++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 01:29:58 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: ./2oh1-1.5-parrot-noncs/2oh1-1.5-parrot-noncs.phi -a -n -t20 Cell and symmetry only from ./2oh1-1.5-parrot-noncs/2oh1-1.5-parrot-noncs.ins Phases from ./2oh1-1.5-parrot-noncs/2oh1-1.5-parrot-noncs.phi Native data from ./2oh1-1.5-parrot-noncs/2oh1-1.5-parrot-noncs.hkl Listing output to ./2oh1-1.5-parrot-noncs/2oh1-1.5-parrot-noncs.lst Phases output to ./2oh1-1.5-parrot-noncs/2oh1-1.5-parrot-noncs.phs Poly-Ala trace output to ./2oh1-1.5-parrot-noncs/2oh1-1.5-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 21 21 21 Allowed origin shift code: 4 127340 Reflections read from file ./2oh1-1.5-parrot-noncs/2oh1-1.5-parrot-noncs.phi 127340 Reflections read from file ./2oh1-1.5-parrot-noncs/2oh1-1.5-parrot-noncs.hkl 127340 Unique data, highest resolution = 1.460 Angstroms Anisotropic scaling: intensities multiplied by -0.000076h^2 -0.000027k^2 +0.000053l^2 +0.000000kl +0.000000hl +0.000000hk 1541 Reflections with d > 1.660 and 0 in range 1.660 > d > 1.460 added Density sharpening factor set to 1.56 Fourier grid = 128 x 256 x 60 0.000 <= z <= 0.250 92 Point spherical net set up with radius 2.42A 40 Extra Fourier layers will be generated <|E^2-1|> = 0.648 ** -f missing ?? ** = 0.300, Contrast = 0.446, Connect. = 0.744 for dens.mod. cycle 1 = 0.300, Contrast = 0.564, Connect. = 0.768 for dens.mod. cycle 2 = 0.300, Contrast = 0.699, Connect. = 0.801 for dens.mod. cycle 3 = 0.300, Contrast = 0.733, Connect. = 0.809 for dens.mod. cycle 4 = 0.300, Contrast = 0.748, Connect. = 0.814 for dens.mod. cycle 5 = 0.300, Contrast = 0.758, Connect. = 0.816 for dens.mod. cycle 6 = 0.300, Contrast = 0.765, Connect. = 0.818 for dens.mod. cycle 7 = 0.300, Contrast = 0.770, Connect. = 0.820 for dens.mod. cycle 8 = 0.300, Contrast = 0.773, Connect. = 0.821 for dens.mod. cycle 9 = 0.300, Contrast = 0.776, Connect. = 0.821 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 3794 peaks > 0.5 sigma used to seed fragment search Space for about 886 unique residues taking solvent into account 833 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 50 46.719 2.317 1.115 0.454 0.918 0.612 CB 1.555 B: 97 68.696 2.349 0.900 0.544 0.938 0.615 CB 1.605 50 residues pruned to eliminate duplicates C: 22 87.222 2.654 1.427 0.935 1.000 0.905 CB 2.059 D: 22 80.959 2.641 1.285 0.918 1.000 0.905 CB 2.065 22 residues pruned to eliminate duplicates E: 23 71.912 2.448 1.272 0.916 1.000 0.682 CB 1.946 F: 23 70.668 2.459 1.269 0.906 0.955 0.727 CB 2.012 23 residues pruned to eliminate duplicates G: 97 68.288 2.362 0.897 0.523 0.927 0.708 CB 1.640 97 residues pruned to eliminate duplicates H: 24 56.759 2.424 0.982 0.891 0.957 0.826 CB 1.852 24 residues pruned to eliminate duplicates I: 9 40.152 2.411 1.434 0.836 1.000 0.750 CB 1.810 J: 23 79.464 2.508 1.503 0.911 0.955 0.682 CA 2.004 23 residues pruned to eliminate duplicates K: 133 84.854 2.307 0.959 0.548 0.947 0.667 CB 1.646 120 residues pruned to eliminate duplicates L: 10 30.191 2.239 1.543 0.832 0.889 0.889 CB 1.493 10 residues pruned to eliminate duplicates M: 23 70.329 2.466 1.282 0.913 0.955 0.773 CB 1.975 23 residues pruned to eliminate duplicates N: 11 32.661 2.153 1.196 0.846 1.000 0.800 CA 1.622 11 residues pruned to eliminate duplicates O: 24 59.525 2.453 0.929 0.886 1.000 0.870 CB 1.893 24 residues pruned to eliminate duplicates P: 10 29.283 2.253 1.310 0.801 0.889 0.778 CB 1.622 10 residues pruned to eliminate duplicates Q: 12 33.965 2.560 0.879 0.758 0.909 0.818 CA 1.861 12 residues pruned to eliminate duplicates R: 22 67.313 2.406 1.252 0.911 1.000 0.857 CB 1.922 22 residues pruned to eliminate duplicates S: 22 65.718 2.562 1.089 0.872 0.952 0.857 CB 2.050 22 residues pruned to eliminate duplicates T: 22 73.210 2.564 1.340 0.926 0.905 0.857 CB 2.064 22 residues pruned to eliminate duplicates U: 10 33.748 2.531 1.627 0.785 0.889 0.667 CB 1.481 V: 23 81.906 2.525 1.425 0.921 1.000 0.727 CB 2.007 23 residues pruned to eliminate duplicates W: 9 36.116 2.494 1.264 0.774 1.000 0.750 CB 1.774 10 residues pruned to eliminate duplicates X: 10 31.824 2.420 1.275 0.747 0.889 0.667 CA 1.739 9 residues pruned to eliminate duplicates Y: 31 63.361 2.270 1.110 0.834 1.000 0.800 CB 1.810 Z: 10 30.284 2.374 0.820 0.858 0.889 0.778 CA 1.934 10 residues pruned to eliminate duplicates Z: 10 26.923 2.321 0.703 0.871 0.889 0.778 CA 1.864 10 residues pruned to