 27.324 2.180 0.884 0.913 1.000 0.875 CB 1.665 9 residues pruned to eliminate duplicates Z: 22 21.943 1.948 0.662 0.581 0.905 0.524 CB 1.513 39 residues pruned to eliminate duplicates Z: 11 23.184 2.133 0.696 0.745 1.000 0.800 CB 1.629 11 residues pruned to eliminate duplicates Z: 14 17.929 1.904 0.509 0.682 1.000 0.615 CB 1.464 13 residues pruned to eliminate duplicates Z: 8 5.242 1.577 0.112 0.557 0.857 0.714 C 1.246 Z: 6 4.215 1.801 0.135 0.376 0.800 0.600 CA 1.315 6 residues pruned to eliminate duplicates Z: 8 4.079 1.613 0.411 0.352 0.714 0.571 CB 1.113 5 residues pruned to eliminate duplicates Z: 9 8.053 1.545 0.165 0.839 1.000 0.750 N 1.182 9 residues pruned to eliminate duplicates Z: 10 8.787 1.495 0.627 0.854 1.000 0.444 CB 0.890 10 residues pruned to eliminate duplicates Z: 9 6.670 1.581 0.397 0.765 0.875 0.750 CB 0.964 9 residues pruned to eliminate duplicates Z: 9 8.351 1.611 0.562 0.767 0.875 0.500 CB 1.059 9 residues pruned to eliminate duplicates Z: 10 9.524 1.562 0.720 0.669 0.889 0.444 CB 1.137 10 residues pruned to eliminate duplicates Z: 9 12.160 1.613 0.572 0.867 1.000 0.750 CB 1.240 9 residues pruned to eliminate duplicates Z: 7 4.070 1.747 0.848 0.215 0.500 0.333 CA 1.438 7 residues pruned to eliminate duplicates Z: 134 85.763 2.255 1.054 0.612 0.932 0.647 CB 1.549 134 residues pruned to eliminate duplicates Z: 8 7.689 1.824 1.129 0.232 0.714 0.286 C 1.433 8 residues pruned to eliminate duplicates Z: 11 5.835 1.782 1.333 0.245 0.600 0.300 CB 0.993 11 residues pruned to eliminate duplicates Z: 80 46.281 2.175 0.807 0.457 0.924 0.544 CB 1.498 80 residues pruned to eliminate duplicates Z: 74 44.111 2.178 0.754 0.462 0.932 0.562 CB 1.508 74 residues pruned to eliminate duplicates Z: 29 19.368 1.962 0.608 0.487 0.893 0.429 CB 1.316 29 residues pruned to eliminate duplicates Z: 58 33.299 2.050 0.666 0.464 0.877 0.596 CB 1.527 58 residues pruned to eliminate duplicates Z: 59 39.385 2.140 0.725 0.496 0.897 0.569 CB 1.569 59 residues pruned to eliminate duplicates Z: 111 51.394 2.209 0.658 0.505 0.873 0.555 CB 1.526 111 residues pruned to eliminate duplicates Z: 106 60.644 2.255 0.860 0.492 0.895 0.590 CB 1.590 106 residues pruned to eliminate duplicates Z: 62 39.599 2.119 0.763 0.488 0.934 0.639 CB 1.470 62 residues pruned to eliminate duplicates Z: 71 42.404 2.150 0.701 0.481 0.914 0.614 CB 1.546 71 residues pruned to eliminate duplicates Z: 35 19.818 1.985 0.677 0.407 0.824 0.441 CB 1.366 35 residues pruned to eliminate duplicates Z: 30 23.946 2.078 0.786 0.337 0.966 0.586 CB 1.482 30 residues pruned to eliminate duplicates Z: 63 43.807 2.136 0.752 0.532 0.952 0.581 CB 1.515 63 residues pruned to eliminate duplicates Z: 165 74.644 2.262 0.784 0.532 0.878 0.567 CB 1.595 165 residues pruned to eliminate duplicates Z: 71 33.270 2.046 0.626 0.438 0.914 0.429 CB 1.393 71 residues pruned to eliminate duplicates Z: 31 24.450 2.094 0.856 0.333 0.900 0.533 CB 1.533 31 residues pruned to eliminate duplicates Z: 64 44.482 2.135 0.774 0.492 0.968 0.651 CB 1.541 64 residues pruned to eliminate duplicates Z: 33 24.037 2.059 0.812 0.310 0.938 0.531 CB 1.500 33 residues pruned to eliminate duplicates Z: 20 11.954 1.962 0.606 0.284 0.842 0.474 CA 1.318 20 residues pruned to eliminate duplicates Z: 64 36.437 2.090 0.747 0.511 0.905 0.571 CB 1.374 64 residues pruned to eliminate duplicates Z: 39 27.054 2.161 0.668 0.399 0.895 0.553 CA 1.514 39 residues pruned to eliminate duplicates Z: 60 38.435 2.091 0.684 0.486 0.932 0.610 CB 1.547 60 residues pruned to eliminate duplicates Z: 16 15.801 2.190 0.859 0.254 0.867 0.467 CB 1.534 16 residues pruned to eliminate duplicates Z: 30 22.283 2.080 0.678 0.350 0.931 0.586 CB 1.498 30 residues pruned to eliminate duplicates Z: 75 45.276 2.165 0.807 0.470 0.919 0.608 CB 1.509 75 residues pruned to eliminate duplicates Z: 146 81.976 2.268 0.877 0.537 0.945 0.662 CB 1.631 146 residues pruned to eliminate duplicates Z: 9 11.867 2.126 0.684 0.354 0.875 0.500 CB 1.567 9 residues pruned to eliminate duplicates Z: 82 64.991 2.338 0.829 0.585 0.926 0.642 CB 1.681 82 residues pruned to eliminate duplicates Z: 91 66.484 2.333 0.843 0.537 0.922 0.589 CB 1.704 91 residues pruned to eliminate duplicates Z: 110 68.221 2.284 0.841 0.533 0.917 0.624 CB 1.640 110 residues pruned to eliminate duplicates Z: 79 65.663 2.356 0.807 0.581 0.923 0.628 CB 1.750 79 residues pruned to eliminate duplicates Z: 135 77.779 2.245 0.866 0.615 0.933 0.619 CB 1.542 135 residues pruned to eliminate duplicates Z: 55 50.023 2.277 0.880 0.615 0.907 0.630 CB 1.571 55 residues pruned to eliminate duplicates Z: 57 51.360 2.327 0.790 0.611 0.946 0.643 CB 1.567 57 residues pruned to eliminate duplicates Z: 74 70.017 2.353 0.921 0.613 0.945 0.644 CB 1.725 74 residues pruned to eliminate duplicates Z: 145 75.322 2.205 0.885 0.607 0.903 0.632 CB 1.512 145 residues pruned to eliminate duplicates Z: 145 63.572 2.193 0.741 0.518 0.903 0.590 CB 1.510 145 residues pruned to eliminate duplicates Z: 133 75.061 2.233 0.870 0.592 0.924 0.598 CB 1.550 133 residues pruned to eliminate duplicates Z: 128 77.888 2.246 0.870 0.621 0.937 0.567 CB 1.567 128 residues pruned to eliminate duplicates Z: 132 64.305 2.214 0.793 0.529 0.916 0.618 CB 1.501 132 residues pruned to eliminate duplicates Z: 106 65.926 2.279 0.799 0.530 0.914 0.638 CB 1.667 106 residues pruned to eliminate duplicates Z: 111 63.640 2.226 0.756 0.517 0.964 0.582 CB 1.585 111 residues pruned to eliminate duplicates Z: 81 65.492 2.364 0.861 0.587 0.900 0.650 CB 1.702 81 residues pruned to eliminate duplicates Z: 141 79.290 2.233 0.856 0.625 0.929 0.614 CB 1.548 141 residues pruned to eliminate duplicates Z: 25 34.403 2.294 0.744 0.604 0.917 0.708 CA 1.734 25 residues pruned to eliminate duplicates Z: 28 29.613 2.199 0.729 0.568 0.926 0.593 CB 1.516 28 residues pruned to eliminate duplicates Z: 104 63.468 2.287 0.773 0.525 0.932 0.612 CB 1.615 104 residues pruned to eliminate duplicates Z: 103 73.346 2.269 0.958 0.582 0.922 0.676 CB 1.639 103 residues pruned to eliminate duplicates Z: 134 79.971 2.238 0.929 0.611 0.925 0.632 CB 1.564 134 residues pruned to eliminate duplicates Z: 84 72.680 2.373 0.960 0.607 0.928 0.614 CB 1.670 84 residues pruned to eliminate duplicates Z: 53 63.508 2.424 1.001 0.612 0.923 0.615 CB 1.768 53 residues pruned to eliminate duplicates Z: 78 73.212 2.351 0.985 0.593 0.935 0.571 CB 1.749 78 residues pruned to eliminate duplicates Z: 111 64.086 2.210 0.932 0.569 0.900 0.545 CB 1.488 111 residues pruned to eliminate duplicates Z: 137 79.666 2.272 0.882 0.558 0.934 0.618 CB 1.617 137 residues pruned to eliminate duplicates Z: 80 67.997 2.347 1.014 0.603 0.873 0.620 CB 1.680 80 residues pruned to eliminate duplicates Z: 104 69.943 2.200 0.951 0.629 0.922 0.641 CB 1.543 104 residues pruned to eliminate duplicates Z: 56 56.785 2.374 0.949 0.555 0.945 0.636 CB 1.658 56 residues pruned to eliminate duplicates Z: 129 77.533 2.233 0.947 0.629 0.906 0.633 CB 1.541 129 residues pruned to eliminate duplicates Z: 140 79.357 2.231 0.896 0.606 0.914 0.604 CB 1.575 140 residues pruned to eliminate duplicates Z: 87 73.917 2.355 0.949 0.578 0.953 0.593 CB 1.690 87 residues pruned to eliminate duplicates Z: 53 62.197 2.423 0.982 0.612 0.923 0.654 CB 1.750 53 residues pruned to eliminate duplicates Z: 54 64.742 2.382 1.099 0.597 0.925 0.698 CB 1.754 54 residues pruned to eliminate duplicates Z: 29 40.824 2.269 1.024 0.557 0.929 0.536 CA 1.712 29 residues pruned to eliminate duplicates Z: 142 76.865 2.263 0.915 0.541 0.894 0.589 CB 1.607 142 residues pruned to eliminate duplicates Z: 200 86.306 2.209 0.867 0.551 0.925 0.583 CB 1.527 200 residues pruned to eliminate duplicates Z: 65 65.386 2.334 1.027 0.609 0.938 0.688 CB 1.661 65 residues pruned to eliminate duplicates Z: 64 70.518 2.362 1.058 0.634 0.937 0.651 CB 1.722 64 residues pruned to eliminate duplicates Z: 53 64.099 2.411 1.043 0.615 0.962 0.615 CB 1.683 53 residues pruned to eliminate duplicates Z: 88 77.175 2.337 1.031 0.618 0.954 0.644 CB 1.634 88 residues pruned to eliminate duplicates Z: 115 75.120 2.267 0.916 0.549 0.947 0.649 CB 1.630 115 residues pruned to eliminate duplicates Z: 57 53.821 2.325 0.880 0.611 0.929 0.661 CB 1.596 57 residues pruned to eliminate duplicates Z: 54 64.478 2.398 1.016 0.596 0.943 0.642 CB 1.772 54 residues pruned to eliminate duplicates Z: 78 67.574 2.353 1.017 0.581 0.896 0.636 CB 1.675 78 residues pruned to eliminate duplicates Z: 33 49.288 2.386 1.101 0.629 0.938 0.594 CB 1.642 33 residues pruned to eliminate duplicates Z: 80 71.583 2.373 0.989 0.586 0.911 0.658 CB 1.724 80 residues pruned to eliminate duplicates Z: 88 63.691 2.293 0.952 0.569 0.908 0.586 CB 1.571 88 residues pruned to eliminate duplicates Z: 62 73.270 2.379 1.080 0.651 0.951 0.738 CB 1.732 62 residues pruned to eliminate duplicates Z: 75 70.596 2.285 1.102 0.626 0.946 0.622 CB 1.604 75 residues pruned to eliminate duplicates Z: 105 73.263 2.226 0.984 0.616 0.942 0.663 CB 1.546 105 residues pruned to eliminate duplicates Z: 36 46.484 2.301 0.979 0.615 1.000 0.686 CB 1.547 36 residues pruned to eliminate duplicates Z: 51 50.873 2.308 1.117 0.549 0.900 0.480 CB 1.560 51 residues pruned to eliminate duplicates Z: 88 75.385 2.331 1.010 0.605 0.954 0.632 CB 1.637 88 residues pruned to eliminate duplicates Z: 61 68.595 2.366 1.119 0.611 0.950 0.650 CB 1.674 61 residues pruned to eliminate duplicates Z: 60 68.971 2.373 1.166 0.616 0.915 0.661 CB 1.710 60 residues pruned to eliminate duplicates Z: 53 66.812 2.415 1.088 0.612 0.942 0.577 CB 1.752 53 residues pruned to eliminate duplicates Z: 26 45.629 2.429 1.044 0.632 0.880 0.720 CB 1.845 26 residues pruned to eliminate duplicates Z: 33 45.115 2.278 0.981 0.617 0.906 0.625 CB 1.746 33 residues pruned to eliminate duplicates Z: 83 62.588 2.232 0.781 0.601 0.939 0.610 CB 1.682 83 residues pruned to eliminate duplicates Z: 89 76.903 2.317 1.020 0.612 0.943 0.591 CB 1.670 89 residues pruned to eliminate duplicates Z: 38 52.347 2.273 1.129 0.698 0.919 0.649 CB 1.616 38 residues pruned to eliminate duplicates Z: 101 74.229 2.256 0.994 0.603 0.940 0.590 CB 1.592 101 residues pruned to eliminate duplicates Z: 28 45.357 2.310 1.030 0.613 0.926 0.556 CB 1.807 28 residues pruned to eliminate duplicates Z: 83 63.497 2.169 1.043 0.641 0.939 0.610 CB 1.477 83 residues pruned to eliminate duplicates Z: 27 46.453 2.387 1.048 0.632 0.923 0.692 CB 1.784 27 residues pruned to eliminate duplicates Z: 56 65.669 2.351 1.064 0.613 0.964 0.527 CB 1.701 56 residues pruned to eliminate duplicates Z: 54 64.784 2.382 1.150 0.635 0.925 0.566 CB 1.656 54 residues pruned to eliminate duplicates Z: 28 44.887 2.320 1.160 0.600 0.889 0.556 CA 1.763 28 residues pruned to eliminate duplicates Z: 44 41.083 2.158 0.963 0.535 0.860 0.605 CB 1.660 44 residues pruned to eliminate duplicates Z: 51 41.603 2.074 0.896 0.594 0.920 0.640 CB 1.486 51 residues pruned to eliminate duplicates Z: 83 60.118 2.156 0.903 0.652 0.963 0.549 CB 1.458 83 residues pruned to eliminate duplicates Z: 32 46.773 2.313 1.099 0.643 0.871 0.548 CB 1.738 32 residues pruned to eliminate duplicates Z: 32 38.847 2.257 0.907 0.577 0.871 0.452 CA 1.729 32 residues pruned to eliminate duplicates Z: 25 45.019 2.352 1.070 0.617 0.917 0.625 CB 1.842 25 residues pruned to eliminate duplicates Z: 56 43.718 2.205 0.832 0.509 0.891 0.564 CB 1.623 56 residues pruned to eliminate duplicates Z: 42 40.308 2.233 0.863 0.539 0.878 0.585 CB 1.659 42 residues pruned to eliminate duplicates Z: 48 31.200 2.207 0.755 0.444 0.809 0.404 CB 1.539 48 residues pruned to eliminate duplicates Z: 46 35.750 2.242 0.750 0.512 0.867 0.556 CB 1.548 30 residues pruned to eliminate duplicates Z: 11 19.931 2.357 0.572 0.733 0.900 0.700 CB 1.533 11 residues pruned to eliminate duplicates Z: 26 19.322 2.156 0.577 0.373 0.840 0.400 CA 1.550 26 residues pruned to eliminate duplicates Z: 19 13.824 2.050 0.458 0.405 0.833 0.444 CB 1.445 19 residues pruned to eliminate duplicates Z: 23 17.361 2.003 0.606 0.386 0.909 0.545 CB 1.429 23 residues pruned to eliminate duplicates Z: 25 22.446 2.137 0.718 0.464 0.833 0.583 CB 1.553 25 residues pruned to eliminate duplicates Z: 21 17.737 2.155 0.600 0.407 0.900 0.550 CB 1.409 21 residues pruned to eliminate duplicates Z: 15 18.667 2.185 0.694 0.498 0.857 0.500 CA 1.576 15 residues pruned to eliminate duplicates Z: 16 19.564 2.242 0.688 0.457 0.867 0.467 CA 1.609 16 residues pruned to eliminate duplicates Z: 18 17.262 2.155 0.582 0.460 0.824 0.647 CA 1.554 18 residues pruned to eliminate duplicates Z: 22 13.784 2.073 0.501 0.358 0.810 0.333 CB 1.392 22 residues pruned to eliminate duplicates Z: 23 16.219 2.191 0.445 0.329 0.773 0.318 CB 1.706 23 residues pruned to eliminate duplicates Z: 17 16.559 2.128 0.594 0.413 0.875 0.375 CA 1.528 17 residues pruned to eliminate duplicates Z: 192 96.120 2.344 0.877 0.538 0.901 0.560 CB 1.691 192 residues pruned to eliminate duplicates Z: 59 38.535 2.162 0.706 0.507 0.897 0.586 CB 1.520 59 residues pruned to eliminate duplicates Z: 82 46.264 2.230 0.780 0.453 0.852 0.605 CB 1.595 82 residues pruned to eliminate duplicates Z: 37 21.341 2.111 0.708 0.410 0.778 0.556 CB 1.393 37 residues pruned to eliminate duplicates Z: 154 85.287 2.379 0.829 0.529 0.908 0.608 CB 1.695 154 residues pruned to eliminate duplicates Z: 45 30.646 2.149 0.476 0.536 0.886 0.568 CB 1.587 45 residues pruned to eliminate duplicates Z: 32 23.867 2.182 0.657 0.447 0.839 0.613 CB 1.493 32 residues pruned to eliminate duplicates Z: 32 24.461 2.185 0.676 0.410 0.871 0.516 CB 1.514 32 residues pruned to eliminate duplicates Z: 59 32.312 2.189 0.573 0.444 0.845 0.552 CB 1.544 59 residues pruned to eliminate duplicates Z: 31 25.799 2.213 0.663 0.473 0.867 0.567 CB 1.518 31 residues pruned to eliminate duplicates Z: 30 29.354 2.239 0.848 0.435 0.931 0.724 CB 1.513 30 residues pruned to eliminate duplicates Z: 72 36.942 2.139 0.741 0.421 0.845 0.549 CB 1.513 72 residues pruned to eliminate duplicates Z: 22 19.416 2.167 0.738 0.529 0.810 0.619 CB 1.351 22 residues pruned to eliminate duplicates Z: 8 17.216 2.407 0.733 0.859 0.714 0.429 CB 1.607 8 residues pruned to eliminate duplicates Z: 202 88.764 2.210 0.825 0.565 0.950 0.617 CB 1.534 202 residues pruned to eliminate duplicates Z: 76 43.063 2.185 0.629 0.489 0.907 0.600 CB 1.558 76 residues pruned to eliminate duplicates Z: 24 17.505 2.099 0.764 0.393 0.826 0.391 CB 1.337 24 residues pruned to eliminate duplicates Z: 25 15.265 2.170 0.536 0.365 0.750 0.375 CB 1.440 25 residues pruned to eliminate duplicates Z: 20 20.900 2.199 0.603 0.467 0.842 0.474 CB 1.670 20 residues pruned to eliminate duplicates Z: 73 32.626 2.064 0.574 0.419 0.833 0.542 CB 1.547 73 residues pruned to eliminate duplicates Z: 21 20.213 2.172 0.606 0.476 0.850 0.400 CB 1.562 21 residues pruned to eliminate duplicates Z: 33 24.411 2.156 0.823 0.431 0.812 0.656 CB 1.451 33 residues pruned to eliminate duplicates Z: 30 26.588 2.201 0.773 0.487 0.931 0.586 CB 1.377 30 residues pruned to eliminate duplicates Z: 32 28.564 2.191 0.810 0.476 0.903 0.645 CB 1.468 32 residues pruned to eliminate duplicates Z: 74 47.507 2.163 0.815 0.504 0.932 0.589 CB 1.514 74 residues pruned to eliminate duplicates Z: 32 27.278 2.224 0.782 0.459 0.871 0.613 CB 1.479 32 residues pruned to eliminate duplicates Z: 89 44.441 2.208 0.665 0.458 0.864 0.614 CB 1.558 89 residues pruned to eliminate duplicates Z: 59 39.255 2.128 0.703 0.555 0.897 0.603 CB 1.503 59 residues pruned to eliminate duplicates Z: 33 25.053 2.160 0.721 0.446 0.906 0.656 CB 1.390 33 residues pruned to eliminate duplicates Z: 42 30.633 2.126 0.465 0.587 0.927 0.634 CB 1.525 42 residues pruned to eliminate duplicates Z: 64 37.696 2.078 0.699 0.553 0.889 0.603 CB 1.437 64 residues pruned to eliminate duplicates Z: 85 51.289 2.178 0.683 0.515 0.940 0.631 CB 1.600 85 residues pruned to eliminate duplicates Z: 76 39.626 2.131 0.578 0.502 0.893 0.560 CB 1.521 76 residues pruned to eliminate duplicates Z: 37 24.032 2.038 0.425 0.530 0.917 0.694 CB 1.460 37 residues pruned to eliminate duplicates Z: 58 35.634 2.014 0.677 0.541 0.912 0.614 CB 1.472 58 residues pruned to eliminate duplicates Z: 197 100.069 2.357 0.850 0.585 0.918 0.668 CB 1.645 197 residues pruned to eliminate duplicates Z: 40 31.689 2.146 0.561 0.603 0.897 0.769 CB 1.530 40 residues pruned to eliminate duplicates Z: 43 33.606 2.114 0.553 0.567 0.976 0.667 CB 1.516 43 residues pruned to eliminate duplicates Z: 76 43.100 2.144 0.773 0.494 0.907 0.627 CB 1.453 76 residues pruned to eliminate duplicates Z: 60 39.193 2.184 0.681 0.495 0.915 0.627 CB 1.526 60 residues pruned to eliminate duplicates Z: 148 71.359 2.249 0.731 0.541 0.925 0.599 CB 1.569 148 residues pruned to eliminate duplicates Z: 46 33.191 2.173 0.702 0.574 0.889 0.600 CB 1.402 46 residues pruned to eliminate duplicates Z: 73 43.952 2.140 0.744 0.479 0.944 0.597 CB 1.501 73 residues pruned to eliminate duplicates Z: 74 41.513 2.126 0.760 0.481 0.918 0.562 CB 1.442 74 residues pruned to eliminate duplicates Z: 45 34.307 2.170 0.677 0.577 0.932 0.659 CB 1.416 45 residues pruned to eliminate duplicates Z: 125 81.228 2.407 0.931 0.545 0.887 0.581 CB 1.694 125 residues pruned to eliminate duplicates Z: 91 53.541 2.201 0.754 0.527 0.911 0.533 CB 1.563 91 residues pruned to eliminate duplicates Z: 137 83.673 2.384 0.879 0.546 0.904 0.588 CB 1.694 137 residues pruned to eliminate duplicates Z: 27 21.106 2.220 0.866 0.266 0.769 0.577 CA 1.696 27 residues pruned to eliminate duplicates Z: 82 46.360 2.209 0.841 0.508 0.889 0.531 CB 1.414 82 residues pruned to eliminate duplicates Z: 39 25.046 2.013 0.826 0.515 0.868 0.526 CB 1.255 39 residues pruned to eliminate duplicates Z: 111 78.473 2.439 0.963 0.518 0.882 0.618 CB 1.741 111 residues pruned to eliminate duplicates Z: 61 34.805 2.152 0.785 0.445 0.900 0.533 CB 1.376 61 residues pruned to eliminate duplicates Z: 51 40.510 2.302 0.712 0.470 0.920 0.620 CA 1.628 51 residues pruned to eliminate duplicates Z: 33 20.425 2.147 0.663 0.297 0.812 0.562 CA 1.562 33 residues pruned to eliminate duplicates Z: 86 63.579 2.379 0.950 0.484 0.894 0.635 CB 1.689 86 residues pruned to eliminate duplicates Z: 198 101.166 2.324 0.976 0.577 0.909 0.604 CB 1.604 198 residues pruned to eliminate duplicates Z: 23 18.333 2.083 0.706 0.341 0.864 0.545 CA 1.515 23 residues pruned to eliminate duplicates Z: 115 82.973 2.410 0.977 0.526 0.912 0.614 CB 1.743 115 residues pruned to eliminate duplicates Z: 24 17.560 2.120 0.656 0.296 0.826 0.391 CA 1.586 24 residues pruned to eliminate duplicates Z: 162 95.845 2.394 0.962 0.564 0.888 0.609 CB 1.701 162 residues pruned to eliminate duplicates Z: 20 17.644 2.232 0.757 0.255 0.842 0.474 CA 1.624 20 residues pruned to eliminate duplicates Z: 158 80.301 2.295 0.927 0.532 0.879 0.567 CB 1.598 158 residues pruned to eliminate duplicates Z: 155 92.438 2.361 0.884 0.570 0.922 0.649 CB 1.697 155 residues pruned to eliminate duplicates Z: 12 9.879 2.232 0.495 0.231 0.909 0.545 CA 1.344 12 residues pruned to eliminate duplicates Z: 28 28.871 2.331 0.852 0.433 0.852 0.556 CB 1.619 28 residues pruned to eliminate duplicates Z: 98 76.478 2.424 0.958 0.544 0.887 0.567 CB 1.766 98 residues pruned to eliminate duplicates Z: 78 39.544 2.115 0.792 0.471 0.909 0.558 CB 1.347 78 residues pruned to eliminate duplicates Z: 148 83.980 2.329 0.918 0.546 0.932 0.605 CB 1.590 148 residues pruned to eliminate duplicates Z: 14 10.167 2.186 0.614 0.212 0.692 0.615 CB 1.621 14 residues pruned to eliminate duplicates Z: 86 68.594 2.375 0.993 0.507 0.929 0.635 CB 1.678 86 residues pruned to eliminate duplicates Z: 86 77.214 2.471 0.984 0.569 0.882 0.600 CB 1.811 86 residues pruned to eliminate duplicates Z: 112 84.193 2.430 1.026 0.535 0.901 0.622 CB 1.740 112 residues pruned to eliminate duplicates Z: 95 82.123 2.430 0.981 0.572 0.936 0.660 CB 1.754 95 residues pruned to eliminate duplicates Z: 145 98.312 2.385 0.986 0.607 0.938 0.660 CB 1.667 145 residues pruned to eliminate duplicates Z: 26 30.773 2.362 0.902 0.530 0.880 0.640 CA 1.512 26 residues pruned to eliminate duplicates Z: 36 39.412 2.319 0.877 0.506 0.943 0.657 CA 1.614 36 residues pruned to eliminate duplicates Z: 85 81.407 2.482 0.960 0.595 0.940 0.655 CB 1.773 85 residues pruned to eliminate duplicates Z: 87 84.248 2.464 1.031 0.602 0.942 0.674 CB 1.749 87 residues pruned to eliminate duplicates Z: 85 84.153 2.482 1.015 0.608 0.940 0.643 CB 1.762 85 residues pruned to eliminate duplicates Z: 116 83.196 2.424 0.966 0.536 0.904 0.626 CB 1.737 116 residues pruned to eliminate duplicates Z: 147 95.227 2.386 0.927 0.603 0.938 0.644 CB 1.656 147 residues pruned to eliminate duplicates Z: 87 80.453 2.474 1.015 0.608 0.907 0.674 CB 1.732 87 residues pruned to eliminate duplicates Z: 191 103.457 2.334 0.964 0.591 0.937 0.637 CB 1.602 191 residues pruned to eliminate duplicates Z: 69 65.708 2.453 1.008 0.534 0.926 0.632 CB 1.689 69 residues pruned to eliminate duplicates Z: 32 28.568 2.201 0.827 0.473 0.871 0.387 CA 1.505 32 residues pruned to eliminate duplicates Z: 88 79.267 2.455 1.031 0.574 0.897 0.644 CB 1.770 88 residues pruned to eliminate duplicates Z: 182 100.939 2.349 0.954 0.591 0.928 0.624 CB 1.614 182 residues pruned to eliminate duplicates Z: 60 63.260 2.446 1.052 0.570 0.915 0.661 CB 1.676 60 residues pruned to eliminate duplicates Z: 86 82.150 2.460 1.107 0.603 0.906 0.659 CB 1.721 86 residues pruned to eliminate duplicates Z: 199 92.892 2.287 0.933 0.555 0.899 0.576 CB 1.574 199 residues pruned to eliminate duplicates Z: 137 102.205 2.415 1.031 0.632 0.934 0.632 CB 1.690 137 residues pruned to eliminate duplicates Z: 87 80.995 2.427 1.039 0.581 0.930 0.558 CB 1.756 87 residues pruned to eliminate duplicates Z: 142 95.464 2.394 0.949 0.620 0.908 0.574 CB 1.694 142 residues pruned to eliminate duplicates Z: 117 85.980 2.406 1.066 0.522 0.931 0.629 CB 1.687 117 residues pruned to eliminate duplicates Z: 96 83.856 2.461 1.025 0.581 0.926 0.663 CB 1.725 96 residues pruned to eliminate duplicates Z: 101 71.563 2.372 0.949 0.499 0.910 0.560 CB 1.703 101 residues pruned to eliminate duplicates Z: 95 75.476 2.397 0.999 0.552 0.894 0.596 CB 1.728 95 residues pruned to eliminate duplicates Z: 115 81.605 2.431 0.948 0.549 0.895 0.623 CB 1.720 115 residues pruned to eliminate duplicates Z: 113 67.434 2.270 0.932 0.511 0.929 0.598 CB 1.547 113 residues pruned to eliminate duplicates Z: 108 84.094 2.379 0.983 0.611 0.925 0.664 CB 1.676 108 residues pruned to eliminate duplicates Z: 88 80.077 2.459 1.036 0.599 0.908 0.586 CB 1.719 88 residues pruned to eliminate duplicates Z: 61 56.456 2.443 0.908 0.545 0.867 0.533 CB 1.727 61 residues pruned to eliminate duplicates Z: 28 33.194 2.298 0.999 0.524 0.889 0.593 CB 1.528 28 residues pruned to eliminate duplicates Z: 88 82.297 2.457 0.990 0.593 0.943 0.644 CB 1.751 88 residues pruned to eliminate duplicates Z: 33 32.851 2.204 1.015 0.469 0.875 0.562 CB 1.543 33 residues pruned to eliminate duplicates Z: 60 64.335 2.450 1.050 0.575 0.949 0.559 CB 1.634 60 residues pruned to eliminate duplicates Z: 28 33.752 2.318 1.041 0.516 0.852 0.593 CB 1.587 28 residues pruned to eliminate duplicates Z: 29 33.347 2.264 0.964 0.533 0.929 0.607 CB 1.477 29 residues pruned to eliminate duplicates Z: 141 86.442 2.336 0.925 0.560 0.929 0.600 CB 1.650 141 residues pruned to eliminate duplicates Z: 127 93.355 2.379 0.974 0.619 0.937 0.595 CB 1.689 127 residues pruned to eliminate duplicates Z: 28 33.228 2.298 1.058 0.461 0.926 0.519 CB 1.520 28 residues pruned to eliminate duplicates Z: 35 56.339 2.456 1.230 0.595 0.941 0.618 CB 1.712 35 residues pruned to eliminate duplicates Z: 86 91.519 2.495 1.127 0.620 0.953 0.624 CB 1.752 86 residues pruned to eliminate duplicates Z: 27 36.917 2.246 1.281 0.543 0.846 0.615 CB 1.602 27 residues pruned to eliminate duplicates Z: 31 33.866 2.216 1.188 0.491 0.867 0.633 CB 1.484 31 residues pruned to eliminate duplicates Z: 27 39.175 2.343 1.324 0.553 0.885 0.500 CB 1.515 27 residues pruned to eliminate duplicates Z: 85 88.497 2.487 1.117 0.608 0.952 0.643 CB 1.738 85 residues pruned to eliminate duplicates Z: 114 68.438 2.312 0.949 0.525 0.929 0.549 CB 1.500 114 residues pruned to eliminate duplicates Z: 36 58.972 2.485 1.203 0.592 0.971 0.571 CB 1.717 36 residues pruned to eliminate duplicates Z: 92 82.828 2.436 1.028 0.587 0.934 0.505 CB 1.732 92 residues pruned to eliminate duplicates Z: 116 92.714 2.411 1.009 0.656 0.913 0.617 CB 1.691 116 residues pruned to eliminate duplicates Z: 88 79.434 2.430 1.035 0.569 0.931 0.609 CB 1.730 88 residues pruned to eliminate duplicates Z: 85 85.445 2.479 1.092 0.599 0.940 0.667 CB 1.739 85 residues pruned to eliminate duplicates Z: 90 83.817 2.454 1.114 0.593 0.921 0.618 CB 1.701 90 residues pruned to eliminate duplicates Z: 141 101.409 2.400 1.012 0.609 0.950 0.593 CB 1.684 141 residues pruned to eliminate duplicates Z: 81 64.126 2.312 0.889 0.593 0.913 0.575 CB 1.646 81 residues pruned to eliminate duplicates Z: 32 42.199 2.429 0.895 0.602 0.871 0.613 CA 1.715 32 residues pruned to eliminate duplicates Z: 81 63.335 2.336 0.838 0.580 0.938 0.600 CB 1.629 81 residues pruned to eliminate duplicates Z: 34 42.810 2.382 0.938 0.594 0.879 0.455 CB 1.680 34 residues pruned to eliminate duplicates Z: 30 44.289 2.447 1.135 0.575 0.897 0.586 CB 1.633 30 residues pruned to eliminate duplicates Z: 30 48.792 2.457 1.159 0.614 0.897 0.724 CB 1.711 30 residues pruned to eliminate duplicates Z: 29 45.991 2.455 1.091 0.608 0.893 0.714 CB 1.713 29 residues pruned to eliminate duplicates Z: 81 77.875 2.423 1.111 0.614 0.925 0.663 CB 1.651 81 residues pruned to eliminate duplicates Z: 33 50.846 2.417 0.986 0.601 0.938 0.500 CB 1.815 33 residues pruned to eliminate duplicates Z: 30 45.345 2.428 1.020 0.609 0.931 0.621 CB 1.663 30 residues pruned to eliminate duplicates Z: 39 50.636 2.424 1.105 0.583 0.921 0.605 CB 1.614 39 residues pruned to eliminate duplicates Z: 32 53.997 2.496 1.099 0.646 0.903 0.677 CB 1.787 32 residues pruned to eliminate duplicates Z: 84 70.501 2.362 0.859 0.653 0.940 0.614 CB 1.626 84 residues pruned to eliminate duplicates Z: 31 55.200 2.466 1.115 0.679 0.933 0.667 CB 1.756 31 residues pruned to eliminate duplicates Z: 76 68.259 2.339 0.907 0.635 0.920 0.600 CB 1.692 76 residues pruned to eliminate duplicates Z: 71 64.507 2.335 0.912 0.670 0.900 0.614 CB 1.640 71 residues pruned to eliminate duplicates Z: 106 81.424 2.417 1.000 0.551 0.943 0.543 CB 1.659 106 residues pruned to eliminate duplicates Z: 30 45.875 2.447 1.059 0.599 0.897 0.586 CB 1.716 30 residues pruned to eliminate duplicates Z: 28 39.596 2.361 1.075 0.530 0.963 0.556 CB 1.568 28 residues pruned to eliminate duplicates Z: 71 66.674 2.336 0.922 0.666 0.914 0.629 CB 1.665 71 residues pruned to eliminate duplicates Z: 81 72.191 2.343 0.948 0.650 0.925 0.550 CB 1.663 81 residues pruned to eliminate duplicates Z: 86 78.124 2.354 1.094 0.619 0.929 0.647 CB 1.653 86 residues pruned to eliminate duplicates Z: 66 60.540 2.324 0.872 0.632 0.923 0.677 CB 1.652 66 residues pruned to eliminate duplicates Z: 110 93.636 2.393 1.149 0.650 0.927 0.679 CB 1.637 110 residues pruned to eliminate duplicates Z: 33 53.142 2.415 1.183 0.610 0.906 0.500 CB 1.771 33 residues pruned to eliminate duplicates Z: 85 72.952 2.351 0.953 0.639 0.929 0.571 CB 1.640 85 residues pruned to eliminate duplicates Z: 38 54.376 2.429 1.053 0.675 0.892 0.595 CB 1.711 38 residues pruned to eliminate duplicates Z: 81 64.984 2.276 1.022 0.601 0.925 0.663 CB 1.550 81 residues pruned to eliminate duplicates Z: 58 56.069 2.242 0.954 0.654 0.930 0.561 CB 1.579 58 residues pruned to eliminate duplicates Z: 110 85.625 2.348 0.984 0.662 0.963 0.606 CB 1.573 110 residues pruned to eliminate duplicates Z: 110 87.620 2.388 1.057 0.629 