eliminate duplicates Z: 20 59.679 2.533 0.929 0.935 1.000 0.947 CB 1.952 20 residues pruned to eliminate duplicates Z: 23 58.969 2.509 0.943 0.906 0.955 0.818 CB 1.921 23 residues pruned to eliminate duplicates Z: 12 24.149 2.012 0.845 0.853 0.909 0.818 C 1.595 Z: 37 43.092 2.474 0.993 0.451 0.861 0.694 CB 1.779 37 residues pruned to eliminate duplicates Z: 23 74.832 2.456 1.313 0.918 1.000 0.773 CB 1.981 23 residues pruned to eliminate duplicates Z: 19 39.667 2.229 0.869 0.855 1.000 0.833 CB 1.657 19 residues pruned to eliminate duplicates Z: 12 32.318 2.540 0.865 0.758 0.909 0.818 CB 1.798 12 residues pruned to eliminate duplicates Z: 23 63.373 2.457 0.979 0.925 1.000 0.909 CB 1.950 23 residues pruned to eliminate duplicates Z: 11 36.268 2.358 1.257 0.866 1.000 0.700 CB 1.577 10 residues pruned to eliminate duplicates Z: 9 7.358 1.854 0.514 0.682 0.500 0.375 C 1.567 9 residues pruned to eliminate duplicates Z: 22 70.866 2.454 1.178 0.931 1.000 0.905 CB 2.022 22 residues pruned to eliminate duplicates Z: 23 58.740 2.423 0.956 0.921 0.955 0.909 CB 1.948 23 residues pruned to eliminate duplicates Z: 59 81.056 2.437 1.206 0.639 0.931 0.707 CB 1.867 40 residues pruned to eliminate duplicates Z: 9 20.559 2.033 0.793 0.841 1.000 0.875 CB 1.487 9 residues pruned to eliminate duplicates Z: 9 20.899 2.081 0.762 0.797 1.000 0.875 CB 1.553 9 residues pruned to eliminate duplicates Z: 8 10.989 2.016 0.231 0.734 0.857 0.571 CA 1.582 Z: 22 72.805 2.644 1.068 0.911 1.000 0.905 CB 2.059 22 residues pruned to eliminate duplicates Z: 13 25.623 2.238 0.819 0.767 0.917 0.667 CB 1.565 Z: 106 86.491 2.382 0.961 0.593 0.952 0.705 CB 1.736 62 residues pruned to eliminate duplicates Z: 14 21.033 2.213 0.939 0.556 0.846 0.538 CB 1.522 Z: 20 13.814 1.826 0.900 0.477 0.842 0.579 CB 1.110 20 residues pruned to eliminate duplicates Z: 135 93.054 2.350 0.925 0.600 0.963 0.694 CB 1.678 106 residues pruned to eliminate duplicates Z: 10 29.954 2.307 0.912 0.783 0.889 0.667 C 1.984 10 residues pruned to eliminate duplicates Z: 10 38.661 2.492 1.575 0.845 1.000 0.556 CB 1.493 11 residues pruned to eliminate duplicates Z: 12 36.966 2.437 0.967 0.753 1.000 0.818 CB 1.856 12 residues pruned to eliminate duplicates Z: 23 57.395 2.494 0.812 0.908 1.000 0.864 CB 1.922 23 residues pruned to eliminate duplicates Z: 10 22.171 2.250 0.894 0.836 0.889 0.778 CB 1.460 Z: 10 37.507 2.262 1.260 0.838 1.000 0.889 CB 1.828 10 residues pruned to eliminate duplicates Z: 18 36.759 2.283 0.712 0.916 0.941 0.882 CB 1.712 18 residues pruned to eliminate duplicates Z: 13 29.874 2.240 1.124 0.742 0.917 0.750 CB 1.592 13 residues pruned to eliminate duplicates Z: 11 32.485 2.345 1.479 0.831 0.900 0.700 CB 1.475 11 residues pruned to eliminate duplicates Z: 43 43.793 2.361 0.822 0.495 0.952 0.619 CB 1.657 18 residues pruned to eliminate duplicates Z: 88 63.011 2.347 0.753 0.534 0.920 0.644 CB 1.727 88 residues pruned to eliminate duplicates Z: 28 19.770 2.120 0.951 0.462 0.704 0.593 CB 1.359 28 residues pruned to eliminate duplicates Z: 9 46.059 2.606 1.636 0.839 1.000 0.750 CB 1.771 9 residues pruned to eliminate duplicates Z: 10 22.966 2.340 0.668 0.840 0.889 0.778 CA 1.646 10 residues pruned to eliminate duplicates Z: 11 20.154 2.112 0.434 0.856 0.900 0.700 C 1.725 11 residues pruned to eliminate duplicates Z: 21 60.755 2.465 0.971 0.905 1.000 0.900 CB 1.990 21 residues pruned to eliminate duplicates Z: 21 65.235 2.551 1.212 0.867 0.950 0.900 CB 1.991 21 residues pruned to eliminate duplicates Z: 23 65.617 2.418 1.021 0.926 1.000 0.773 CA 2.007 23 residues pruned to eliminate duplicates Z: 22 83.828 2.545 1.449 0.930 1.000 0.810 CB 2.052 22 residues pruned to eliminate duplicates Z: 8 25.398 2.169 0.900 0.885 1.000 0.714 C 1.682 Z: 9 19.353 2.125 0.848 0.852 0.750 0.500 C 1.718 Z: 12 29.596 2.350 0.872 0.813 0.909 0.727 CB 1.699 12 residues pruned to eliminate duplicates Z: 12 39.050 2.452 0.988 0.834 1.000 0.727 CB 1.811 12 residues pruned to eliminate duplicates Z: 22 51.481 2.338 0.827 0.913 1.000 0.905 CB 1.861 Z: 9 21.058 2.027 0.797 0.791 1.000 0.875 C 1.584 9 residues pruned to eliminate duplicates Z: 23 49.573 2.254 0.905 0.885 1.000 0.773 CA 1.776 23 residues pruned to eliminate duplicates Z: 10 32.090 2.262 1.030 0.895 0.889 0.778 C 1.879 10 residues pruned to eliminate duplicates Z: 63 80.809 2.368 1.153 0.649 0.968 0.677 CB 1.810 68 residues pruned to eliminate duplicates Z: 9 21.518 1.999 0.893 0.796 1.000 0.875 C 1.552 9 residues pruned to eliminate duplicates Z: 8 16.968 2.142 0.462 0.838 1.000 0.714 CA 1.530 8 residues pruned to eliminate duplicates Z: 33 39.842 2.386 0.835 0.544 0.906 0.594 CB 1.701 22 residues pruned to eliminate duplicates Z: 12 34.952 2.403 1.003 0.744 1.000 0.636 CB 1.759 12 residues pruned to eliminate duplicates Z: 24 57.633 2.355 0.813 0.931 1.000 0.870 CB 1.966 24 residues pruned to eliminate duplicates Z: 97 56.684 2.268 0.788 0.527 0.885 0.635 CB 1.569 76 residues pruned to eliminate duplicates Z: 10 14.965 2.141 0.386 0.789 0.778 0.667 CA 1.676 10 residues pruned to eliminate duplicates Z: 50 59.266 2.322 0.951 0.710 0.918 0.735 CB 1.682 50 residues pruned to eliminate duplicates Z: 23 52.850 2.272 1.010 0.919 0.955 0.864 CA 1.822 23 residues pruned to eliminate duplicates Z: 61 85.411 2.418 1.236 0.663 0.950 0.733 CB 1.846 62 residues pruned to eliminate duplicates Z: 8 24.990 2.372 0.753 0.808 1.000 0.714 CB 1.736 8 residues pruned to eliminate duplicates Z: 22 16.859 2.256 0.615 0.360 0.762 0.667 CB 1.541 22 residues pruned to eliminate duplicates Z: 70 74.661 2.298 1.066 0.659 0.986 0.725 CB 1.657 55 residues pruned to eliminate duplicates Z: 129 93.918 2.392 0.946 0.608 0.945 0.773 CB 1.702 130 residues pruned to eliminate duplicates Z: 8 24.972 2.189 0.963 0.870 1.000 0.857 CB 1.602 8 residues pruned to eliminate duplicates Z: 20 30.053 2.180 0.553 0.885 1.000 0.895 CB 1.471 20 residues pruned to eliminate duplicates Z: 22 52.884 2.358 0.820 0.923 1.000 0.952 CB 1.891 22 residues pruned to eliminate duplicates Z: 69 83.469 2.407 1.189 0.656 0.956 0.765 CB 1.738 69 residues pruned to eliminate duplicates Z: 9 25.514 2.278 1.067 0.783 0.875 0.875 CB 1.706 Z: 9 35.977 2.370 1.180 0.843 1.000 0.750 CB 1.833 9 residues pruned to eliminate duplicates Z: 9 18.546 1.928 0.816 0.759 1.000 0.500 C 1.487 9 residues pruned to eliminate duplicates Z: 10 22.772 2.057 0.962 0.901 1.000 0.889 CB 1.342 10 residues pruned to eliminate duplicates Z: 12 34.006 2.331 0.934 0.728 1.000 0.727 CB 1.852 9 residues pruned to eliminate duplicates Z: 9 17.751 2.007 0.708 0.807 1.000 0.750 CB 1.401 9 residues pruned to eliminate duplicates Z: 9 28.018 2.441 0.619 0.908 1.000 1.000 CB 1.780 9 residues pruned to eliminate duplicates Z: 9 22.181 2.043 0.730 0.865 1.000 0.750 CB 1.626 9 residues pruned to eliminate duplicates Z: 18 41.926 2.307 0.787 0.936 1.000 0.941 CB 1.718 18 residues pruned to eliminate duplicates Z: 31 41.555 2.209 1.037 0.557 0.967 0.800 CB 1.650 31 residues pruned to eliminate duplicates Z: 10 32.483 2.327 1.364 0.797 1.000 0.667 CB 1.518 10 residues pruned to eliminate duplicates Z: 15 20.872 2.165 0.975 0.521 0.857 0.643 CB 1.491 15 residues pruned to eliminate duplicates Z: 11 13.862 1.943 0.874 0.652 0.800 0.700 CB 1.306 Z: 23 44.472 2.243 0.722 0.912 1.000 0.955 CB 1.738 23 residues pruned to eliminate duplicates Z: 20 34.759 2.074 0.599 0.937 1.000 1.000 CA 1.673 20 residues pruned to eliminate duplicates Z: 39 41.558 2.333 0.916 0.471 0.947 0.579 CB 1.639 39 residues pruned to eliminate duplicates Z: 20 48.122 2.273 1.041 0.910 0.947 0.947 CB 1.781 20 residues pruned to eliminate duplicates Z: 21 58.119 2.379 1.132 0.896 0.950 0.800 CA 1.932 21 residues pruned to eliminate duplicates Z: 21 57.354 2.384 1.028 0.904 1.000 0.900 CB 1.890 21 residues pruned to eliminate duplicates Z: 96 74.146 2.321 0.992 0.539 0.926 0.642 CB 1.709 87 residues pruned to eliminate duplicates Z: 24 60.541 2.382 1.039 0.922 0.957 0.739 CB 1.911 24 residues pruned to eliminate duplicates Z: 10 29.043 2.122 1.341 0.778 1.000 0.667 CB 1.525 10 residues pruned to eliminate duplicates Z: 99 86.361 2.346 1.047 0.602 0.949 0.704 CB 1.737 98 residues pruned to eliminate duplicates Z: 14 17.486 2.129 0.879 0.666 0.846 0.692 CB 1.229 11 residues pruned to eliminate duplicates Z: 23 63.715 2.429 1.114 0.941 0.955 0.909 CB 1.923 23 residues pruned to eliminate duplicates Z: 13 29.041 2.092 0.833 0.910 1.000 0.917 CA 1.551 Z: 23 55.163 2.258 1.070 0.906 1.000 0.727 CB 1.789 23 residues pruned to eliminate duplicates Z: 69 65.057 2.408 0.999 0.511 0.956 0.632 CB 1.695 69 residues pruned to eliminate duplicates Z: 12 30.575 2.143 0.812 0.905 1.000 0.909 CA 1.690 13 residues pruned to eliminate duplicates Z: 22 48.776 2.219 1.066 0.908 0.952 0.810 CB 1.732 22 residues pruned to eliminate duplicates Z: 9 28.421 2.104 1.082 0.893 1.000 1.000 CB 1.647 9 residues pruned to eliminate