0.927 0.615 CB 1.634 110 residues pruned to eliminate duplicates Z: 83 71.938 2.316 0.979 0.631 0.939 0.671 CB 1.632 83 residues pruned to eliminate duplicates Z: 83 72.277 2.349 0.949 0.627 0.939 0.683 CB 1.648 83 residues pruned to eliminate duplicates Z: 80 59.513 2.302 0.930 0.578 0.886 0.456 CB 1.577 80 residues pruned to eliminate duplicates Z: 55 56.787 2.284 0.931 0.638 0.907 0.667 CB 1.697 55 residues pruned to eliminate duplicates Z: 69 65.727 2.306 1.024 0.645 0.941 0.691 CB 1.584 69 residues pruned to eliminate duplicates Z: 85 73.184 2.323 0.899 0.639 0.964 0.643 CB 1.647 85 residues pruned to eliminate duplicates Z: 84 78.509 2.361 1.033 0.637 0.964 0.627 CB 1.638 84 residues pruned to eliminate duplicates Z: 83 78.518 2.366 1.007 0.653 0.939 0.634 CB 1.686 83 residues pruned to eliminate duplicates Z: 75 64.032 2.308 0.812 0.625 0.959 0.676 CB 1.648 75 residues pruned to eliminate duplicates Z: 84 75.270 2.361 0.950 0.639 0.940 0.675 CB 1.677 84 residues pruned to eliminate duplicates Z: 71 57.979 2.223 0.864 0.602 0.971 0.729 CB 1.563 71 residues pruned to eliminate duplicates Z: 81 80.715 2.381 1.033 0.660 0.950 0.600 CB 1.691 81 residues pruned to eliminate duplicates Z: 92 73.377 2.313 1.014 0.603 0.923 0.582 CB 1.622 92 residues pruned to eliminate duplicates Z: 70 60.553 2.258 0.950 0.644 0.928 0.783 CB 1.561 70 residues pruned to eliminate duplicates Z: 82 69.596 2.357 0.926 0.631 0.926 0.691 CB 1.627 82 residues pruned to eliminate duplicates Z: 67 69.832 2.292 1.018 0.610 1.000 0.606 CB 1.674 67 residues pruned to eliminate duplicates Z: 83 78.295 2.385 0.977 0.652 0.951 0.671 CB 1.673 83 residues pruned to eliminate duplicates Z: 66 68.437 2.332 0.989 0.676 0.923 0.569 CB 1.685 66 residues pruned to eliminate duplicates Z: 72 74.771 2.350 0.964 0.660 0.958 0.662 CB 1.730 72 residues pruned to eliminate duplicates Z: 73 74.341 2.364 0.940 0.659 0.972 0.681 CB 1.696 73 residues pruned to eliminate duplicates Z: 50 50.278 2.246 0.806 0.623 0.959 0.612 CB 1.643 50 residues pruned to eliminate duplicates Z: 84 75.292 2.330 1.027 0.640 0.952 0.627 CB 1.613 84 residues pruned to eliminate duplicates Z: 71 71.138 2.362 0.993 0.665 0.914 0.571 CB 1.696 71 residues pruned to eliminate duplicates Z: 29 36.408 2.352 0.973 0.493 0.929 0.571 CB 1.608 29 residues pruned to eliminate duplicates Z: 57 50.824 2.268 0.761 0.659 0.929 0.661 CB 1.581 57 residues pruned to eliminate duplicates Z: 18 26.972 2.306 0.924 0.533 0.882 0.706 CA 1.618 18 residues pruned to eliminate duplicates Z: 11 21.127 2.434 0.687 0.668 0.800 0.500 CA 1.741 11 residues pruned to eliminate duplicates Z: 55 62.618 2.286 0.931 0.652 0.963 0.611 CB 1.741 55 residues pruned to eliminate duplicates Z: 83 82.213 2.373 1.055 0.664 0.963 0.634 CB 1.661 83 residues pruned to eliminate duplicates Z: 86 72.741 2.367 0.926 0.626 0.941 0.647 CB 1.633 86 residues pruned to eliminate duplicates Z: 86 73.524 2.336 0.944 0.645 0.953 0.612 CB 1.610 86 residues pruned to eliminate duplicates Z: 82 76.342 2.374 1.012 0.645 0.951 0.642 CB 1.631 82 residues pruned to eliminate duplicates Z: 22 24.633 2.171 1.129 0.435 0.905 0.476 CB 1.375 22 residues pruned to eliminate duplicates Z: 86 69.539 2.331 0.899 0.644 0.929 0.694 CB 1.602 86 residues pruned to eliminate duplicates Z: 22 22.570 2.170 0.801 0.500 0.905 0.524 CB 1.393 22 residues pruned to eliminate duplicates Z: 72 67.420 2.271 0.986 0.610 0.972 0.746 CB 1.644 72 residues pruned to eliminate duplicates Z: 20 29.468 2.282 0.994 0.521 0.947 0.632 CB 1.536 20 residues pruned to eliminate duplicates Z: 82 82.206 2.368 1.063 0.664 0.963 0.716 CB 1.667 82 residues pruned to eliminate duplicates Z: 56 56.700 2.263 0.938 0.664 0.945 0.655 CB 1.584 56 residues pruned to eliminate duplicates Z: 88 73.117 2.286 1.018 0.614 0.943 0.609 CB 1.619 88 residues pruned to eliminate duplicates Z: 83 62.831 2.303 0.859 0.619 0.939 0.671 CB 1.542 83 residues pruned to eliminate duplicates Z: 18 21.930 2.293 1.001 0.474 0.882 0.647 CB 1.350 18 residues pruned to eliminate duplicates Z: 21 33.978 2.338 1.168 0.520 0.950 0.650 CB 1.546 21 residues pruned to eliminate duplicates Z: 84 75.409 2.359 0.968 0.642 0.952 0.675 CB 1.640 84 residues pruned to eliminate duplicates Z: 83 79.331 2.377 1.048 0.662 0.939 0.768 CB 1.649 83 residues pruned to eliminate duplicates Z: 13 20.048 2.181 1.001 0.477 0.917 0.667 CA 1.481 13 residues pruned to eliminate duplicates Z: 12 5.015 1.383 0.512 0.449 0.818 0.455 CB 0.932 12 residues pruned to eliminate duplicates Z: 10 7.009 1.436 0.448 0.709 0.889 0.444 CB 1.045 10 residues pruned to eliminate duplicates Z: 9 8.272 1.485 0.473 0.819 1.000 0.875 CB 1.014 10 residues pruned to eliminate duplicates Z: 7 6.903 1.516 0.556 0.858 0.833 0.667 CB 1.056 7 residues pruned to eliminate duplicates Z: 9 8.878 1.511 0.398 0.851 1.000 0.750 CB 1.100 9 residues pruned to eliminate duplicates Z: 9 9.731 1.544 0.549 0.868 1.000 0.625 CB 1.052 9 residues pruned to eliminate duplicates Z: 9 6.888 1.545 0.512 0.814 1.000 0.250 CB 0.794 9 residues pruned to eliminate duplicates Z: 10 7.736 1.558 0.491 0.889 1.000 0.778 CB 0.800 10 residues pruned to eliminate duplicates Z: 15 6.874 1.720 0.178 0.530 0.786 0.571 CB 1.121 15 residues pruned to eliminate duplicates Z: 14 8.536 1.708 0.346 0.545 0.846 0.538 CB 1.164 13 residues pruned to eliminate duplicates Z: 9 9.674 1.778 0.206 0.883 1.000 0.875 CB 1.154 9 residues pruned to eliminate duplicates Z: 19 9.508 1.628 0.354 0.433 0.944 0.444 CB 1.153 17 residues pruned to eliminate duplicates Z: 9 8.067 1.743 0.271 0.830 1.000 0.625 CB 0.968 9 residues pruned to eliminate duplicates Z: 16 8.726 1.691 0.392 0.510 0.933 0.533 CB 1.015 16 residues pruned to eliminate duplicates Z: 18 6.845 1.658 0.105 0.441 0.824 0.471 CB 1.169 18 residues pruned to eliminate duplicates Z: 15 8.680 1.652 0.351 0.517 0.929 0.571 CB 1.100 15 residues pruned to eliminate duplicates Z: 17 7.178 1.690 0.212 0.455 0.938 0.562 CB 0.979 17 residues pruned to eliminate duplicates Z: 15 7.614 1.659 0.316 0.572 0.929 0.571 CB 0.937 15 residues pruned to eliminate duplicates Z: 35 9.882 1.637 0.206 0.454 0.853 0.500 CB 1.055 38 residues pruned to eliminate duplicates Z: 6 4.076 1.450 0.491 0.415 0.800 0.600 CB 1.152 6 residues pruned to eliminate duplicates Z: 19 10.679 1.664 0.564 0.492 0.778 0.444 CB 1.253 20 residues pruned to eliminate duplicates Z: 6 2.223 1.610 0.231 0.180 0.600 0.200 CA 1.230 Z: 17 18.696 1.909 0.716 0.737 0.938 0.438 CB 1.231 17 residues pruned to eliminate duplicates Z: 16 12.373 1.855 0.532 0.328 0.933 0.533 CA 1.456 16 residues pruned to eliminate duplicates Z: 26 12.569 1.882 0.406 0.252 0.880 0.520 CB 1.434 26 residues pruned to eliminate duplicates Z: 37 22.426 1.904 0.486 0.492 0.944 0.639 CB 1.410 37 residues pruned to eliminate duplicates Z: 110 62.787 2.176 0.804 0.576 0.899 0.633 CB 1.584 110 residues pruned to eliminate duplicates Z: 39 23.044 1.956 0.495 0.449 0.947 0.632 CB 1.422 39 residues pruned to eliminate duplicates Z: 79 57.496 2.219 0.814 0.603 0.949 0.603 CB 1.545 79 residues pruned to eliminate duplicates Z: 155 82.927 2.207 0.780 0.592 0.961 0.662 CB 1.622 155 residues pruned to eliminate duplicates Z: 26 22.602 1.988 0.514 0.552 1.000 0.680 CB 1.428 26 residues pruned to eliminate duplicates Z: 30 22.032 1.970 0.526 0.579 0.931 0.621 CB 1.355 30 residues pruned to eliminate duplicates Z: 137 83.218 2.243 0.858 0.609 0.963 0.676 CB 1.603 137 residues pruned to eliminate duplicates Z: 57 27.350 1.963 0.541 0.434 0.946 0.607 CB 1.366 57 residues pruned to eliminate duplicates Z: 156 76.057 2.171 0.765 0.567 0.961 0.600 CB 1.554 156 residues pruned to eliminate duplicates Z: 31 17.895 1.963 0.384 0.531 0.900 0.633 CB 1.296 31 residues pruned to eliminate duplicates Z: 153 78.257 2.204 0.785 0.591 0.928 0.618 CB 1.594 153 residues pruned to eliminate duplicates Z: 71 56.800 2.245 0.828 0.619 0.929 0.614 CB 1.592 71 residues pruned to eliminate duplicates Z: 74 46.389 2.120 0.698 0.524 0.973 0.603 CB 1.514 74 residues pruned to eliminate duplicates Z: 30 18.561 1.949 0.503 0.541 0.862 0.552 CB 1.311 30 residues pruned to eliminate duplicates Z: 148 78.998 2.217 0.798 0.600 0.918 0.592 CB 1.618 148 residues pruned to eliminate duplicates Z: 142 79.878 2.230 0.787 0.627 0.929 0.603 CB 1.613 142 residues pruned to eliminate duplicates Z: 33 18.781 1.947 0.521 0.511 0.844 0.531 CB 1.315 33 residues pruned to eliminate duplicates Z: 138 89.454 2.253 0.886 0.639 0.964 0.664 CB 1.639 138 residues pruned to eliminate duplicates Z: 24 24.564 2.041 0.694 0.553 1.000 0.565 CB 1.407 24 residues pruned to eliminate duplicates Z: 153 74.419 2.181 0.767 0.565 0.934 0.605 CB 1.574 153 residues pruned to eliminate duplicates Z: 155 85.408 2.201 0.837 0.601 0.968 0.643 CB 1.597 155 residues pruned to eliminate duplicates Z: 139 83.910 2.241 0.850 0.629 0.949 0.659 CB 1.607 139 residues pruned to eliminate duplicates Z: 142 82.718 2.226 0.829 0.630 0.943 0.638 CB 1.605 142 residues pruned to eliminate duplicates Z: 145 80.089 2.224 0.790 0.610 0.938 0.639 CB 1.612 145 residues pruned to eliminate duplicates Z: 148 81.879 2.231 0.802 0.602 0.946 0.626 CB 1.613 148 residues pruned to eliminate duplicates Z: 144 83.929 2.234 0.869 0.609 0.937 0.629 CB 1.618 144 residues pruned to eliminate duplicates Z: 159 77.197 2.179 0.823 0.579 0.918 0.589 CB 1.561 159 residues pruned to eliminate duplicates Z: 96 69.131 2.231 0.896 0.614 0.947 0.621 CB 1.589 96 residues pruned to eliminate duplicates Z: 71 65.145 2.282 0.946 0.647 0.929 0.643 CB 1.646 71 residues pruned to eliminate duplicates Z: 47 47.648 2.276 0.903 0.601 0.935 0.696 CB 1.576 47 residues pruned to eliminate duplicates Z: 82 56.207 2.189 0.795 0.559 0.938 0.580 CB 1.600 82 residues pruned to eliminate duplicates Z: 154 79.053 2.207 0.774 0.591 0.928 0.654 CB 1.612 154 residues pruned to eliminate duplicates Z: 103 77.505 2.286 0.957 0.641 0.902 0.627 CB 1.666 103 residues pruned to eliminate duplicates Z: 116 78.780 2.279 0.852 0.622 0.922 0.643 CB 1.684 116 residues pruned to eliminate duplicates Z: 158 76.186 2.174 0.751 0.585 0.936 0.624 CB 1.573 158 residues pruned to eliminate duplicates Z: 153 79.368 2.201 0.802 0.591 0.934 0.592 CB 1.592 153 residues pruned to eliminate duplicates Z: 154 79.844 2.202 0.800 0.596 0.928 0.634 CB 1.601 154 residues pruned to eliminate duplicates Z: 37 44.620 2.271 0.992 0.581 0.972 0.667 CB 1.563 37 residues pruned to eliminate duplicates Z: 118 81.187 2.269 0.908 0.620 0.932 0.581 CB 1.662 118 residues pruned to eliminate duplicates Z: 59 46.527 2.185 0.870 0.553 0.948 0.552 CB 1.498 59 residues pruned to eliminate duplicates Z: 60 47.017 2.191 0.758 0.568 0.966 0.610 CB 1.540 60 residues pruned to eliminate duplicates Z: 114 74.401 2.257 0.921 0.589 0.894 0.602 CB 1.659 56 residues pruned to eliminate duplicates Z: 17 46.965 2.270 1.265 0.915 1.000 0.438 CA 1.614 14 residues pruned to eliminate duplicates Z: 16 52.815 2.326 1.469 0.924 1.000 0.800 CA 1.668 16 residues pruned to eliminate duplicates Z: 120 82.919 2.268 0.924 0.629 0.933 0.655 CB 1.654 108 residues pruned to eliminate duplicates Z: 16 51.601 2.405 1.228 0.939 1.000 0.800 CA 1.728 16 residues pruned to eliminate duplicates Z: 90 73.269 2.265 0.994 0.655 0.910 0.685 CB 1.637 90 residues pruned to eliminate duplicates Z: 155 79.559 2.200 0.818 0.580 0.929 0.636 CB 1.598 116 residues pruned to eliminate duplicates Z: 14 51.256 2.461 1.499 0.927 0.923 0.615 CB 1.754 14 residues pruned to eliminate duplicates Z: 116 78.172 2.285 0.875 0.627 0.904 0.643 CB 1.669 116 residues pruned to eliminate duplicates Z: 36 42.154 2.257 0.955 0.575 0.914 0.629 CB 1.643 36 residues pruned to eliminate duplicates Z: 75 48.759 2.125 0.762 0.527 0.973 0.554 CB 1.516 75 residues pruned to eliminate duplicates Z: 60 46.632 2.171 0.783 0.559 0.966 0.644 CB 1.533 60 residues pruned to eliminate duplicates Z: 140 83.482 2.238 0.838 0.614 0.964 0.640 CB 1.602 155 residues pruned to eliminate duplicates Z: 9 8.235 1.857 0.526 0.299 1.000 0.000 CB 1.285 Z: 16 30.126 2.130 0.920 0.745 0.933 0.733 CA 1.637 16 residues pruned to eliminate duplicates Z: 85 69.628 2.255 0.837 0.658 0.964 0.679 CB 1.642 85 residues pruned to eliminate duplicates Z: 141 80.754 2.218 0.848 0.621 0.936 0.650 CB 1.587 141 residues pruned to eliminate duplicates Z: 83 71.006 2.288 0.838 0.659 0.963 0.695 CB 1.669 83 residues pruned to eliminate duplicates Z: 88 67.121 2.242 0.905 0.642 0.897 0.586 CB 1.646 88 residues pruned to eliminate duplicates Z: 91 66.084 2.235 0.805 0.624 0.933 0.622 CB 1.646 91 residues pruned to eliminate duplicates Z: 14 38.660 2.434 0.978 0.848 0.923 0.692 CB 1.789 14 residues pruned to eliminate duplicates Z: 34 39.910 2.227 1.003 0.617 0.909 0.636 CB 1.534 34 residues pruned to eliminate duplicates Z: 84 67.876 2.263 0.855 0.646 0.928 0.602 CB 1.669 84 residues pruned to eliminate duplicates Z: 120 77.683 2.252 0.860 0.618 0.933 0.588 CB 1.631 120 residues pruned to eliminate duplicates Z: 75 69.298 2.275 0.959 0.663 0.932 0.622 CB 1.666 75 residues pruned to eliminate duplicates Z: 150 84.020 2.208 0.869 0.599 0.960 0.591 CB 1.582 149 residues pruned to eliminate duplicates Z: 14 36.358 2.310 1.157 0.841 0.923 0.538 CB 1.635 14 residues pruned to eliminate duplicates Z: 115 88.335 2.282 0.971 0.634 0.974 0.605 CB 1.666 115 residues pruned to eliminate duplicates Z: 87 65.292 2.263 0.757 0.630 0.942 0.570 CB 1.664 87 residues pruned to eliminate duplicates Z: 143 83.659 2.214 0.847 0.629 0.965 0.599 CB 1.576 143 residues pruned to eliminate duplicates Z: 34 41.103 2.208 0.979 0.631 0.879 0.636 CB 1.647 34 residues pruned to eliminate duplicates Z: 85 68.835 2.229 0.897 0.637 0.952 0.560 CB 1.640 85 residues pruned to eliminate duplicates Z: 69 61.345 2.244 0.829 0.629 0.956 0.588 CB 1.680 69 residues pruned to eliminate duplicates Z: 84 69.405 2.264 0.868 0.646 0.940 0.602 CB 1.672 84 residues pruned to eliminate duplicates Z: 108 59.892 2.151 0.682 0.573 0.925 0.626 CB 1.611 108 residues pruned to eliminate duplicates Z: 127 76.350 2.211 0.864 0.643 0.937 0.579 CB 1.542 127 residues pruned to eliminate duplicates Z: 86 68.200 2.246 0.851 0.640 0.941 0.718 CB 1.659 86 residues pruned to eliminate duplicates Z: 116 90.123 2.287 1.016 0.640 0.948 0.609 CB 1.687 116 residues pruned to eliminate duplicates Z: 84 74.460 2.274 0.876 0.674 0.964 0.651 CB 1.693 84 residues pruned to eliminate duplicates Z: 117 84.170 2.269 0.909 0.641 0.974 0.621 CB 1.624 117 residues pruned to eliminate duplicates Z: 83 70.708 2.267 0.915 0.650 0.939 0.634 CB 1.666 83 residues pruned to eliminate duplicates Z: 88 65.964 2.201 0.865 0.624 0.920 0.644 CB 1.667 88 residues pruned to eliminate duplicates Z: 91 68.742 2.218 0.855 0.645 0.933 0.656 CB 1.648 91 residues pruned to eliminate duplicates Z: 90 60.299 2.167 0.747 0.602 0.933 0.551 CB 1.642 90 residues pruned to eliminate duplicates Z: 64 63.608 2.238 0.845 0.712 0.984 0.683 CB 1.628 64 residues pruned to eliminate duplicates Z: 155 77.810 2.186 0.790 0.581 0.942 0.610 CB 1.574 155 residues pruned to eliminate duplicates Z: 68 70.862 2.268 0.927 0.654 1.000 0.687 CB 1.717 68 residues pruned to eliminate duplicates Z: 88 66.794 2.218 0.847 0.641 0.920 0.644 CB 1.666 88 residues pruned to eliminate duplicates Z: 114 87.581 2.286 0.960 0.648 0.965 0.646 CB 1.660 114 residues pruned to eliminate duplicates Z: 87 71.551 2.254 0.923 0.647 0.942 0.663 CB 1.648 87 residues pruned to eliminate duplicates Z: 86 73.335 2.249 0.918 0.654 0.965 0.682 CB 1.656 86 residues pruned to eliminate duplicates Z: 88 71.122 2.239 0.898 0.641 0.954 0.632 CB 1.648 88 residues pruned to eliminate duplicates Z: 74 61.094 2.177 0.903 0.644 0.932 0.644 CB 1.619 74 residues pruned to eliminate duplicates Z: 85 66.647 2.251 0.802 0.642 0.940 0.679 CB 1.669 85 residues pruned to eliminate duplicates Z: 117 88.276 2.281 0.979 0.633 0.966 0.638 CB 1.660 117 residues pruned to eliminate duplicates Z: 83 68.472 2.271 0.869 0.644 0.927 0.610 CB 1.679 83 residues pruned to eliminate duplicates Z: 88 72.378 2.228 0.942 0.635 0.966 0.667 CB 1.637 88 residues pruned to eliminate duplicates Z: 85 67.047 2.267 0.840 0.641 0.917 0.560 CB 1.677 85 residues pruned to eliminate duplicates Z: 66 62.056 2.247 0.962 0.671 0.908 0.615 CB 1.642 66 residues pruned to eliminate duplicates Z: 84 72.412 2.271 0.922 0.658 0.952 0.687 CB 1.652 84 residues pruned to eliminate duplicates Z: 73 59.271 2.213 0.799 0.622 0.944 0.569 CA 1.655 73 residues pruned to eliminate duplicates Z: 122 80.102 2.229 0.886 0.656 0.942 0.628 CB 1.590 122 residues pruned to eliminate duplicates Z: 118 86.008 2.261 0.952 0.621 0.957 0.632 CB 1.679 118 residues pruned to eliminate duplicates Z: 130 83.082 2.218 0.963 0.649 0.922 0.674 CB 1.584 130 residues pruned to eliminate duplicates Z: 45 49.124 2.220 0.891 0.638 0.955 0.659 CA 1.625 45 residues pruned to eliminate duplicates Z: 47 48.753 2.229 0.840 0.611 0.935 0.587 CA 1.688 47 residues pruned to eliminate duplicates Z: 157 80.297 2.164 0.779 0.599 0.974 0.545 CB 1.558 157 residues pruned to eliminate duplicates Z: 116 90.468 2.284 1.024 0.651 0.957 0.687 CB 1.657 116 residues pruned to eliminate duplicates Z: 66 62.251 2.218 0.855 0.670 0.954 0.585 CB 1.683 66 residues pruned to eliminate duplicates Z: 80 65.149 2.224 0.879 0.604 0.949 0.633 CB 1.673 80 residues pruned to eliminate duplicates Z: 44 53.756 2.289 0.854 0.656 0.977 0.698 CA 1.710 44 residues pruned to eliminate duplicates Z: 123 79.052 2.220 0.910 0.633 0.934 0.615 CB 1.595 123 residues pruned to eliminate duplicates Z: 43 51.751 2.213 1.037 0.661 0.952 0.548 CA 1.602 43 residues pruned to eliminate duplicates Z: 90 72.944 2.218 0.916 0.654 0.955 0.663 CB 1.652 90 residues pruned to eliminate duplicates Z: 48 47.405 2.226 0.794 0.622 0.936 0.617 CB 1.648 48 residues pruned to eliminate duplicates Z: 50 45.120 2.213 0.836 0.608 0.898 0.571 CA 1.595 50 residues pruned to eliminate duplicates Z: 127 84.001 2.232 0.944 0.638 0.944 0.698 CB 1.605 127 residues pruned to eliminate duplicates Z: 91 75.646 2.231 0.965 0.635 0.956 0.667 CB 1.678 91 residues pruned to eliminate duplicates Z: 86 68.843 2.209 0.866 0.632 0.953 0.565 CB 1.679 86 residues pruned to eliminate duplicates Z: 22 29.978 2.186 0.803 0.534 1.000 0.476 CB 1.604 22 residues pruned to eliminate duplicates Z: 136 89.807 2.240 0.954 0.651 0.963 0.674 CB 1.592 136 residues pruned to eliminate duplicates Z: 85 73.591 2.247 0.975 0.654 0.952 0.631 CB 1.647 85 residues pruned to eliminate duplicates Z: 85 77.301 2.252 1.000 0.663 0.964 0.667 CB 1.670 85 residues pruned to eliminate duplicates Z: 16 17.903 2.086 0.568 0.480 0.933 0.467 CB 1.545 16 residues pruned to eliminate duplicates Z: 15 21.585 2.202 0.580 0.498 0.929 0.429 CA 1.789 15 residues pruned to eliminate duplicates Z: 49 50.336 2.197 0.943 0.641 0.917 0.646 CA 1.628 49 residues pruned to eliminate duplicates Z: 84 77.474 2.259 1.010 0.667 0.952 0.639 CB 1.687 84 residues pruned to eliminate duplicates Z: 84 77.193 2.281 0.941 0.665 0.964 0.651 CB 1.703 84 residues pruned to eliminate duplicates Z: 22 17.877 2.030 0.609 0.442 0.857 0.619 CA 1.480 22 residues pruned to eliminate duplicates Z: 18 16.683 2.105 0.673 0.413 0.765 0.471 CA 1.646 18 residues pruned to eliminate duplicates Z: 85 69.954 2.262 0.910 0.647 0.929 0.643 CB 1.658 85 residues pruned to eliminate duplicates Z: 18 18.626 2.061 0.610 0.463 0.882 0.529 CA 1.602 18 residues pruned to eliminate duplicates Z: 44 23.328 1.962 0.552 0.518 0.814 0.605 CB 1.410 18 residues pruned to eliminate duplicates Z: 11 9.498 1.696 0.228 0.692 0.900 0.600 CB 1.345 Z: 7 5.932 1.630 0.118 0.623 1.000 0.500 O 1.184 7 residues pruned to eliminate duplicates Z: 11 13.142 1.832 0.276 0.720 1.000 0.400 CB 1.457 11 residues pruned to eliminate duplicates Z: 11 11.545 1.856 0.313 0.739 0.900 0.600 CB 1.343 11 residues pruned to eliminate duplicates Z: 10 10.041 1.809 0.323 0.684 0.889 0.778 CB 1.329 10 residues pruned to eliminate duplicates Z: 18 21.368 2.010 0.612 0.519 1.000 0.588 CB 1.570 29 residues pruned to eliminate duplicates Z: 17 21.839 2.061 0.598 0.543 1.000 0.625 CB 1.589 17 residues pruned to eliminate duplicates Z: 19 17.738 1.977 0.609 0.436 1.000 0.556 CB 1.404 19 residues pruned to eliminate duplicates Z: 17 21.067 2.029 0.657 0.502 1.000 0.562 CB 1.563 17 residues pruned to eliminate duplicates Z: 18 19.803 2.037 0.618 0.483 1.000 0.647 CB 1.484 18 residues pruned to eliminate duplicates Z: 18 17.560 2.016 0.491 0.456 1.000 0.471 CB 1.481 18 residues pruned to eliminate duplicates Z: 17 19.368 2.027 0.594 0.486 1.000 0.500 CB 1.521 17 residues pruned to eliminate duplicates Z: 21 17.222 1.824 0.612 0.436 1.000 0.600 CB 1.399 21 residues pruned to eliminate duplicates Z: 15 20.312 1.989 0.518 0.570 1.000 0.571 CA 1.679 15 residues pruned to eliminate duplicates Z: 25 17.334 2.020 0.370 0.438 0.875 0.500 CB 1.558 192 residues pruned to eliminate duplicates Z: 37 22.046 2.049 0.591 0.366 0.861 0.389 CB 1.511 37 residues pruned to eliminate duplicates Z: 37 27.436 2.118 0.624 0.430 0.889 0.583 CB 1.608 37 residues pruned to eliminate duplicates Z: 37 25.530 2.102 0.708 0.373 0.861 0.583 CB 1.577 37 residues pruned to eliminate duplicates Z: 26 19.160 2.016 0.624 0.402 0.880 0.640 CB 1.474 Z: 7 8.432 2.150 0.527 0.506 0.833 0.500 CA 1.251 7 residues pruned to eliminate duplicates Z: 26 23.339 2.081 0.802 0.401 0.920 0.560 CB 1.501 26 residues pruned to eliminate duplicates Z: 6 4.923 2.185 0.667 0.284 0.600 0.400 CA 1.285 6 residues pruned to eliminate duplicates Z: 36 28.575 2.125 0.670 0.399 0.914 0.571 CB 1.656 62 residues pruned to eliminate duplicates Z: 29 17.552 2.011 0.770 0.319 0.786 0.500 CA 1.448 Z: 6 6.811 1.802 0.827 0.282 0.800 0.400 CA 1.478 6 residues pruned to eliminate duplicates Z: 15 20.264 2.297 0.882 0.357 0.857 0.571 CB 1.704 18 residues pruned to eliminate duplicates Z: 8 11.532 1.968 0.656 0.443 1.000 0.429 CA 1.418 Z: 8 9.974 1.763 0.813 0.580 0.857 0.571 CA 1.275 8 residues pruned to eliminate duplicates Z: 60 68.083 2.437 0.919 0.591 0.966 0.678 CB 1.798 6 residues pruned to eliminate duplicates Z: 7 9.738 1.932 0.611 0.612 0.833 0.167 CB 1.379 7 residues pruned to eliminate duplicates Z: 125 91.145 2.327 1.001 0.626 0.944 0.661 CB 1.655 60 residues pruned to eliminate duplicates Z: 9 14.197 1.971 1.048 0.335 0.875 0.500 CA 1.702 10 residues pruned to eliminate duplicates Z: 17 38.972 2.349 1.018 0.800 0.938 0.625 CA 1.686 17 residues pruned to eliminate duplicates Z: 58 64.689 2.418 0.938 0.603 0.930 0.702 CB 1.782 59 residues pruned to eliminate duplicates Z: 15 32.285 2.339 0.793 0.887 0.929 0.786 CA 1.598 15 residues pruned to eliminate duplicates Z: 60 62.706 2.375 1.012 0.571 0.949 0.542 CB 1.680 60 residues pruned to eliminate duplicates Z: 118 86.228 2.305 0.981 0.627 0.957 0.624 CB 1.617 116 residues pruned to eliminate duplicates Z: 13 41.058 2.542 0.967 0.921 1.000 0.833 CA 1.668 13 residues pruned to eliminate duplicates Z: 102 81.631 2.339 0.972 0.623 0.950 0.594 CB 1.649 104 residues pruned to eliminate duplicates Z: 14 37.876 2.393 0.992 0.914 1.000 1.000 CA 1.558 14 residues pruned to eliminate duplicates Z: 95 67.555 2.265 0.851 0.522 0.968 0.521 CB 1.680 246 residues pruned to eliminate duplicates Z: 48 43.189 2.237 0.908 0.498 0.915 0.660 CB 1.616 Z: 16 36.864 2.423 0.853 0.778 1.000 0.600 CB 1.659 16 residues pruned to eliminate duplicates Z: 58 67.884 2.411 1.002 0.596 0.965 0.684 CB 1.761 25 residues pruned to eliminate duplicates Z: 15 36.164 2.469 1.105 0.713 0.929 0.857 CA 1.651 15 residues pruned to eliminate duplicates Z: 76 66.099 2.359 1.007 0.547 0.907 0.613 CB 1.698 76 residues pruned to eliminate duplicates Z: 60 62.659 2.363 0.948 0.587 0.949 0.644 CB 1.717 60 residues pruned to eliminate duplicates Z: 60 65.698 2.376 0.987 0.584 0.949 0.678 CB 1.761 60 residues pruned to eliminate duplicates Z: 58 65.542 2.411 0.967 0.594 0.965 0.649 CB 1.734 58 residues pruned to eliminate duplicates Z: 167 95.237 2.300 0.948 0.589 0.928 0.608 CB 1.633 81 residues pruned to eliminate duplicates Z: 8 6.128 1.384 1.099 0.497 0.857 0.714 C 0.933 8 residues pruned to eliminate duplicates Z: 93 59.703 2.222 0.886 0.503 0.924 0.674 CB 1.603 93 residues pruned to eliminate duplicates Z: 57 66.835 2.396 0.999 0.594 0.964 0.625 CB 1.768 57 residues pruned to eliminate duplicates Z: 86 85.016 2.467 1.002 0.618 0.941 0.671 CB 1.774 86 residues pruned to eliminate duplicates Z: 59 61.999 2.356 0.992 0.581 0.914 0.672 CB 1.756 59 residues pruned to eliminate duplicates Z: 149 87.960 2.302 0.899 0.594 0.926 0.608 CB 1.632 149 residues pruned to eliminate duplicates Z: 116 83.859 2.293 0.949 0.629 0.957 0.591 CB 1.620 116 residues pruned to eliminate duplicates Z: 125 88.597 2.334 0.926 0.640 0.944 0.613 CB 1.645 125 residues pruned to eliminate duplicates Z: 38 40.271 2.342 1.035 0.565 0.811 0.568 CB 1.609 38 residues pruned to eliminate duplicates Z: 110 80.529 2.337 0.975 0.542 0.945 0.642 CB 1.697 110 residues pruned to eliminate duplicates Z: 142 89.976 2.324 0.947 0.620 0.936 0.574 CB 1.597 142 residues pruned to eliminate duplicates Z: 62 64.694 2.385 0.976 0.580 0.951 0.607 CB 1.712 62 residues pruned to eliminate duplicates Z: 76 68.976 2.361 0.988 0.542 0.960 0.653 CB 1.696 76 residues pruned to eliminate duplicates Z: 83 65.563 2.269 1.026 0.531 0.951 0.646 CB 1.605 83 residues pruned to eliminate duplicates Z: 60 62.157 2.399 1.025 0.566 0.898 0.695 CB 1.739 60 residues pruned to eliminate duplicates Z: 101 80.147 2.339 1.049 0.609 0.920 0.630 CB 1.639 101 residues pruned to eliminate duplicates Z: 67 66.174 2.363 0.995 0.554 0.939 0.606 CB 1.744 67 residues pruned to eliminate duplicates Z: 76 70.050 2.363 0.988 0.556 0.947 0.733 CB 1.723 76 residues pruned to eliminate duplicates Z: 60 68.385 2.390 1.087 0.574 0.949 0.678 CB 1.750 60 residues pruned to eliminate duplicates Z: 71 80.237 2.433 1.127 0.611 0.929 0.671 CB 1.797 71 residues pruned to eliminate duplicates Z: 102 81.872 2.343 1.042 0.610 0.931 0.673 CB 1.647 102 residues pruned to eliminate duplicates Z: 124 68.214 2.191 0.907 0.589 0.911 0.577 CB 1.485 119 residues pruned to eliminate duplicates Z: 14 27.989 2.182 1.147 0.876 0.846 0.615 CA 1.422 14 residues pruned to eliminate duplicates Z: 95 60.345 2.235 0.925 0.506 0.894 0.596 CB 1.609 95 residues pruned to eliminate duplicates Z: 54 64.677 2.427 1.088 0.592 0.906 0.642 CB 1.773 54 residues pruned to eliminate duplicates Z: 90 84.543 2.400 1.074 0.599 0.921 0.685 CB 1.778 90 residues pruned to eliminate duplicates Z: 117 76.934 2.307 1.002 0.538 0.879 0.569 CB 1.694 117 residues pruned to eliminate duplicates Z: 78 78.001 2.425 1.079 0.581 0.935 0.636 CB 1.744 78 residues pruned to eliminate duplicates Z: 143 90.193 2.317 0.973 0.607 0.930 0.620 CB 1.609 143 residues pruned to eliminate duplicates Z: 143 89.180 2.319 0.973 0.614 0.915 0.613 CB 1.604 143 residues pruned to eliminate duplicates Z: 98 84.080 2.362 1.113 0.611 0.918 0.660 CB 1.677 98 residues pruned to eliminate duplicates Z: 151 94.524 2.327 0.974 0.603 0.933 0.613 CB 1.631 151 residues pruned to eliminate duplicates Z: 121 80.202 2.292 0.964 0.614 0.917 0.633 CB 1.592 121 residues pruned to eliminate duplicates Z: 104 74.895 2.263 0.990 0.625 0.922 0.612 CB 1.579 62 residues pruned to eliminate duplicates Z: 14 36.818 2.309 1.338 0.846 0.923 0.615 CA 1.522 14 residues pruned to eliminate duplicates Z: 33 49.093 2.448 0.999 0.616 0.906 0.688 CA 1.754 33 residues pruned to eliminate duplicates Z: 41 49.145 2.303 1.010 0.612 0.900 0.450 CB 1.678 32 residues pruned to eliminate duplicates Z: 13 44.596 2.502 1.176 0.884 1.000 0.750 CA 1.708 13 residues