duplicates Z: 12 30.175 2.405 0.898 0.742 0.909 0.818 CB 1.765 12 residues pruned to eliminate duplicates Z: 12 35.787 2.260 0.926 0.909 1.000 0.818 CA 1.760 12 residues pruned to eliminate duplicates Z: 17 24.001 2.223 0.997 0.553 0.875 0.688 CB 1.467 Z: 8 33.970 2.499 0.880 0.882 1.000 1.000 CA 1.977 8 residues pruned to eliminate duplicates Z: 23 75.766 2.455 1.407 0.923 1.000 0.818 CB 1.921 23 residues pruned to eliminate duplicates Z: 10 20.469 2.261 0.910 0.647 0.889 0.778 CB 1.549 10 residues pruned to eliminate duplicates Z: 12 29.029 2.120 1.029 0.844 0.909 0.818 C 1.666 12 residues pruned to eliminate duplicates Z: 11 25.382 2.126 0.845 0.821 0.900 0.800 CA 1.722 11 residues pruned to eliminate duplicates Z: 9 20.143 2.240 0.550 0.820 0.875 0.875 CB 1.775 9 residues pruned to eliminate duplicates Z: 69 65.630 2.426 0.954 0.535 0.941 0.676 CB 1.724 69 residues pruned to eliminate duplicates Z: 10 32.570 2.310 1.504 0.795 0.889 0.778 CB 1.631 10 residues pruned to eliminate duplicates Z: 10 17.799 1.970 0.577 0.898 1.000 0.889 CB 1.366 10 residues pruned to eliminate duplicates Z: 34 47.510 2.419 0.922 0.552 0.939 0.636 CB 1.799 34 residues pruned to eliminate duplicates Z: 23 84.159 2.519 1.523 0.904 1.000 0.773 CB 2.011 23 residues pruned to eliminate duplicates Z: 7 7.777 2.019 0.644 0.770 0.667 0.667 CA 1.129 Z: 70 55.103 2.316 0.718 0.554 0.942 0.667 CB 1.679 70 residues pruned to eliminate duplicates Z: 24 50.740 2.181 1.078 0.924 0.957 0.913 CB 1.714 24 residues pruned to eliminate duplicates Z: 7 7.968 1.962 0.184 0.802 0.833 0.833 CB 1.290 7 residues pruned to eliminate duplicates Z: 19 36.888 2.241 0.823 0.920 1.000 0.833 CB 1.499 19 residues pruned to eliminate duplicates Z: 19 36.410 2.238 0.758 0.937 1.000 0.944 CB 1.519 19 residues pruned to eliminate duplicates Z: 22 54.457 2.310 1.024 0.925 1.000 0.952 CB 1.783 22 residues pruned to eliminate duplicates Z: 36 28.373 2.065 0.994 0.466 0.857 0.571 CB 1.406 15 residues pruned to eliminate duplicates Z: 18 42.295 2.424 0.837 0.891 1.000 0.882 CB 1.656 18 residues pruned to eliminate duplicates Z: 25 29.120 2.092 0.891 0.622 0.917 0.750 CB 1.460 25 residues pruned to eliminate duplicates Z: 10 23.177 2.168 0.966 0.762 0.778 0.778 CB 1.846 10 residues pruned to eliminate duplicates Z: 122 83.050 2.352 1.008 0.567 0.917 0.603 CB 1.633 116 residues pruned to eliminate duplicates Z: 22 45.614 2.219 0.811 0.917 1.000 0.905 CB 1.748 22 residues pruned to eliminate duplicates Z: 22 88.259 2.631 1.498 0.928 1.000 0.810 CB 2.051 22 residues pruned to eliminate duplicates Z: 14 36.285 2.261 0.861 0.873 0.923 0.769 CB 1.887 14 residues pruned to eliminate duplicates Z: 18 29.875 2.049 0.614 0.928 1.000 0.824 CB 1.534 18 residues pruned to eliminate duplicates Z: 23 34.043 2.202 0.949 0.652 0.909 0.773 CB 1.615 23 residues pruned to eliminate duplicates Z: 13 30.502 2.059 0.863 0.889 1.000 0.833 CA 1.653 13 residues pruned to eliminate duplicates Z: 42 33.035 2.139 0.771 0.509 0.902 0.659 CB 1.495 17 residues pruned to eliminate duplicates Z: 33 37.389 2.379 0.747 0.595 0.906 0.688 CB 1.603 33 residues pruned to eliminate duplicates Z: 15 16.044 2.102 0.545 0.471 0.929 0.857 CB 1.465 16 residues pruned to eliminate duplicates Z: 12 24.627 2.177 0.979 0.585 0.909 0.727 CB 1.747 12 residues pruned to eliminate duplicates Z: 23 41.436 2.197 0.836 0.873 0.909 0.864 CA 1.754 23 residues pruned to eliminate duplicates Z: 26 25.159 2.006 0.863 0.590 0.880 0.760 CB 1.404 26 residues pruned to eliminate duplicates Z: 13 28.108 2.061 0.675 0.939 1.000 1.000 CA 1.634 13 residues pruned to eliminate duplicates Z: 13 45.972 2.659 1.151 0.680 0.917 0.583 CB 2.146 13 residues pruned to eliminate duplicates Z: 67 49.458 2.272 0.672 0.526 0.955 0.727 CB 1.636 67 residues pruned to eliminate duplicates Z: 9 17.103 1.910 0.713 0.793 1.000 0.750 CB 1.429 9 residues pruned to eliminate duplicates Z: 10 30.941 2.336 1.287 0.832 0.889 0.778 CB 1.631 10 residues pruned to eliminate duplicates Z: 8 6.832 1.814 0.345 0.605 0.714 0.429 CA 1.340 8 residues pruned to eliminate duplicates Z: 32 55.352 2.245 1.110 0.786 0.903 0.806 CB 1.806 32 residues pruned to eliminate duplicates Z: 41 32.436 2.151 0.731 0.555 0.900 0.725 CB 1.450 38 residues pruned to eliminate duplicates Z: 13 32.294 2.080 0.892 0.935 1.000 1.000 CA 1.651 13 residues pruned to eliminate duplicates Z: 49 42.698 2.224 0.998 0.496 0.917 0.708 CB 1.518 49 residues pruned to eliminate duplicates Z: 23 42.750 2.197 0.705 0.902 1.000 0.955 CB 1.735 23 residues pruned to eliminate duplicates Z: 10 15.294 1.934 0.632 0.767 0.889 0.778 CB 1.434 10 residues pruned to eliminate duplicates Z: 21 41.879 2.311 0.643 0.931 0.950 0.950 CB 1.814 21 residues pruned to eliminate duplicates Z: 13 27.920 2.229 1.144 0.691 0.917 0.750 CB 1.546 14 residues pruned to eliminate duplicates Z: 23 68.428 2.423 1.184 0.926 1.000 0.818 CB 1.933 23 residues pruned to eliminate duplicates Z: 17 15.034 1.968 0.682 0.578 0.875 0.625 CB 1.204 17 residues pruned to eliminate duplicates Z: 9 15.511 1.889 0.607 0.876 0.875 0.875 C 1.501 9 residues pruned to eliminate duplicates Z: 21 51.167 2.198 1.216 0.896 0.950 0.650 CB 1.772 21 residues pruned to eliminate duplicates Z: 12 38.357 2.477 1.149 0.767 1.000 0.727 CA 1.714 12 residues pruned to eliminate duplicates Z: 13 34.108 2.193 1.016 0.765 1.000 0.500 CA 1.761 12 residues pruned to eliminate duplicates Z: 57 51.871 2.234 0.792 0.580 0.946 0.714 CB 1.694 57 residues pruned to eliminate duplicates Z: 18 30.642 2.045 0.650 0.923 1.000 0.941 CB 1.549 18 residues pruned to eliminate duplicates Z: 9 18.842 1.992 0.819 0.829 0.875 0.875 C 1.582 9 residues pruned to eliminate duplicates Z: 24 39.477 2.133 0.717 0.889 0.957 0.826 CB 1.692 24 residues pruned to eliminate duplicates Z: 72 52.761 2.259 0.741 0.552 0.901 0.690 CB 1.679 72 residues pruned to eliminate duplicates Z: 9 25.944 2.219 1.096 0.875 1.000 0.750 CB 1.434 9 residues pruned to eliminate duplicates Z: 18 30.340 2.387 0.414 0.882 1.000 0.882 CB 1.578 18 residues pruned to eliminate duplicates Z: 49 56.109 2.287 0.948 0.694 0.938 0.771 CB 1.624 49 residues pruned to eliminate duplicates Z: 9 26.366 2.225 0.988 0.868 1.000 0.875 CB 1.540 9 residues pruned to eliminate duplicates Z: 24 43.921 2.090 1.092 0.869 0.957 0.783 CB 1.600 24 residues pruned to eliminate duplicates Z: 7 18.120 2.085 0.692 0.830 1.000 0.833 CB 1.577 7 residues pruned to eliminate duplicates Z: 22 21.270 2.193 0.824 0.517 0.810 0.571 CB 1.409 22 residues pruned to eliminate duplicates Z: 32 20.369 1.951 0.503 0.631 0.903 0.742 CB 1.222 4 residues pruned to eliminate duplicates Z: 18 34.069 2.044 0.804 0.927 1.000 1.000 CB 1.570 18 residues pruned to eliminate duplicates Z: 20 54.944 2.471 0.998 0.899 0.895 0.842 CB 2.039 20 residues pruned to eliminate duplicates Z: 9 25.380 2.252 0.825 0.792 0.875 0.750 N 1.931 9 residues pruned to eliminate duplicates Z: 135 96.606 2.360 0.981 0.602 0.955 0.701 CB 1.696 135 residues pruned to eliminate duplicates Z: 33 36.981 2.256 0.988 0.530 0.875 0.531 CB 1.618 33 residues pruned to eliminate duplicates Z: 17 17.671 1.907 0.286 0.928 1.000 0.938 CB 1.262 17 residues pruned to eliminate duplicates Z: 10 32.900 2.222 1.565 0.809 0.889 0.889 CB 1.654 10 residues pruned to eliminate duplicates Z: 23 42.602 2.144 0.863 0.912 0.955 0.818 CB 1.687 23 residues pruned to eliminate duplicates Z: 21 45.325 2.354 0.836 0.886 0.950 0.900 CB 1.781 21 residues pruned to eliminate duplicates Z: 23 71.420 2.411 1.265 0.909 1.000 0.773 C 1.978 23 residues pruned to eliminate duplicates Z: 97 71.268 2.321 0.921 0.584 0.885 0.667 CB 1.700 97 residues pruned to eliminate duplicates Z: 11 12.504 1.875 0.428 0.869 1.000 0.900 CB 1.079 11 residues pruned to eliminate duplicates Z: 31 35.574 2.172 0.848 0.537 0.967 0.767 CB 1.614 31 residues pruned to eliminate duplicates Z: 23 55.741 2.254 1.045 0.919 1.000 0.909 CB 1.816 23 residues pruned to eliminate duplicates Z: 30 32.053 2.186 0.955 0.547 0.862 0.517 CB 1.543 30 residues pruned to eliminate duplicates Z: 23 92.888 2.548 1.646 0.927 1.000 0.773 CB 2.058 23 residues pruned to eliminate duplicates Z: 24 40.801 2.151 0.756 0.892 0.957 0.826 CB 1.692 24 residues pruned to eliminate duplicates Z: 8 35.512 2.302 1.318 0.888 1.000 1.000 CB 1.813 8 residues pruned to eliminate duplicates Z: 120 82.478 2.334 1.015 0.567 0.950 0.706 CB 1.588 120 residues pruned to eliminate duplicates Z: 24 37.784 2.038 0.758 0.888 1.000 0.870 CB 1.584 24 residues pruned to eliminate duplicates Z: 22 44.694 2.193 0.816 0.907 1.000 0.857 CB 1.741 22 residues pruned to eliminate duplicates Z: 18 26.768 2.029 0.470 0.934 1.000 0.941 CB 1.517 18 residues pruned to eliminate duplicates Z: 6 5.341 1.885 0.058 0.591 0.800 0.400 CA 1.372 6 residues pruned to eliminate duplicates Z: 24 50.253 2.383 0.887 0.893 0.957 0.826 CB 1.749 24 residues pruned to eliminate