pruned to eliminate duplicates Z: 22 38.066 2.465 1.019 0.616 0.857 0.714 CA 1.745 22 residues pruned to eliminate duplicates Z: 83 66.869 2.253 0.988 0.637 0.939 0.610 CB 1.545 83 residues pruned to eliminate duplicates Z: 96 61.476 2.199 0.840 0.616 0.937 0.547 CB 1.491 40 residues pruned to eliminate duplicates Z: 15 39.282 2.180 1.308 0.878 1.000 0.714 CA 1.514 15 residues pruned to eliminate duplicates Z: 144 91.376 2.313 0.990 0.605 0.944 0.601 CB 1.590 152 residues pruned to eliminate duplicates Z: 15 35.581 2.238 1.301 0.865 0.857 0.857 CA 1.578 15 residues pruned to eliminate duplicates Z: 143 99.064 2.336 1.046 0.635 0.951 0.606 CB 1.612 143 residues pruned to eliminate duplicates Z: 142 94.365 2.332 0.971 0.624 0.936 0.596 CB 1.643 142 residues pruned to eliminate duplicates Z: 6 5.627 1.843 0.791 0.342 0.800 0.600 CB 1.131 6 residues pruned to eliminate duplicates Z: 110 84.504 2.358 1.002 0.572 0.954 0.642 CB 1.676 110 residues pruned to eliminate duplicates Z: 95 91.088 2.414 1.163 0.622 0.936 0.638 CB 1.713 95 residues pruned to eliminate duplicates Z: 150 89.700 2.303 0.954 0.609 0.926 0.644 CB 1.590 150 residues pruned to eliminate duplicates Z: 6 13.323 1.867 1.277 0.426 1.000 0.400 C 1.515 Z: 11 16.200 1.739 1.021 0.674 0.900 0.400 CB 1.379 11 residues pruned to eliminate duplicates Z: 138 92.870 2.323 0.981 0.622 0.964 0.591 CB 1.595 138 residues pruned to eliminate duplicates Z: 142 87.210 2.280 0.999 0.593 0.929 0.610 CB 1.587 146 residues pruned to eliminate duplicates Z: 10 11.175 1.709 0.813 0.762 0.778 0.556 CB 1.225 10 residues pruned to eliminate duplicates Z: 95 89.170 2.390 1.165 0.632 0.936 0.670 CB 1.677 95 residues pruned to eliminate duplicates Z: 88 65.101 2.260 0.882 0.616 0.943 0.621 CB 1.560 88 residues pruned to eliminate duplicates Z: 155 89.964 2.296 0.938 0.583 0.942 0.636 CB 1.599 155 residues pruned to eliminate duplicates Z: 125 96.124 2.335 1.054 0.653 0.960 0.621 CB 1.627 125 residues pruned to eliminate duplicates Z: 88 68.248 2.269 0.929 0.622 0.943 0.598 CB 1.581 88 residues pruned to eliminate duplicates Z: 117 83.182 2.241 1.030 0.620 0.974 0.560 CB 1.556 117 residues pruned to eliminate duplicates Z: 78 62.895 2.231 0.946 0.602 0.935 0.571 CB 1.603 78 residues pruned to eliminate duplicates Z: 156 98.221 2.321 1.036 0.596 0.955 0.587 CB 1.595 158 residues pruned to eliminate duplicates Z: 15 15.771 1.942 0.301 0.899 1.000 0.857 CB 1.192 15 residues pruned to eliminate duplicates Z: 124 89.780 2.316 0.987 0.642 0.943 0.618 CB 1.634 124 residues pruned to eliminate duplicates Z: 45 39.775 2.145 0.760 0.632 0.977 0.682 CB 1.435 45 residues pruned to eliminate duplicates Z: 48 44.516 2.212 0.791 0.646 0.979 0.681 CB 1.461 48 residues pruned to eliminate duplicates Z: 167 96.345 2.277 1.006 0.589 0.946 0.645 CB 1.589 167 residues pruned to eliminate duplicates Z: 130 88.024 2.290 1.004 0.612 0.938 0.605 CB 1.619 130 residues pruned to eliminate duplicates Z: 126 95.224 2.337 1.083 0.636 0.936 0.608 CB 1.646 126 residues pruned to eliminate duplicates Z: 46 41.648 2.221 0.824 0.641 0.933 0.622 CB 1.439 46 residues pruned to eliminate duplicates Z: 70 65.969 2.244 1.009 0.654 0.942 0.681 CB 1.621 70 residues pruned to eliminate duplicates Z: 122 86.537 2.292 1.049 0.629 0.934 0.628 CB 1.588 122 residues pruned to eliminate duplicates Z: 45 40.286 2.150 0.733 0.643 0.977 0.705 CB 1.460 45 residues pruned to eliminate duplicates Z: 117 78.224 2.276 0.961 0.606 0.922 0.612 CB 1.595 117 residues pruned to eliminate duplicates Z: 46 36.984 2.161 0.726 0.624 0.978 0.622 CB 1.346 46 residues pruned to eliminate duplicates Z: 74 50.572 2.153 0.812 0.553 0.945 0.534 CB 1.525 74 residues pruned to eliminate duplicates Z: 46 40.011 2.056 0.925 0.637 0.933 0.622 CB 1.419 46 residues pruned to eliminate duplicates Z: 109 76.315 2.274 0.952 0.616 0.935 0.565 CB 1.585 109 residues pruned to eliminate duplicates Z: 126 80.749 2.274 0.983 0.632 0.928 0.688 CB 1.524 126 residues pruned to eliminate duplicates Z: 131 94.956 2.320 1.031 0.636 0.962 0.738 CB 1.617 131 residues pruned to eliminate duplicates Z: 144 97.681 2.319 1.051 0.625 0.958 0.657 CB 1.593 144 residues pruned to eliminate duplicates Z: 51 44.830 2.080 0.898 0.697 0.960 0.660 CB 1.398 51 residues pruned to eliminate duplicates Z: 37 36.643 2.083 0.833 0.644 0.972 0.806 CB 1.438 37 residues pruned to eliminate duplicates Z: 43 41.174 2.178 0.930 0.645 0.952 0.714 CB 1.386 43 residues pruned to eliminate duplicates Z: 33 33.186 2.286 0.846 0.483 0.844 0.500 CB 1.675 33 residues pruned to eliminate duplicates Z: 87 59.730 2.244 0.912 0.599 0.884 0.558 CB 1.545 87 residues pruned to eliminate duplicates Z: 66 51.347 2.130 0.924 0.633 0.954 0.631 CB 1.438 66 residues pruned to eliminate duplicates Z: 121 86.408 2.290 1.031 0.636 0.950 0.600 CB 1.572 120 residues pruned to eliminate duplicates Z: 6 3.868 1.517 1.021 0.261 0.600 0.200 N 1.236 6 residues pruned to eliminate duplicates Z: 14 22.629 2.292 0.673 0.531 0.923 0.538 CA 1.719 14 residues pruned to eliminate duplicates Z: 142 99.746 2.346 1.059 0.630 0.943 0.638 CB 1.631 142 residues pruned to eliminate duplicates Z: 74 55.023 2.167 1.014 0.602 0.945 0.562 CB 1.417 74 residues pruned to eliminate duplicates Z: 6 5.567 1.717 0.676 0.340 0.800 0.400 CB 1.288 6 residues pruned to eliminate duplicates Z: 18 22.913 2.284 0.786 0.455 0.941 0.588 CB 1.516 19 residues pruned to eliminate duplicates 831 residues left after pruning, divided into chains as follows: A: 7 B: 21 C: 223 D: 6 E: 223 F: 9 G: 35 H: 6 I: 19 J: 111 K: 10 L: 50 M: 103 N: 8 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 37.64 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.483, Connect. = 0.737 for dens.mod. cycle 1 = 0.300, Contrast = 0.553, Connect. = 0.760 for dens.mod. cycle 2 = 0.300, Contrast = 0.664, Connect. = 0.789 for dens.mod. cycle 3 = 0.300, Contrast = 0.671, Connect. = 0.789 for dens.mod. cycle 4 = 0.300, Contrast = 0.683, Connect. = 0.791 for dens.mod. cycle 5 = 0.300, Contrast = 0.688, Connect. = 0.792 for dens.mod. cycle 6 = 0.300, Contrast = 0.694, Connect. = 0.793 for dens.mod. cycle 7 = 0.300, Contrast = 0.696, Connect. = 0.793 for dens.mod. cycle 8 = 0.300, Contrast = 0.700, Connect. = 0.794 for dens.mod. cycle 9 = 0.300, Contrast = 0.700, Connect. = 0.795 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 6682 peaks > 0.5 sigma used to seed fragment search Space for about 1274 unique residues taking solvent into account 1326 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 16 51.585 2.431 1.224 0.940 1.000 0.600 CB 1.710 B: 13 39.645 2.386 0.942 0.886 1.000 0.833 CB 1.782 C: 16 48.513 2.438 1.087 0.944 1.000 0.667 CB 1.706 16 residues pruned to eliminate duplicates D: 13 41.556 2.404 0.989 0.919 1.000 0.667 CB 1.769 E: 17 51.232 2.370 1.279 0.940 1.000 0.812 CB 1.646 16 residues pruned to eliminate duplicates F: 13 48.562 2.493 1.249 0.916 0.917 0.667 CB 1.926 13 residues pruned to eliminate duplicates G: 13 38.830 2.342 1.328 0.851 0.917 0.750 CB 1.661 13 residues pruned to eliminate duplicates H: 20 43.968 2.328 1.206 0.820 0.947 0.737 CB 1.571 20 residues pruned to eliminate duplicates I: 14 34.723 2.243 1.077 0.869 1.000 0.923 CA 1.509 J: 14 32.328 2.297 0.760 0.888 1.000 0.846 CA 1.597 14 residues pruned to eliminate duplicates K: 11 49.577 2.589 1.175 0.917 1.000 0.800 CA 1.965 12 residues pruned to eliminate duplicates L: 13 39.495 2.327 0.926 0.935 1.000 1.000 CA 1.774 14 residues pruned to eliminate duplicates M: 12 40.037 2.471 1.158 0.877 0.909 0.545 CA 1.808 12 residues pruned to eliminate duplicates N: 14 30.197 2.348 0.936 0.841 0.846 0.846 CA 1.624 O: 14 33.723 2.321 0.962 0.831 0.923 0.692 CB 1.672 14 residues pruned to eliminate duplicates P: 14 36.712 2.253 1.333 0.809 0.923 0.615 CA 1.604 14 residues pruned to eliminate duplicates Q: 13 38.304 2.271 0.977 0.895 1.000 0.917 CA 1.765 R: 13 24.351 2.104 0.719 0.847 0.917 0.750 CB 1.574 13 residues pruned to eliminate duplicates S: 16 42.725 2.356 0.862 0.934 1.000 0.933 CB 1.754 T: 17 42.536 2.245 1.039 0.922 1.000 0.625 CB 1.633 17 residues pruned to eliminate duplicates U: 12 37.249 2.542 0.647 0.915 1.000 0.818 CA 1.897 12 residues pruned to eliminate duplicates V: 34 44.781 2.328 1.089 0.557 0.879 0.636 CB 1.725 19 residues pruned to eliminate duplicates W: 15 34.622 2.262 1.049 0.875 0.929 0.786 CB 1.563 15 residues pruned to eliminate duplicates X: 14 40.378 2.366 0.770 0.905 1.000 0.769 CA 1.903 14 residues pruned to eliminate duplicates Y: 13 41.606 2.443 0.998 0.924 0.917 0.750 CB 1.885 13 residues pruned to eliminate duplicates Z: 12 44.841 2.572 0.964 0.900 1.000 0.727 CA 1.912 12 residues pruned to eliminate duplicates Z: 90 77.705 2.387 1.002 0.600 0.944 0.607 CB 1.661 43 residues pruned to eliminate duplicates Z: 18 36.253 2.201 0.840 0.920 1.000 0.882 CB 1.529 Z: 18 34.569 2.219 0.959 0.915 0.941 0.824 CB 1.448 18 residues pruned to eliminate duplicates Z: 15 30.322 2.370 0.713 0.865 0.929 0.714 CB 1.575 15 residues pruned to eliminate duplicates Z: 13 33.253 2.386 0.557 0.878 1.000 0.917 CA 1.875 13 residues pruned to eliminate duplicates Z: 16 31.556 2.229 0.890 0.843 0.933 0.800 CA 1.542 16 residues pruned to eliminate duplicates Z: 28 44.194 2.466 1.141 0.631 0.889 0.481 CB 1.602 16 residues pruned to eliminate duplicates Z: 88 75.899 2.428 1.030 0.592 0.897 0.598 CB 1.687 56 residues pruned to eliminate duplicates Z: 14 30.360 2.227 0.748 0.897 1.000 0.692 CB 1.548 Z: 12 45.936 2.557 0.963 0.917 1.000 0.727 CA 1.948 12 residues pruned to eliminate duplicates Z: 60 46.647 2.145 0.784 0.591 0.983 0.644 CB 1.480 Z: 13 33.365 2.207 0.874 0.914 1.000 0.750 CB 1.647 13 residues pruned to eliminate duplicates Z: 13 38.227 2.345 0.901 0.923 1.000 0.833 CA 1.741 13 residues pruned to eliminate duplicates Z: 90 68.639 2.293 0.909 0.604 0.921 0.584 CB 1.634 28 residues pruned to eliminate duplicates Z: 15 42.940 2.184 1.308 0.921 1.000 0.857 CA 1.601 15 residues pruned to eliminate duplicates Z: 13 34.407 2.431 0.752 0.906 1.000 0.833 CA 1.659 13 residues pruned to eliminate duplicates Z: 13 33.129 2.226 0.700 0.899 1.000 0.833 CB 1.806 13 residues pruned to eliminate duplicates Z: 10 16.687 2.030 0.542 0.742 1.000 0.778 CA 1.432 10 residues pruned to eliminate duplicates Z: 14 24.917 2.286 1.090 0.571 0.923 0.538 CB 1.463 14 residues pruned to eliminate duplicates Z: 14 45.753 2.356 1.088 0.908 1.000 0.769 CA 1.832 14 residues pruned to eliminate duplicates Z: 10 16.402 2.064 0.664 0.801 0.889 0.667 CA 1.377 10 residues pruned to eliminate duplicates Z: 122 82.476 2.208 0.950 0.634 0.942 0.545 CB 1.630 50 residues pruned to eliminate duplicates Z: 58 60.073 2.375 0.967 0.608 0.930 0.632 CB 1.653 60 residues pruned to eliminate duplicates Z: 14 39.182 2.317 1.089 0.877 1.000 0.846 CA 1.631 14 residues pruned to eliminate duplicates Z: 17 40.494 2.321 1.190 0.789 0.938 0.688 CB 1.648 17 residues pruned to eliminate duplicates Z: 17 47.684 2.286 1.208 0.914 1.000 0.688 CA 1.671 17 residues pruned to eliminate duplicates Z: 141 95.223 2.368 0.956 0.612 0.936 0.607 CB 1.670 150 residues pruned to eliminate duplicates Z: 15 33.675 2.482 0.705 0.822 0.929 0.643 CB 1.732 15 residues pruned to eliminate duplicates Z: 82 69.423 2.335 0.989 0.638 0.914 0.654 CB 1.597 82 residues pruned to eliminate duplicates Z: 16 45.981 2.296 1.173 0.917 1.000 0.667 CA 1.680 16 residues pruned to eliminate duplicates Z: 15 38.996 2.337 1.090 0.920 1.000 0.786 CB 1.502 15 residues pruned to eliminate duplicates Z: 12 13.700 2.200 0.829 0.317 0.909 0.636 CA 1.381 7 residues pruned to eliminate duplicates Z: 14 40.199 2.363 0.985 0.909 0.923 0.615 CA 1.828 14 residues pruned to eliminate duplicates Z: 10 24.737 2.272 0.625 0.907 1.000 0.889 CB 1.588 Z: 13 37.918 2.252 0.991 0.898 1.000 0.667 CB 1.747 13 residues pruned to eliminate duplicates Z: 12 15.648 2.041 0.540 0.791 0.909 0.636 CA 1.280 Z: 14 31.644 2.309 0.741 0.880 0.923 0.615 CB 1.713 14 residues pruned to eliminate duplicates Z: 21 32.526 2.174 1.365 0.574 0.900 0.800 CB 1.463 14 residues pruned to eliminate duplicates Z: 15 32.098 2.270 0.985 0.830 0.929 0.714 CB 1.541 15 residues pruned to eliminate duplicates Z: 17 29.935 2.070 0.914 0.875 0.938 0.812 CA 1.465 17 residues pruned to eliminate duplicates Z: 84 79.389 2.345 1.021 0.658 0.952 0.687 CB 1.668 84 residues pruned to eliminate duplicates Z: 11 16.059 2.118 0.487 0.845 0.900 0.800 CB 1.333 Z: 16 47.814 2.400 1.032 0.929 1.000 0.867 CA 1.771 16 residues pruned to eliminate duplicates Z: 17 40.610 2.306 1.096 0.931 0.875 0.750 CB 1.678 17 residues pruned to eliminate duplicates Z: 11 16.896 2.108 0.420 0.915 1.000 0.800 CB 1.262 11 residues pruned to eliminate duplicates Z: 28 48.469 2.391 1.020 0.660 0.963 0.704 CB 1.729 28 residues pruned to eliminate duplicates Z: 18 40.183 2.318 1.282 0.560 1.000 0.765 CB 1.738 21 residues pruned to eliminate duplicates Z: 16 36.100 2.283 1.008 0.926 1.000 0.800 CB 1.426 16 residues pruned to eliminate duplicates Z: 14 39.931 2.257 0.997 0.862 1.000 0.615 CA 1.804 14 residues pruned to eliminate duplicates Z: 14 39.074 2.248 1.116 0.883 1.000 0.769 CA 1.647 14 residues pruned to eliminate duplicates Z: 33 20.867 2.044 0.593 0.385 0.875 0.469 CB 1.462 8 residues pruned to eliminate duplicates Z: 14 27.433 2.360 0.676 0.864 0.846 0.846 CA 1.667 14 residues pruned to eliminate duplicates Z: 13 42.718 2.504 0.937 0.928 1.000 0.583 CA 1.781 13 residues pruned to eliminate duplicates Z: 13 32.113 2.242 0.668 0.919 1.000 1.000 CA 1.748 13 residues pruned to eliminate duplicates Z: 7 6.906 1.766 1.297 0.448 0.667 0.333 CB 1.099 7 residues pruned to eliminate duplicates Z: 13 44.071 2.363 1.398 0.871 0.917 0.750 CA 1.786 13 residues pruned to eliminate duplicates Z: 9 24.855 2.214 0.829 0.784 1.000 0.500 CA 1.690 9 residues pruned to eliminate duplicates Z: 10 16.844 2.224 0.554 0.793 0.889 0.667 CB 1.413 Z: 17 41.776 2.243 1.034 0.933 1.000 0.500 CB 1.597 18 residues pruned to eliminate duplicates Z: 31 24.851 2.058 0.840 0.501 0.800 0.500 CB 1.496 26 residues pruned to eliminate duplicates Z: 13 39.569 2.265 1.038 0.893 1.000 0.833 CB 1.776 13 residues pruned to eliminate duplicates Z: 11 18.942 1.790 1.393 0.771 0.900 0.700 CB 1.223 11 residues pruned to eliminate duplicates Z: 45 45.516 2.262 1.066 0.544 0.886 0.591 CB 1.587 45 residues pruned to eliminate duplicates Z: 79 44.703 2.209 0.784 0.459 0.885 0.538 CB 1.513 26 residues pruned to eliminate duplicates Z: 11 20.704 2.100 0.823 0.900 1.000 0.800 CB 1.222 11 residues pruned to eliminate duplicates Z: 14 41.684 2.406 0.922 0.898 1.000 0.692 CB 1.788 14 residues pruned to eliminate duplicates Z: 94 78.182 2.372 1.067 0.612 0.892 0.602 CB 1.665 89 residues pruned to eliminate duplicates Z: 10 20.384 2.094 0.921 0.795 1.000 0.778 CA 1.305 10 residues pruned to eliminate duplicates Z: 14 32.055 2.404 0.874 0.913 0.923 0.462 CB 1.513 14 residues pruned to eliminate duplicates Z: 14 40.219 2.232 1.217 0.918 1.000 0.692 CB 1.590 14 residues pruned to eliminate duplicates Z: 17 24.743 2.173 1.082 0.595 0.875 0.625 CB 1.427 Z: 11 18.782 2.018 0.777 0.835 0.900 0.800 CB 1.378 11 residues pruned to eliminate duplicates Z: 15 31.732 2.181 1.143 0.906 0.929 0.714 CA 1.390 15 residues pruned to eliminate duplicates Z: 17 44.589 2.321 1.203 0.907 0.938 0.812 CA 1.653 17 residues pruned to eliminate duplicates Z: 17 32.039 2.301 0.830 0.781 0.938 0.688 CB 1.584 17 residues pruned to eliminate duplicates Z: 10 20.483 2.165 0.866 0.854 0.889 0.778 CB 1.404 Z: 12 48.487 2.546 1.199 0.926 0.909 0.636 CA 2.014 13 residues pruned to eliminate duplicates Z: 13 33.318 2.470 0.641 0.939 1.000 0.917 CA 1.649 13 residues pruned to eliminate duplicates Z: 34 46.956 2.345 1.037 0.604 0.879 0.667 CA 1.764 34 residues pruned to eliminate duplicates Z: 17 38.109 2.167 1.147 0.928 1.000 0.812 CB 1.434 16 residues pruned to eliminate duplicates Z: 11 33.615 2.453 1.037 0.864 0.900 0.800 CA 1.733 16 residues pruned to eliminate duplicates Z: 121 78.510 2.209 0.909 0.622 0.925 0.608 CB 1.638 121 residues pruned to eliminate duplicates Z: 15 36.035 2.273 0.813 0.889 1.000 0.571 CB 1.683 15 residues pruned to eliminate duplicates Z: 135 71.863 2.209 0.897 0.534 0.910 0.567 CB 1.574 123 residues pruned to eliminate duplicates Z: 15 34.140 2.247 0.900 0.896 1.000 0.571 CA 1.531 15 residues pruned to eliminate duplicates Z: 10 16.593 2.076 0.686 0.736 0.889 0.778 CB 1.438 10 residues pruned to eliminate duplicates Z: 27 23.599 2.075 0.844 0.306 0.923 0.615 CA 1.626 Z: 17 29.072 2.027 0.855 0.884 1.000 0.688 CA 1.396 15 residues pruned to eliminate duplicates Z: 14 34.961 2.298 0.957 0.881 0.923 0.615 CB 1.692 14 residues pruned to eliminate duplicates Z: 31 27.720 2.190 0.811 0.506 0.833 0.500 CB 1.523 10 residues pruned to eliminate duplicates Z: 60 58.876 2.239 0.986 0.639 0.966 0.678 CB 1.566 60 residues pruned to eliminate duplicates Z: 10 21.770 2.113 0.911 0.788 1.000 0.556 CA 1.395 10 residues pruned to eliminate duplicates Z: 17 37.652 2.360 0.925 0.923 0.938 0.812 CB 1.553 17 residues pruned to eliminate duplicates Z: 94 78.781 2.432 0.971 0.584 0.892 0.634 CB 1.762 94 residues pruned to eliminate duplicates Z: 14 19.332 2.004 1.026 0.572 0.846 0.615 CB 1.455 14 residues pruned to eliminate duplicates Z: 44 36.014 2.095 0.931 0.529 0.860 0.535 CA 1.534 44 residues pruned to eliminate duplicates Z: 11 19.220 2.096 1.013 0.593 0.900 0.600 CB 1.464 10 residues pruned to eliminate duplicates Z: 57 64.430 2.395 1.070 0.608 0.929 0.679 CB 1.689 57 residues pruned to eliminate duplicates Z: 11 16.605 2.103 0.555 0.923 0.900 0.800 CB 1.254 11 residues pruned to eliminate duplicates Z: 17 48.183 2.289 1.339 0.915 0.938 0.750 CA 1.696 17 residues pruned to eliminate duplicates Z: 84 70.364 2.187 0.996 0.658 0.928 0.663 CB 1.647 84 residues pruned to eliminate duplicates Z: 15 34.414 2.128 0.985 0.863 1.000 0.714 CA 1.597 15 residues pruned to eliminate duplicates Z: 16 25.565 2.237 0.517 0.811 0.933 0.533 CA 1.589 16 residues pruned to eliminate duplicates Z: 55 36.093 2.242 0.684 0.423 0.870 0.611 CA 1.619 55 residues pruned to eliminate duplicates Z: 12 43.735 2.525 1.007 0.902 1.000 0.727 CB 1.857 12 residues pruned to eliminate duplicates Z: 140 89.144 2.300 0.939 0.628 0.914 0.626 CB 1.645 94 residues pruned to eliminate duplicates Z: 17 36.563 2.182 0.828 0.902 1.000 0.750 CB 1.634 17 residues pruned to eliminate duplicates Z: 16 28.714 2.136 0.813 0.917 0.933 0.733 CA 1.447 16 residues pruned to eliminate duplicates Z: 16 26.722 2.040 0.849 0.890 0.867 0.733 CA 1.519 16 residues pruned to eliminate duplicates Z: 16 39.616 2.313 0.991 0.881 1.000 0.800 CB 1.609 16 residues pruned to eliminate duplicates Z: 9 15.585 2.109 0.788 0.728 0.750 0.500 CA 1.587 Z: 17 42.174 2.313 1.067 0.930 1.000 0.688 CB 1.542 17 residues pruned to eliminate duplicates Z: 13 20.985 2.034 0.724 0.910 0.917 0.750 CB 1.336 Z: 24 12.787 2.065 0.516 0.417 0.739 0.565 CB 1.257 14 residues pruned to eliminate duplicates Z: 17 36.961 2.234 1.037 0.931 1.000 1.000 CA 1.419 17 residues pruned to eliminate duplicates Z: 9 20.743 2.122 0.771 0.829 0.875 0.625 CA 1.678 9 residues pruned to eliminate duplicates Z: 13 39.976 2.452 1.058 0.914 0.917 0.750 CB 1.765 13 residues pruned to eliminate duplicates Z: 85 79.592 2.442 1.008 0.618 0.917 0.690 CB 1.729 85 residues pruned to eliminate duplicates Z: 10 18.805 1.969 0.529 0.908 1.000 0.889 CB 1.479 Z: 11 11.131 2.064 0.342 0.765 0.700 0.400 CB 1.435 11 residues pruned to eliminate duplicates Z: 76 66.167 2.216 0.888 0.648 0.960 0.667 CB 1.657 76 residues pruned to eliminate duplicates Z: 15 29.616 2.103 1.022 0.857 1.000 0.714 CA 1.372 15 residues pruned to eliminate duplicates Z: 14 32.874 2.101 1.052 0.872 0.923 0.692 CB 1.670 14 residues pruned to eliminate duplicates Z: 11 20.125 1.970 0.915 0.706 1.000 0.700 CA 1.398 9 residues pruned to eliminate duplicates Z: 15 32.727 2.328 0.563 0.950 1.000 1.000 CB 1.658 15 residues pruned to eliminate duplicates Z: 9 17.573 2.190 0.567 0.759 1.000 0.875 CA 1.437 9 residues pruned to eliminate duplicates Z: 16 28.643 2.167 0.825 0.911 0.933 0.667 CA 1.420 16 residues pruned to eliminate duplicates Z: 10 16.661 2.056 0.800 0.756 0.889 0.778 CA 1.344 10 residues pruned to eliminate duplicates Z: 18 14.769 1.790 0.497 0.530 1.000 0.588 CB 1.298 18 residues pruned to eliminate duplicates Z: 83 62.715 2.177 0.916 0.604 0.951 0.549 CB 1.580 62 residues pruned to eliminate duplicates Z: 21 21.113 2.183 0.638 0.449 0.900 0.550 CB 1.545 21 residues pruned to eliminate duplicates Z: 11 17.876 2.095 0.641 0.913 1.000 1.000 CB 1.164 11 residues pruned to eliminate duplicates Z: 18 28.835 2.194 0.750 0.825 0.941 0.824 CB 1.461 18 residues pruned to eliminate duplicates Z: 21 41.023 2.210 1.053 0.826 1.000 0.800 CA 1.525 21 residues pruned to eliminate duplicates Z: 8 15.626 2.402 0.400 0.787 0.857 0.429 CB 1.593 8 residues pruned to eliminate duplicates Z: 93 51.584 2.172 0.725 0.515 0.913 0.641 CB 1.549 73 residues pruned to eliminate duplicates Z: 12 13.306 2.027 0.817 0.537 0.818 0.636 CB 1.283 5 residues pruned to eliminate duplicates Z: 13 29.261 2.319 0.710 0.875 0.917 0.750 CA 1.689 13 residues pruned to eliminate duplicates Z: 24 19.096 2.144 0.646 0.458 0.870 0.565 CB 1.355 24 residues pruned to eliminate duplicates Z: 78 48.755 2.301 0.754 0.491 0.870 0.532 CB 1.597 78 residues pruned to eliminate duplicates Z: 15 21.358 2.197 0.466 0.864 0.929 0.857 CA 1.399 15 residues pruned to eliminate duplicates Z: 139 78.514 2.245 0.974 0.598 0.899 0.609 CB 1.530 139 residues pruned to eliminate duplicates Z: 17 41.264 2.258 0.990 0.920 1.000 0.812 CA 1.617 17 residues pruned to eliminate duplicates Z: 30 41.121 2.379 0.998 0.622 0.862 0.724 CB 1.660 30 residues pruned to eliminate duplicates Z: 14 33.585 2.286 1.067 0.862 0.923 0.692 CB 1.568 14 residues pruned to eliminate duplicates Z: 17 40.240 2.268 0.962 0.919 1.000 0.750 CB 1.594 17 residues pruned to eliminate duplicates Z: 11 15.809 1.943 0.544 0.784 1.000 0.600 CA 1.298 11 residues pruned to eliminate duplicates Z: 6 7.506 1.516 0.738 0.770 1.000 0.800 O 1.003 6 residues pruned to eliminate duplicates Z: 13 34.223 2.468 0.722 0.947 1.000 1.000 CA 1.607 13 residues pruned to eliminate duplicates Z: 128 80.239 2.280 0.866 0.621 0.929 0.606 CB 1.607 128 residues pruned to eliminate duplicates Z: 16 26.138 2.380 0.611 0.790 0.800 0.533 CB 1.705 16 residues pruned to eliminate duplicates Z: 114 80.284 2.421 0.953 0.533 0.903 0.584 CB 1.713 114 residues pruned to eliminate duplicates Z: 10 23.593 2.223 0.710 0.909 1.000 0.889 CB 1.468 10 residues pruned to eliminate duplicates Z: 18 39.445 2.162 0.989 0.939 1.000 0.765 CB 1.545 18 residues pruned to eliminate duplicates Z: 14 36.483 2.381 1.045 0.915 0.923 0.462 CB 1.591 14 residues pruned to eliminate duplicates Z: 15 25.832 2.136 0.561 0.934 0.929 0.857 CA 1.554 15 residues pruned to eliminate duplicates Z: 48 45.403 2.148 1.037 0.651 0.894 0.660 CB 1.472 48 residues pruned to eliminate duplicates Z: 79 66.326 2.258 1.050 0.623 0.923 0.564 CB 1.565 79 residues pruned to eliminate duplicates Z: 14 27.793 2.091 0.648 0.899 1.000 0.846 CA 1.599 14 residues pruned to eliminate duplicates Z: 24 18.262 2.241 0.605 0.403 0.783 0.391 CB 1.499 24 residues pruned to eliminate duplicates Z: 39 52.192 2.308 1.165 0.679 0.895 0.579 CB 1.605 39 residues pruned to eliminate duplicates Z: 17 48.384 2.259 1.212 0.922 1.000 0.812 CA 1.702 17 residues pruned to eliminate duplicates Z: 29 51.152 2.436 1.022 0.681 0.929 0.750 CB 1.790 29 residues pruned to eliminate duplicates Z: 116 84.780 2.269 0.956 0.641 0.957 0.687 CB 1.631 116 residues pruned to eliminate duplicates Z: 14 34.733 2.378 0.977 0.914 0.923 0.615 CB 1.569 14 residues pruned to eliminate duplicates Z: 18 34.756 2.284 1.011 0.807 0.941 0.588 CB 1.491 18 residues pruned to eliminate duplicates Z: 15 35.204 2.229 0.994 0.927 1.000 0.714 CA 1.483 15 residues pruned to eliminate duplicates Z: 18 37.945 2.171 0.856 0.942 1.000 0.941 CA 1.584 18 residues pruned to eliminate duplicates Z: 15 53.949 2.415 1.383 0.941 1.000 0.643 CB 1.739 15 residues pruned to eliminate duplicates Z: 80 76.806 2.363 1.004 0.657 0.962 0.684 CB 1.639 80 residues pruned to eliminate duplicates Z: 43 52.788 2.332 0.960 0.632 0.905 0.667 CB 1.740 43 residues pruned to eliminate duplicates Z: 90 70.271 2.366 0.903 0.562 0.910 0.607 CB 1.712 90 residues pruned to eliminate duplicates Z: 74 42.647 2.176 0.772 0.450 0.890 0.589 CB 1.530 74 residues pruned to eliminate duplicates Z: 72 38.217 2.153 0.684 0.437 0.845 0.620 CB 1.579 72 residues pruned to eliminate duplicates Z: 16 32.639 2.182 0.907 0.929 1.000 0.800 CA 1.417 16 residues pruned to eliminate duplicates Z: 48 30.338 2.115 0.831 0.463 0.830 0.596 CB 1.430 44 residues pruned to eliminate duplicates Z: 11 14.031 2.171 1.243 0.444 0.600 0.600 CB 1.609 14 residues pruned to eliminate duplicates Z: 126 72.576 2.245 0.908 0.539 0.896 0.608 CB 1.627 126 residues pruned to eliminate duplicates Z: 121 80.867 2.270 1.033 0.642 0.900 0.575 CB 1.556 121 residues pruned to eliminate duplicates Z: 15 40.866 2.334 1.070 0.900 1.000 0.643 CB 1.616 15 residues pruned to eliminate duplicates Z: 16 42.780 2.349 0.966 0.941 0.933 0.800 CB 1.778 16 residues pruned to eliminate duplicates Z: 10 15.976 2.193 0.558 0.631 0.889 0.889 CB 1.551 10 residues pruned to eliminate duplicates Z: 16 33.668 2.116 1.037 0.905 1.000 0.933 CB 1.436 16 residues pruned to eliminate duplicates Z: 11 16.945 1.853 0.555 0.915 1.000 0.600 CA 1.314 11 residues pruned to eliminate duplicates Z: 67 55.795 2.170 1.027 0.619 0.955 0.652 CB 1.462 67 residues pruned to eliminate duplicates Z: 26 17.920 1.819 0.659 0.492 0.880 0.480 CA 1.361 26 residues pruned to eliminate duplicates Z: 10 20.886 2.077 0.994 0.782 1.000 0.556 CA 1.311 10 residues pruned to eliminate duplicates Z: 11 18.380 1.965 0.813 0.732 1.000 0.600 CA 1.324 11 residues pruned to eliminate duplicates Z: 17 37.834 2.225 0.890 0.921 0.938 0.750 CB 1.689 17 residues pruned to eliminate duplicates Z: 111 79.845 2.267 1.005 0.641 0.955 0.618 CB 1.538 111 residues pruned to eliminate duplicates Z: 18 32.603 2.158 0.828 0.881 1.000 0.882 CB 1.451 18 residues pruned to eliminate duplicates Z: 17 20.890 1.946 0.687 0.775 1.000 0.750 CA 1.248 17 residues pruned to eliminate duplicates Z: 51 28.155 1.930 0.650 0.513 0.940 0.620 CB 1.313 36 residues pruned to eliminate duplicates Z: 7 7.367 1.927 0.247 0.585 0.833 0.667 CA 1.383 7 residues pruned to eliminate duplicates Z: 31 25.041 2.184 0.676 0.454 0.867 0.567 CB 1.510 32 residues pruned to eliminate duplicates Z: 17 24.916 1.962 0.597 0.873 0.938 0.875 CB 1.544 17 residues pruned to eliminate duplicates Z: 14 34.091 2.149 0.857 0.900 1.000 0.846 CB 1.693 14 residues pruned to eliminate duplicates Z: 33 26.044 2.147 0.614 0.465 0.906 0.719 CB 1.519 31 residues pruned to eliminate duplicates Z: 12 12.259 1.956 0.622 0.741 0.727 0.545 CA 1.290 12 residues pruned to eliminate duplicates Z: 17 50.407 2.398 1.321 0.941 1.000 0.500 CB 1.571 17 residues pruned to eliminate duplicates Z: 16 22.639 2.229 0.427 0.815 0.933 0.733 CA 1.497 16 residues pruned to eliminate duplicates Z: 13 20.830 2.185 0.895 0.462 0.917 0.667 CB 1.647 13 residues pruned to eliminate duplicates Z: 16 57.178 2.389 1.381 0.952 1.000 0.600 CA 1.787 16 residues pruned to eliminate duplicates Z: 17 43.467 2.256 0.991 0.934 1.000 0.875 CB 1.687 17 residues pruned to eliminate duplicates Z: 123 76.505 2.215 0.826 0.613 0.934 0.615 CB 1.647 123 residues pruned to eliminate duplicates Z: 15 24.804 2.045 0.658 0.911 1.000 0.357 CB 1.385 15 residues pruned to eliminate duplicates Z: 