duplicates Z: 23 45.723 2.217 0.731 0.928 1.000 0.909 CB 1.779 23 residues pruned to eliminate duplicates Z: 65 39.391 2.079 0.615 0.560 0.953 0.641 CB 1.452 65 residues pruned to eliminate duplicates Z: 10 21.707 2.022 0.966 0.890 1.000 1.000 CB 1.310 10 residues pruned to eliminate duplicates Z: 22 91.068 2.548 1.609 0.941 1.000 0.857 CB 2.074 22 residues pruned to eliminate duplicates Z: 8 21.889 2.129 0.654 0.893 1.000 1.000 CB 1.687 Z: 24 53.557 2.184 1.149 0.913 0.957 0.826 CA 1.760 24 residues pruned to eliminate duplicates Z: 18 32.456 2.067 0.675 0.938 1.000 0.882 CB 1.581 18 residues pruned to eliminate duplicates Z: 23 45.532 2.199 0.960 0.836 0.955 0.864 CA 1.765 23 residues pruned to eliminate duplicates Z: 13 32.610 2.036 1.010 0.929 1.000 0.833 CA 1.610 13 residues pruned to eliminate duplicates Z: 23 42.515 2.163 0.913 0.905 0.955 0.909 CB 1.634 23 residues pruned to eliminate duplicates Z: 18 25.824 2.020 0.461 0.910 1.000 0.941 CB 1.506 18 residues pruned to eliminate duplicates Z: 17 25.474 2.247 0.877 0.596 0.938 0.750 CB 1.470 11 residues pruned to eliminate duplicates Z: 7 26.383 2.340 0.868 0.852 1.000 0.833 CA 1.823 7 residues pruned to eliminate duplicates Z: 11 22.444 2.092 1.165 0.625 1.000 0.700 CB 1.393 10 residues pruned to eliminate duplicates Z: 33 34.672 2.282 0.681 0.541 0.844 0.656 CB 1.818 33 residues pruned to eliminate duplicates Z: 22 45.211 2.206 0.773 0.928 1.000 0.952 CB 1.766 22 residues pruned to eliminate duplicates Z: 18 19.102 1.948 1.051 0.540 0.941 0.706 CB 1.184 18 residues pruned to eliminate duplicates Z: 32 50.898 2.211 0.966 0.788 0.903 0.710 CB 1.807 32 residues pruned to eliminate duplicates Z: 67 41.105 2.169 0.660 0.539 0.909 0.636 CB 1.488 67 residues pruned to eliminate duplicates Z: 8 23.946 2.085 0.917 0.899 1.000 0.857 CB 1.618 9 residues pruned to eliminate duplicates Z: 22 57.693 2.320 1.064 0.931 1.000 0.810 CB 1.837 22 residues pruned to eliminate duplicates Z: 6 7.588 1.990 0.617 0.531 0.800 0.600 CB 1.278 6 residues pruned to eliminate duplicates Z: 18 15.267 1.824 0.162 0.889 1.000 0.882 CB 1.258 18 residues pruned to eliminate duplicates Z: 18 28.802 1.989 0.636 0.928 1.000 0.882 CB 1.503 18 residues pruned to eliminate duplicates Z: 18 29.833 2.005 0.681 0.916 1.000 0.824 CB 1.516 18 residues pruned to eliminate duplicates Z: 22 55.621 2.307 1.047 0.908 1.000 0.762 CB 1.826 22 residues pruned to eliminate duplicates Z: 11 15.838 2.070 0.917 0.817 0.800 0.600 CB 1.198 11 residues pruned to eliminate duplicates Z: 17 14.191 1.884 0.140 0.896 1.000 0.875 CB 1.183 17 residues pruned to eliminate duplicates Z: 38 23.927 1.964 0.624 0.561 0.919 0.676 CB 1.265 38 residues pruned to eliminate duplicates Z: 9 15.784 1.961 0.633 0.850 0.875 0.750 CB 1.475 9 residues pruned to eliminate duplicates Z: 65 49.205 2.272 0.884 0.511 0.891 0.656 CB 1.596 65 residues pruned to eliminate duplicates Z: 135 76.115 2.245 0.876 0.590 0.925 0.709 CB 1.548 135 residues pruned to eliminate duplicates Z: 36 24.103 1.912 0.668 0.653 0.914 0.629 CB 1.211 36 residues pruned to eliminate duplicates Z: 26 24.609 2.095 0.841 0.573 0.800 0.640 CB 1.487 26 residues pruned to eliminate duplicates Z: 76 73.816 2.372 1.112 0.615 0.947 0.693 CB 1.611 76 residues pruned to eliminate duplicates Z: 10 16.683 2.012 0.753 0.555 1.000 0.556 CA 1.495 10 residues pruned to eliminate duplicates Z: 21 16.692 2.013 0.895 0.536 0.800 0.550 CB 1.180 14 residues pruned to eliminate duplicates Z: 18 43.945 2.422 0.922 0.890 1.000 0.765 CB 1.648 18 residues pruned to eliminate duplicates Z: 22 30.040 2.329 0.873 0.495 0.952 0.619 CB 1.585 22 residues pruned to eliminate duplicates Z: 10 20.207 2.146 0.405 0.836 1.000 0.778 CB 1.672 10 residues pruned to eliminate duplicates Z: 23 52.071 2.229 1.028 0.895 1.000 0.818 CA 1.760 23 residues pruned to eliminate duplicates Z: 22 66.646 2.524 1.124 0.939 0.952 0.810 CB 1.980 22 residues pruned to eliminate duplicates Z: 63 85.555 2.397 1.199 0.669 0.968 0.710 CB 1.821 63 residues pruned to eliminate duplicates Z: 23 88.126 2.536 1.531 0.932 1.000 0.818 CA 2.044 23 residues pruned to eliminate duplicates Z: 12 21.698 1.911 0.662 0.938 1.000 1.000 CB 1.432 Z: 13 26.553 2.072 0.667 0.896 1.000 0.917 CA 1.590 13 residues pruned to eliminate duplicates Z: 22 34.804 2.384 0.773 0.636 0.952 0.619 CB 1.660 22 residues pruned to eliminate duplicates Z: 23 47.496 2.120 1.028 0.912 1.000 0.909 CB 1.668 23 residues pruned to eliminate duplicates Z: 22 47.755 2.292 0.885 0.922 0.952 0.905 CB 1.781 22 residues pruned to eliminate duplicates Z: 23 46.083 2.133 1.068 0.898 1.000 0.682 CB 1.592 23 residues pruned to eliminate duplicates Z: 40 37.550 2.191 1.056 0.474 0.897 0.590 CB 1.526 38 residues pruned to eliminate duplicates Z: 18 15.488 1.791 0.330 0.916 1.000 0.941 CB 1.113 18 residues pruned to eliminate duplicates Z: 8 24.611 2.208 0.733 0.867 1.000 0.571 CB 1.779 8 residues pruned to eliminate duplicates Z: 37 33.697 2.138 0.663 0.538 0.972 0.694 CB 1.565 37 residues pruned to eliminate duplicates Z: 54 55.134 2.294 0.947 0.615 0.943 0.604 CB 1.612 54 residues pruned to eliminate duplicates Z: 13 19.352 1.829 0.491 0.940 1.000 0.917 CA 1.422 13 residues pruned to eliminate duplicates Z: 68 70.124 2.373 0.974 0.638 0.940 0.746 CB 1.709 68 residues pruned to eliminate duplicates Z: 11 17.414 1.953 0.464 0.903 1.000 1.000 CB 1.373 11 residues pruned to eliminate duplicates Z: 23 82.467 2.439 1.607 0.923 1.000 0.591 CB 1.942 23 residues pruned to eliminate duplicates Z: 72 50.363 2.294 0.803 0.507 0.887 0.704 CB 1.617 72 residues pruned to eliminate duplicates Z: 22 50.214 2.292 0.922 0.917 1.000 0.762 CB 1.756 22 residues pruned to eliminate duplicates Z: 11 23.636 1.854 1.285 0.911 1.000 0.900 CB 1.250 11 residues pruned to eliminate duplicates Z: 11 18.617 1.968 0.460 0.926 1.000 0.900 CB 1.437 11 residues pruned to eliminate duplicates Z: 46 51.327 2.401 1.038 0.535 0.911 0.622 CB 1.658 46 residues pruned to eliminate duplicates Z: 21 44.833 2.516 1.099 0.565 1.000 0.600 CB 1.782 21 residues pruned to eliminate duplicates Z: 43 48.359 2.346 0.945 0.534 0.929 0.619 CB 1.704 43 residues pruned to eliminate duplicates Z: 10 27.144 2.227 0.794 0.879 1.000 0.889 CB 1.643 10 residues pruned to eliminate duplicates Z: 23 46.703 2.227 0.826 0.889 1.000 0.818 CA 1.763 23 residues pruned to eliminate duplicates Z: 10 13.883 1.748 0.442 0.867 1.000 0.778 C 1.343 10 residues pruned to eliminate duplicates Z: 22 17.415 2.204 0.630 0.364 0.810 0.619 CB 1.512 22 residues pruned to eliminate duplicates Z: 29 24.378 2.030 0.804 0.552 0.929 0.750 CB 1.288 29 residues pruned to eliminate duplicates Z: 85 61.137 2.271 0.824 0.582 0.929 0.714 CB 1.602 85 residues pruned to eliminate duplicates Z: 7 7.282 1.738 0.343 0.636 0.833 0.667 CA 1.346 7 residues pruned to eliminate duplicates Z: 8 9.229 1.976 1.036 0.608 0.857 0.571 CB 0.913 8 residues pruned to eliminate duplicates Z: 13 22.800 1.841 0.772 0.925 1.000 1.000 CA 1.416 15 residues pruned to eliminate duplicates Z: 46 49.234 2.354 0.854 0.552 0.889 0.733 CB 1.798 46 residues pruned to eliminate duplicates Z: 67 56.041 2.316 1.030 0.524 0.909 0.682 CB 1.576 67 residues pruned to eliminate duplicates Z: 9 21.447 2.293 0.339 0.916 1.000 1.000 CB 1.744 9 residues pruned to eliminate duplicates Z: 83 67.130 2.364 0.908 0.617 0.915 0.732 CB 1.609 83 residues pruned to eliminate duplicates Z: 96 69.346 2.351 0.881 0.531 0.947 0.684 CB 1.647 96 residues pruned to eliminate duplicates Z: 29 33.905 2.227 0.876 0.590 0.929 0.750 CB 1.516 29 residues pruned to eliminate duplicates Z: 11 18.201 1.978 0.404 0.941 1.000 1.000 CB 1.438 11 residues pruned to eliminate duplicates Z: 18 18.123 1.843 0.487 0.915 1.000 0.882 CB 1.133 18 residues pruned to eliminate duplicates Z: 9 7.468 1.635 0.618 0.616 0.750 0.625 CB 1.193 Z: 31 49.587 2.441 1.081 0.600 0.933 0.600 CB 1.735 31 residues pruned to eliminate duplicates Z: 8 26.863 2.662 0.484 0.865 1.000 0.857 CB 1.884 8 residues pruned to eliminate duplicates Z: 27 25.082 2.024 0.767 0.586 0.923 0.692 CB 1.372 28 residues pruned to eliminate duplicates Z: 9 9.483 1.770 0.503 0.604 0.875 0.875 CB 1.304 Z: 12 22.484 1.911 0.748 0.935 1.000 0.909 CB 1.413 12 residues pruned to eliminate duplicates Z: 9 12.713 1.882 0.627 0.749 0.875 0.625 C 1.343 9 residues pruned to eliminate duplicates Z: 18 24.503 2.083 0.352 0.890 1.000 0.882 CB 1.518 18 residues pruned to eliminate duplicates Z: 13 23.139 1.959 0.735 0.879 1.000 0.750 CA 1.425 13 residues pruned to eliminate duplicates Z: 37 35.939 2.149 0.831 0.561 0.917 0.722 CB 1.564 37 residues pruned to eliminate duplicates Z: 7 3.696 1.560 0.195 0.819 0.667 0.500 CB 0.921 7 residues pruned to eliminate duplicates Z: 22 50.788 2.216 1.070 0.897 1.000 0.714 CB 1.729 22 residues pruned to eliminate duplicates Z: 40 31.966 2.089 0.878 0.571 0.897 0.667 CB 1.358 40 residues pruned to