13 23.693 2.186 0.466 0.870 1.000 0.833 CB 1.558 13 residues pruned to eliminate duplicates Z: 85 61.132 2.209 0.891 0.620 0.929 0.595 CB 1.535 85 residues pruned to eliminate duplicates Z: 13 39.611 2.245 0.974 0.926 1.000 0.833 CB 1.809 13 residues pruned to eliminate duplicates Z: 17 36.601 2.235 0.790 0.895 1.000 0.625 CA 1.639 17 residues pruned to eliminate duplicates Z: 10 19.091 2.142 0.512 0.897 1.000 0.778 CB 1.406 11 residues pruned to eliminate duplicates Z: 11 18.494 2.104 0.528 0.903 1.000 0.800 CB 1.296 11 residues pruned to eliminate duplicates Z: 13 16.276 2.012 0.446 0.800 0.917 0.583 CB 1.356 13 residues pruned to eliminate duplicates Z: 16 28.360 2.176 0.757 0.897 1.000 0.800 CA 1.370 16 residues pruned to eliminate duplicates Z: 81 74.762 2.349 1.008 0.654 0.938 0.650 CB 1.639 81 residues pruned to eliminate duplicates Z: 10 15.280 1.954 0.796 0.824 1.000 0.667 CB 1.096 10 residues pruned to eliminate duplicates Z: 10 19.233 2.226 0.493 0.880 0.889 0.667 CA 1.571 10 residues pruned to eliminate duplicates Z: 15 38.262 2.222 1.070 0.915 0.929 0.786 CB 1.692 15 residues pruned to eliminate duplicates Z: 15 18.306 1.769 0.678 0.884 0.929 0.786 CB 1.283 15 residues pruned to eliminate duplicates Z: 11 13.636 2.050 0.807 0.489 0.800 0.800 CB 1.471 11 residues pruned to eliminate duplicates Z: 13 20.235 1.809 0.759 0.787 1.000 0.750 CA 1.426 13 residues pruned to eliminate duplicates Z: 16 35.214 2.159 1.121 0.900 1.000 0.467 CA 1.418 16 residues pruned to eliminate duplicates Z: 14 30.520 2.239 0.672 0.915 1.000 0.923 CA 1.598 14 residues pruned to eliminate duplicates Z: 34 29.375 2.205 0.725 0.485 0.909 0.545 CB 1.502 34 residues pruned to eliminate duplicates Z: 58 64.280 2.370 1.037 0.617 0.947 0.684 CB 1.666 58 residues pruned to eliminate duplicates Z: 83 61.160 2.270 0.936 0.531 0.927 0.610 CB 1.609 83 residues pruned to eliminate duplicates Z: 72 42.943 2.222 0.770 0.547 0.887 0.592 CB 1.396 70 residues pruned to eliminate duplicates Z: 113 78.932 2.276 0.829 0.633 0.938 0.670 CB 1.687 113 residues pruned to eliminate duplicates Z: 21 12.502 2.002 0.800 0.305 0.700 0.400 CA 1.377 21 residues pruned to eliminate duplicates Z: 10 18.618 2.002 0.940 0.795 0.889 0.667 CA 1.388 10 residues pruned to eliminate duplicates Z: 85 62.458 2.358 0.878 0.509 0.893 0.583 CB 1.709 85 residues pruned to eliminate duplicates Z: 7 5.599 1.946 0.264 0.310 0.833 0.500 CA 1.377 7 residues pruned to eliminate duplicates Z: 16 28.138 2.067 0.585 0.902 1.000 0.800 CB 1.582 16 residues pruned to eliminate duplicates Z: 13 44.366 2.396 1.119 0.864 1.000 0.917 CA 1.849 13 residues pruned to eliminate duplicates Z: 88 69.661 2.216 0.959 0.640 0.920 0.552 CB 1.641 90 residues pruned to eliminate duplicates Z: 137 92.440 2.299 1.010 0.643 0.956 0.684 CB 1.571 137 residues pruned to eliminate duplicates Z: 17 23.950 2.083 1.044 0.862 0.875 0.688 CB 1.180 17 residues pruned to eliminate duplicates Z: 10 15.719 2.026 0.952 0.712 0.778 0.667 CA 1.405 10 residues pruned to eliminate duplicates Z: 14 36.928 2.371 0.885 0.884 1.000 0.769 CB 1.656 14 residues pruned to eliminate duplicates Z: 18 28.627 2.069 0.853 0.805 0.941 0.647 CA 1.474 18 residues pruned to eliminate duplicates Z: 8 11.835 1.757 0.745 0.714 1.000 0.857 CA 1.201 8 residues pruned to eliminate duplicates Z: 21 37.069 2.444 0.907 0.724 0.900 0.500 CB 1.615 21 residues pruned to eliminate duplicates Z: 88 65.902 2.220 0.763 0.648 0.943 0.678 CB 1.669 88 residues pruned to eliminate duplicates Z: 10 14.131 1.921 0.985 0.754 0.778 0.556 CB 1.267 10 residues pruned to eliminate duplicates Z: 8 10.484 1.865 0.995 0.589 0.857 0.714 CB 1.140 8 residues pruned to eliminate duplicates Z: 12 18.417 2.070 0.494 0.838 1.000 0.727 CA 1.342 12 residues pruned to eliminate duplicates Z: 16 50.520 2.387 1.295 0.953 0.933 0.800 CB 1.756 16 residues pruned to eliminate duplicates Z: 13 23.417 2.076 0.727 0.910 0.917 0.750 CB 1.459 13 residues pruned to eliminate duplicates Z: 10 15.014 1.993 0.470 0.841 1.000 0.778 CA 1.274 10 residues pruned to eliminate duplicates Z: 11 21.372 2.158 0.777 0.899 0.900 0.900 CB 1.400 11 residues pruned to eliminate duplicates Z: 10 20.956 2.008 1.052 0.817 1.000 0.889 CA 1.287 10 residues pruned to eliminate duplicates Z: 71 70.222 2.311 0.953 0.662 0.957 0.671 CB 1.672 71 residues pruned to eliminate duplicates Z: 11 18.910 1.847 1.181 0.776 1.000 0.800 CA 1.163 11 residues pruned to eliminate duplicates Z: 14 42.254 2.419 1.166 0.936 0.923 0.615 CB 1.688 14 residues pruned to eliminate duplicates Z: 17 49.245 2.360 1.469 0.926 0.938 0.625 CB 1.580 17 residues pruned to eliminate duplicates Z: 10 21.144 1.981 1.132 0.828 1.000 0.556 CB 1.257 10 residues pruned to eliminate duplicates Z: 28 43.980 2.375 1.046 0.603 0.889 0.630 CB 1.776 28 residues pruned to eliminate duplicates Z: 15 26.929 2.096 0.795 0.898 0.929 0.643 CB 1.473 15 residues pruned to eliminate duplicates Z: 14 10.745 1.880 0.250 0.484 0.923 0.538 CB 1.397 14 residues pruned to eliminate duplicates Z: 14 29.527 2.357 0.650 0.865 1.000 0.769 CA 1.542 14 residues pruned to eliminate duplicates Z: 14 21.808 1.998 0.757 0.930 1.000 0.846 CB 1.205 14 residues pruned to eliminate duplicates Z: 84 65.377 2.254 0.942 0.597 0.928 0.627 CB 1.612 84 residues pruned to eliminate duplicates Z: 14 30.501 2.198 1.093 0.923 0.923 0.615 CA 1.400 14 residues pruned to eliminate duplicates Z: 113 78.946 2.263 0.829 0.631 0.938 0.607 CB 1.701 113 residues pruned to eliminate duplicates Z: 17 21.012 2.264 0.970 0.617 0.750 0.750 CB 1.406 17 residues pruned to eliminate duplicates Z: 12 13.789 2.001 0.247 0.864 0.909 0.818 CB 1.343 12 residues pruned to eliminate duplicates Z: 14 34.802 2.365 0.829 0.888 1.000 0.769 CA 1.608 14 residues pruned to eliminate duplicates Z: 14 35.628 2.309 0.959 0.934 0.923 0.846 CA 1.651 14 residues pruned to eliminate duplicates Z: 15 31.788 2.144 1.015 0.904 0.929 0.643 CB 1.509 15 residues pruned to eliminate duplicates Z: 13 16.105 1.954 0.408 0.819 1.000 0.583 CB 1.281 13 residues pruned to eliminate duplicates Z: 16 23.908 2.058 0.463 0.924 0.933 0.933 CB 1.541 16 residues pruned to eliminate duplicates Z: 13 34.083 2.478 0.837 0.923 0.917 0.500 CA 1.657 13 residues pruned to eliminate duplicates Z: 26 29.585 2.179 0.935 0.640 0.840 0.520 CB 1.465 26 residues pruned to eliminate duplicates Z: 127 87.616 2.295 0.916 0.629 0.968 0.556 CB 1.624 127 residues pruned to eliminate duplicates Z: 102 80.286 2.315 1.021 0.608 0.950 0.624 CB 1.621 102 residues pruned to eliminate duplicates Z: 17 40.169 2.262 1.023 0.886 0.938 0.688 CA 1.689 17 residues pruned to eliminate duplicates Z: 51 45.255 2.235 0.949 0.537 0.920 0.580 CB 1.540 51 residues pruned to eliminate duplicates Z: 12 16.099 1.834 0.838 0.752 0.909 0.545 CA 1.265 12 residues pruned to eliminate duplicates Z: 39 31.437 2.096 0.659 0.639 0.895 0.684 CB 1.439 39 residues pruned to eliminate duplicates Z: 11 10.853 2.097 0.326 0.766 0.700 0.300 CB 1.392 11 residues pruned to eliminate duplicates Z: 17 37.603 2.198 0.995 0.852 1.000 0.812 CA 1.585 17 residues pruned to eliminate duplicates Z: 11 16.000 2.130 0.642 0.834 0.900 0.500 CB 1.205 11 residues pruned to eliminate duplicates Z: 83 61.653 2.274 0.844 0.605 0.927 0.610 CB 1.586 83 residues pruned to eliminate duplicates Z: 15 21.170 2.159 0.322 0.913 1.000 0.929 CA 1.403 15 residues pruned to eliminate duplicates Z: 17 21.962 1.902 0.470 0.823 1.000 0.625 CB 1.484 17 residues pruned to eliminate duplicates Z: 10 17.844 2.224 0.390 0.786 1.000 1.000 CA 1.496 10 residues pruned to eliminate duplicates Z: 92 63.519 2.190 0.804 0.624 0.934 0.582 CB 1.605 92 residues pruned to eliminate duplicates Z: 142 85.115 2.216 0.864 0.641 0.950 0.660 CB 1.600 142 residues pruned to eliminate duplicates Z: 144 92.757 2.297 1.032 0.622 0.923 0.664 CB 1.604 144 residues pruned to eliminate duplicates Z: 28 36.375 2.387 0.861 0.574 0.926 0.630 CB 1.584 28 residues pruned to eliminate duplicates Z: 9 21.381 2.213 0.627 0.813 1.000 0.625 CA 1.598 9 residues pruned to eliminate duplicates Z: 16 26.522 2.085 0.555 0.900 1.000 0.800 CB 1.509 16 residues pruned to eliminate duplicates Z: 12 8.200 1.823 0.723 0.342 0.909 0.545 CB 1.028 12 residues pruned to eliminate duplicates Z: 15 33.640 2.142 1.010 0.916 1.000 0.857 CA 1.474 15 residues pruned to eliminate duplicates Z: 15 27.005 2.087 0.938 0.876 0.929 0.429 CA 1.397 15 residues pruned to eliminate duplicates Z: 22 20.367 2.228 0.555 0.463 0.905 0.667 CB 1.473 22 residues pruned to eliminate duplicates Z: 17 40.415 2.266 0.889 0.919 1.000 0.750 CB 1.663 17 residues pruned to eliminate duplicates Z: 91 64.229 2.189 0.815 0.639 0.944 0.656 CB 1.583 91 residues pruned to eliminate duplicates Z: 9 9.000 1.933 0.634 0.547 0.875 0.750 CA 1.100 9 residues pruned to eliminate duplicates Z: 14 29.365 2.111 0.521 0.925 1.000 0.923 CB 1.779 14 residues pruned to eliminate duplicates Z: 95 66.241 2.184 0.977 0.617 0.926 0.638 CB 1.531 95 residues pruned to eliminate duplicates Z: 40 31.786 2.182 0.898 0.498 0.795 0.538 CB 1.549 40 residues pruned to eliminate duplicates Z: 54 39.593 2.065 0.844 0.617 0.887 0.623 CB 1.442 54 residues pruned to eliminate duplicates Z: 72 58.989 2.199 0.809 0.643 0.930 0.620 CB 1.656 72 residues pruned to eliminate duplicates Z: 11 15.582 1.842 0.906 0.708 0.900 0.500 CA 1.291 11 residues pruned to eliminate duplicates Z: 86 66.932 2.240 0.777 0.667 0.953 0.671 CB 1.639 86 residues pruned to eliminate duplicates Z: 112 78.984 2.283 0.891 0.637 0.910 0.649 CB 1.678 112 residues pruned to eliminate duplicates Z: 27 18.508 2.010 0.738 0.337 0.846 0.577 CB 1.466 27 residues pruned to eliminate duplicates Z: 79 64.883 2.267 1.029 0.602 0.936 0.590 CB 1.550 79 residues pruned to eliminate duplicates Z: 21 38.609 2.367 0.871 0.706 0.900 0.500 CA 1.796 21 residues pruned to eliminate duplicates Z: 17 20.519 1.985 0.568 0.882 1.000 0.750 CB 1.192 17 residues pruned to eliminate duplicates Z: 14 8.637 1.869 0.637 0.182 0.846 0.385 CA 1.358 14 residues pruned to eliminate duplicates Z: 12 12.919 2.054 0.423 0.817 0.909 0.818 CA 1.114 12 residues pruned to eliminate duplicates Z: 142 88.596 2.310 0.916 0.621 0.922 0.667 CB 1.631 142 residues pruned to eliminate duplicates Z: 7 3.856 1.833 -0.141 0.560 0.833 0.500 N 1.131 Z: 14 13.246 1.891 0.339 0.832 0.769 0.769 CB 1.416 14 residues pruned to eliminate duplicates Z: 72 65.903 2.368 0.888 0.603 0.930 0.620 CB 1.706 72 residues pruned to eliminate duplicates Z: 10 17.989 1.948 0.605 0.921 1.000 0.778 CB 1.349 10 residues pruned to eliminate duplicates Z: 10 17.449 2.066 0.735 0.742 1.000 0.444 CA 1.307 10 residues pruned to eliminate duplicates Z: 16 16.632 2.255 0.443 0.507 0.867 0.667 CB 1.512 16 residues pruned to eliminate duplicates Z: 106 69.306 2.251 0.924 0.571 0.914 0.610 CB 1.595 106 residues pruned to eliminate duplicates Z: 21 26.960 2.181 0.712 0.531 0.950 0.600 CA 1.649 25 residues pruned to eliminate duplicates Z: 12 14.102 2.105 0.873 0.463 0.818 0.455 CB 1.368 12 residues pruned to eliminate duplicates Z: 84 78.516 2.249 0.988 0.691 0.964 0.771 CB 1.679 84 residues pruned to eliminate duplicates Z: 73 65.763 2.257 0.924 0.633 0.944 0.625 CB 1.668 73 residues pruned to eliminate duplicates Z: 19 10.594 1.656 0.708 0.547 0.833 0.389 CB 1.012 19 residues pruned to eliminate duplicates Z: 11 18.667 1.909 1.035 0.748 0.900 0.400 CA 1.352 11 residues pruned to eliminate duplicates Z: 12 20.474 1.794 1.127 0.803 0.909 0.545 CB 1.366 12 residues pruned to eliminate duplicates Z: 9 18.499 2.023 0.719 0.878 1.000 0.625 CB 1.364 9 residues pruned to eliminate duplicates Z: 15 25.696 2.200 0.771 0.930 1.000 0.786 CB 1.232 15 residues pruned to eliminate duplicates Z: 43 36.551 2.100 0.730 0.559 0.952 0.738 CB 1.540 43 residues pruned to eliminate duplicates Z: 88 57.359 2.187 0.729 0.633 0.908 0.655 CB 1.581 88 residues pruned to eliminate duplicates Z: 17 44.714 2.404 1.331 0.929 0.875 0.750 CB 1.595 17 residues pruned to eliminate duplicates Z: 15 29.695 2.162 0.760 0.905 1.000 0.857 CA 1.484 15 residues pruned to eliminate duplicates Z: 15 26.727 2.048 0.809 0.904 0.929 0.357 CB 1.480 15 residues pruned to eliminate duplicates Z: 8 10.951 1.884 0.985 0.583 0.857 0.571 CB 1.192 Z: 8 11.256 2.067 0.920 0.582 0.714 0.714 CB 1.387 8 residues pruned to eliminate duplicates Z: 11 20.140 1.946 0.860 0.790 1.000 0.900 CA 1.364 11 residues pruned to eliminate duplicates Z: 13 19.550 1.903 0.428 0.908 1.000 0.917 CB 1.476 13 residues pruned to eliminate duplicates Z: 124 89.211 2.354 0.990 0.598 0.935 0.602 CB 1.673 124 residues pruned to eliminate duplicates Z: 16 27.110 2.172 0.640 0.937 1.000 0.867 CA 1.367 16 residues pruned to eliminate duplicates Z: 12 15.839 1.814 0.938 0.794 0.909 0.636 CB 1.155 12 residues pruned to eliminate duplicates Z: 17 36.372 2.202 1.141 0.888 0.875 0.750 CB 1.589 17 residues pruned to eliminate duplicates Z: 15 21.786 1.928 0.771 0.903 1.000 0.786 CB 1.216 15 residues pruned to eliminate duplicates Z: 127 88.543 2.296 1.043 0.626 0.944 0.611 CB 1.582 127 residues pruned to eliminate duplicates Z: 15 16.378 1.781 0.590 0.873 0.929 0.571 CB 1.212 15 residues pruned to eliminate duplicates Z: 15 20.564 1.905 0.667 0.891 1.000 0.571 CB 1.244 15 residues pruned to eliminate duplicates Z: 17 22.257 1.999 0.660 0.897 0.938 0.812 CA 1.280 17 residues pruned to eliminate duplicates Z: 15 52.467 2.392 1.255 0.943 1.000 0.786 CB 1.802 15 residues pruned to eliminate duplicates Z: 83 78.940 2.337 1.045 0.654 0.939 0.720 CB 1.684 83 residues pruned to eliminate duplicates Z: 15 31.086 2.076 0.979 0.908 1.000 0.714 CA 1.436 15 residues pruned to eliminate duplicates Z: 212 96.515 2.239 0.866 0.579 0.948 0.607 CB 1.556 209 residues pruned to eliminate duplicates Z: 11 20.297 1.903 0.973 0.834 1.000 0.700 CB 1.282 11 residues pruned to eliminate duplicates Z: 77 69.291 2.380 0.958 0.590 0.921 0.645 CB 1.700 77 residues pruned to eliminate duplicates Z: 7 3.833 1.753 -0.063 0.619 0.667 0.667 CB 1.278 Z: 10 15.201 2.163 0.120 0.912 1.000 1.000 CA 1.482 10 residues pruned to eliminate duplicates Z: 26 15.407 1.966 0.604 0.340 0.840 0.600 CB 1.385 26 residues pruned to eliminate duplicates Z: 14 11.820 2.034 0.841 0.365 0.769 0.462 CB 1.315 14 residues pruned to eliminate duplicates Z: 104 77.052 2.276 1.065 0.622 0.913 0.563 CB 1.577 104 residues pruned to eliminate duplicates Z: 14 31.918 2.187 1.002 0.924 0.923 0.462 CB 1.538 14 residues pruned to eliminate duplicates Z: 28 22.005 2.128 0.662 0.322 0.889 0.556 CB 1.639 28 residues pruned to eliminate duplicates Z: 16 53.440 2.364 1.285 0.933 1.000 0.733 CB 1.783 16 residues pruned to eliminate duplicates Z: 17 37.860 2.221 1.048 0.890 0.938 0.625 CB 1.597 17 residues pruned to eliminate duplicates Z: 13 6.655 1.763 -0.029 0.518 0.833 0.750 N 1.323 Z: 70 54.009 2.156 1.083 0.616 0.957 0.638 CB 1.357 69 residues pruned to eliminate duplicates Z: 12 10.751 1.740 0.565 0.671 0.818 0.545 CA 1.243 12 residues pruned to eliminate duplicates Z: 32 26.017 2.247 0.641 0.349 0.903 0.613 CA 1.653 32 residues pruned to eliminate duplicates Z: 11 14.771 2.060 0.382 0.910 1.000 0.800 CB 1.164 11 residues pruned to eliminate duplicates Z: 7 6.687 1.977 0.337 0.537 0.667 0.500 CA 1.494 7 residues pruned to eliminate duplicates Z: 103 76.910 2.291 1.066 0.617 0.922 0.559 CB 1.563 103 residues pruned to eliminate duplicates Z: 64 57.881 2.350 0.907 0.647 0.857 0.571 CB 1.655 64 residues pruned to eliminate duplicates Z: 10 18.291 1.962 0.719 0.883 1.000 0.556 CB 1.307 10 residues pruned to eliminate duplicates Z: 101 75.624 2.315 0.976 0.619 0.900 0.670 CB 1.641 101 residues pruned to eliminate duplicates Z: 17 44.073 2.339 1.240 0.925 0.875 0.625 CB 1.687 17 residues pruned to eliminate duplicates Z: 13 18.857 1.945 0.463 0.853 1.000 0.667 CA 1.413 13 residues pruned to eliminate duplicates Z: 7 3.659 1.519 0.205 0.472 0.833 0.333 N 1.007 Z: 81 59.800 2.220 0.820 0.671 0.925 0.600 CB 1.528 81 residues pruned to eliminate duplicates Z: 118 77.295 2.237 0.853 0.627 0.915 0.641 CB 1.673 118 residues pruned to eliminate duplicates Z: 198 92.849 2.253 0.836 0.574 0.929 0.629 CB 1.603 198 residues pruned to eliminate duplicates Z: 16 26.332 2.164 0.797 0.894 0.933 0.733 CA 1.343 16 residues pruned to eliminate duplicates Z: 10 19.664 2.258 0.307 0.870 1.000 0.889 CA 1.621 10 residues pruned to eliminate duplicates Z: 16 35.532 2.238 1.059 0.883 0.933 0.733 CB 1.543 16 residues pruned to eliminate duplicates Z: 16 15.160 2.057 0.522 0.554 0.867 0.467 CB 1.368 16 residues pruned to eliminate duplicates Z: 140 95.686 2.394 0.964 0.613 0.914 0.612 CB 1.698 140 residues pruned to eliminate duplicates Z: 15 35.275 2.453 0.774 0.809 1.000 0.571 CB 1.655 15 residues pruned to eliminate duplicates Z: 8 2.212 1.582 0.483 0.244 0.571 0.286 CB 0.839 5 residues pruned to eliminate duplicates Z: 83 68.225 2.231 0.850 0.632 0.951 0.622 CB 1.694 83 residues pruned to eliminate duplicates Z: 117 84.573 2.249 0.936 0.638 0.948 0.621 CB 1.671 117 residues pruned to eliminate duplicates Z: 6 5.942 1.835 0.254 0.635 1.000 0.400 C 1.017 6 residues pruned to eliminate duplicates Z: 13 35.535 2.201 1.202 0.924 0.917 0.833 CB 1.621 13 residues pruned to eliminate duplicates Z: 12 14.904 1.978 0.649 0.460 0.909 0.545 CB 1.580 12 residues pruned to eliminate duplicates Z: 8 8.598 1.702 0.237 0.789 0.857 0.571 CA 1.397 8 residues pruned to eliminate duplicates Z: 15 20.771 1.833 0.448 0.895 1.000 0.786 CB 1.499 15 residues pruned to eliminate duplicates Z: 11 19.392 1.857 0.997 0.769 1.000 0.500 CA 1.303 11 residues pruned to eliminate duplicates Z: 10 24.544 2.277 0.675 0.919 1.000 1.000 CB 1.512 10 residues pruned to eliminate duplicates Z: 84 62.243 2.211 0.905 0.646 0.916 0.578 CB 1.545 84 residues pruned to eliminate duplicates Z: 15 23.039 1.952 0.607 0.894 1.000 0.857 CB 1.408 15 residues pruned to eliminate duplicates Z: 16 25.350 2.025 0.730 0.906 0.933 0.667 CA 1.423 16 residues pruned to eliminate duplicates Z: 12 21.263 1.842 0.727 0.872 1.000 0.545 CA 1.469 12 residues pruned to eliminate duplicates Z: 16 44.133 2.298 0.993 0.946 1.000 1.000 CB 1.721 16 residues pruned to eliminate duplicates Z: 62 46.609 2.261 0.797 0.566 0.934 0.639 CB 1.474 62 residues pruned to eliminate duplicates Z: 16 34.568 2.182 1.012 0.929 1.000 0.933 CA 1.423 16 residues pruned to eliminate duplicates Z: 37 22.812 2.084 0.705 0.432 0.778 0.528 CA 1.475 37 residues pruned to eliminate duplicates Z: 8 14.674 2.063 0.442 0.891 0.857 0.286 CB 1.564 8 residues pruned to eliminate duplicates Z: 11 11.617 1.841 0.436 0.841 0.900 0.800 CB 1.151 11 residues pruned to eliminate duplicates Z: 27 17.643 1.935 0.660 0.520 0.846 0.385 CB 1.248 27 residues pruned to eliminate duplicates Z: 10 17.464 2.220 0.566 0.782 0.889 0.444 CB 1.470 10 residues pruned to eliminate duplicates Z: 8 8.518 1.726 0.716 0.643 0.857 0.429 CA 1.110 9 residues pruned to eliminate duplicates Z: 34 50.890 2.190 1.220 0.640 0.909 0.667 CB 1.758 34 residues pruned to eliminate duplicates Z: 14 17.662 1.851 0.480 0.904 1.000 1.000 CA 1.274 14 residues pruned to eliminate duplicates Z: 9 16.437 1.939 0.869 0.818 0.875 0.500 CA 1.390 9 residues pruned to eliminate duplicates Z: 13 32.369 2.397 0.442 0.924 1.000 0.917 CB 1.899 13 residues pruned to eliminate duplicates Z: 74 66.942 2.424 0.983 0.532 0.904 0.589 CB 1.748 74 residues pruned to eliminate duplicates Z: 15 26.251 2.208 1.114 0.920 0.929 0.643 CB 1.140 15 residues pruned to eliminate duplicates Z: 21 19.497 2.080 0.622 0.443 0.900 0.450 CB 1.524 21 residues pruned to eliminate duplicates Z: 14 9.195 1.600 0.590 0.455 0.846 0.538 CB 1.241 7 residues pruned to eliminate duplicates Z: 17 20.606 1.941 0.543 0.853 0.938 0.750 CB 1.355 17 residues pruned to eliminate duplicates Z: 53 41.533 2.055 0.717 0.655 0.942 0.558 CB 1.500 53 residues pruned to eliminate duplicates Z: 11 13.717 1.766 0.842 0.798 0.900 0.700 CA 1.141 11 residues pruned to eliminate duplicates Z: 16 38.116 2.228 1.103 0.897 0.933 0.800 CB 1.611 16 residues pruned to eliminate duplicates Z: 13 15.330 1.939 0.657 0.640 0.917 0.583 CA 1.318 13 residues pruned to eliminate duplicates Z: 123 75.236 2.188 0.867 0.620 0.951 0.648 CB 1.567 127 residues pruned to eliminate duplicates Z: 17 25.961 1.994 0.916 0.893 0.938 0.750 CA 1.301 17 residues pruned to eliminate duplicates Z: 16 27.267 2.149 0.720 0.888 1.000 0.867 CA 1.372 16 residues pruned to eliminate duplicates Z: 15 28.176 2.251 0.606 0.923 1.000 0.857 CA 1.464 15 residues pruned to eliminate duplicates Z: 6 5.048 2.000 -0.387 0.758 1.000 0.800 CB 1.465 Z: 12 12.790 1.765 0.927 0.580 0.818 0.455 CA 1.283 12 residues pruned to eliminate duplicates Z: 11 5.640 1.774 0.228 0.442 0.700 0.400 CB 1.242 7 residues pruned to eliminate duplicates Z: 10 19.946 2.233 0.703 0.890 0.889 0.556 CB 1.415 10 residues pruned to eliminate duplicates Z: 8 8.667 1.882 -0.034 0.912 1.000 1.000 CB 1.276 Z: 44 38.600 2.239 0.827 0.552 0.907 0.488 CB 1.509 44 residues pruned to eliminate duplicates Z: 79 54.259 2.297 0.888 0.522 0.897 0.641 CB 1.544 79 residues pruned to eliminate duplicates Z: 7 7.091 1.640 0.378 0.655 1.000 0.833 CA 1.109 7 residues pruned to eliminate duplicates Z: 15 29.056 2.188 0.902 0.898 0.929 0.786 CA 1.437 15 residues pruned to eliminate duplicates Z: 148 88.421 2.290 0.949 0.614 0.918 0.626 CB 1.598 146 residues pruned to eliminate duplicates Z: 36 22.146 2.190 0.544 0.433 0.771 0.400 CB 1.539 36 residues pruned to eliminate duplicates Z: 10 8.451 1.487 0.566 0.871 1.000 0.778 CB 0.882 Z: 84 58.178 2.188 0.871 0.593 0.904 0.578 CB 1.579 84 residues pruned to eliminate duplicates Z: 15 18.819 1.879 0.791 0.838 0.929 0.571 CB 1.202 15 residues pruned to eliminate duplicates Z: 75 45.286 2.170 0.880 0.463 0.905 0.649 CB 1.480 75 residues pruned to eliminate duplicates Z: 15 23.438 2.201 0.815 0.920 0.929 0.643 CB 1.189 15 residues pruned to eliminate duplicates Z: 10 15.086 2.216 0.144 0.786 1.000 0.667 CA 1.543 10 residues pruned to eliminate duplicates Z: 29 29.968 2.156 0.931 0.611 0.893 0.500 CB 1.371 29 residues pruned to eliminate duplicates Z: 140 82.678 2.335 0.882 0.594 0.906 0.568 CB 1.610 140 residues pruned to eliminate duplicates Z: 10 11.635 1.791 0.686 0.650 0.889 0.667 CB 1.257 5 residues pruned to eliminate duplicates Z: 16 22.799 1.983 0.406 0.894 1.000 0.800 CA 1.514 16 residues pruned to eliminate duplicates Z: 7 6.286 1.726 0.370 0.341 0.833 0.667 C 1.548 Z: 36 44.049 2.217 1.058 0.622 0.943 0.629 CB 1.542 36 residues pruned to eliminate duplicates Z: 12 17.748 1.710 0.985 0.829 1.000 0.909 CA 1.186 12 residues pruned to eliminate duplicates Z: 8 10.209 2.104 0.432 0.543 0.857 0.571 CA 1.432 8 residues pruned to eliminate duplicates Z: 9 21.843 2.311 0.740 0.791 0.875 0.875 CA 1.700 9 residues pruned to eliminate duplicates Z: 15 30.866 2.189 0.864 0.917 1.000 0.786 CA 1.427 15 residues pruned to eliminate duplicates Z: 32 48.202 2.322 1.061 0.654 0.903 0.645 CB 1.735 32 residues pruned to eliminate duplicates Z: 10 15.138 2.035 0.662 0.736 0.889 0.556 CA 1.358 10 residues pruned to eliminate duplicates Z: 7 4.469 1.306 1.051 0.468 0.667 0.667 C 1.056 7 residues pruned to eliminate duplicates Z: 23 28.622 2.306 0.823 0.548 0.864 0.591 CB 1.603 23 residues pruned to eliminate duplicates Z: 108 83.277 2.311 1.043 0.641 0.935 0.598 CB 1.599 108 residues pruned to eliminate duplicates Z: 10 11.446 1.555 0.493 0.781 1.000 0.556 CA 1.284 Z: 7 7.854 1.589 0.125 0.865 1.000 1.000 CA 1.314 7 residues pruned to eliminate duplicates Z: 73 56.571 2.166 0.978 0.610 0.944 0.722 CB 1.484 72 residues pruned to eliminate duplicates Z: 10 7.194 1.447 0.651 0.854 1.000 0.889 CB 0.741 10 residues pruned to eliminate duplicates Z: 15 29.090 2.169 0.732 0.911 1.000 0.857 CA 1.467 15 residues pruned to eliminate duplicates Z: 6 11.126 1.959 0.180 0.808 1.000 1.000 C 1.646 5 residues pruned to eliminate duplicates Z: 56 46.943 2.277 0.889 0.523 0.855 0.600 CB 1.683 56 residues pruned to eliminate duplicates Z: 16 23.820 2.049 0.536 0.892 0.933 0.600 CB 1.505 16 residues pruned to eliminate duplicates Z: 10 18.193 2.164 0.385 0.911 1.000 1.000 CA 1.434 10 residues pruned to eliminate duplicates Z: 17 20.278 1.922 0.668 0.883 0.938 0.812 CA 1.219 17 residues pruned to eliminate duplicates Z: 28 42.523 2.277 1.161 0.594 0.963 0.704 CB 1.578 28 residues pruned to eliminate duplicates Z: 14 19.750 1.998 0.543 0.926 1.000 0.769 CB 1.246 14 residues pruned to eliminate duplicates Z: 17 16.558 1.762 0.550 0.726 0.938 0.562 CB 1.318 17 residues pruned to eliminate duplicates Z: 47 24.361 2.126 0.516 0.423 0.804 0.522 CB 1.500 47 residues pruned to eliminate duplicates Z: 18 39.441 2.148 1.026 0.872 1.000 0.824 CA 1.602 18 residues pruned to eliminate duplicates Z: 15 24.678 2.151 0.578 0.873 0.929 0.643 CA 1.524 15 residues pruned to eliminate duplicates Z: 16 19.224 1.919 0.692 0.790 0.867 0.733 CB 1.367 16 residues pruned to eliminate duplicates Z: 9 19.804 1.872 1.160 0.859 1.000 0.750 CA 1.274 9 residues pruned to eliminate duplicates Z: 16 31.342 2.245 0.737 0.897 0.933 0.600 CB 1.591 16 residues pruned to eliminate duplicates Z: 6 3.756 1.451 0.521 0.638 0.800 0.600 CB 0.836 6 residues pruned to eliminate duplicates Z: 21 30.080 2.169 0.811 0.718 0.950 0.750 CB 1.480 21 residues pruned to eliminate duplicates Z: 81 66.314 2.287 0.872 0.638 0.938 0.588 CB 1.623 81 residues pruned to eliminate duplicates Z: 16 30.217 2.366 0.592 0.922 1.000 0.733 CB 1.457 16 residues pruned to eliminate duplicates Z: 53 48.365 2.173 0.909 0.697 0.923 0.635 CB 1.463 53 residues pruned to eliminate duplicates Z: 9 9.284 1.968 0.401 0.429 0.875 0.500 CB 1.465 9 residues pruned to eliminate duplicates Z: 7 7.992 1.832 0.225 0.751 0.833 0.667 CB 1.395 7 residues pruned to eliminate duplicates Z: 10 20.286 1.984 1.090 0.813 1.000 0.556 CB 1.242 10 residues pruned to eliminate duplicates Z: 84 73.598 2.246 0.921 0.673 0.964 0.747 CB 1.656 84 residues pruned to eliminate duplicates Z: 10 12.000 1.891 0.952 0.794 0.778 0.778 CB 1.077 10 residues pruned to eliminate duplicates Z: 84 75.508 2.263 1.051 0.656 0.952 0.614 CB 1.623 84 residues pruned to eliminate duplicates Z: 15 25.338 2.108 0.701 0.896 0.929 0.643 CA 1.457 15 residues pruned to eliminate duplicates Z: 7 6.239 1.505 0.687 0.493 0.833 0.667 CA 1.212 7 residues pruned to eliminate duplicates Z: 16 19.013 2.074 0.505 0.915 0.933 0.800 CB 1.191 16 residues pruned to eliminate duplicates Z: 10 21.731 2.212 0.547 0.913 1.000 0.778 CB 1.497 10 residues pruned to eliminate duplicates Z: 12 26.632 2.446 0.591 0.866 0.909 0.818 CB 1.663 12 residues pruned to eliminate duplicates Z: 85 75.608 2.438 0.974 0.589 0.929 0.690 CB 1.695 85 residues pruned to eliminate duplicates Z: 17 12.154 1.784 0.245 0.525 1.000 0.562 CB 1.334 17 residues pruned to eliminate duplicates Z: 7 10.221 1.874 0.537 0.773 1.000 0.500 CB 1.138 7 residues pruned to eliminate duplicates Z: 7 5.359 1.576 0.804 0.652 0.667 0.667 N 1.002 7 residues pruned to eliminate duplicates Z: 17 38.417 2.191 0.980 0.886 1.000 0.750 CA 1.597 17 residues pruned to eliminate duplicates Z: 138 88.742 2.277 1.017 0.617 0.927 0.613 CB 1.594 138 residues pruned to eliminate duplicates Z: 7 5.694 1.690 0.110 0.598 1.000 0.500 CB 1.128 Z: 85 49.967 2.233 0.862 0.510 0.869 0.595 CB 1.494 85 residues pruned to eliminate duplicates Z: 130 72.990 2.135 0.874 0.587 0.922 0.636 CB 1.601 130 residues pruned to eliminate duplicates Z: 17 13.380 1.825 0.375 0.550 0.938 0.562 CB 1.353 17 residues pruned to eliminate duplicates Z: 9 8.844 1.591 0.364 0.891 1.000 0.750 CB 1.036 9 residues pruned to eliminate duplicates Z: 17 26.472 1.963 1.058 0.813 0.875 0.562 CA 1.426 17 residues pruned to eliminate duplicates Z: 9 19.788 1.924 0.998 0.858 1.000 0.750 CB 1.341 9 residues pruned to eliminate duplicates Z: 16 15.640 1.738 0.330 0.900 0.933 0.867 CA 1.337 16 residues pruned to eliminate duplicates Z: 16 25.731 2.130 0.684 0.896 0.933 0.533 CA 1.421 16 residues pruned to eliminate duplicates Z: 7 15.269 1.972 0.969 0.856 0.833 0.667 CA 1.420 7 residues pruned to eliminate duplicates Z: 57 63.293 2.272 0.995 0.699 0.946 0.679 CB 1.644 57 residues pruned to eliminate duplicates Z: 6 6.944 1.947 0.284 0.511 0.800 0.200 C 1.535 6 residues pruned to eliminate duplicates Z: 83 74.364 2.250 1.172 0.648 0.939 0.720 CB 1.559 83 residues pruned to eliminate duplicates Z: 17 24.225 2.046 0.656 0.851 0.938 0.812 CA 1.411 17 residues pruned to eliminate duplicates Z: 36 39.457 2.290 0.831 0.508 0.943 0.629 CB 1.674 36 residues pruned to eliminate duplicates Z: 14 8.553 1.836 0.323 0.256 1.000 0.615 CA 1.293 14 residues pruned to eliminate duplicates Z: 11 12.004 1.691 0.433 0.879 1.000 0.800 CB 1.136 11 residues pruned to eliminate duplicates Z: 77 40.943 2.127 0.631 0.484 0.895 0.474 CB 1.537 77 residues pruned to eliminate duplicates Z: 15 21.799 1.868 1.177 0.898 0.929 0.714 CB 1.103 15 residues pruned to eliminate duplicates Z: 82 68.221 2.275 0.997 0.639 0.914 0.593 CB 1.603 82 residues pruned to eliminate duplicates Z: 19 18.397 2.095 0.751 0.553 0.778 0.556 CB 1.443 19 residues pruned to eliminate duplicates Z: 13 18.947 1.836 0.717 0.881 1.000 0.917 CB 1.256 13 residues pruned to eliminate duplicates Z: 71 67.526 2.312 0.962 0.674 0.900 0.686 CB 1.683 71 residues pruned to eliminate duplicates Z: 10 20.187 1.969 0.958 0.820 0.889 0.778 CA 1.488 10 residues pruned to eliminate duplicates Z: 14 21.251 2.012 0.553 0.884 0.923 0.692 CB 1.477 14 residues pruned to eliminate duplicates Z: 85 83.317 2.410 1.048 0.640 0.952 0.571 CB 1.696 85 residues pruned to eliminate duplicates Z: 214 95.078 2.227 0.902 0.553 0.939 0.606 CB 1.556 214 residues pruned to eliminate duplicates Z: 19 11.796 1.677 0.347 0.591 0.889 0.611 CB 1.269 10 residues pruned to eliminate duplicates Z: 16 27.524 2.075 0.833 0.878 0.933 0.867 CB 1.452 16 residues pruned to eliminate duplicates Z: 12 21.027 1.963 0.903 0.916 1.000 0.636 CB 1.199 12 residues pruned to eliminate duplicates Z: 9 8.595 2.138 0.644 0.428 0.750 0.500 CA 1.241 9 residues pruned to eliminate duplicates Z: 38 35.008 2.164 0.822 0.485 0.892 0.541 CB 1.662 38 residues pruned to eliminate duplicates Z: 103 73.875 2.268 0.980 0.611 0.931 0.588 CB 1.574 103 residues pruned to eliminate duplicates Z: 10 19.731 2.021 1.033 0.802 1.000 0.778 CA 1.229 10 residues pruned to eliminate duplicates Z: 8 2.560 1.581 -0.047 0.495 1.000 0.571 CB 0.645 Z: 24 15.315 1.901 0.590 0.477 0.826 0.565 CB 1.308 21 residues pruned to eliminate duplicates Z: 27 35.977 2.360 0.947 0.586 0.846 0.654 CB 1.671 27 residues pruned to eliminate duplicates Z: 10 19.005 1.954 0.610 0.849 1.000 0.778 CA 1.494 10 residues pruned to eliminate duplicates Z: 7 4.686 1.696 0.007 0.538 1.000 0.500 CB 1.079 Z: 13 31.428 2.140 0.844 0.884 1.000 0.750 CB 1.661 13 residues pruned to eliminate duplicates Z: 57 33.217 2.077 0.690 0.474 0.893 0.536 CB 1.454 57 residues pruned to eliminate duplicates Z: 16 21.672 2.048 0.820 0.892 0.933 0.600 CB 1.156 16 residues pruned to eliminate duplicates Z: 16 16.316 1.926 0.294 0.815 0.867 0.667 CB 1.483 16 residues pruned to eliminate duplicates Z: 10 13.028 2.133 0.445 0.782 0.778 0.667 CB 1.413 10 residues pruned to eliminate duplicates Z: 9 11.955 2.068 0.187 0.862 1.000 0.625 CA 1.264 9 residues pruned to eliminate duplicates Z: 100 86.591 2.316 1.074 0.665 0.949 0.737 CB 1.639 100 residues pruned to eliminate duplicates Z: 22 37.402 2.414 0.945 0.711 0.905 0.714 CB 1.587 22 residues pruned to eliminate duplicates Z: 121 76.878 2.267 0.929 0.616 0.933 0.633 CB 1.541 121 residues pruned to eliminate duplicates Z: 16 29.887 2.098 0.964 0.884 1.000 0.867 CA 1.353 16 residues pruned to eliminate duplicates Z: 17 31.452 2.177 0.695 0.881 1.000 0.750 CB 1.542 17 residues pruned to eliminate duplicates Z: 19 17.456 2.010 0.759 0.361 0.944 0.611 CB 1.432 19 residues pruned to eliminate duplicates Z: 12 15.920 2.064 0.642 0.791 0.909 0.727 CA 1.207 12 residues pruned to eliminate duplicates Z: 44 26.949 2.092 0.843 0.494 0.791 0.442 CB 1.356 58 residues pruned to eliminate duplicates Z: 7 6.493 1.711 0.569 0.413 1.000 0.667 CA 1.081 7 residues pruned to eliminate duplicates 6 1.249 1.372 0.011 0.292 0.800 0.400 N 0.635 ? Z: 6 2.287 1.348 0.875 0.294 0.600 0.400 N 0.849 Z: 17 14.094 1.670 0.610 0.849 0.875 0.688 CB 1.111 17 residues pruned to eliminate duplicates Z: 11 15.844 2.164 0.412 0.881 0.900 0.900 CB 1.320 11 residues pruned to eliminate duplicates Z: 14 24.279 2.204 0.834 0.912 1.000 0.846 CB 1.179 14 residues pruned to eliminate duplicates Z: 88 57.962 2.249 0.786 0.616 0.908 0.632 CB 1.527 88 residues pruned to eliminate duplicates Z: 11 10.998 1.972 0.680 0.328 0.900 0.400 CB 1.409 11 residues pruned to eliminate duplicates Z: 10 10.066 1.779 0.379 0.903 1.000 0.889 CB 0.975 8 residues pruned to eliminate duplicates Z: 16 34.815 2.280 0.970 0.896 0.933 0.600 CB 1.536 16 residues pruned to eliminate duplicates Z: 9 19.462 2.065 1.089 0.714 0.875 0.375 CB 1.501 9 residues pruned to eliminate duplicates Z: 119 78.012 2.224 0.895 0.645 0.941 0.695 CB 1.582 119 residues pruned to eliminate duplicates Z: 19 9.599 1.674 0.269 0.510 0.944 0.556 CB 1.116 19 residues pruned to eliminate duplicates Z: 9 7.562 1.699 0.382 0.463 0.875 0.750 CA 1.352 9 residues pruned to eliminate duplicates Z: 17 30.727 1.980 1.184 0.889 1.000 0.812 CA 1.279 17 residues pruned to eliminate duplicates Z: 7 7.308 1.708 0.477 0.675 1.000 0.500 CB 1.007 7 residues pruned to eliminate duplicates Z: 64 56.918 2.190 0.987 0.668 0.968 0.571 CB 1.457 64 residues pruned to eliminate duplicates Z: 16 18.156 2.084 0.470 0.874 0.933 0.667 CB 1.193 16 residues pruned to eliminate duplicates Z: 9 2.270 1.475 -0.171 0.635 0.750 0.625 CB 0.771 Z: 17 36.169 2.227 1.141 0.912 0.875 0.500 CB 1.536 17 residues pruned to eliminate duplicates Z: 9 11.299 2.033 0.359 0.766 0.875 0.375 CB 1.305 9 residues pruned to eliminate duplicates Z: 16 53.196 2.312 1.416 0.943 1.000 0.733 CA 1.704 16 residues pruned to eliminate duplicates Z: 48 24.479 2.142 0.517 0.401 0.851 0.511 CB 1.432 48 residues pruned to eliminate duplicates Z: 7 11.141 1.846 0.791 0.772 1.000 1.000 CB 1.081 7 residues pruned to eliminate duplicates Z: 16 12.899 1.823 0.329 0.525 0.933 0.533 CA 1.436 16 residues pruned to eliminate duplicates Z: 136 84.039 2.224 0.904 0.630 0.933 0.607 CB 1.620 136 residues pruned to eliminate duplicates Z: 16 23.073 2.150 0.625 0.787 0.933 0.600 CB 1.420 16 residues pruned to eliminate duplicates Z: 35 30.405 2.194 0.553 0.544 0.912 0.500 CA 1.607 35 residues pruned to eliminate duplicates Z: 10 13.409 1.819 0.544 0.884 1.000 0.667 CB 1.150 10 residues pruned to eliminate duplicates Z: 10 14.993 1.779 1.046 0.766 0.889 0.778 CB 1.220 10 residues pruned to eliminate duplicates Z: 10 21.624 2.208 0.499 0.881 1.000 0.778 CB 1.576 13 residues pruned to eliminate duplicates Z: 7 5.716 1.646 -0.027 0.842 0.833 0.667 CB 1.302 8 residues pruned to eliminate duplicates Z: 14 18.607 1.845 0.739 0.901 0.846 0.846 CB 1.356 14 residues pruned to eliminate duplicates Z: 28 43.427 2.279 1.042 0.661 0.889 0.778 CB 1.740 28 residues pruned to eliminate duplicates Z: 15 27.209 2.054 0.919 0.903 0.929 0.786 CB 1.417 15 residues pruned to eliminate duplicates Z: 14 19.140 2.027 1.056 0.494 0.923 0.769 CB 1.388 14 residues pruned to eliminate duplicates Z: 8 12.434 1.816 0.401 0.860 1.000 0.714 CB 1.358 8 residues pruned to eliminate duplicates Z: 45 40.988 2.148 0.837 0.617 0.909 0.682 CA 1.542 33 residues pruned to eliminate duplicates Z: 26 18.411 2.034 0.772 0.323 0.840 0.560 CB 1.478 26 residues pruned to eliminate duplicates Z: 15 26.381 2.071 0.596 0.925 1.000 0.786 CB 1.496 15 residues pruned to eliminate duplicates Z: 18 44.215 2.174 1.223 0.875 1.000 0.706 CB 1.614 18 residues pruned to eliminate duplicates Z: 9 5.305 1.723 0.262 0.627 0.750 0.500 CB 1.021 6 residues pruned to eliminate duplicates Z: 14 21.639 2.199 0.626 0.906 1.000 0.692 CB 1.194 14 residues pruned to eliminate duplicates Z: 8 9.268 1.681 0.543 0.711 0.857 0.857 CB 1.301 7 residues pruned to eliminate duplicates Z: 50 43.799 2.105 0.872 0.687 0.918 0.633 CB 1.457 50 residues pruned to eliminate duplicates Z: 10 21.751 2.006 0.962 0.861 0.889 0.667 CA 1.524 10 residues pruned to eliminate duplicates Z: 8 3.883 1.768 0.486 0.281 0.571 0.571 CB 1.251 Z: 57 47.063 2.276 0.815 0.551 0.911 0.500 CB 1.590 57 residues pruned to eliminate duplicates Z: 85 67.949 2.229 0.888 0.641 0.940 0.619 CB 1.642 85 residues pruned to eliminate duplicates Z: 89 78.998 2.326 1.057 0.642 0.943 0.648 CB 1.634 101 residues pruned to eliminate duplicates Z: 9 16.581 2.069 0.616 0.855 0.875 0.750 CA 1.479 9 residues pruned to eliminate duplicates Z: 12 7.206 1.789 0.403 0.331 0.818 0.455 CB 1.273 12 residues pruned to eliminate duplicates Z: 38 40.561 2.294 0.845 0.513 0.973 0.541 CB 1.598 38 residues pruned to eliminate duplicates Z: 65 71.779 2.385 1.115 0.619 0.922 0.641 CB 1.724 65 residues pruned to eliminate duplicates Z: 16 45.077 2.294 1.163 0.916 1.000 1.000 CA 1.656 16 residues pruned to eliminate duplicates Z: 57 44.254 2.133 0.872 0.597 0.911 0.554 CB 1.482 57 residues pruned to eliminate duplicates Z: 9 9.720 1.840 0.154 0.915 1.000 1.000 CB 1.144 9 residues pruned to eliminate duplicates Z: 82 75.380 2.297 1.043 0.659 0.951 0.568 CB 1.620 82 residues pruned to eliminate duplicates Z: 19 14.882 1.827 0.404 0.529 0.944 0.444 CA 1.407 Z: 147 94.564 2.388 0.949 0.574 0.904 0.658 CB 1.731 147 residues pruned to eliminate duplicates Z: 10 16.856 1.947 0.483 0.894 1.000 0.778 CA 1.396 10 residues pruned to eliminate duplicates Z: 20 43.608 2.240 1.142 0.817 1.000 0.526 CB 1.584 20 residues pruned to eliminate duplicates Z: 13 40.156 2.402 0.953 0.908 1.000 0.667 CB 1.756 13 residues pruned to eliminate duplicates Z: 9 22.136 2.037 0.713 0.915 1.000 0.875 CB 1.585 10 residues pruned to eliminate duplicates Z: 17 11.927 1.868 0.431 0.446 0.875 0.625 CA 1.348 17 residues pruned to eliminate duplicates Z: 127 94.095 2.386 0.938 0.627 0.929 0.619 CB 1.733 127 residues pruned to eliminate duplicates Z: 153 90.498 2.287 0.927 0.610 0.941 0.645 CB 1.595 153 residues pruned to eliminate duplicates Z: 67 60.597 2.325 0.940 0.582 0.909 0.606 CB 1.681 67 residues pruned to eliminate duplicates Z: 16 29.713 2.143 0.725 0.899 1.000 0.933 CA 1.484 16 residues pruned to eliminate duplicates Z: 15 25.229 2.179 0.716 0.913 1.000 0.857 CB 1.276 15 residues pruned to eliminate duplicates Z: 9 8.731 1.648 0.479 0.670 0.875 0.625 CB 1.237 9 residues pruned to eliminate duplicates Z: 82 75.149 2.279 1.073 0.675 0.963 0.642 CB 1.561 82 residues pruned to eliminate duplicates Z: 133 62.488 2.205 0.749 0.507 0.902 0.576 CB 1.553 133 residues pruned to eliminate duplicates Z: 10 11.022 1.551 0.437 0.889 1.000 1.000 CB 1.186 10 residues pruned to eliminate duplicates Z: 55 57.540 2.337 0.911 0.616 0.926 0.722 CB 1.698 55 residues pruned to eliminate duplicates Z: 24 29.456 2.183 0.966 0.538 0.870 0.565 CB 1.586 24 residues pruned to eliminate duplicates Z: 54 60.075 2.366 0.919 0.618 0.943 0.642 CB 1.723 54 residues pruned to eliminate duplicates Z: 58 46.123 2.314 0.848 0.537 0.860 0.649 CB 1.602 58 residues pruned to eliminate duplicates Z: 9 8.620 1.565 0.267 0.839 0.875 0.750 CA 1.312 9 residues pruned to eliminate duplicates Z: 15 18.314 1.894 0.701 0.893 0.929 0.786 CB 1.174 15 residues pruned to eliminate duplicates Z: 16 32.287 2.098 0.934 0.918 1.000 0.600 CA 1.449 16 residues pruned to eliminate duplicates Z: 16 46.016 2.364 1.226 0.900 1.000 0.467 CB 1.614 16 residues pruned to eliminate duplicates Z: 10 20.547 2.036 1.142 0.746 0.889 0.444 CB 1.418 10 residues pruned to eliminate duplicates Z: 11 22.817 2.141 0.732 0.846 0.900 0.800 CB 1.607 11 residues pruned to eliminate duplicates Z: 6 10.715 1.738 0.423 0.827 1.000 1.000 CB 1.460 6 residues pruned to eliminate duplicates Z: 10 16.996 2.071 0.554 0.790 1.000 0.667 CA 1.364 10 residues pruned to eliminate duplicates Z: 10 14.005 2.028 0.633 0.753 0.778 0.556 CA 1.446 10 residues pruned to eliminate duplicates Z: 14 29.022 2.059 0.861 0.918 1.000 0.615 CB 1.481 14 residues pruned to eliminate duplicates Z: 13 11.117 1.793 0.907 0.720 0.750 0.583 CB 1.026 13 residues pruned to eliminate duplicates Z: 17 28.901 2.028 0.787 0.896 1.000 0.688 CA 1.428 17 residues pruned to eliminate duplicates Z: 15 32.561 2.123 0.952 0.915 1.000 0.714 CA 1.483 15 residues pruned to eliminate duplicates Z: 10 19.363 1.963 0.612 0.907 1.000 1.000 CB 1.449 10 residues pruned to eliminate duplicates Z: 84 74.635 2.332 0.985 0.637 0.928 0.675 CB 1.678 84 residues pruned to eliminate duplicates Z: 15 25.404 2.117 0.729 0.895 1.000 0.857 CA 1.330 15 residues pruned to eliminate duplicates Z: 9 6.962 1.613 0.030 0.813 1.000 0.875 CB 1.128 9 residues pruned to eliminate duplicates Z: 8 4.518 1.543 0.670 0.555 0.714 0.429 N 0.879 Z: 14 20.067 2.000 0.712 0.900 0.923 0.692 CB 1.258 14 residues pruned to eliminate duplicates Z: 16 25.114 2.099 0.529 0.912 1.000 0.867 CA 1.431 16 residues pruned to eliminate duplicates Z: 7 9.127 1.813 0.280 0.753 1.000 0.500 CB 1.280 7 residues pruned to eliminate duplicates Z: 15 20.529 2.170 0.352 0.804 0.929 0.571 CB 1.545 15 residues pruned to eliminate duplicates Z: 15 27.711 2.216 1.021 0.929 1.000 0.643 CB 1.157 15 residues pruned to eliminate duplicates Z: 74 53.534 2.159 0.762 0.636 0.918 0.644 CB 1.580 74 residues pruned to eliminate duplicates Z: 16 20.145 1.925 0.521 0.811 0.933 0.733 CB 1.452 16 residues pruned to eliminate duplicates Z: 144 91.468 2.365 0.963 0.596 0.902 0.629 CB 1.667 144 residues pruned to eliminate duplicates Z: 24 20.569 2.150 0.734 0.462 0.783 0.522 CB 1.528 24 residues pruned to eliminate duplicates Z: 8 23.652 2.258 1.126 0.843 0.857 0.857 CB 1.618 8 residues pruned to eliminate duplicates Z: 12 16.529 2.138 0.903 0.564 0.818 0.636 CB 1.407 12 residues pruned to eliminate duplicates Z: 16 25.083 2.026 0.765 0.884 0.933 0.733 CA 1.402 16 residues pruned to eliminate duplicates Z: 73 48.019 2.148 0.788 0.596 0.931 0.597 CB 1.444 73 residues pruned to eliminate duplicates Z: 9 20.727 2.135 0.562 0.835 1.000 0.750 CA 1.646 9 residues pruned to eliminate duplicates Z: 56 57.495 2.321 1.032 0.642 0.891 0.455 CB 1.616 56 residues pruned to eliminate duplicates Z: 44 28.693 2.175 0.645 0.446 0.884 0.512 CB 1.462 44 residues pruned to eliminate duplicates Z: 8 11.548 1.790 0.794 0.790 0.857 0.286 CA 1.229 8 residues pruned to eliminate duplicates Z: 87 71.998 2.240 1.094 0.629 0.919 0.593 CB 1.596 87 residues pruned to eliminate duplicates Z: 11 10.056 1.531 0.332 0.860 1.000 0.800 CA 1.146 11 residues pruned to eliminate duplicates Z: 10 19.190 1.928 1.204 0.748 0.889 0.778 CA 1.357 10 residues pruned to eliminate duplicates Z: 117 83.020 2.269 0.906 0.651 0.948 0.690 CB 1.632 108 residues pruned to eliminate duplicates Z: 140 78.669 2.204 0.859 0.624 0.921 0.662 CB 1.574 140 residues pruned to eliminate duplicates Z: 22 21.463 2.242 0.855 0.299 0.952 0.524 CA 1.479 22 residues pruned to eliminate duplicates Z: 10 25.832 1.986 1.230 0.838 1.000 0.778 CA 1.453 10 residues pruned to eliminate duplicates Z: 8 5.495 1.584 1.029 0.332 0.857 0.571 CA 0.906 Z: 78 39.744 2.162 0.564 0.459 0.870 0.597 CB 1.605 78 residues pruned to eliminate duplicates Z: 9 21.043 2.118 0.923 0.841 1.000 0.625 CB 1.362 9 residues pruned to eliminate duplicates Z: 16 21.051 2.005 0.470 0.877 1.000 0.667 CB 1.339 16 residues pruned to eliminate duplicates Z: 18 24.273 2.080 0.919 0.548 0.941 0.765 CB 1.496 18 residues pruned to eliminate duplicates Z: 14 35.251 2.289 0.879 0.906 0.923 0.385 CB 1.750 14 residues pruned to eliminate duplicates Z: 54 41.876 2.328 0.801 0.562 0.849 0.623 CB 1.521 54 residues pruned to eliminate duplicates Z: 74 63.722 2.294 0.995 0.573 0.904 0.685 CB 1.680 74 residues pruned to eliminate duplicates Z: 54 51.933 2.175 0.871 0.646 0.943 0.623 CA 1.622 54 residues pruned to eliminate duplicates Z: 12 15.828 2.171 0.527 0.697 0.818 0.727 CA 1.470 12 residues pruned to eliminate duplicates Z: 10 11.777 1.606 0.617 0.870 0.889 0.556 CB 1.242 10 residues pruned to eliminate duplicates Z: 7 5.202 1.777 0.172 0.800 0.833 0.833 CB 0.941 7 residues pruned to eliminate duplicates Z: 34 37.093 2.324 0.767 0.523 0.939 0.515 CB 1.635 34 residues pruned to eliminate duplicates Z: 19 16.787 2.103 0.762 0.422 0.833 0.500 CA 1.390 19 residues pruned to eliminate duplicates Z: 14 19.034 1.882 0.480 0.883 1.000 0.692 CA 1.370 14 residues pruned to eliminate duplicates Z: 9 9.517 1.827 0.142 0.894 1.000 1.000 CB 1.158 9 residues pruned to eliminate duplicates Z: 16 38.155 2.295 0.901 0.907 1.000 0.733 CB 1.604 16 residues pruned to eliminate duplicates Z: 8 3.709 1.564 0.464 0.609 0.714 0.714 N 0.773 Z: 7 10.713 2.009 0.820 0.600 1.000 0.500 CA 1.087 7 residues pruned to eliminate duplicates Z: 86 73.419 2.313 0.987 0.629 0.941 0.624 CB 1.631 86 residues pruned to eliminate duplicates Z: 8 7.345 1.757 0.869 0.627 0.857 0.714 CB 0.875 Z: 10 9.471 1.698 0.528 0.858 1.000 0.667 CB 0.896 10 residues pruned to eliminate duplicates Z: 25 14.818 2.062 0.629 0.440 0.750 0.625 CB 1.277 25 residues pruned to eliminate duplicates Z: 10 15.877 2.074 0.470 0.724 1.000 0.556 CB 1.418 10 residues pruned to eliminate duplicates Z: 15 30.936 2.116 0.992 0.909 1.000 0.857 CA 1.392 15 residues pruned to eliminate duplicates Z: 70 58.215 2.272 0.872 0.558 0.957 0.638 CB 1.628 70 residues pruned to eliminate duplicates Z: 107 68.296 2.313 0.887 0.544 0.953 0.594 CB 1.529 107 residues pruned to eliminate duplicates Z: 9 16.384 2.130 0.550 0.832 0.875 0.875 CA 1.505 9 residues pruned to eliminate duplicates Z: 62 50.583 2.290 0.675 0.579 0.934 0.672 CB 1.674 62 residues pruned to eliminate duplicates Z: 135 95.099 2.402 0.973 0.630 0.918 0.634 CB 1.670 135 residues pruned to eliminate duplicates Z: 17 15.083 1.802 0.539 0.738 0.875 0.625 CB 1.255 17 residues pruned to eliminate duplicates Z: 23 32.313 2.320 0.898 0.546 0.909 0.591 CA 1.645 23 residues pruned to eliminate duplicates Z: 8 6.999 1.715 0.917 0.479 0.857 0.714 CB 0.959 8 residues pruned to eliminate duplicates Z: 14 29.649 2.185 0.825 0.900 1.000 0.846 CA 1.473 14 residues pruned to eliminate duplicates Z: 8 8.679 1.863 0.237 0.850 0.857 0.857 CB 1.231 8 residues pruned to eliminate duplicates Z: 16 27.673 2.182 0.642 0.927 1.000 0.867 CA 1.398 16 residues pruned to eliminate duplicates Z: 41 27.145 2.068 0.823 0.449 0.825 0.550 CB 1.454 41 residues pruned to eliminate duplicates Z: 7 7.126 1.775 0.243 0.482 1.000 0.833 CB 1.342 Z: 15 21.714 1.778 0.696 0.913 1.000 0.929 CB 1.362 15 residues pruned to eliminate duplicates Z: 32 56.290 2.430 1.154 0.681 0.903 0.742 CB 1.811 32 residues pruned to eliminate duplicates Z: 10 15.543 1.905 0.806 0.799 1.000 0.778 CA 1.160 10 residues pruned to eliminate duplicates Z: 32 41.999 2.093 1.046 0.720 0.968 0.710 CB 1.492 32 residues pruned to eliminate duplicates Z: 22 31.931 2.341 0.808 0.573 0.952 0.524 CA 1.611 22 residues pruned to eliminate duplicates Z: 13 26.693 2.250 0.913 0.887 0.917 0.667 CB 1.407 13 residues pruned to eliminate duplicates Z: 10 4.363 1.308 0.802 0.353 0.889 0.444 N 0.814 Z: 6 8.028 2.053 0.547 0.486 0.800 0.400 CB 1.434 6 residues pruned to eliminate duplicates Z: 115 80.789 2.241 0.903 0.647 0.956 0.632 CB 1.618 115 residues pruned to eliminate duplicates Z: 38 39.954 2.189 0.931 0.609 0.919 0.541 CB 1.525 38 residues pruned to eliminate duplicates Z: 10 10.260 1.797 0.289 0.861 1.000 0.778 CB 1.085 10 residues pruned to eliminate duplicates Z: 15 9.846 1.894 0.437 0.428 0.786 0.286 CB 1.326 15 residues pruned to eliminate duplicates Z: 32 53.079 2.438 1.259 0.641 0.935 0.839 CB 1.621 32 residues pruned to eliminate duplicates Z: 10 8.595 1.563 0.234 0.868 1.000 0.778 CB 1.086 10 residues pruned to eliminate duplicates Z: 32 48.340 2.345 1.128 0.633 0.871 0.677 CB 1.763 32 residues pruned to eliminate duplicates Z: 19 11.729 1.715 0.300 0.573 0.889 0.500 CB 1.301 19 residues pruned to eliminate duplicates Z: 14 15.509 1.881 0.566 0.687 0.923 0.769 CB 1.332 13 residues pruned to eliminate duplicates Z: 31 32.897 2.071 0.806 0.678 0.900 0.533 CB 1.515 31 residues pruned to eliminate duplicates Z: 9 23.111 2.051 0.941 0.862 1.000 0.875 CA 1.506 9 residues pruned to eliminate duplicates Z: 7 7.726 1.802 0.594 0.693 0.833 0.167 CB 1.105 7 residues pruned to eliminate duplicates Z: 16 20.471 1.980 0.625 0.571 1.000 0.667 CB 1.534 16 residues pruned to eliminate duplicates Z: 14 8.224 1.719 0.440 0.275 0.846 0.538 CB 1.404 13 residues pruned to eliminate duplicates Z: 10 12.137 1.810 0.329 0.900 1.000 0.889 CB 1.202 10 residues pruned to eliminate duplicates Z: 17 21.275 2.063 0.635 0.846 0.938 0.688 CA 1.249 17 residues pruned to eliminate duplicates Z: 20 28.783 2.195 0.860 0.564 0.842 0.421 CB 1.805 20 residues pruned to eliminate duplicates Z: 6 5.969 1.500 0.362 0.699 1.000 0.600 C 1.089 Z: 35 23.437 2.023 0.438 0.540 0.853 0.765 CB 1.558 35 residues pruned to eliminate duplicates Z: 70 67.547 2.278 0.963 0.650 0.957 0.609 CB 1.653 70 residues pruned to eliminate duplicates Z: 83 66.760 2.248 0.969 0.608 0.939 0.585 CB 1.600 83 residues pruned to eliminate duplicates Z: 11 12.597 1.730 0.563 0.843 0.900 0.400 CA 1.219 11 residues pruned to eliminate duplicates Z: 9 2.726 1.753 -0.343 0.441 0.875 0.250 CB 1.016 9 residues pruned to eliminate duplicates Z: 25 19.215 2.162 0.785 0.419 0.750 0.417 CA 1.474 25 residues pruned to eliminate duplicates Z: 15 19.387 2.167 0.229 0.930 1.000 0.857 CA 1.361 15 residues pruned to eliminate duplicates Z: 148 70.935 2.271 0.747 0.534 0.878 0.639 CB 1.625 148 residues pruned to eliminate duplicates Z: 129 67.911 2.219 0.883 0.567 0.898 0.617 CB 1.499 139 residues pruned to eliminate duplicates Z: 13 21.173 1.960 0.506 0.910 1.000 1.000 CB 1.469 13 residues pruned to eliminate duplicates Z: 44 54.311 2.392 0.998 0.628 0.907 0.535 CB 1.694 44 residues pruned to eliminate duplicates Z: 14 18.330 1.968 0.594 0.912 1.000 0.769 CB 1.148 14 residues pruned to eliminate duplicates Z: 10 12.220 1.613 0.425 0.847 1.000 0.556 CA 1.316 10 residues pruned to eliminate duplicates Z: 16 29.983 2.251 0.535 0.891 1.000 0.867 CB 1.611 16 residues pruned to eliminate duplicates Z: 25 19.429 2.007 0.695 0.460 0.875 0.583 CB 1.388 25 residues pruned to eliminate duplicates Z: 6 2.655 1.409 -0.152 0.650 1.000 0.800 CB 0.864 Z: 8 5.865 1.760 -0.110 0.603 1.000 0.714 CB 1.283 Z: 9 13.844 1.821 0.597 0.900 1.000 0.875 CB 1.203 10 residues pruned to eliminate duplicates Z: 6 6.343 1.655 0.382 0.603 0.800 0.600 CA 1.406 6 residues pruned to eliminate duplicates Z: 16 34.736 2.136 1.045 0.934 1.000 0.933 CA 1.432 16 residues pruned to eliminate duplicates Z: 6 3.246 1.295 0.902 0.485 0.800 0.600 N 0.748 Z: 86 55.327 2.157 0.858 0.587 0.906 0.529 CB 1.520 86 residues pruned to eliminate duplicates Z: 32 33.417 2.269 0.866 0.537 0.903 0.613 CB 1.514 32 residues pruned to eliminate duplicates Z: 52 32.483 2.053 0.675 0.523 0.941 0.588 CB 1.374 52 residues pruned to eliminate duplicates Z: 10 7.677 1.647 0.244 0.633 1.000 0.444 CB 1.102 10 residues pruned to eliminate duplicates Z: 16 24.972 2.058 0.956 0.827 0.867 0.867 CA 1.393 16 residues pruned to eliminate duplicates Z: 23 13.949 1.955 0.923 0.332 0.727 0.409 CB 1.307 23 residues pruned to eliminate duplicates Z: 7 6.004 1.297 0.393 0.806 1.000 0.833 CB 1.038 7 residues pruned to eliminate duplicates Z: 11 6.748 1.823 0.298 0.295 0.900 0.600 CB 1.261 11 residues pruned to eliminate duplicates Z: 28 27.693 2.178 0.803 0.488 0.963 0.667 CB 1.426 28 residues pruned to eliminate duplicates Z: 6 11.221 1.815 0.876 0.818 1.000 0.800 CB 1.118 6 residues pruned to eliminate duplicates Z: 19 18.276 2.085 0.624 0.522 0.833 0.500 CB 1.494 19 residues pruned to eliminate duplicates Z: 36 48.152 2.246 1.178 0.615 0.857 0.629 CB 1.741 36 residues pruned to eliminate duplicates Z: 14 3.686 1.385 0.750 0.212 0.692 0.154 CA 0.855 Z: 102 82.646 2.282 0.946 0.665 0.950 0.594 CB 1.673 102 residues pruned to eliminate duplicates Z: 14 4.648 1.469 0.287 0.209 0.846 0.385 CB 1.137 Z: 59 45.399 2.149 0.778 0.567 0.914 0.586 CB 1.600 66 residues pruned to eliminate duplicates Z: 15 11.141 1.820 0.687 0.353 0.857 0.571 CB 1.326 6 residues pruned to eliminate duplicates Z: 8 5.993 1.682 0.223 0.683 0.857 0.571 CB 1.087 11 residues pruned to eliminate duplicates Z: 11 7.181 1.857 0.403 0.329 0.900 0.700 CA 1.167 11 residues pruned to eliminate duplicates Z: 46 51.260 2.296 0.961 0.640 0.889 0.644 CB 1.675 46 residues pruned to eliminate duplicates Z: 112 78.764 2.420 0.869 0.546 0.901 0.667 CB 1.755 112 residues pruned to eliminate duplicates Z: 6 3.869 1.618 -0.092 0.641 0.800 0.200 O 1.290 Z: 8 16.722 2.381 0.652 0.768 0.857 0.571 CB 1.478 8 residues pruned to eliminate duplicates Z: 10 24.128 2.125 0.886 0.837 0.889 0.667 CB 1.689 10 residues pruned to eliminate duplicates Z: 8 4.909 1.654 -0.249 0.739 1.000 0.857 CB 1.206 Z: 36 27.553 2.108 0.924 0.380 0.914 0.600 CB 1.427 36 residues pruned to eliminate duplicates Z: 12 5.347 1.731 0.261 0.435 0.727 0.455 CA 1.087 Z: 10 10.383 1.774 0.191 0.918 1.000 0.889 CB 1.156 9 residues pruned to eliminate duplicates Z: 14 18.652 2.004 0.683 0.884 0.923 0.692 CB 1.201 14 residues pruned to eliminate duplicates Z: 6 3.513 1.395 0.431 0.352 0.800 0.400 N 1.154 Z: 13 25.621 2.221 0.528 0.878 1.000 0.917 CB 1.582 13 residues pruned to eliminate duplicates Z: 12 18.739 2.193 0.768 0.609 0.909 0.727 CB 1.446 12 residues pruned to eliminate duplicates Z: 9 9.254 2.061 0.335 0.893 0.875 0.750 CB 0.976 9 residues pruned to eliminate duplicates Z: 9 10.537 1.763 0.171 0.838 1.000 1.000 CB 1.348 9 residues pruned to eliminate duplicates Z: 9 3.008 1.233 0.875 0.295 0.750 0.500 CB 0.772 Z: 71 64.350 2.327 1.038 0.588 0.886 0.643 CB 1.683 33 residues pruned to eliminate duplicates Z: 45 38.381 2.131 0.797 0.658 0.886 0.591 CB 1.472 45 residues pruned to eliminate duplicates Z: 28 35.870 2.190 1.075 0.606 0.926 0.778 CB 1.484 28 residues pruned to eliminate duplicates Z: 10 4.789 1.716 0.088 0.444 0.778 0.444 CB 1.165 6 residues pruned to eliminate duplicates Z: 29 26.080 2.088 1.064 0.651 0.893 0.679 CB 1.113 29 residues pruned to eliminate duplicates Z: 10 11.865 1.816 0.499 0.905 1.000 0.889 CB 1.033 10 residues pruned to eliminate duplicates Z: 10 15.414 1.846 0.656 0.869 1.000 0.889 CA 1.227 Z: 114 76.813 2.256 0.832 0.627 0.920 0.611 CB 1.686 114 residues pruned to eliminate duplicates Z: 10 13.382 1.764 0.951 0.871 1.000 1.000 CA 0.945 11 residues pruned to eliminate duplicates Z: 9 3.577 1.612 0.530 0.232 0.750 0.500 CB 0.934 9 residues pruned to eliminate duplicates Z: 7 6.534 1.987 -0.328 0.770 1.000 0.667 C 1.573 Z: 33 23.281 2.214 0.674 0.323 0.844 0.594 CB 1.598 33 residues pruned to eliminate duplicates Z: 102 59.104 2.135 0.853 0.555 0.911 0.624 CB 1.546 102 residues pruned to eliminate duplicates Z: 6 4.207 1.734 1.321 0.282 0.600 0.400 CB 0.996 6 residues pruned to eliminate duplicates Z: 144 89.039 2.307 1.020 0.588 0.916 0.622 CB 1.602 143 residues pruned to eliminate duplicates Z: 19 6.870 1.639 0.317 0.225 0.889 0.500 CB 1.164 26 residues pruned to eliminate duplicates Z: 6 3.523 1.850 -0.246 0.538 0.800 0.600 CB 1.361 8 residues pruned to eliminate duplicates Z: 6 9.092 1.966 -0.028 0.789 1.000 1.000 CB 1.650 6 residues pruned to eliminate duplicates Z: 103 67.379 2.307 0.931 0.541 0.941 0.667 CB 1.528 103 residues pruned to eliminate duplicates Z: 20 21.653 2.081 0.767 0.639 0.947 0.421 CB 1.252 20 residues pruned to eliminate duplicates Z: 35 36.739 2.199 0.815 0.577 0.941 0.529 CB 1.557 35 residues pruned to eliminate duplicates Z: 11 19.584 1.871 1.016 0.868 0.900 0.700 CA 1.334 11 residues pruned to eliminate duplicates Z: 7 5.590 1.552 0.084 0.702 1.000 0.667 CB 1.128 7 residues pruned to eliminate duplicates Z: 9 13.691 1.896 0.423 0.893 1.000 0.875 CB 1.288 9 residues pruned to eliminate duplicates Z: 6 2.544 1.570 -0.326 0.609 0.800 0.800 N 1.212 Z: 12 18.709 2.146 1.017 0.565 1.000 0.727 CB 1.224 12 residues pruned to eliminate duplicates 6 1.269 1.461 -0.247 0.470 0.800 0.800 CB 0.665 ? Z: 23 17.929 2.040 0.834 0.417 0.773 0.545 CB 1.442 23 residues pruned to eliminate duplicates Z: 18 9.972 1.880 0.573 0.332 0.765 0.353 CA 1.286 18 residues pruned to eliminate duplicates Z: 22 35.717 2.328 0.862 0.634 0.905 0.667 CA 1.753 22 residues pruned to eliminate duplicates Z: 9 4.850 1.448 0.594 0.370 0.750 0.625 CB 1.138 4 residues pruned to eliminate duplicates Z: 8 11.585 2.025 0.327 0.857 0.857 0.857 CB 1.401 8 residues pruned to eliminate duplicates Z: 36 38.798 2.239 0.781 0.550 0.943 0.571 CB 1.662 36 residues pruned to eliminate duplicates Z: 6 4.532 1.663 0.691 0.502 0.800 0.800 CA 0.899 6 residues pruned to eliminate duplicates Z: 25 22.192 2.113 0.811 0.379 0.875 0.667 CB 1.539 36 residues pruned to eliminate duplicates Z: 82 68.756 2.231 0.981 0.655 0.938 0.704 CB 1.595 82 residues pruned to eliminate duplicates Z: 16 32.812 2.006 1.064 0.920 1.000 0.800 CB 1.440 16 residues pruned to eliminate duplicates Z: 13 24.441 2.242 0.782 0.581 1.000 0.667 CB 1.633 12 residues pruned to eliminate duplicates Z: 8 3.446 1.703 0.457 0.466 0.714 0.429 CB 0.760 Z: 41 36.619 2.197 0.790 0.606 0.950 0.725 CB 1.401 41 residues pruned to eliminate duplicates Z: 10 7.351 1.618 0.193 0.687 1.000 0.667 CB 1.069 11 residues pruned to eliminate duplicates Z: 73 45.649 2.159 0.699 0.534 0.917 0.597 CB 1.548 73 residues pruned to eliminate duplicates Z: 6 6.046 1.464 0.241 0.820 1.000 0.800 CB 1.127 Z: 8 10.130 1.838 0.504 0.744 1.000 0.714 CB 1.113 8 residues pruned to eliminate duplicates Z: 25 25.215 2.126 0.684 0.540 0.917 0.417 CA 1.508 25 residues pruned to eliminate duplicates Z: 74 40.535 2.110 0.627 0.515 0.918 0.658 CB 1.484 74 residues pruned to eliminate duplicates Z: 13 23.187 2.293 0.686 0.522 1.000 0.583 CB 1.695 13 residues pruned to eliminate duplicates Z: 9 12.489 1.870 0.731 0.869 0.875 0.500 CB 1.139 9 residues pruned to eliminate duplicates Z: 85 71.976 2.235 0.882 0.669 0.976 0.655 CB 1.637 85 residues pruned to eliminate duplicates Z: 14 43.204 2.226 1.158 0.903 1.000 0.846 CA 1.777 19 residues pruned to eliminate duplicates Z: 8 6.983 1.681 0.605 0.533 0.857 0.286 CB 1.105 Z: 7 4.051 1.695 0.573 0.359 0.667 0.333 CA 1.083 7 residues pruned to eliminate duplicates Z: 28 50.086 2.458 1.014 0.660 0.963 0.852 CB 1.743 28 residues pruned to eliminate duplicates Z: 118 80.159 2.253 0.890 0.620 0.940 0.632 CB 1.653 118 residues pruned to eliminate duplicates Z: 88 67.255 2.209 0.872 0.647 0.943 0.632 CB 1.613 88 residues pruned to eliminate duplicates Z: 6 4.184 1.589 0.619 0.452 0.600 0.400 CB 1.274 Z: 8 5.013 1.436 0.286 0.743 1.000 0.571 CB 0.825 8 residues pruned to eliminate duplicates Z: 117 82.909 2.236 1.055 0.632 0.948 0.578 CB 1.561 75 residues pruned to eliminate duplicates Z: 10 22.422 2.198 0.656 0.934 1.000 0.889 CB 1.432 10 residues pruned to eliminate duplicates Z: 6 2.304 1.456 -0.219 0.691 1.000 0.800 CB 0.760 Z: 56 59.588 2.238 0.979 0.653 0.964 0.709 CB 1.633 56 residues pruned to eliminate duplicates Z: 23 11.553 1.855 0.551 0.341 0.864 0.636 CB 1.180 23 residues pruned to eliminate duplicates Z: 6 2.638 1.334 0.105 0.647 1.000 0.600 C 0.698 6 residues pruned to eliminate duplicates Z: 16 23.837 1.967 0.720 0.904 0.933 0.800 CB 1.388 16 residues pruned to eliminate duplicates Z: 27 40.324 2.309 1.067 0.585 0.923 0.731 CB 1.654 27 residues pruned to eliminate duplicates Z: 8 26.502 2.189 0.990 0.836 1.000 1.000 CB 1.721 8 residues pruned to eliminate duplicates Z: 6 9.453 1.695 0.617 0.848 1.000 0.600 CA 1.144 6 residues pruned to eliminate duplicates Z: 88 73.790 2.321 0.953 0.664 0.908 0.667 CB 1.650 88 residues pruned to eliminate duplicates Z: 7 19.904 2.168 0.843 0.722 1.000 0.667 CA 1.665 7 residues pruned to eliminate duplicates Z: 114 83.896 2.283 0.924 0.646 0.947 0.673 CB 1.655 117 residues pruned to eliminate duplicates Z: 7 7.348 1.655 0.394 0.809 0.833 0.833 C 1.193 7 residues pruned to eliminate duplicates Z: 11 15.051 1.868 0.660 0.561 0.900 0.600 N 1.607 11 residues pruned to eliminate duplicates Z: 11 9.601 1.760 0.246 0.878 0.900 0.300 CA 1.116 11 residues pruned to eliminate duplicates Z: 18 19.285 1.883 0.916 0.845 0.941 0.412 CB 1.024 18 residues pruned to eliminate duplicates Z: 10 6.609 1.969 0.085 0.266 0.889 0.444 CA 1.513 10 residues pruned to eliminate duplicates Z: 101 78.271 2.345 0.968 0.625 0.900 0.590 CB 1.676 101 residues pruned to eliminate duplicates Z: 8 12.956 2.039 0.396 0.876 1.000 0.714 CB 1.250 8 residues pruned to eliminate duplicates Z: 12 48.314 2.520 1.090 0.911 1.000 0.636 CA 1.961 12 residues pruned to eliminate duplicates Z: 8 2.349 1.464 0.043 0.214 0.714 0.571 CA 1.140 8 residues pruned to eliminate duplicates Z: 7 4.926 1.737 0.246 0.706 0.667 0.500 CB 1.156 7 residues pruned to eliminate duplicates Z: 12 37.466 2.438 1.005 0.906 0.909 0.364 CA 1.808 12 residues pruned to eliminate duplicates Z: 7 4.226 1.465 0.648 0.301 1.000 0.500 CA 0.892 7 residues pruned to eliminate duplicates Z: 68 52.135 2.117 0.774 0.637 0.955 0.612 CB 1.562 68 residues pruned to eliminate duplicates Z: 24 20.011 2.072 0.612 0.434 0.913 0.522 CB 1.465 24 residues pruned to eliminate duplicates Z: 12 6.818 1.524 0.429 0.576 0.909 0.545 CB 0.965 Z: 16 17.960 1.857 0.543 0.915 1.000 0.867 CB 1.144 18 residues pruned to eliminate duplicates Z: 62 57.141 2.201 1.057 0.626 0.934 0.656 CB 1.536 62 residues pruned to eliminate duplicates Z: 15 7.353 1.650 0.750 0.402 0.714 0.429 N 1.057 4 residues pruned to eliminate duplicates Z: 12 8.150 1.697 0.077 0.613 0.909 0.909 CB 1.329 12 residues pruned to eliminate duplicates Z: 6 8.855 2.142 0.557 0.378 0.800 0.600 CB 1.690 6 residues pruned to eliminate duplicates Z: 14 11.892 1.905 0.557 0.396 0.846 0.462 CB 1.466 14 residues pruned to eliminate duplicates Z: 8 4.729 1.509 0.238 0.422 1.000 0.571 CB 1.038 8 residues pruned to eliminate duplicates Z: 16 26.337 2.220 0.454 0.897 0.933 0.733 CB 1.617 16 residues pruned to eliminate duplicates Z: 7 16.766 1.916 1.190 0.848 1.000 0.833 CB 1.211 7 residues pruned to eliminate duplicates Z: 42 52.526 2.262 1.080 0.651 0.878 0.634 CA 1.725 42 residues pruned to eliminate duplicates Z: 51 41.344 2.078 0.847 0.591 0.880 0.600 CB 1.588 51 residues pruned to eliminate duplicates Z: 27 33.750 2.212 1.005 0.560 0.885 0.577 CB 1.591 27 residues pruned to eliminate duplicates Z: 72 63.012 2.235 0.908 0.653 0.915 0.634 CB 1.662 72 residues pruned to eliminate duplicates Z: 12 2.773 1.526 0.073 0.363 0.818 0.273 CB 0.723 3 residues pruned to eliminate duplicates Z: 39 47.224 2.300 0.981 0.582 0.947 0.526 CB 1.640 39 residues pruned to eliminate duplicates Z: 9 8.475 1.706 0.235 0.912 1.000 1.000 CB 1.007 9 residues pruned to eliminate duplicates Z: 6 3.828 1.633 0.886 0.310 0.600 0.200 CB 1.143 Z: 9 8.959 1.798 0.447 0.857 0.875 0.625 CB 1.025 9 residues pruned to eliminate duplicates Z: 8 4.403 1.419 0.112 0.765 1.000 0.714 CB 0.834 7 residues pruned to eliminate duplicates Z: 42 50.945 2.356 0.971 0.615 0.951 0.585 CB 1.615 42 residues pruned to eliminate duplicates Z: 6 2.197 1.452 -0.043 0.713 0.800 0.600 CB 0.729 Z: 17 40.012 2.190 1.033 0.924 1.000 0.875 CB 1.578 17 residues pruned to eliminate duplicates Z: 67 67.745 2.281 1.014 0.663 0.939 0.727 CB 1.662 73 residues pruned to eliminate duplicates Z: 17 33.185 2.159 0.773 0.898 1.000 0.875 CA 1.550 17 residues pruned to eliminate duplicates Z: 10 2.667 1.219 0.495 0.376 0.889 0.333 C 0.626 Z: 115 80.608 2.253 0.940 0.648 0.947 0.623 CB 1.588 115 residues pruned to eliminate duplicates Z: 15 34.575 2.092 1.232 0.910 1.000 0.643 CA 1.403 15 residues pruned to eliminate duplicates Z: 73 34.608 2.172 0.670 0.384 0.875 0.528 CB 1.455 73 residues pruned to eliminate duplicates Z: 50 40.459 2.271 0.816 0.499 0.898 0.571 CB 1.562 50 residues pruned to eliminate duplicates Z: 102 73.982 2.308 0.949 0.598 0.911 0.624 CB 1.637 102 residues pruned to eliminate duplicates Z: 84 72.244 2.346 0.977 0.586 0.928 0.639 CB 1.697 84 residues pruned to eliminate duplicates Z: 115 82.004 2.234 0.929 0.620 0.939 0.614 CB 1.695 115 residues pruned to eliminate duplicates Z: 18 10.986 1.854 0.417 0.308 0.882 0.588 CB 1.423 18 residues pruned to eliminate duplicates Z: 15 18.708 1.899 0.740 0.908 1.000 0.786 CB 1.075 15 residues pruned to eliminate duplicates Z: 121 79.730 2.214 0.821 0.654 0.958 0.700 CB 1.632 121 residues pruned to eliminate duplicates Z: 8 3.548 1.704 -0.354 0.742 1.000 0.714 CB 0.980 8 residues pruned to eliminate duplicates Z: 10 18.351 2.168 0.520 0.794 1.000 0.556 CA 1.434 10 residues pruned to eliminate duplicates Z: 12 17.910 2.090 0.603 0.627 1.000 0.636 CA 1.429 12 residues pruned to eliminate duplicates Z: 10 9.505 1.568 0.326 0.864 1.000 0.667 CB 1.118 10 residues pruned to eliminate duplicates Z: 61 54.075 2.202 0.899 0.620 0.933 0.583 CB 1.597 61 residues pruned to eliminate duplicates Z: 7 6.125 1.520 0.710 0.570 0.833 0.667 CA 1.079 Z: 8 2.586 1.495 -0.167 0.352 0.857 0.714 CB 1.074 8 residues pruned to eliminate duplicates Z: 8 5.520 1.529 0.109 0.669 1.000 0.429 N 1.053 6 residues pruned to eliminate duplicates Z: 22 9.714 1.718 0.273 0.378 0.952 0.619 CB 1.160 22 residues pruned to eliminate duplicates Z: 7 6.153 1.899 0.044 0.529 0.833 0.667 C 1.478 7 residues pruned to eliminate duplicates Z: 89 70.872 2.235 0.949 0.658 0.966 0.659 CB 1.551 57 residues pruned to eliminate duplicates Z: 15 19.048 2.192 0.823 0.287 0.929 0.429 CA 1.742 15 residues pruned to eliminate duplicates Z: 56 54.779 2.336 0.961 0.573 0.909 0.636 CB 1.654 56 residues pruned to eliminate duplicates Z: 8 14.662 2.124 0.531 0.832 0.857 0.571 CA 1.493 8 residues pruned to eliminate duplicates Z: 7 5.652 1.804 1.191 0.470 0.667 0.500 CB 0.903 Z: 81 68.506 2.292 1.013 0.616 0.925 0.562 CB 1.608 81 residues pruned to eliminate duplicates Z: 10 15.896 1.843 0.711 0.630 1.000 0.667 CB 1.486 10 residues pruned to eliminate duplicates Z: 12 17.943 1.965 0.456 0.866 1.000 0.909 CB 1.384 12 residues pruned to eliminate duplicates Z: 14 9.902 1.941 0.476 0.368 0.923 0.385 CA 1.197 14 residues pruned to eliminate duplicates Z: 23 52.146 2.422 1.265 0.733 0.955 0.682 CB 1.722 23 residues pruned to eliminate duplicates Z: 8 14.585 2.386 0.401 0.771 0.857 0.286 CB 1.515 8 residues pruned to eliminate duplicates Z: 10 4.698 1.383 0.578 0.467 0.778 0.444 O 0.954 Z: 18 47.150 2.193 1.276 0.945 1.000 0.647 CB 1.585 18 residues pruned to eliminate duplicates Z: 9 6.300 1.693 0.496 0.529 0.750 0.625 CB 1.140 3 residues pruned to eliminate duplicates Z: 96 72.438 2.420 0.944 0.516 0.905 0.589 CB 1.717 96 residues pruned to eliminate duplicates Z: 215 89.557 2.239 0.815 0.553 0.911 0.593 CB 1.570 215 residues pruned to eliminate duplicates Z: 209 100.655 2.352 0.969 0.566 0.880 0.635 CB 1.606 209 residues pruned to eliminate duplicates Z: 10 8.720 2.020 0.305 0.293 1.000 0.444 CA 1.389 10 residues pruned to eliminate duplicates Z: 10 3.118 1.485 -0.085 0.436 0.889 0.444 CB 0.920 Z: 10 21.536 2.036 1.114 0.773 1.000 0.556 CB 1.310 10 residues pruned to eliminate duplicates Z: 15 15.983 1.774 0.392 0.876 0.929 0.857 CB 1.354 15 residues pruned to eliminate duplicates Z: 11 9.202 1.740 0.379 0.695 0.800 0.500 CA 1.269 11 residues pruned to eliminate duplicates Z: 16 5.991 1.711 0.337 0.398 0.667 0.400 CA 1.129 16 residues pruned to eliminate duplicates 6 1.637 1.553 0.583 0.438 0.600 0.400 CB 0.529 ? Z: 26 30.188 2.169 0.771 0.593 0.880 0.640 CA 1.634 26 residues pruned to eliminate duplicates Z: 14 6.401 1.713 0.279 0.373 0.846 0.538 CB 1.098 14 residues pruned to eliminate duplicates Z: 8 8.034 1.815 0.321 0.566 1.000 0.857 CB 1.187 8 residues pruned to eliminate duplicates Z: 8 13.426 1.925 0.516 0.698 1.000 0.714 CB 1.452 8 residues pruned to eliminate duplicates Z: 85 71.982 2.244 0.875 0.657 0.964 0.655 CB 1.672 85 residues pruned to eliminate duplicates Z: 11 11.560 2.073 0.715 0.230 0.900 0.600 CB 1.565 11 residues pruned to eliminate duplicates Z: 10 9.202 1.914 0.258 0.717 0.778 0.333 CA 1.346 10 residues pruned to eliminate duplicates Z: 10 23.248 1.997 1.139 0.850 1.000 0.556 CA 1.344 10 residues pruned to eliminate duplicates Z: 45 46.859 2.191 0.941 0.677 0.886 0.614 CA 1.592 45 residues pruned to eliminate duplicates Z: 9 17.727 2.023 0.871 0.865 0.875 0.750 CA 1.386 9 residues pruned to eliminate duplicates Z: 41 44.017 2.233 0.901 0.550 0.925 0.650 CA 1.687 41 residues pruned to eliminate duplicates Z: 38 43.973 2.318 1.079 0.593 0.892 0.514 CB 1.538 38 residues pruned to eliminate duplicates Z: 33 38.623 2.229 0.929 0.572 0.906 0.656 CB 1.634 33 residues pruned to eliminate duplicates Z: 8 4.712 1.762 -0.219 0.596 0.857 0.571 CB 1.378 8 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 9 11.747 1.802 0.963 0.413 0.875 0.500 CA 1.470 8 residues pruned to eliminate duplicates Z: 6 5.697 1.570 0.935 0.440 0.800 0.400 CB 1.115 6 residues pruned to eliminate duplicates Z: 9 9.632 1.834 0.740 0.625 0.750 0.500 CB 1.264 10 residues pruned to eliminate duplicates Z: 9 25.017 2.132 0.877 0.919 1.000 0.875 CB 1.558 19 residues pruned to eliminate duplicates Z: 10 18.921 2.002 0.503 0.897 1.000 0.889 CB 1.501 9 residues pruned to eliminate duplicates Z: 10 21.601 1.937 0.965 0.911 1.000 0.667 CB 1.341 10 residues pruned to eliminate duplicates Z: 11 18.323 2.076 0.436 0.734 1.000 0.500 CB 1.575 11 residues pruned to eliminate duplicates Z: 25 18.992 2.009 0.609 0.439 0.833 0.542 CB 1.533 25 residues pruned to eliminate duplicates Z: 10 19.678 2.187 0.423 0.813 1.000 0.556 CB 1.605 10 residues pruned to eliminate duplicates Z: 13 17.136 2.008 0.551 0.617 0.917 0.583 CB 1.551 13 residues pruned to eliminate duplicates Z: 28 17.994 1.968 0.456 0.424 0.889 0.481 CB 1.472 28 residues pruned to eliminate duplicates Z: 12 17.383 2.090 0.521 0.664 0.909 0.455 CB 1.558 12 residues pruned to eliminate duplicates Z: 16 13.758 1.997 0.344 0.524 0.867 0.600 CB 1.492 16 residues pruned to eliminate duplicates Z: 22 20.574 1.942 0.574 0.533 0.905 0.571 CA 1.571 28 residues pruned to eliminate duplicates Z: 8 3.586 1.561 0.739 0.414 0.571 0.286 CB 0.956 8 residues pruned to eliminate duplicates Z: 17 9.253 1.747 0.464 0.376 0.875 0.312 CB 1.180 17 residues pruned to eliminate duplicates Z: 16 9.310 1.779 0.418 0.393 0.867 0.467 CB 1.231 16 residues pruned to eliminate duplicates Z: 89 71.072 2.399 0.981 0.536 0.909 0.568 CB 1.693 89 residues pruned to eliminate duplicates Z: 154 96.442 2.392 0.972 0.573 0.922 0.641 CB 1.671 154 residues pruned to eliminate duplicates Z: 56 59.195 2.417 1.025 0.581 0.891 0.545 CB 1.693 56 residues pruned to eliminate duplicates Z: 140 99.284 2.389 0.972 0.614 0.935 0.604 CB 1.715 140 residues pruned to eliminate duplicates Z: 111 82.982 2.441 1.008 0.550 0.909 0.618 CB 1.691 111 residues pruned to eliminate duplicates Z: 143 91.064 2.364 0.957 0.603 0.915 0.648 CB 1.636 143 residues pruned to eliminate duplicates Z: 172 84.352 2.333 0.867 0.525 0.918 0.585 CB 1.574 172 residues pruned to eliminate duplicates Z: 60 55.973 2.435 0.822 0.563 0.915 0.644 CB 1.687 60 residues pruned to eliminate duplicates Z: 57 65.091 2.449 0.992 0.601 0.964 0.554 CB 1.679 57 residues pruned to eliminate duplicates Z: 141 89.917 2.383 0.909 0.599 0.921 0.671 CB 1.648 141 residues pruned to eliminate duplicates Z: 95 70.110 2.393 0.959 0.534 0.915 0.606 CB 1.630 95 residues pruned to eliminate duplicates Z: 127 96.758 2.386 1.023 0.634 0.921 0.659 CB 1.710 127 residues pruned to eliminate duplicates Z: 65 57.911 2.356 0.918 0.558 0.922 0.531 CB 1.642 65 residues pruned to eliminate duplicates Z: 89 78.818 2.440 0.952 0.594 0.955 0.614 CB 1.689 89 residues pruned to eliminate duplicates Z: 142 91.751 2.375 0.937 0.585 0.915 0.624 CB 1.693 142 residues pruned to eliminate duplicates Z: 41 50.430 2.436 0.896 0.560 0.925 0.675 CB 1.762 41 residues pruned to eliminate duplicates Z: 114 82.039 2.332 1.002 0.606 0.912 0.637 CB 1.641 114 residues pruned to eliminate duplicates Z: 26 38.351 2.373 1.047 0.570 0.920 0.560 CB 1.605 26 residues pruned to eliminate duplicates Z: 118 80.895 2.393 1.000 0.543 0.889 0.590 CB 1.685 118 residues pruned to eliminate duplicates Z: 60 59.468 2.428 0.958 0.548 0.949 0.593 CB 1.637 60 residues pruned to eliminate duplicates Z: 29 26.790 2.212 0.825 0.467 0.893 0.607 CB 1.453 29 residues pruned to eliminate duplicates Z: 28 34.813 2.281 1.096 0.526 0.889 0.593 CB 1.537 28 residues pruned to eliminate duplicates Z: 27 36.959 2.398 1.067 0.548 0.885 0.538 CB 1.577 27 residues pruned to eliminate duplicates Z: 108 86.573 2.350 1.094 0.616 0.935 0.636 CB 1.630 108 residues pruned to eliminate duplicates Z: 87 78.700 2.434 0.999 0.597 0.919 0.651 CB 1.731 87 residues pruned to eliminate duplicates Z: 25 39.643 2.383 1.151 0.594 0.917 0.667 CB 1.574 25 residues pruned to eliminate duplicates Z: 62 67.647 2.444 1.014 0.588 0.934 0.574 CB 1.731 62 residues pruned to eliminate duplicates Z: 126 92.230 2.390 0.973 0.637 0.912 0.680 CB 1.687 126 residues pruned to eliminate duplicates Z: 112 83.447 2.335 1.055 0.600 0.919 0.613 CB 1.633 112 residues pruned to eliminate duplicates Z: 61 61.346 2.352 1.007 0.578 0.950 0.550 CB 1.637 61 residues pruned to eliminate duplicates Z: 121 86.004 2.363 0.919 0.599 0.933 0.567 CB 1.688 121 residues pruned to eliminate duplicates Z: 62 58.534 2.397 0.980 0.555 0.918 0.508 CB 1.630 62 residues pruned to eliminate duplicates Z: 87 69.325 2.394 0.995 0.499 0.919 0.535 CB 1.705 87 residues pruned to eliminate duplicates Z: 61 62.717 2.421 1.052 0.563 0.900 0.517 CB 1.704 61 residues pruned to eliminate duplicates Z: 88 78.534 2.422 1.066 0.596 0.908 0.621 CB 1.690 88 residues pruned to eliminate duplicates Z: 88 79.963 2.412 1.081 0.585 0.920 0.529 CB 1.713 88 residues pruned to eliminate duplicates Z: 141 94.695 2.383 1.010 0.601 0.921 0.600 CB 1.647 141 residues pruned to eliminate duplicates Z: 88 80.220 2.424 1.069 0.579 0.920 0.563 CB 1.727 88 residues pruned to eliminate duplicates Z: 129 92.792 2.377 0.993 0.619 0.914 0.594 CB 1.694 129 residues pruned to eliminate duplicates Z: 210 101.542 2.323 0.942 0.565 0.914 0.593 CB 1.601 210 residues pruned to eliminate duplicates Z: 88 77.962 2.335 0.999 0.628 0.931 0.621 CB 1.705 88 residues pruned to eliminate duplicates Z: 14 35.755 2.415 1.086 0.800 0.923 0.923 CB 1.641 14 residues pruned to eliminate duplicates Z: 32 37.435 2.329 0.935 0.590 0.839 0.677 CB 1.633 32 residues pruned to eliminate duplicates Z: 89 70.846 2.318 0.944 0.618 0.920 0.614 CB 1.628 89 residues pruned to eliminate duplicates Z: 86 68.946 2.317 0.929 0.647 0.894 0.706 CB 1.630 86 residues pruned to eliminate duplicates Z: 81 73.524 2.363 0.958 0.653 0.913 0.625 CB 1.690 81 residues pruned to eliminate duplicates Z: 69 72.122 2.359 0.971 0.677 0.926 0.647 CB 1.725 69 residues pruned to eliminate duplicates Z: 93 68.669 2.332 0.854 0.616 0.902 0.522 CB 1.645 93 residues pruned to eliminate duplicates Z: 29 44.255 2.459 1.052 0.620 0.857 0.679 CB 1.727 29 residues pruned to eliminate duplicates Z: 82 72.207 2.358 0.999 0.644 0.914 0.617 CB 1.628 82 residues pruned to eliminate duplicates Z: 84 74.678 2.330 1.072 0.624 0.916 0.639 CB 1.649 84 residues pruned to eliminate duplicates Z: 92 73.323 2.380 1.079 0.572 0.868 0.527 CB 1.669 92 residues pruned to eliminate duplicates Z: 133 87.566 2.334 1.050 0.606 0.902 0.583 CB 1.597 73 residues pruned to eliminate duplicates Z: 15 28.054 2.535 0.904 0.720 0.786 0.643 CB 1.621 15 residues pruned to eliminate duplicates Z: 86 73.870 2.329 1.020 0.629 0.918 0.635 CB 1.644 86 residues pruned to eliminate duplicates Z: 28 47.470 2.461 0.961 0.653 0.926 0.741 CB 1.773 28 residues pruned to eliminate duplicates Z: 89 75.875 2.336 0.959 0.630 0.932 0.602 CB 1.679 89 residues pruned to eliminate duplicates Z: 84 68.107 2.316 1.019 0.623 0.904 0.639 CB 1.575 84 residues pruned to eliminate duplicates Z: 32 50.811 2.466 1.041 0.641 0.903 0.548 CB 1.760 32 residues pruned to eliminate duplicates Z: 69 72.162 2.358 0.977 0.692 0.926 0.765 CB 1.700 69 residues pruned to eliminate duplicates Z: 122 87.501 2.359 1.001 0.612 0.901 0.686 CB 1.682 146 residues pruned to eliminate duplicates Z: 6 3.342 1.558 0.219 0.391 0.800 0.800 CA 1.104 6 residues pruned to eliminate duplicates Z: 83 76.409 2.355 1.064 0.631 0.939 0.671 CB 1.635 83 residues pruned to eliminate duplicates Z: 85 77.085 2.338 1.057 0.629 0.952 0.619 CB 1.626 85 residues pruned to eliminate duplicates Z: 81 80.750 2.378 1.043 0.659 0.950 0.688 CB 1.687 81 residues pruned to eliminate duplicates Z: 74 70.927 2.298 1.010 0.613 0.945 0.644 CB 1.709 74 residues pruned to eliminate duplicates Z: 71 75.949 2.268 1.147 0.646 0.957 0.743 CB 1.700 71 residues pruned to eliminate duplicates Z: 88 72.262 2.348 0.971 0.613 0.908 0.598 CB 1.656 88 residues pruned to eliminate duplicates Z: 93 71.154 2.306 1.022 0.602 0.902 0.576 CB 1.600 89 residues pruned to eliminate duplicates Z: 12 12.485 1.778 0.985 0.778 0.909 0.818 CB 0.918 12 residues pruned to eliminate duplicates Z: 57 54.513 2.216 0.921 0.613 0.946 0.518 CA 1.624 57 residues pruned to eliminate duplicates Z: 69 73.679 2.353 0.991 0.667 0.956 0.721 CB 1.710 69 residues pruned to eliminate duplicates Z: 57 54.336 2.202 1.069 0.625 0.929 0.571 CB 1.526 57 residues pruned to eliminate duplicates Z: 65 55.626 2.244 0.890 0.599 0.938 0.641 CB 1.592 65 residues pruned to eliminate duplicates Z: 86 73.326 2.324 1.022 0.628 0.941 0.624 CB 1.594 85 residues pruned to eliminate duplicates Z: 12 18.413 1.902 0.942 0.663 1.000 0.636 CB 1.293 12 residues pruned to eliminate duplicates Z: 109 74.470 2.351 0.916 0.600 0.880 0.667 CB 1.644 109 residues pruned to eliminate duplicates Z: 83 73.125 2.342 0.944 0.653 0.963 0.598 CB 1.598 83 residues pruned to eliminate duplicates Z: 79 67.678 2.302 1.045 0.560 0.936 0.577 CB 1.641 79 residues pruned to eliminate duplicates Z: 84 77.256 2.342 1.114 0.634 0.916 0.651 CB 1.650 86 residues pruned to eliminate duplicates Z: 15 26.844 2.210 0.561 0.930 1.000 0.857 CA 1.454 15 residues pruned to eliminate duplicates Z: 73 67.082 2.281 0.990 0.598 0.958 0.694 CB 1.655 73 residues pruned to eliminate duplicates Z: 72 67.334 2.315 1.018 0.636 0.930 0.648 CB 1.620 72 residues pruned to eliminate duplicates Z: 81 74.155 2.317 1.032 0.632 0.938 0.663 CB 1.659 81 residues pruned to eliminate duplicates Z: 88 78.457 2.344 1.014 0.648 0.931 0.632 CB 1.666 88 residues pruned to eliminate duplicates Z: 82 73.810 2.370 1.019 0.637 0.926 0.605 CB 1.628 82 residues pruned to eliminate duplicates Z: 82 73.061 2.329 1.051 0.622 0.938 0.593 CB 1.614 82 residues pruned to eliminate duplicates Z: 82 69.281 2.340 0.962 0.627 0.914 0.580 CB 1.629 82 residues pruned to eliminate duplicates Z: 86 70.484 2.305 1.031 0.628 0.918 0.659 CB 1.578 86 residues pruned to eliminate duplicates Z: 38 35.310 2.112 0.916 0.615 0.892 0.595 CB 1.442 38 residues pruned to eliminate duplicates Z: 84 76.163 2.341 1.022 0.627 0.952 0.614 CB 1.646 84 residues pruned to eliminate duplicates Z: 88 76.022 2.342 1.022 0.620 0.931 0.690 CB 1.650 88 residues pruned to eliminate duplicates Z: 67 61.002 2.314 0.838 0.633 0.939 0.621 CB 1.658 67 residues pruned to eliminate duplicates Z: 85 69.955 2.335 0.911 0.615 0.940 0.548 CB 1.631 85 residues pruned to eliminate duplicates Z: 88 55.202 2.236 0.817 0.553 0.874 0.609 CB 1.584 88 residues pruned to eliminate duplicates Z: 84 76.894 2.340 1.019 0.640 0.952 0.627 CB 1.646 82 residues pruned to eliminate duplicates Z: 10 24.170 2.141 1.045 0.758 1.000 0.778 CA 1.463 10 residues pruned to eliminate duplicates Z: 87 75.116 2.340 1.015 0.609 0.919 0.698 CB 1.685 89 residues pruned to eliminate duplicates Z: 11 19.192 1.952 1.026 0.778 1.000 0.700 CA 1.201 11 residues pruned to eliminate duplicates Z: 81 79.997 2.367 1.055 0.652 0.950 0.663 CB 1.681 81 residues pruned to eliminate duplicates Z: 67 64.872 2.293 1.055 0.624 0.924 0.712 CB 1.631 67 residues pruned to eliminate duplicates Z: 68 63.441 2.310 0.954 0.590 0.955 0.612 CB 1.649 68 residues pruned to eliminate duplicates Z: 35 40.134 2.347 0.924 0.523 0.912 0.500 CB 1.635 35 residues pruned to eliminate duplicates Z: 82 74.019 2.343 1.022 0.628 0.926 0.691 CB 1.663 82 residues pruned to eliminate duplicates Z: 25 29.826 2.234 1.106 0.542 0.875 0.583 CB 1.420 25 residues pruned to eliminate duplicates Z: 85 74.985 2.336 1.021 0.663 0.952 0.643 CB 1.565 85 residues pruned to eliminate duplicates Z: 72 64.124 2.299 0.905 0.603 0.958 0.648 CB 1.645 72 residues pruned to eliminate duplicates Z: 87 75.702 2.359 1.001 0.607 0.942 0.640 CB 1.659 87 residues pruned to eliminate duplicates Z: 24 24.152 2.182 0.842 0.434 0.957 0.652 CB 1.403 24 residues pruned to eliminate duplicates Z: 19 30.143 2.367 1.095 0.509 0.889 0.722 CB 1.597 19 residues pruned to eliminate duplicates Z: 17 16.648 2.166 1.137 0.386 0.750 0.500 CB 1.353 Z: 7 3.736 1.725 0.596 0.337 0.667 0.167 CA 0.993 7 residues pruned to eliminate duplicates Z: 87 77.076 2.366 1.000 0.641 0.919 0.698 CB 1.675 104 residues pruned to eliminate duplicates Z: 122 82.647 2.354 0.983 0.593 0.884 0.645 CB 1.665 72 residues pruned to eliminate duplicates Z: 11 17.126 2.155 0.573 0.764 0.900 0.700 CB 1.405 Z: 10 21.277 2.204 0.712 0.844 1.000 0.889 CB 1.398 11 residues pruned to eliminate duplicates Z: 10 20.847 2.269 0.519 0.903 1.000 0.889 CB 1.437 11 residues pruned to eliminate duplicates Z: 11 19.055 2.120 0.518 0.881 1.000 0.800 CB 1.355 11 residues pruned to eliminate duplicates Z: 50 35.722 2.201 0.646 0.579 0.898 0.633 CB 1.453 9 residues pruned to eliminate duplicates Z: 11 17.278 2.126 0.707 0.804 0.900 0.500 CB 1.283 11 residues pruned to eliminate duplicates Z: 15 22.015 2.277 0.630 0.495 0.929 0.500 CB 1.716 15 residues pruned to eliminate duplicates Z: 18 19.268 2.156 0.663 0.480 0.882 0.471 CB 1.507 18 residues pruned to eliminate duplicates Z: 104 69.278 2.289 0.865 0.574 0.922 0.650 CB 1.615 154 residues pruned to eliminate duplicates Z: 22 17.265 2.043 0.557 0.437 0.857 0.571 CA 1.475 Z: 14 25.987 2.157 0.698 0.663 1.000 0.538 CA 1.692 21 residues pruned to eliminate duplicates 6 0.607 1.482 0.250 0.320 0.200 0.200 CA 0.894 ? 6 1.354 1.623 1.050 0.472 0.200 0.200 CB 0.936 ? Z: 9 11.437 2.175 0.422 0.747 0.750 0.375 CB 1.398 Z: 20 18.045 2.163 0.402 0.544 0.842 0.474 CB 1.552 14 residues pruned to eliminate duplicates Z: 13 14.651 1.988 0.509 0.800 0.833 0.500 CB 1.302 13 residues pruned to eliminate duplicates Z: 35 19.515 2.128 0.548 0.420 0.794 0.471 CB 1.391 21 residues pruned to eliminate duplicates Z: 12 16.123 2.169 0.523 0.759 0.818 0.636 CB 1.429 12 residues pruned to eliminate duplicates Z: 85 42.732 2.227 0.639 0.489 0.845 0.548 CB 1.528 51 residues pruned to eliminate duplicates Z: 11 12.495 2.159 0.281 0.746 0.800 0.400 CA 1.433 11 residues pruned to eliminate duplicates Z: 145 72.726 2.326 0.813 0.505 0.896 0.611 CB 1.596 145 residues pruned to eliminate duplicates Z: 47 30.169 2.206 0.637 0.356 0.891 0.478 CB 1.615 47 residues pruned to eliminate duplicates Z: 36 20.393 2.128 0.703 0.357 0.800 0.514 CB 1.387 36 residues pruned to eliminate duplicates Z: 78 47.727 2.218 0.767 0.481 0.909 0.701 CB 1.557 69 residues pruned to eliminate duplicates Z: 7 13.430 2.107 0.596 0.498 1.000 0.833 CB 1.635 7 residues pruned to eliminate duplicates Z: 144 77.054 2.371 0.901 0.513 0.846 0.594 CB 1.669 144 residues pruned to eliminate duplicates Z: 16 14.962 2.050 0.641 0.432 0.867 0.533 CB 1.421 16 residues pruned to eliminate duplicates Z: 21 27.141 2.171 0.720 0.602 0.950 0.750 CB 1.554 21 residues pruned to eliminate duplicates Z: 22 14.137 1.942 0.727 0.331 0.905 0.524 CB 1.223 22 residues pruned to eliminate duplicates Z: 141 85.522 2.380 0.877 0.549 0.914 0.650 CB 1.688 141 residues pruned to eliminate duplicates Z: 61 37.163 2.239 0.648 0.477 0.883 0.667 CB 1.506 61 residues pruned to eliminate duplicates Z: 43 36.326 2.226 0.769 0.535 0.952 0.714 CB 1.443 43 residues pruned to eliminate duplicates Z: 42 31.329 2.203 0.692 0.579 0.927 0.659 CB 1.313 42 residues pruned to eliminate duplicates Z: 76 43.853 2.199 0.813 0.474 0.893 0.600 CB 1.460 76 residues pruned to eliminate duplicates Z: 67 42.901 2.256 0.803 0.460 0.924 0.591 CB 1.464 67 residues pruned to eliminate duplicates Z: 140 83.240 2.360 0.919 0.553 0.906 0.604 CB 1.634 140 residues pruned to eliminate duplicates Z: 223 106.762 2.359 0.921 0.562 0.901 0.590 CB 1.652 223 residues pruned to eliminate duplicates Z: 38 34.135 2.214 0.843 0.602 0.919 0.676 CB 1.359 38 residues pruned to eliminate duplicates Z: 37 33.388 2.213 0.874 0.579 0.944 0.500 CB 1.316 37 residues pruned to eliminate duplicates Z: 136 71.716 2.313 0.848 0.510 0.911 0.593 CB 1.569 229 residues pruned to eliminate duplicates Z: 66 47.378 2.268 0.869 0.484 0.923 0.508 CB 1.526 Z: 16 22.833 2.127 0.914 0.848 0.933 0.533 CB 1.151 16 residues pruned to eliminate duplicates Z: 57 38.681 2.235 0.761 0.503 0.911 0.500 CB 1.438 45 residues pruned to eliminate duplicates Z: 14 26.084 2.205 1.132 0.919 0.923 0.462 CB 1.175 14 residues pruned to eliminate duplicates Z: 29 28.716 2.160 0.784 0.631 0.964 0.750 CB 1.291 29 residues pruned to eliminate duplicates Z: 202 95.607 2.305 0.909 0.570 0.900 0.617 CB 1.590 280 residues pruned to eliminate duplicates Z: 38 37.792 2.202 1.037 0.623 0.919 0.595 CB 1.342 Z: 16 25.101 2.203 1.080 0.861 0.933 0.733 CB 1.113 16 residues pruned to eliminate duplicates Z: 90 48.069 2.244 0.749 0.453 0.899 0.562 CB 1.516 38 residues pruned to eliminate duplicates Z: 7 4.009 1.581 0.555 0.339 0.667 0.333 CA 1.191 7 residues pruned to eliminate duplicates Z: 119 70.697 2.357 0.903 0.529 0.890 0.585 CB 1.585 209 residues pruned to eliminate duplicates Z: 66 36.807 2.172 0.779 0.487 0.862 0.554 CB 1.389 Z: 6 4.271 1.783 0.437 0.275 0.800 0.600 CA 1.203 6 residues pruned to eliminate duplicates Z: 157 79.056 2.374 0.847 0.522 0.878 0.583 CB 1.608 223 residues pruned to eliminate duplicates Z: 171 103.408 2.383 0.950 0.581 0.918 0.582 CB 1.720 159 residues pruned to eliminate duplicates Z: 6 8.299 2.019 0.728 0.405 0.800 0.400 N 1.470 Z: 6 8.134 1.591 0.562 0.746 1.000 0.400 C 1.174 6 residues pruned to eliminate duplicates Z: 6 9.023 2.022 0.563 0.413 1.000 0.400 CA 1.398 6 residues pruned to eliminate duplicates Z: 7 8.210 2.120 0.260 0.396 0.833 0.167 CA 1.680 7 residues pruned to eliminate duplicates Z: 194 101.668 2.366 0.947 0.572 0.907 0.627 CB 1.635 200 residues pruned to eliminate duplicates Z: 212 104.465 2.362 0.910 0.566 0.910 0.607 CB 1.643 212 residues pruned to eliminate duplicates Z: 31 28.816 2.272 0.770 0.367 0.933 0.633 CA 1.618 Z: 30 30.444 2.243 0.909 0.388 0.897 0.621 CB 1.658 30 residues pruned to eliminate duplicates Z: 17 22.470 2.213 0.957 0.308 0.938 0.500 CA 1.712 18 residues pruned to eliminate duplicates Z: 6 4.524 1.715 0.496 0.390 0.800 0.400 CA 1.107 6 residues pruned to eliminate duplicates Z: 19 14.244 2.029 0.645 0.239 0.889 0.444 CA 1.530 18 residues pruned to eliminate duplicates Z: 7 7.973 1.876 0.767 0.362 0.833 0.333 CB 1.366 7 residues pruned to eliminate duplicates Z: 146 94.350 2.396 0.881 0.599 0.931 0.634 CB 1.699 177 residues pruned to eliminate duplicates Z: 201 106.930 2.354 0.951 0.579 0.925 0.630 CB 1.650 201 residues pruned to eliminate duplicates Z: 163 99.938 2.378 0.987 0.564 0.907 0.630 CB 1.721 163 residues pruned to eliminate duplicates Z: 66 59.404 2.415 0.962 0.567 0.862 0.585 CB 1.691 66 residues pruned to eliminate duplicates Z: 32 32.842 2.248 0.983 0.398 0.935 0.581 CB 1.575 Z: 11 9.131 1.847 0.423 0.525 0.900 0.300 CA 1.191 9 residues pruned to eliminate duplicates Z: 7 11.529 2.046 0.878 0.615 0.833 0.167 CA 1.318 7 residues pruned to eliminate duplicates Z: 32 37.363 2.389 0.828 0.520 0.903 0.581 CB 1.667 16 residues pruned to eliminate duplicates Z: 24 27.550 2.280 0.594 0.593 0.913 0.696 CB 1.585 24 residues pruned to eliminate duplicates Z: 83 76.299 2.461 0.948 0.621 0.915 0.732 CB 1.714 50 residues pruned to eliminate duplicates Z: 10 12.175 1.823 0.651 0.486 1.000 0.444 CA 1.367 10 residues pruned to eliminate duplicates Z: 141 98.619 2.401 0.977 0.618 0.929 0.621 CB 1.691 141 residues pruned to eliminate duplicates Z: 60 51.041 2.392 0.726 0.569 0.915 0.678 CB 1.646 60 residues pruned to eliminate duplicates Z: 51 46.317 2.342 0.889 0.493 0.900 0.600 CB 1.658 51 residues pruned to eliminate duplicates Z: 28 34.551 2.311 0.855 0.588 0.926 0.519 CB 1.540 28 residues pruned to eliminate duplicates Z: 51 37.884 2.315 0.708 0.468 0.860 0.580 CB 1.627 51 residues pruned to eliminate duplicates Z: 67 66.611 2.423 0.974 0.572 0.970 0.697 CB 1.649 67 residues pruned to eliminate duplicates Z: 23 30.088 2.374 0.731 0.597 0.864 0.545 CA 1.648 23 residues pruned to eliminate duplicates Z: 94 78.003 2.444 0.915 0.572 0.935 0.645 CB 1.723 94 residues pruned to eliminate duplicates Z: 123 87.779 2.363 0.958 0.611 0.926 0.721 CB 1.668 123 residues pruned to eliminate duplicates Z: 14 13.603 1.858 0.848 0.401 0.846 0.538 CB 1.441 12 residues pruned to eliminate duplicates Z: 6 2.708 1.307 0.211 0.526 0.800 0.400 CB 0.932 Z: 11 13.402 2.186 0.184 0.755 0.900 0.800 CB 1.450 11 residues pruned to eliminate duplicates Z: 16 12.461 2.213 0.171 0.476 0.800 0.600 CB 1.589 16 residues pruned to eliminate duplicates Z: 22 18.214 2.061 0.462 0.473 0.905 0.476 CB 1.499 15 residues pruned to eliminate duplicates Z: 10 19.431 2.260 0.292 0.916 1.000 0.889 CB 1.567 10 residues pruned to eliminate duplicates Z: 17 16.999 2.075 0.509 0.453 0.875 0.438 CA 1.628 17 residues pruned to eliminate duplicates Z: 23 14.843 2.027 0.424 0.374 0.955 0.455 CB 1.314 23 residues pruned to eliminate duplicates Z: 18 13.821 2.182 0.340 0.405 0.824 0.471 CB 1.538 18 residues pruned to eliminate duplicates Z: 21 15.256 2.186 0.488 0.362 0.850 0.350 CB 1.431 21 residues pruned to eliminate duplicates Z: 110 69.255 2.315 0.807 0.560 0.890 0.642 CB 1.681 110 residues pruned to eliminate duplicates Z: 17 19.901 2.180 0.448 0.445 1.000 0.438 CA 1.669 17 residues pruned to eliminate duplicates Z: 21 13.029 2.023 0.551 0.368 0.750 0.500 CA 1.426 21 residues pruned to eliminate duplicates Z: 19 16.132 2.167 0.439 0.431 0.833 0.611 CB 1.573 19 residues pruned to eliminate duplicates Z: 20 17.908 2.087 0.629 0.385 0.947 0.421 CB 1.441 20 residues pruned to eliminate duplicates Z: 21 14.973 2.160 0.443 0.399 0.850 0.600 CB 1.405 21 residues pruned to eliminate duplicates Z: 45 35.005 2.231 0.796 0.503 0.864 0.614 CB 1.521 45 residues pruned to eliminate duplicates Z: 6 2.900 1.796 -0.195 0.266 0.800 0.600 O 1.465 Z: 7 2.941 1.691 0.364 0.315 0.667 0.500 CB 0.959 7 residues pruned to eliminate duplicates Z: 74 43.974 2.174 0.626 0.460 0.945 0.616 CB 1.605 74 residues pruned to eliminate duplicates Z: 73 33.483 1.994 0.627 0.523 0.833 0.597 CB 1.427 76 residues pruned to eliminate duplicates Z: 12 16.389 2.158 0.565 0.731 0.818 0.455 CB 1.453 12 residues pruned to eliminate duplicates Z: 148 73.439 2.275 0.743 0.525 0.905 0.646 CB 1.646 148 residues pruned to eliminate duplicates Z: 161 79.662 2.269 0.747 0.537 0.919 0.613 CB 1.667 161 residues pruned to eliminate duplicates Z: 23 16.580 2.113 0.608 0.454 0.818 0.455 CB 1.333 23 residues pruned to eliminate duplicates Z: 33 24.527 2.095 0.768 0.424 0.875 0.562 CB 1.448 33 residues pruned to eliminate duplicates Z: 31 25.584 2.159 0.708 0.432 0.900 0.600 CB 1.510 31 residues pruned to eliminate duplicates Z: 136 69.606 2.296 0.792 0.488 0.904 0.593 CB 1.631 311 residues pruned to eliminate duplicates Z: 8 23.463 2.393 0.827 0.758 1.000 0.571 CB 1.613 8 residues pruned to eliminate duplicates Z: 45 23.485 2.147 0.685 0.390 0.773 0.568 CB 1.423 45 residues pruned to eliminate duplicates Z: 56 37.093 2.142 0.652 0.521 0.909 0.618 CB 1.523 56 residues pruned to eliminate duplicates Z: 26 23.305 2.247 0.699 0.443 0.880 0.640 CB 1.472 26 residues pruned to eliminate duplicates Z: 73 44.293 2.122 0.814 0.485 0.931 0.611 CB 1.479 73 residues pruned to eliminate duplicates Z: 33 24.230 2.137 0.773 0.399 0.844 0.562 CB 1.491 33 residues pruned to eliminate duplicates Z: 222 95.637 2.238 0.826 0.570 0.941 0.615 CB 1.564 222 residues pruned to eliminate duplicates Z: 65 40.976 2.161 0.701 0.468 0.922 0.578 CB 1.561 65 residues pruned to eliminate duplicates Z: 213 96.830 2.248 0.883 0.566 0.929 0.651 CB 1.586 213 residues pruned to eliminate duplicates Z: 193 87.170 2.244 0.795 0.579 0.901 0.599 CB 1.607 193 residues pruned to eliminate duplicates Z: 137 73.238 2.242 0.759 0.554 0.926 0.669 CB 1.631 137 residues pruned to eliminate duplicates Z: 45 34.975 2.188 0.660 0.539 0.932 0.750 CB 1.500 45 residues pruned to eliminate duplicates Z: 69 33.956 2.117 0.482 0.464 0.882 0.515 CB 1.543 69 residues pruned to eliminate duplicates Z: 210 93.575 2.247 0.873 0.574 0.909 0.612 CB 1.576 210 residues pruned to eliminate duplicates Z: 45 34.558 2.135 0.649 0.538 0.955 0.614 CB 1.494 45 residues pruned to eliminate duplicates Z: 48 31.290 2.093 0.621 0.532 0.915 0.638 CB 1.425 48 residues pruned to eliminate duplicates Z: 45 30.467 2.154 0.554 0.497 0.909 0.659 CB 1.514 45 residues pruned to eliminate duplicates Z: 35 27.473 2.107 0.540 0.504 0.912 0.618 CA 1.586 35 residues pruned to eliminate duplicates Z: 212 88.150 2.252 0.768 0.554 0.910 0.583 CB 1.590 212 residues pruned to eliminate duplicates Z: 22 21.107 1.981 0.558 0.602 0.952 0.762 CB 1.422 22 residues pruned to eliminate duplicates Z: 94 45.616 2.166 0.646 0.459 0.892 0.559 CB 1.550 94 residues pruned to eliminate duplicates Z: 77 41.537 2.231 0.635 0.432 0.882 0.645 CB 1.591 77 residues pruned to eliminate duplicates Z: 44 27.970 2.095 0.562 0.505 0.860 0.605 CB 1.506 44 residues pruned to eliminate duplicates Z: 48 27.471 2.074 0.589 0.517 0.872 0.596 CB 1.371 48 residues pruned to eliminate duplicates Z: 89 44.180 2.174 0.681 0.466 0.852 0.580 CB 1.565 89 residues pruned to eliminate duplicates Z: 39 31.375 2.168 0.627 0.573 0.921 0.763 CB 1.460 39 residues pruned to eliminate duplicates Z: 67 38.878 2.111 0.656 0.512 0.909 0.606 CB 1.488 67 residues pruned to eliminate duplicates Z: 83 45.817 2.177 0.635 0.495 0.902 0.585 CB 1.583 83 residues pruned to eliminate duplicates Z: 74 45.620 2.175 0.771 0.474 0.918 0.616 CB 1.551 74 residues pruned to eliminate duplicates Z: 66 33.206 2.060 0.580 0.460 0.892 0.585 CB 1.478 66 residues pruned to eliminate duplicates Z: 30 22.777 2.092 0.780 0.337 0.828 0.517 CB 1.641 Z: 7 5.241 1.651 0.779 0.394 0.833 0.667 CA 0.978 7 residues pruned to eliminate duplicates Z: 186 90.460 2.252 0.858 0.574 0.919 0.611 CB 1.611 216 residues pruned to eliminate duplicates Z: 52 34.312 2.059 0.674 0.446 0.922 0.549 CB 1.598 Z: 6 7.498 1.816 0.412 0.487 1.000 0.600 CA 1.326 6 residues pruned to eliminate duplicates Z: 174 88.295 2.279 0.863 0.562 0.942 0.572 CB 1.579 226 residues pruned to eliminate duplicates Z: 51 38.243 2.211 0.730 0.448 0.900 0.600 CB 1.657 Z: 6 3.937 1.770 0.375 0.390 1.000 0.600 CA 0.813 6 residues pruned to eliminate duplicates Z: 154 79.719 2.270 0.749 0.579 0.922 0.641 CB 1.632 52 residues pruned to eliminate duplicates Z: 6 6.192 1.890 0.547 0.266 0.800 0.600 C 1.545 6 residues pruned to eliminate duplicates Z: 90 46.399 2.157 0.733 0.463 0.876 0.584 CB 1.560 252 residues pruned to eliminate duplicates Z: 6 8.553 1.970 1.112 0.423 1.000 0.400 CA 0.996 Z: 6 4.972 1.628 0.672 0.292 1.000 0.600 N 1.031 Z: 8 8.348 1.973 0.343 0.417 0.857 0.286 CA 1.514 4 residues pruned to eliminate duplicates Z: 6 10.461 2.005 0.424 0.613 1.000 0.200 CB 1.473 7 residues pruned to eliminate duplicates Z: 7 8.894 1.984 0.363 0.564 0.833 0.167 CB 1.514 7 residues pruned to eliminate duplicates Z: 26 26.450 2.230 0.562 0.544 0.880 0.600 CA 1.654 9 residues pruned to eliminate duplicates Z: 10 6.577 1.749 -0.024 0.444 1.000 0.556 CB 1.359 10 residues pruned to eliminate duplicates Z: 89 50.732 2.258 0.709 0.476 0.886 0.580 CB 1.620 32 residues pruned to eliminate duplicates Z: 17 30.848 2.161 0.904 0.817 0.938 0.562 CA 1.518 17 residues pruned to eliminate duplicates Z: 134 87.824 2.292 0.946 0.627 0.932 0.617 CB 1.626 64 residues pruned to eliminate duplicates Z: 14 19.217 2.121 0.430 0.912 0.769 0.462 CA 1.618 14 residues pruned to eliminate duplicates Z: 141 91.041 2.315 0.886 0.633 0.957 0.621 CB 1.625 134 residues pruned to eliminate duplicates Z: 150 86.156 2.291 0.884 0.586 0.933 0.570 CB 1.615 150 residues pruned to eliminate duplicates Z: 138 88.365 2.317 0.931 0.620 0.934 0.599 CB 1.612 139 residues pruned to eliminate duplicates Z: 16 27.456 2.066 0.819 0.880 0.933 0.467 CA 1.464 16 residues pruned to eliminate duplicates Z: 144 67.005 2.205 0.733 0.523 0.916 0.601 CB 1.566 309 residues pruned to eliminate duplicates Z: 55 44.489 2.268 0.741 0.549 0.926 0.574 CB 1.579 Z: 16 30.906 2.070 0.875 0.907 1.000 0.467 CA 1.461 7 residues pruned to eliminate duplicates Z: 15 28.109 2.111 0.805 0.928 1.000 0.714 CA 1.381 16 residues pruned to eliminate duplicates Z: 14 29.573 2.219 0.961 0.878 0.923 0.692 CB 1.482 14 residues pruned to eliminate duplicates Z: 124 77.880 2.287 0.924 0.613 0.894 0.675 CB 1.603 23 residues pruned to eliminate duplicates Z: 18 31.091 2.267 0.853 0.712 0.941 0.706 CB 1.573 18 residues pruned to eliminate duplicates Z: 92 69.709 2.312 0.898 0.597 0.901 0.648 CB 1.685 92 residues pruned to eliminate duplicates Z: 136 84.739 2.284 0.906 0.609 0.970 0.563 CB 1.557 116 residues pruned to eliminate duplicates Z: 6 3.674 1.618 0.761 0.279 0.800 0.600 CA 0.925 6 residues pruned to eliminate duplicates Z: 33 51.676 2.349 0.936 0.634 1.000 0.719 CB 1.771 33 residues pruned to eliminate duplicates Z: 81 62.939 2.319 0.934 0.548 0.913 0.588 CB 1.640 73 residues pruned to eliminate duplicates Z: 6 5.025 1.753 0.523 0.408 0.800 0.600 CA 1.159 Z: 8 9.635 1.549 0.757 0.490 1.000 0.429 N 1.351 Z: 10 5.170 1.738 0.002 0.527 0.778 0.333 CA 1.238 10 residues pruned to eliminate duplicates Z: 150 73.548 2.237 0.812 0.526 0.919 0.617 CB 1.576 150 residues pruned to eliminate duplicates Z: 140 92.319 2.313 0.917 0.642 0.950 0.633 CB 1.629 154 residues pruned to eliminate duplicates Z: 19 37.755 2.262 0.949 0.778 0.944 0.611 CB 1.672 19 residues pruned to eliminate duplicates Z: 158 86.632 2.270 0.881 0.560 0.936 0.637 CB 1.631 158 residues pruned to eliminate duplicates Z: 63 65.857 2.380 0.977 0.628 0.919 0.629 CB 1.714 63 residues pruned to eliminate duplicates Z: 59 53.488 2.352 0.860 0.581 0.897 0.586 CB 1.657 59 residues pruned to eliminate duplicates Z: 152 93.802 2.297 0.982 0.594 0.960 0.616 CB 1.597 152 residues pruned to eliminate duplicates Z: 17 45.249 2.268 1.097 0.933 1.000 0.688 CB 1.660 17 residues pruned to eliminate duplicates Z: 81 54.422 2.235 0.861 0.508 0.938 0.562 CB 1.549 81 residues pruned to eliminate duplicates Z: 115 87.173 2.309 1.029 0.642 0.939 0.553 CB 1.627 115 residues pruned to eliminate duplicates Z: 114 89.786 2.323 1.017 0.653 0.965 0.646 CB 1.621 114 residues pruned to eliminate duplicates Z: 17 42.257 2.257 1.058 0.937 1.000 0.750 CB 1.583 17 residues pruned to eliminate duplicates Z: 28 29.079 2.096 0.892 0.517 0.963 0.593 CB 1.440 28 residues pruned to eliminate duplicates Z: 128 78.130 2.266 0.955 0.558 0.906 0.614 CB 1.633 128 residues pruned to eliminate duplicates Z: 116 74.575 2.248 0.867 0.597 0.930 0.600 CB 1.624 116 residues pruned to eliminate duplicates Z: 147 86.288 2.303 0.953 0.604 0.918 0.637 CB 1.567 147 residues pruned to eliminate duplicates Z: 128 82.313 2.281 0.880 0.626 0.929 0.669 CB 1.628 128 residues pruned to eliminate duplicates Z: 130 87.534 2.292 0.921 0.614 0.961 0.612 CB 1.635 130 residues pruned to eliminate duplicates Z: 28 33.226 2.215 0.927 0.562 0.926 0.296 CB 1.524 28 residues pruned to eliminate duplicates Z: 63 49.085 2.275 0.890 0.560 0.903 0.581 CB 1.514 63 residues pruned to eliminate duplicates Z: 145 86.744 2.271 0.994 0.580 0.910 0.576 CB 1.624 138 residues pruned to eliminate duplicates Z: 7 6.024 1.508 0.703 0.422 1.000 0.333 N 1.039 7 residues pruned to eliminate duplicates Z: 192 93.990 2.240 0.906 0.579 0.953 0.592 CB 1.550 192 residues pruned to eliminate duplicates Z: 89 73.953 2.352 0.938 0.614 0.920 0.568 CB 1.686 89 residues pruned to eliminate duplicates Z: 109 82.231 2.314 1.031 0.594 0.935 0.574 CB 1.645 109 residues pruned to eliminate duplicates Z: 31 52.585 2.350 1.010 0.694 0.933 0.733 CB 1.825 31 residues pruned to eliminate duplicates Z: 93 61.395 2.199 0.783 0.590 0.902 0.630 CB 1.659 93 residues pruned to eliminate duplicates Z: 131 82.470 2.291 0.927 0.616 0.931 0.608 CB 1.578 131 residues pruned to eliminate duplicates Z: 31 47.407 2.352 0.916 0.668 0.933 0.600 CB 1.762 31 residues pruned to eliminate duplicates Z: 23 33.182 2.350 1.166 0.567 0.773 0.500 CB 1.685 23 residues pruned to eliminate duplicates Z: 25 35.430 2.287 0.921 0.555 0.875 0.542 CA 1.783 25 residues pruned to eliminate duplicates Z: 22 35.679 2.314 0.965 0.608 0.857 0.619 CA 1.803 22 residues pruned to eliminate duplicates Z: 172 93.488 2.268 0.976 0.576 0.912 0.673 CB 1.625 172 residues pruned to eliminate duplicates Z: 136 86.187 2.292 0.949 0.616 0.919 0.607 CB 1.620 136 residues pruned to eliminate duplicates Z: 79 69.060 2.265 1.028 0.628 0.936 0.615 CB 1.613 79 residues pruned to eliminate duplicates Z: 22 39.045 2.355 0.987 0.632 0.905 0.762 CA 1.779 22 residues pruned to eliminate duplicates Z: 38 59.087 2.337 1.122 0.718 0.919 0.649 CB 1.749 38 residues pruned to eliminate duplicates Z: 91 73.374 2.320 0.936 0.611 0.922 0.600 CB 1.681 91 residues pruned to eliminate duplicates Z: 140 91.482 2.288 1.003 0.634 0.950 0.619 CB 1.572 140 residues pruned to eliminate duplicates Z: 59 49.347 2.210 0.945 0.630 0.914 0.638 CB 1.459 59 residues pruned to eliminate duplicates Z: 82 78.391 2.293 1.099 0.661 0.963 0.654 CB 1.619 82 residues pruned to eliminate duplicates Z: 6 4.036 2.015 0.076 0.349 0.800 0.600 CB 1.225 6 residues pruned to eliminate duplicates Z: 74 67.792 2.304 0.981 0.665 0.932 0.616 CB 1.601 74 residues pruned to eliminate duplicates Z: 84 65.931 2.257 0.964 0.652 0.904 0.590 CB 1.569 84 residues pruned to eliminate duplicates Z: 97 74.631 2.338 0.960 0.581 0.927 0.562 CB 1.659 97 residues pruned to eliminate duplicates Z: 33 48.929 2.301 1.053 0.659 0.875 0.750 CB 1.805 33 residues pruned to eliminate duplicates Z: 81 76.021 2.299 1.004 0.685 0.975 0.650 CB 1.596 81 residues pruned to eliminate duplicates Z: 82 71.328 2.292 1.006 0.663 0.926 0.605 CB 1.601 82 residues pruned to eliminate duplicates Z: 35 38.508 2.192 0.940 0.595 0.912 0.706 CB 1.556 35 residues pruned to eliminate duplicates Z: 43 40.977 2.208 0.964 0.536 0.857 0.595 CB 1.642 43 residues pruned to eliminate duplicates Z: 83 59.471 2.203 1.008 0.648 0.890 0.585 CB 1.452 83 residues pruned to eliminate duplicates Z: 81 69.407 2.289 1.064 0.662 0.913 0.625 CB 1.549 81 residues pruned to eliminate duplicates Z: 96 75.795 2.299 0.991 0.634 0.937 0.537 CB 1.599 96 residues pruned to eliminate duplicates Z: 139 92.180 2.298 1.006 0.623 0.942 0.529 CB 1.608 139 residues pruned to eliminate duplicates Z: 86 70.495 2.243 1.025 0.633 0.953 0.659 CB 1.559 86 residues pruned to eliminate duplicates Z: 146 65.330 2.174 0.739 0.518 0.903 0.559 CB 1.561 146 residues pruned to eliminate duplicates Z: 141 87.551 2.307 0.933 0.612 0.936 0.586 CB 1.595 141 residues pruned to eliminate duplicates Z: 83 62.085 2.223 0.978 0.600 0.951 0.549 CB 1.490 83 residues pruned to eliminate duplicates Z: 156 91.273 2.290 0.974 0.589 0.942 0.587 CB 1.581 156 residues pruned to eliminate duplicates Z: 15 16.683 1.823 1.053 0.581 0.857 0.429 CA 1.286 15 residues pruned to eliminate duplicates Z: 144 86.708 2.267 0.944 0.606 0.944 0.608 CB 1.576 144 residues pruned to eliminate duplicates Z: 85 68.588 2.260 0.951 0.635 0.964 0.583 CB 1.551 85 residues pruned to eliminate duplicates Z: 82 69.867 2.279 0.973 0.642 0.938 0.630 CB 1.611 82 residues pruned to eliminate duplicates Z: 83 70.699 2.274 1.052 0.631 0.939 0.659 CB 1.576 83 residues pruned to eliminate duplicates Z: 84 70.481 2.268 1.070 0.610 0.952 0.530 CB 1.559 84 residues pruned to eliminate duplicates Z: 70 56.268 2.182 0.966 0.615 0.913 0.551 CB 1.551 70 residues pruned to eliminate duplicates Z: 209 94.390 2.255 0.869 0.564 0.928 0.620 CB 1.573 209 residues pruned to eliminate duplicates Z: 146 85.079 2.254 0.945 0.574 0.938 0.621 CB 1.600 146 residues pruned to eliminate duplicates Z: 82 72.575 2.290 0.988 0.650 0.963 0.593 CB 1.600 82 residues pruned to eliminate duplicates Z: 84 69.845 2.265 1.002 0.623 0.952 0.602 CB 1.582 84 residues pruned to eliminate duplicates Z: 68 50.460 2.192 0.838 0.604 0.925 0.612 CB 1.498 68 residues pruned to eliminate duplicates Z: 83 65.212 2.249 1.008 0.631 0.902 0.598 CB 1.563 83 residues pruned to eliminate duplicates Z: 77 66.697 2.275 0.990 0.616 0.934 0.684 CB 1.621 77 residues pruned to eliminate duplicates Z: 150 84.950 2.269 0.964 0.607 0.906 0.591 CB 1.558 150 residues pruned to eliminate duplicates Z: 71 58.586 2.198 0.924 0.615 0.986 0.657 CB 1.507 71 residues pruned to eliminate duplicates Z: 58 52.437 2.237 0.938 0.608 0.982 0.684 CB 1.471 58 residues pruned to eliminate duplicates Z: 114 87.338 2.320 1.036 0.632 0.965 0.628 CB 1.593 114 residues pruned to eliminate duplicates Z: 91 64.717 2.204 0.988 0.589 0.944 0.633 CB 1.514 91 residues pruned to eliminate duplicates Z: 139 88.130 2.310 0.951 0.619 0.928 0.645 CB 1.604 139 residues pruned to eliminate duplicates Z: 82 61.446 2.223 0.953 0.596 0.926 0.580 CB 1.549 82 residues pruned to eliminate duplicates Z: 136 77.745 2.250 0.942 0.553 0.926 0.585 CB 1.570 136 residues pruned to eliminate duplicates Z: 138 90.309 2.284 1.035 0.616 0.942 0.679 CB 1.579 138 residues pruned to eliminate duplicates Z: 29 38.372 2.228 1.119 0.543 0.964 0.607 CB 1.527 29 residues pruned to eliminate duplicates Z: 12 15.696 2.069 0.873 0.590 0.909 0.364 CB 1.233 12 residues pruned to eliminate duplicates Z: 75 73.509 2.302 1.055 0.648 0.946 0.662 CB 1.662 75 residues pruned to eliminate duplicates Z: 81 67.498 2.246 0.962 0.604 0.975 0.663 CB 1.591 81 residues pruned to eliminate duplicates Z: 82 74.950 2.290 1.025 0.645 0.975 0.630 CB 1.608 82 residues pruned to eliminate duplicates Z: 83 68.577 2.271 1.091 0.649 0.902 0.634 CB 1.537 83 residues pruned to eliminate duplicates Z: 85 66.353 2.271 0.909 0.606 0.929 0.536 CB 1.627 85 residues pruned to eliminate duplicates Z: 82 74.316 2.281 1.093 0.654 0.926 0.667 CB 1.618 82 residues pruned to eliminate duplicates Z: 84 73.085 2.251 1.105 0.626 0.952 0.627 CB 1.580 84 residues pruned to eliminate duplicates Z: 83 72.656 2.269 1.127 0.633 0.927 0.598 CB 1.584 83 residues pruned to eliminate duplicates Z: 13 23.704 2.166 1.375 0.510 1.000 0.750 CB 1.317 13 residues pruned to eliminate duplicates Z: 13 21.896 2.166 1.306 0.517 0.917 0.667 CB 1.358 13 residues pruned to eliminate duplicates Z: 82 68.019 2.241 1.029 0.621 0.938 0.580 CB 1.580 82 residues pruned to eliminate duplicates Z: 110 76.122 2.288 0.899 0.594 0.936 0.633 CB 1.640 110 residues pruned to eliminate duplicates Z: 14 20.247 2.176 1.086 0.447 0.923 0.538 CB 1.415 14 residues pruned to eliminate duplicates Z: 84 71.797 2.266 0.992 0.625 0.964 0.627 CB 1.609 84 residues pruned to eliminate duplicates Z: 6 7.741 1.690 0.319 0.658 1.000 0.400 CB 1.341 6 residues pruned to eliminate duplicates Z: 10 6.487 1.479 0.314 0.698 1.000 0.778 CB 0.929 10 residues pruned to eliminate duplicates Z: 10 10.319 1.554 0.518 0.755 1.000 0.444 CB 1.162 10 residues pruned to eliminate duplicates Z: 8 11.566 1.677 0.572 0.847 1.000 0.571 CB 1.232 8 residues pruned to eliminate duplicates Z: 10 11.098 1.559 0.481 0.859 1.000 0.667 CB 1.179 10 residues pruned to eliminate duplicates Z: 11 8.671 1.475 0.464 0.679 1.000 0.500 CB 1.077 11 residues pruned to eliminate duplicates Z: 8 9.012 1.647 0.240 0.878 1.000 0.714 CB 1.210 8 residues pruned to eliminate duplicates Z: 16 9.501 1.755 0.187 0.546 0.933 0.533 CB 1.207 14 residues pruned to eliminate duplicates Z: 12 9.835 1.741 0.171 0.688 1.000 0.818 CA 1.224 12 residues pruned to eliminate duplicates Z: 15 11.231 1.825 0.408 0.515 0.929 0.571 CB 1.239 15 residues pruned to eliminate duplicates Z: 16 10.706 1.802 0.365 0.528 0.867 0.533 CB 1.262 16 residues pruned to eliminate duplicates Z: 10 11.643 1.836 0.239 0.877 1.000 0.778 CB 1.239 10 residues pruned to eliminate duplicates Z: 15 11.189 1.820 0.516 0.538 0.929 0.500 CB 1.124 15 residues pruned to eliminate duplicates Z: 18 8.410 1.736 0.209 0.470 0.824 0.529 CB 1.217 18 residues pruned to eliminate duplicates Z: 17 7.479 1.742 0.134 0.496 0.812 0.500 CB 1.170 17 residues pruned to eliminate duplicates Z: 19 8.487 1.744 0.290 0.441 0.833 0.444 CB 1.134 19 residues pruned to eliminate duplicates Z: 24 9.593 1.747 0.226 0.348 0.870 0.435 CB 1.266 20 residues pruned to eliminate duplicates Z: 11 8.950 1.809 0.047 0.732 1.000 0.800 CB 1.213 11 residues pruned to eliminate duplicates Z: 16 8.273 1.780 0.094 0.531 0.867 0.533 CB 1.228 16 residues pruned to eliminate duplicates Z: 14 11.878 1.876 0.274 0.563 1.000 0.615 CB 1.297 14 residues pruned to eliminate duplicates Z: 15 10.796 1.827 0.316 0.538 0.929 0.500 CB 1.245 15 residues pruned to eliminate duplicates Z: 36 12.760 1.684 0.295 0.445 0.914 0.457 CB 1.144 36 residues pruned to eliminate duplicates Z: 11 4.123 1.683 0.196 0.199 0.800 0.300 CB 1.158 11 residues pruned to eliminate duplicates Z: 20 8.074 1.651 0.187 0.415 0.947 0.474 CB 1.091 20 residues pruned to eliminate duplicates Z: 11 4.186 1.668 0.040 0.159 0.900 0.300 CB 1.286 11 residues pruned to eliminate duplicates Z: 22 11.288 1.793 0.295 0.407 0.905 0.619 CB 1.292 22 residues pruned to eliminate duplicates Z: 35 12.815 1.746 0.227 0.441 0.882 0.618 CB 1.236 35 residues pruned to eliminate duplicates Z: 27 10.256 1.690 0.281 0.419 0.923 0.615 CB 1.095 27 residues pruned to eliminate duplicates Z: 9 4.981 1.789 0.334 0.326 0.875 0.375 CB 1.020 9 residues pruned to eliminate duplicates Z: 25 11.892 1.781 0.358 0.436 0.875 0.542 CB 1.225 25 residues pruned to eliminate duplicates Z: 18 5.420 1.735 0.166 0.282 0.706 0.529 CB 1.177 18 residues pruned to eliminate duplicates Z: 19 8.174 1.714 0.361 0.435 0.833 0.556 CB 1.060 19 residues pruned to eliminate duplicates Z: 10 10.383 1.642 0.508 0.786 0.889 0.556 CB 1.223 10 residues pruned to eliminate duplicates Z: 13 8.238 1.707 0.532 0.532 0.750 0.417 CB 1.175 14 residues pruned to eliminate duplicates Z: 10 11.467 1.569 0.513 0.839 1.000 0.667 CB 1.203 9 residues pruned to eliminate duplicates Z: 9 11.452 1.686 0.619 0.828 0.875 0.375 CB 1.277 9 residues pruned to eliminate duplicates Z: 10 10.369 1.633 0.698 0.674 1.000 0.556 CB 1.062 11 residues pruned to eliminate duplicates Z: 9 12.137 1.666 0.755 0.832 0.875 0.500 CB 1.260 9 residues pruned to eliminate duplicates Z: 9 9.582 1.718 0.472 0.756 0.875 0.000 CB 1.220 9 residues pruned to eliminate duplicates Z: 9 9.191 1.688 0.526 0.766 0.875 0.500 CB 1.138 9 residues pruned to eliminate duplicates Z: 14 8.695 1.899 0.506 0.206 0.846 0.692 CA 1.411 14 residues pruned to eliminate duplicates Z: 13 10.355 1.934 0.482 0.260 1.000 0.583 CA 1.372 13 residues pruned to eliminate duplicates Z: 86 53.079 2.162 0.750 0.548 0.918 0.624 CB 1.582 86 residues pruned to eliminate duplicates Z: 13 9.218 1.791 0.415 0.268 0.917 0.583 CA 1.491 13 residues pruned to eliminate duplicates Z: 32 21.884 1.843 0.684 0.557 0.903 0.677 CB 1.327 32 residues pruned to eliminate duplicates Z: 138 83.591 2.232 0.823 0.628 0.956 0.642 CB 1.627 142 residues pruned to eliminate duplicates Z: 14 21.525 1.895 0.701 0.927 0.923 0.769 CB 1.406 14 residues pruned to eliminate duplicates Z: 138 79.254 2.234 0.796 0.624 0.927 0.613 CB 1.620 139 residues pruned to eliminate duplicates Z: 12 24.802 2.000 0.805 0.890 1.000 0.727 CB 1.490 12 residues pruned to eliminate duplicates Z: 140 82.740 2.223 0.846 0.624 0.942 0.619 CB 1.615 140 residues pruned to eliminate duplicates Z: 141 79.868 2.223 0.790 0.609 0.950 0.607 CB 1.611 141 residues pruned to eliminate duplicates Z: 87 53.405 2.177 0.788 0.552 0.919 0.663 CB 1.531 87 residues pruned to eliminate duplicates Z: 154 77.707 2.157 0.846 0.580 0.935 0.621 CB 1.564 154 residues pruned to eliminate duplicates Z: 50 27.197 2.029 0.583 0.511 0.898 0.694 CB 1.333 50 residues pruned to eliminate duplicates Z: 140 80.586 2.233 0.808 0.625 0.950 0.604 CB 1.585 140 residues pruned to eliminate duplicates Z: 138 81.602 2.211 0.874 0.596 0.964 0.613 CB 1.594 138 residues pruned to eliminate duplicates Z: 97 63.624 2.183 0.817 0.623 0.927 0.615 CB 1.572 97 residues pruned to eliminate duplicates Z: 144 81.773 2.213 0.833 0.611 0.951 0.671 CB 1.596 144 residues pruned to eliminate duplicates Z: 73 59.791 2.221 0.889 0.617 0.958 0.667 CB 1.568 73 residues pruned to eliminate duplicates Z: 144 78.943 2.210 0.797 0.613 0.951 0.671 CB 1.570 144 residues pruned to eliminate duplicates Z: 137 82.399 2.240 0.826 0.626 0.949 0.640 CB 1.616 137 residues pruned to eliminate duplicates Z: 98 57.126 2.165 0.838 0.561 0.907 0.567 CB 1.515 98 residues pruned to eliminate duplicates Z: 85 66.277 2.238 0.824 0.665 0.917 0.655 CB 1.658 85 residues pruned to eliminate duplicates Z: 88 67.400 2.224 0.806 0.650 0.943 0.644 CB 1.660 88 residues pruned to eliminate duplicates Z: 44 41.426 2.129 0.910 0.655 0.884 0.628 CB 1.522 44 residues pruned to eliminate duplicates Z: 119 81.953 2.265 0.877 0.643 0.941 0.653 CB 1.650 119 residues pruned to eliminate duplicates Z: 90 69.227 2.203 0.932 0.633 0.955 0.640 CB 1.594 90 residues pruned to eliminate duplicates Z: 150 78.765 2.195 0.796 0.589 0.940 0.658 CB 1.600 150 residues pruned to eliminate duplicates Z: 68 58.796 2.237 0.737 0.639 0.955 0.701 CB 1.699 68 residues pruned to eliminate duplicates Z: 72 56.902 2.208 0.670 0.638 0.986 0.606 CB 1.632 72 residues pruned to eliminate duplicates Z: 126 81.225 2.197 0.958 0.615 0.952 0.656 CB 1.591 126 residues pruned to eliminate duplicates Z: 146 82.560 2.191 0.900 0.622 0.938 0.634 CB 1.565 146 residues pruned to eliminate duplicates Z: 142 77.132 2.177 0.850 0.607 0.929 0.624 CB 1.569 142 residues pruned to eliminate duplicates Z: 90 67.999 2.211 0.854 0.631 0.944 0.674 CB 1.648 90 residues pruned to eliminate duplicates Z: 70 53.613 2.209 0.806 0.609 0.913 0.638 CB 1.598 70 residues pruned to eliminate duplicates Z: 113 86.232 2.275 0.956 0.643 0.946 0.634 CB 1.693 113 residues pruned to eliminate duplicates Z: 88 71.384 2.222 0.868 0.642 0.966 0.667 CB 1.672 88 residues pruned to eliminate duplicates Z: 70 59.654 2.210 0.793 0.637 0.971 0.652 CB 1.641 69 residues pruned to eliminate duplicates Z: 17 23.879 2.040 0.500 0.894 1.000 0.750 CA 1.399 17 residues pruned to eliminate duplicates Z: 89 63.735 2.188 0.839 0.630 0.932 0.625 CB 1.603 89 residues pruned to eliminate duplicates Z: 64 51.097 2.164 0.724 0.624 0.937 0.571 CA 1.639 64 residues pruned to eliminate duplicates Z: 138 83.108 2.229 0.859 0.627 0.949 0.693 CB 1.601 138 residues pruned to eliminate duplicates Z: 140 78.239 2.191 0.858 0.612 0.935 0.655 CB 1.567 140 residues pruned to eliminate duplicates Z: 114 84.229 2.259 0.972 0.633 0.938 0.602 CB 1.673 114 residues pruned to eliminate duplicates Z: 73 52.959 2.168 0.760 0.604 0.917 0.653 CB 1.615 73 residues pruned to eliminate duplicates Z: 84 71.145 2.236 0.849 0.659 0.976 0.663 CB 1.669 84 residues pruned to eliminate duplicates Z: 118 87.216 2.268 0.906 0.650 0.974 0.624 CB 1.664 118 residues pruned to eliminate duplicates Z: 46 52.305 2.264 0.896 0.626 0.956 0.467 CB 1.688 46 residues pruned to eliminate duplicates Z: 152 84.770 2.192 0.919 0.608 0.934 0.576 CB 1.585 152 residues pruned to eliminate duplicates Z: 88 69.599 2.205 0.889 0.632 0.966 0.609 CB 1.639 88 residues pruned to eliminate duplicates Z: 121 82.897 2.227 0.935 0.632 0.942 0.592 CB 1.647 121 residues pruned to eliminate duplicates Z: 47 50.967 2.261 0.820 0.600 0.978 0.565 CB 1.697 47 residues pruned to eliminate duplicates Z: 140 83.500 2.216 0.874 0.635 0.950 0.626 CB 1.582 140 residues pruned to eliminate duplicates Z: 113 82.752 2.250 0.922 0.656 0.955 0.652 CB 1.638 113 residues pruned to eliminate duplicates Z: 96 82.493 2.281 1.001 0.679 0.937 0.663 CB 1.679 96 residues pruned to eliminate duplicates Z: 83 72.447 2.241 0.884 0.679 0.976 0.659 CB 1.647 83 residues pruned to eliminate duplicates Z: 49 44.823 2.204 0.846 0.623 0.875 0.583 CA 1.618 49 residues pruned to eliminate duplicates Z: 92 63.016 2.173 0.826 0.637 0.934 0.626 CB 1.567 92 residues pruned to eliminate duplicates Z: 69 62.753 2.211 0.917 0.644 0.941 0.662 CB 1.668 69 residues pruned to eliminate duplicates Z: 139 83.735 2.222 0.868 0.628 0.949 0.601 CB 1.605 139 residues pruned to eliminate duplicates Z: 49 51.401 2.226 0.815 0.650 0.958 0.458 CA 1.667 49 residues pruned to eliminate duplicates Z: 117 84.844 2.257 0.922 0.658 0.966 0.741 CB 1.623 117 residues pruned to eliminate duplicates Z: 142 87.673 2.219 0.923 0.630 0.950 0.645 CB 1.611 142 residues pruned to eliminate duplicates Z: 13 22.186 2.226 0.926 0.461 1.000 0.583 CB 1.555 13 residues pruned to eliminate duplicates Z: 85 73.156 2.236 0.940 0.662 0.964 0.726 CB 1.642 85 residues pruned to eliminate duplicates Z: 8 4.476 1.535 0.846 0.293 0.857 0.286 CA 0.878 8 residues pruned to eliminate duplicates Z: 86 72.525 2.237 0.887 0.662 0.965 0.706 CB 1.662 86 residues pruned to eliminate duplicates Z: 89 69.431 2.215 0.903 0.646 0.943 0.614 CB 1.625 89 residues pruned to eliminate duplicates Z: 71 67.256 2.221 0.932 0.652 0.986 0.643 CB 1.649 71 residues pruned to eliminate duplicates Z: 113 88.829 2.274 0.978 0.646 0.964 0.616 CB 1.688 113 residues pruned to eliminate duplicates Z: 113 80.005 2.258 0.900 0.630 0.938 0.643 CB 1.664 113 residues pruned to eliminate duplicates Z: 113 82.473 2.292 0.912 0.617 0.929 0.607 CB 1.714 113 residues pruned to eliminate duplicates Z: 84 71.249 2.259 0.913 0.652 0.940 0.675 CB 1.671 84 residues pruned to eliminate duplicates Z: 116 79.812 2.270 0.901 0.614 0.922 0.617 CB 1.680 116 residues pruned to eliminate duplicates Z: 138 82.397 2.231 0.873 0.630 0.934 0.635 CB 1.596 138 residues pruned to eliminate duplicates Z: 115 75.990 2.243 0.846 0.605 0.939 0.614 CB 1.657 115 residues pruned to eliminate duplicates Z: 58 47.313 2.185 0.891 0.570 0.930 0.544 CB 1.524 58 residues pruned to eliminate duplicates Z: 149 82.777 2.211 0.849 0.600 0.939 0.568 CB 1.611 149 residues pruned to eliminate duplicates Z: 114 81.710 2.272 0.870 0.634 0.938 0.619 CB 1.701 114 residues pruned to eliminate duplicates Z: 27 43.067 2.332 1.122 0.545 0.962 0.500 CB 1.698 27 residues pruned to eliminate duplicates Z: 114 75.377 2.259 0.888 0.606 0.920 0.655 CB 1.633 114 residues pruned to eliminate duplicates Z: 121 78.370 2.218 0.907 0.635 0.942 0.650 CB 1.582 121 residues pruned to eliminate duplicates Z: 88 63.246 2.201 0.868 0.609 0.943 0.736 CB 1.578 88 residues pruned to eliminate duplicates Z: 150 79.744 2.208 0.790 0.602 0.940 0.617 CB 1.597 150 residues pruned to eliminate duplicates Z: 72 45.722 2.115 0.752 0.553 0.944 0.676 CB 1.473 72 residues pruned to eliminate duplicates Z: 119 79.337 2.232 0.875 0.624 0.932 0.619 CB 1.667 119 residues pruned to eliminate duplicates Z: 119 81.276 2.244 0.941 0.617 0.924 0.610 CB 1.665 119 residues pruned to eliminate duplicates Z: 150 77.404 2.185 0.818 0.597 0.933 0.651 CB 1.560 150 residues pruned to eliminate duplicates Z: 119 81.215 2.247 0.868 0.625 0.949 0.602 CB 1.668 119 residues pruned to eliminate duplicates Z: 71 58.250 2.211 0.860 0.641 0.957 0.686 CB 1.550 71 residues pruned to eliminate duplicates Z: 119 80.193 2.250 0.852 0.641 0.941 0.627 CB 1.651 119 residues pruned to eliminate duplicates Z: 118 78.092 2.269 0.865 0.608 0.923 0.564 CB 1.667 118 residues pruned to eliminate duplicates Z: 29 31.205 2.209 1.014 0.540 0.821 0.429 CB 1.551 29 residues pruned to eliminate duplicates Z: 30 44.880 2.294 1.181 0.675 0.897 0.655 CB 1.582 30 residues pruned to eliminate duplicates Z: 114 85.471 2.269 0.925 0.633 0.956 0.637 CB 1.700 114 residues pruned to eliminate duplicates Z: 70 65.589 2.278 0.967 0.662 0.928 0.638 CB 1.635 70 residues pruned to eliminate duplicates Z: 27 40.660 2.209 1.120 0.575 0.962 0.346 CB 1.647 27 residues pruned to eliminate duplicates Z: 36 48.173 2.294 1.052 0.594 0.971 0.457 CB 1.628 36 residues pruned to eliminate duplicates Z: 115 70.898 2.187 0.894 0.630 0.904 0.658 CB 1.570 115 residues pruned to eliminate duplicates Z: 89 61.807 2.216 0.873 0.595 0.920 0.580 CB 1.574 89 residues pruned to eliminate duplicates Z: 135 74.325 2.157 0.901 0.597 0.896 0.634 CB 1.593 135 residues pruned to eliminate duplicates Z: 35 41.413 2.346 0.740 0.630 0.912 0.676 CB 1.688 35 residues pruned to eliminate duplicates Z: 143 77.717 2.204 0.800 0.619 0.923 0.592 CB 1.592 143 residues pruned to eliminate duplicates Z: 136 85.960 2.233 0.928 0.629 0.948 0.630 CB 1.605 136 residues pruned to eliminate duplicates Z: 106 65.949 2.170 0.875 0.606 0.943 0.676 CB 1.517 106 residues pruned to eliminate duplicates Z: 88 65.473 2.216 0.830 0.634 0.943 0.563 CB 1.618 88 residues pruned to eliminate duplicates Z: 85 66.045 2.255 0.765 0.635 0.940 0.619 CB 1.696 85 residues pruned to eliminate duplicates Z: 142 80.236 2.203 0.858 0.608 0.936 0.567 CB 1.591 113 residues pruned to eliminate duplicates Z: 14 35.940 2.136 0.954 0.914 1.000 0.846 CA 1.688 14 residues pruned to eliminate duplicates Z: 119 86.649 2.254 0.928 0.647 0.966 0.636 CB 1.656 119 residues pruned to eliminate duplicates Z: 142 81.032 2.212 0.821 0.630 0.957 0.624 CB 1.566 142 residues pruned to eliminate duplicates Z: 144 75.690 2.189 0.819 0.604 0.923 0.622 CB 1.560 144 residues pruned to eliminate duplicates Z: 84 71.255 2.244 0.873 0.668 0.964 0.651 CB 1.654 84 residues pruned to eliminate duplicates Z: 76 56.310 2.159 0.845 0.598 0.960 0.640 CB 1.548 76 residues pruned to eliminate duplicates Z: 114 84.548 2.271 0.932 0.647 0.956 0.708 CB 1.654 114 residues pruned to eliminate duplicates Z: 120 82.472 2.231 0.936 0.622 0.941 0.613 CB 1.658 120 residues pruned to eliminate duplicates Z: 85 68.001 2.232 0.858 0.648 0.964 0.631 CB 1.617 85 residues pruned to eliminate duplicates Z: 85 68.048 2.246 0.820 0.641 0.964 0.655 CB 1.652 85 residues pruned to eliminate duplicates Z: 33 35.269 2.286 0.798 0.603 0.844 0.656 CB 1.630 33 residues pruned to eliminate duplicates Z: 116 79.811 2.254 0.911 0.636 0.913 0.583 CB 1.666 116 residues pruned to eliminate duplicates Z: 121 80.137 2.206 0.925 0.627 0.925 0.592 CB 1.651 121 residues pruned to eliminate duplicates Z: 111 84.735 2.253 0.946 0.633 0.964 0.564 CB 1.688 111 residues pruned to eliminate duplicates Z: 89 64.155 2.220 0.800 0.634 0.920 0.648 CB 1.639 89 residues pruned to eliminate duplicates Z: 97 61.876 2.177 0.808 0.581 0.938 0.646 CB 1.583 34 residues pruned to eliminate duplicates Z: 6 3.449 1.397 0.802 0.445 0.800 0.600 CA 0.810 6 residues pruned to eliminate duplicates Z: 151 77.849 2.185 0.805 0.600 0.913 0.647 CB 1.603 99 residues pruned to eliminate duplicates Z: 6 3.369 1.601 0.764 0.273 0.800 0.400 CB 0.862 Z: 7 6.728 2.164 0.480 0.480 0.667 0.333 CA 1.313 7 residues pruned to eliminate duplicates Z: 77 55.503 2.275 0.858 0.527 0.908 0.592 CB 1.615 77 residues pruned to eliminate duplicates Z: 24 22.785 2.148 0.868 0.377 0.870 0.609 CB 1.552 24 residues pruned to eliminate duplicates Z: 26 20.792 2.058 0.709 0.313 0.920 0.560 CA 1.580 26 residues pruned to eliminate duplicates Z: 40 18.539 1.907 0.547 0.323 0.872 0.436 CB 1.402 40 residues pruned to eliminate duplicates Z: 38 21.809 1.944 0.596 0.377 0.919 0.486 CB 1.434 50 residues pruned to eliminate duplicates Z: 24 20.496 2.084 0.825 0.322 0.913 0.565 CB 1.498 24 residues pruned to eliminate duplicates Z: 26 19.595 2.045 0.810 0.353 0.840 0.600 CB 1.478 26 residues pruned to eliminate duplicates Z: 48 34.062 2.204 0.811 0.485 0.830 0.596 CB 1.523 48 residues pruned to eliminate duplicates Z: 40 22.151 1.903 0.681 0.395 0.872 0.590 CB 1.421 40 residues pruned to eliminate duplicates Z: 27 17.341 1.967 0.677 0.323 0.885 0.615 CB 1.415 27 residues pruned to eliminate duplicates Z: 26 17.908 2.071 0.577 0.332 0.880 0.520 CB 1.498 26 residues pruned to eliminate duplicates Z: 67 60.180 2.311 0.976 0.579 0.909 0.606 CB 1.654 67 residues pruned to eliminate duplicates Z: 27 23.655 2.060 0.905 0.414 0.885 0.654 CB 1.463 27 residues pruned to eliminate duplicates Z: 69 56.810 2.308 0.841 0.546 0.912 0.588 CB 1.701 69 residues pruned to eliminate duplicates Z: 111 79.515 2.347 0.995 0.564 0.900 0.636 CB 1.691 111 residues pruned to eliminate duplicates Z: 23 35.697 2.335 0.963 0.597 0.909 0.636 CA 1.665 23 residues pruned to eliminate duplicates Z: 24 38.106 2.343 1.006 0.586 0.957 0.696 CA 1.627 24 residues pruned to eliminate duplicates Z: 50 34.279 2.077 0.860 0.473 0.837 0.612 CB 1.556 50 residues pruned to eliminate duplicates Z: 101 79.947 2.362 0.959 0.602 0.920 0.610 CB 1.705 101 residues pruned to eliminate duplicates Z: 24 31.956 2.286 0.897 0.571 0.870 0.609 CA 1.650 24 residues pruned to eliminate duplicates Z: 57 61.138 2.399 0.953 0.618 0.929 0.714 CB 1.679 57 residues pruned to eliminate duplicates Z: 27 35.256 2.194 0.921 0.575 0.962 0.538 CB 1.587 27 residues pruned to eliminate duplicates Z: 84 59.517 2.258 0.866 0.516 0.952 0.627 CB 1.603 84 residues pruned to eliminate duplicates Z: 26 40.891 2.292 0.989 0.606 1.000 0.680 CB 1.623 26 residues pruned to eliminate duplicates Z: 87 70.966 2.370 0.986 0.559 0.919 0.593 CB 1.672 87 residues pruned to eliminate duplicates Z: 159 88.759 2.269 0.909 0.588 0.943 0.633 CB 1.588 159 residues pruned to eliminate duplicates Z: 125 66.189 2.213 0.888 0.541 0.887 0.581 CB 1.541 125 residues pruned to eliminate duplicates Z: 59 64.357 2.391 1.003 0.586 0.948 0.552 CB 1.714 59 residues pruned to eliminate duplicates Z: 60 65.599 2.330 1.055 0.612 0.949 0.729 CB 1.690 60 residues pruned to eliminate duplicates Z: 86 78.195 2.423 0.908 0.627 0.929 0.682 CB 1.751 86 residues pruned to eliminate duplicates Z: 25 39.807 2.362 0.968 0.595 0.958 0.667 CB 1.666 25 residues pruned to eliminate duplicates Z: 145 90.248 2.284 0.955 0.630 0.951 0.618 CB 1.567 145 residues pruned to eliminate duplicates Z: 102 74.680 2.322 0.917 0.620 0.931 0.594 CB 1.601 102 residues pruned to eliminate duplicates Z: 76 77.159 2.418 1.014 0.600 0.960 0.613 CB 1.732 76 residues pruned to eliminate duplicates Z: 94 78.981 2.385 0.963 0.614 0.925 0.624 CB 1.698 94 residues pruned to eliminate duplicates Z: 57 61.642 2.382 0.956 0.610 0.946 0.607 CB 1.683 57 residues pruned to eliminate duplicates Z: 59 61.671 2.376 0.965 0.583 0.948 0.569 CB 1.688 59 residues pruned to eliminate duplicates Z: 124 76.582 2.273 0.928 0.578 0.935 0.577 CB 1.564 124 residues pruned to eliminate duplicates Z: 133 86.317 2.285 0.952 0.609 0.939 0.606 CB 1.617 133 residues pruned to eliminate duplicates Z: 108 74.419 2.289 0.968 0.594 0.925 0.654 CB 1.577 108 residues pruned to eliminate duplicates Z: 59 64.827 2.363 1.034 0.603 0.966 0.672 CB 1.663 59 residues pruned to eliminate duplicates Z: 35 48.982 2.323 1.006 0.605 0.971 0.588 CB 1.681 35 residues pruned to eliminate duplicates Z: 48 41.929 2.200 0.943 0.616 0.851 0.596 CB 1.506 48 residues pruned to eliminate duplicates Z: 118 79.290 2.303 1.034 0.573 0.915 0.538 CB 1.596 118 residues pruned to eliminate duplicates Z: 35 41.691 2.360 0.982 0.546 0.824 0.559 CA 1.774 35 residues pruned to eliminate duplicates Z: 90 69.176 2.328 1.029 0.560 0.910 0.607 CB 1.610 90 residues pruned to eliminate duplicates Z: 53 42.863 2.189 0.867 0.578 0.885 0.500 CB 1.525 53 residues pruned to eliminate duplicates Z: 94 88.121 2.397 1.121 0.639 0.935 0.602 CB 1.688 94 residues pruned to eliminate duplicates Z: 31 49.078 2.393 1.055 0.653 0.900 0.667 CA 1.755 31 residues pruned to eliminate duplicates Z: 102 81.390 2.341 0.965 0.621 0.960 0.584 CB 1.636 102 residues pruned to eliminate duplicates Z: 90 61.191 2.202 0.902 0.622 0.921 0.629 CB 1.499 90 residues pruned to eliminate duplicates Z: 138 89.772 2.316 0.933 0.633 0.942 0.620 CB 1.606 138 residues pruned to eliminate duplicates Z: 65 67.096 2.393 1.018 0.616 0.938 0.609 CB 1.661 65 residues pruned to eliminate duplicates Z: 99 76.876 2.326 1.051 0.609 0.898 0.541 CB 1.634 99 residues pruned to eliminate duplicates Z: 81 63.988 2.246 1.021 0.599 0.925 0.575 CB 1.550 81 residues pruned to eliminate duplicates Z: 119 86.550 2.316 1.059 0.593 0.941 0.627 CB 1.625 119 residues pruned to eliminate duplicates Z: 102 79.417 2.295 1.045 0.643 0.911 0.564 CB 1.618 102 residues pruned to eliminate duplicates Z: 85 89.874 2.446 1.143 0.632 0.964 0.643 CB 1.714 85 residues pruned to eliminate duplicates Z: 120 83.091 2.299 1.053 0.581 0.941 0.546 CB 1.586 120 residues pruned to eliminate duplicates Z: 103 78.182 2.311 1.045 0.616 0.931 0.667 CB 1.575 103 residues pruned to eliminate duplicates Z: 46 48.847 2.209 0.978 0.672 0.911 0.578 CB 1.560 46 residues pruned to eliminate duplicates Z: 43 40.252 2.124 0.967 0.517 0.905 0.571 CB 1.617 43 residues pruned to eliminate duplicates Z: 142 90.855 2.300 1.038 0.613 0.922 0.567 CB 1.591 142 residues pruned to eliminate duplicates Z: 20 32.152 2.116 1.168 0.723 0.842 0.579 CA 1.561 20 residues pruned to eliminate duplicates Z: 57 71.880 2.364 1.270 0.636 0.929 0.696 CB 1.697 57 residues pruned to eliminate duplicates Z: 114 78.807 2.260 1.004 0.629 0.929 0.611 CB 1.560 114 residues pruned to eliminate duplicates Z: 87 60.817 2.208 0.824 0.624 0.919 0.640 CB 1.577 87 residues pruned to eliminate duplicates Z: 47 42.191 2.217 0.885 0.617 0.891 0.674 CB 1.494 47 residues pruned to eliminate duplicates Z: 84 62.140 2.211 0.949 0.634 0.928 0.566 CB 1.505 84 residues pruned to eliminate duplicates Z: 79 54.719 2.185 0.979 0.566 0.923 0.513 CB 1.456 79 residues pruned to eliminate duplicates Z: 115 69.560 2.241 0.904 0.623 0.895 0.614 CB 1.519 115 residues pruned to eliminate duplicates Z: 48 48.041 2.202 0.970 0.629 0.915 0.596 CB 1.565 48 residues pruned to eliminate duplicates Z: 72 64.611 2.257 1.139 0.611 0.915 0.577 CB 1.561 72 residues pruned to eliminate duplicates Z: 115 78.534 2.255 1.026 0.589 0.947 0.588 CB 1.561 115 residues pruned to eliminate duplicates Z: 90 65.562 2.219 0.892 0.627 0.955 0.596 CB 1.537 91 residues pruned to eliminate duplicates Z: 12 13.874 1.752 0.888 0.622 1.000 0.545 CA 1.127 12 residues pruned to eliminate duplicates Z: 86 62.607 2.204 0.879 0.629 0.953 0.647 CB 1.523 86 residues pruned to eliminate duplicates Z: 36 26.432 1.979 0.891 0.530 0.914 0.600 CB 1.269 36 residues pruned to eliminate duplicates Z: 35 24.725 1.983 0.773 0.519 0.882 0.529 CB 1.341 35 residues pruned to eliminate duplicates Z: 80 68.244 2.219 0.882 0.674 0.975 0.671 CB 1.606 80 residues pruned to eliminate duplicates Z: 47 45.440 2.192 0.998 0.610 0.913 0.587 CB 1.509 47 residues pruned to eliminate duplicates Z: 131 62.695 2.141 0.812 0.544 0.885 0.577 CB 1.535 131 residues pruned to eliminate duplicates Z: 164 87.091 2.251 0.964 0.581 0.920 0.644 CB 1.552 164 residues pruned to eliminate duplicates Z: 49 36.796 2.142 0.727 0.601 0.896 0.625 CB 1.456 49 residues pruned to eliminate duplicates Z: 63 37.063 1.999 0.835 0.566 0.903 0.532 CB 1.332 63 residues pruned to eliminate duplicates Z: 144 90.979 2.297 0.973 0.608 0.944 0.622 CB 1.604 144 residues pruned to eliminate duplicates Z: 82 64.505 2.238 0.867 0.638 0.975 0.605 CB 1.546 82 residues pruned to eliminate duplicates Z: 51 42.110 2.156 0.756 0.609 0.980 0.640 CB 1.447 51 residues pruned to eliminate duplicates Z: 44 37.107 2.143 0.617 0.635 0.977 0.698 CB 1.473 44 residues pruned to eliminate duplicates Z: 48 39.005 2.188 0.813 0.583 0.894 0.574 CB 1.483 48 residues pruned to eliminate duplicates Z: 118 76.950 2.225 0.998 0.619 0.915 0.624 CB 1.564 118 residues pruned to eliminate duplicates Z: 88 63.801 2.234 0.898 0.639 0.908 0.552 CB 1.559 88 residues pruned to eliminate duplicates Z: 55 41.281 2.069 0.799 0.626 0.944 0.593 CB 1.418 55 residues pruned to eliminate duplicates Z: 61 47.467 2.132 0.815 0.632 0.950 0.600 CB 1.472 31 residues pruned to eliminate duplicates Z: 10 20.566 2.095 1.005 0.687 1.000 0.556 CA 1.375 Z: 74 48.964 2.149 0.834 0.588 0.890 0.589 CB 1.501 84 residues pruned to eliminate duplicates Z: 102 77.951 2.236 1.070 0.626 0.950 0.703 CB 1.566 102 residues pruned to eliminate duplicates Z: 44 40.297 2.145 0.747 0.646 0.977 0.674 CB 1.465 44 residues pruned to eliminate duplicates Z: 128 72.085 2.187 0.912 0.589 0.937 0.583 CB 1.499 128 residues pruned to eliminate duplicates Z: 96 72.556 2.219 1.043 0.630 0.937 0.642 CB 1.551 96 residues pruned to eliminate duplicates Z: 89 62.795 2.207 0.951 0.634 0.932 0.602 CB 1.472 89 residues pruned to eliminate duplicates Z: 85 63.352 2.202 0.908 0.610 0.952 0.524 CB 1.556 85 residues pruned to eliminate duplicates Z: 56 34.108 2.080 0.684 0.551 0.909 0.545 CB 1.375 56 residues pruned to eliminate duplicates Z: 86 59.145 2.215 0.880 0.610 0.918 0.588 CB 1.513 86 residues pruned to eliminate duplicates Z: 142 89.612 2.300 1.049 0.619 0.915 0.610 CB 1.563 142 residues pruned to eliminate duplicates Z: 40 33.725 2.070 0.666 0.609 0.949 0.744 CB 1.489 40 residues pruned to eliminate duplicates Z: 123 72.833 2.231 0.909 0.602 0.902 0.590 CB 1.557 123 residues pruned to eliminate duplicates Z: 90 62.111 2.227 0.843 0.609 0.921 0.618 CB 1.570 90 residues pruned to eliminate duplicates Z: 148 90.790 2.272 1.006 0.621 0.932 0.646 CB 1.573 148 residues pruned to eliminate duplicates Z: 108 75.927 2.269 0.973 0.630 0.925 0.682 CB 1.569 108 residues pruned to eliminate duplicates Z: 84 50.352 2.151 0.814 0.557 0.916 0.554 CB 1.464 84 residues pruned to eliminate duplicates Z: 19 17.484 2.018 0.742 0.428 0.889 0.389 CB 1.422 19 residues pruned to eliminate duplicates Z: 12 18.727 2.219 0.687 0.513 0.909 0.636 CB 1.637 12 residues pruned to eliminate duplicates Z: 11 10.671 1.938 0.967 0.333 0.800 0.200 CB 1.329 11 residues pruned to eliminate duplicates Z: 39 41.945 2.262 1.086 0.502 0.895 0.658 CB 1.609 39 residues pruned to eliminate duplicates Z: 107 80.319 2.279 0.966 0.646 0.953 0.632 CB 1.594 107 residues pruned to eliminate duplicates Z: 39 38.192 2.190 1.034 0.527 0.868 0.553 CB 1.559 39 residues pruned to eliminate duplicates Z: 70 66.931 2.367 1.064 0.567 0.942 0.565 CB 1.642 70 residues pruned to eliminate duplicates Z: 59 61.540 2.380 1.038 0.586 0.948 0.534 CB 1.618 59 residues pruned to eliminate duplicates Z: 94 79.397 2.381 1.025 0.630 0.914 0.581 CB 1.653 94 residues pruned to eliminate duplicates Z: 168 86.409 2.265 0.961 0.539 0.910 0.557 CB 1.592 168 residues pruned to eliminate duplicates Z: 56 68.770 2.395 1.125 0.633 0.964 0.636 CB 1.668 56 residues pruned to eliminate duplicates Z: 120 76.884 2.289 0.961 0.572 0.899 0.655 CB 1.629 120 residues pruned to eliminate duplicates Z: 106 77.494 2.231 1.031 0.635 0.933 0.638 CB 1.575 99 residues pruned to eliminate duplicates Z: 18 44.979 2.225 1.302 0.840 1.000 0.588 CB 1.589 18 residues pruned to eliminate duplicates Z: 56 65.632 2.401 1.039 0.618 0.945 0.636 CB 1.710 56 residues pruned to eliminate duplicates Z: 97 74.846 2.343 1.050 0.595 0.906 0.583 CB 1.603 97 residues pruned to eliminate duplicates Z: 51 55.295 2.291 1.199 0.558 0.900 0.640 CB 1.629 51 residues pruned to eliminate duplicates Z: 58 59.005 2.370 0.946 0.591 0.947 0.632 CB 1.640 58 residues pruned to eliminate duplicates Z: 29 40.894 2.303 1.149 0.569 0.893 0.571 CB 1.635 29 residues pruned to eliminate duplicates Z: 100 73.142 2.270 1.074 0.573 0.919 0.545 CB 1.583 100 residues pruned to eliminate duplicates Z: 56 54.456 2.292 1.017 0.615 0.891 0.564 CB 1.599 56 residues pruned to eliminate duplicates Z: 28 41.456 2.225 1.104 0.642 0.926 0.519 CB 1.613 28 residues pruned to eliminate duplicates Z: 60 63.558 2.364 1.034 0.591 0.949 0.695 CB 1.662 60 residues pruned to eliminate duplicates Z: 64 67.057 2.329 1.083 0.640 0.921 0.508 CB 1.659 36 residues pruned to eliminate duplicates Z: 20 47.624 2.309 1.194 0.843 0.947 0.684 CB 1.695 20 residues pruned to eliminate duplicates Z: 146 85.841 2.246 1.022 0.619 0.910 0.566 CB 1.541 146 residues pruned to eliminate duplicates Z: 31 42.361 2.198 1.260 0.577 0.933 0.500 CB 1.549 31 residues pruned to eliminate duplicates Z: 27 31.787 2.240 0.917 0.551 0.923 0.462 CB 1.496 27 residues pruned to eliminate duplicates Z: 93 76.516 2.345 0.989 0.588 0.924 0.630 CB 1.701 93 residues pruned to eliminate duplicates Z: 46 60.642 2.421 1.114 0.634 0.933 0.689 CB 1.669 46 residues pruned to eliminate duplicates Z: 87 76.007 2.395 1.040 0.599 0.919 0.581 CB 1.662 87 residues pruned to eliminate duplicates Z: 33 42.397 2.398 0.887 0.541 0.906 0.562 CB 1.755 33 residues pruned to eliminate duplicates Z: 26 18.722 2.064 0.795 0.465 0.840 0.440 CB 1.247 26 residues pruned to eliminate duplicates Z: 88 69.242 2.261 0.946 0.638 0.954 0.678 CB 1.554 88 residues pruned to eliminate duplicates Z: 88 67.691 2.227 0.986 0.635 0.943 0.586 CB 1.533 88 residues pruned to eliminate duplicates Z: 19 21.930 2.216 0.858 0.445 0.889 0.667 CB 1.495 19 residues pruned to eliminate duplicates Z: 50 44.471 2.172 0.814 0.640 0.959 0.612 CB 1.475 50 residues pruned to eliminate duplicates Z: 12 21.800 2.102 0.799 0.646 0.909 0.545 CB 1.668 698 residues left after pruning, divided into chains as follows: A: 7 B: 8 C: 6 D: 8 E: 102 F: 121 G: 17 H: 133 I: 10 J: 35 K: 10 L: 21 M: 82 N: 35 O: 103 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 31.21 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 3 used as input for final density modification = 0.300, Contrast = 0.499, Connect. = 0.726 for dens.mod. cycle 1 = 0.300, Contrast = 0.573, Connect. = 0.751 for dens.mod. cycle 2 = 0.300, Contrast = 0.673, Connect. = 0.783 for dens.mod. cycle 3 = 0.300, Contrast = 0.678, Connect. = 0.785 for dens.mod. cycle 4 = 0.300, Contrast = 0.688, Connect. = 0.787 for dens.mod. cycle 5 = 0.300, Contrast = 0.691, Connect. = 0.789 for dens.mod. cycle 6 = 0.300, Contrast = 0.697, Connect. = 0.791 for dens.mod. cycle 7 = 0.300, Contrast = 0.699, Connect. = 0.792 for dens.mod. cycle 8 = 0.300, Contrast = 0.702, Connect. = 0.793 for dens.mod. cycle 9 = 0.300, Contrast = 0.703, Connect. = 0.794 for dens.mod. cycle 10 TimeTaking 633.12