eliminate duplicates Z: 17 14.627 1.909 0.657 0.582 0.875 0.625 CB 1.221 17 residues pruned to eliminate duplicates Z: 52 35.608 2.239 0.804 0.458 0.882 0.588 CB 1.461 52 residues pruned to eliminate duplicates Z: 11 16.772 1.934 0.366 0.919 1.000 0.900 CB 1.415 11 residues pruned to eliminate duplicates Z: 13 21.509 2.034 0.557 0.828 0.917 0.667 CA 1.610 13 residues pruned to eliminate duplicates Z: 18 26.987 2.011 0.503 0.932 1.000 0.941 CB 1.513 18 residues pruned to eliminate duplicates Z: 85 73.212 2.417 0.970 0.578 0.929 0.714 CB 1.676 85 residues pruned to eliminate duplicates Z: 10 17.819 2.013 1.037 0.833 0.889 0.556 CB 1.223 10 residues pruned to eliminate duplicates Z: 13 21.690 1.827 0.706 0.914 1.000 0.917 CA 1.420 13 residues pruned to eliminate duplicates Z: 7 4.967 1.689 0.447 0.423 0.667 0.500 CB 1.349 7 residues pruned to eliminate duplicates Z: 10 5.932 1.651 0.446 0.426 0.667 0.444 C 1.341 6 residues pruned to eliminate duplicates Z: 9 13.620 2.112 0.953 0.573 0.750 0.625 CB 1.451 9 residues pruned to eliminate duplicates Z: 35 37.781 2.399 0.784 0.525 0.853 0.588 CB 1.732 35 residues pruned to eliminate duplicates Z: 43 63.903 2.389 1.039 0.694 0.929 0.643 CB 1.825 43 residues pruned to eliminate duplicates Z: 20 14.637 2.127 0.703 0.418 0.789 0.579 CB 1.279 20 residues pruned to eliminate duplicates Z: 35 34.197 2.261 0.756 0.499 0.853 0.676 CB 1.734 35 residues pruned to eliminate duplicates Z: 20 33.093 2.193 0.818 0.820 0.947 0.632 CB 1.523 20 residues pruned to eliminate duplicates Z: 65 71.175 2.338 1.029 0.651 0.953 0.641 CB 1.709 65 residues pruned to eliminate duplicates Z: 24 68.142 2.386 1.285 0.896 0.957 0.826 C 1.952 24 residues pruned to eliminate duplicates Z: 42 24.848 1.879 0.821 0.566 0.902 0.659 CB 1.179 41 residues pruned to eliminate duplicates Z: 13 28.193 2.029 0.949 0.920 1.000 1.000 CA 1.449 13 residues pruned to eliminate duplicates Z: 10 17.955 1.967 0.617 0.763 0.889 0.889 C 1.675 10 residues pruned to eliminate duplicates Z: 18 15.714 1.754 0.366 0.886 1.000 0.824 CB 1.148 18 residues pruned to eliminate duplicates Z: 11 23.058 2.288 0.583 0.768 0.900 0.800 CB 1.764 11 residues pruned to eliminate duplicates Z: 31 34.497 2.132 0.829 0.525 0.967 0.667 CB 1.630 31 residues pruned to eliminate duplicates Z: 37 52.015 2.208 0.976 0.757 0.972 0.694 CB 1.625 37 residues pruned to eliminate duplicates Z: 40 31.019 2.069 0.859 0.547 0.872 0.667 CB 1.415 40 residues pruned to eliminate duplicates Z: 18 16.594 1.803 0.287 0.932 0.941 0.882 CB 1.286 18 residues pruned to eliminate duplicates Z: 18 16.860 2.158 0.671 0.467 0.765 0.647 CB 1.534 18 residues pruned to eliminate duplicates Z: 14 15.189 2.055 0.690 0.556 0.923 0.769 CB 1.244 13 residues pruned to eliminate duplicates Z: 7 10.456 1.885 0.768 0.834 1.000 0.833 CB 0.960 8 residues pruned to eliminate duplicates Z: 61 55.281 2.327 0.943 0.561 0.900 0.700 CB 1.652 68 residues pruned to eliminate duplicates Z: 36 38.994 2.249 0.775 0.545 0.971 0.686 CB 1.626 36 residues pruned to eliminate duplicates Z: 16 21.573 1.889 0.543 0.941 1.000 0.800 CB 1.326 16 residues pruned to eliminate duplicates Z: 60 42.428 2.123 0.707 0.593 0.949 0.763 CB 1.469 60 residues pruned to eliminate duplicates Z: 18 22.593 1.859 0.730 0.927 0.941 0.882 CB 1.269 18 residues pruned to eliminate duplicates Z: 28 39.257 2.231 1.091 0.611 0.889 0.778 CB 1.640 28 residues pruned to eliminate duplicates Z: 6 3.873 1.828 0.754 0.260 0.800 0.800 CA 0.888 6 residues pruned to eliminate duplicates Z: 18 17.288 1.840 0.442 0.880 1.000 0.824 CB 1.145 18 residues pruned to eliminate duplicates Z: 43 64.525 2.377 1.150 0.711 0.881 0.738 CB 1.827 43 residues pruned to eliminate duplicates Z: 7 4.646 1.269 1.120 0.591 0.833 0.500 CB 0.776 5 residues pruned to eliminate duplicates Z: 29 36.478 2.169 1.061 0.580 0.893 0.786 CB 1.599 29 residues pruned to eliminate duplicates Z: 18 30.930 2.368 0.442 0.901 1.000 0.882 CB 1.569 18 residues pruned to eliminate duplicates Z: 45 60.994 2.363 1.029 0.671 0.909 0.705 CB 1.802 45 residues pruned to eliminate duplicates Z: 12 17.816 1.882 0.427 0.930 1.000 0.909 CB 1.398 12 residues pruned to eliminate duplicates Z: 27 27.219 2.154 0.900 0.572 0.808 0.577 CB 1.507 27 residues pruned to eliminate duplicates Z: 136 73.426 2.240 0.931 0.547 0.919 0.644 CB 1.519 137 residues pruned to eliminate duplicates Z: 12 15.324 1.883 0.887 0.481 1.000 0.727 CB 1.326 12 residues pruned to eliminate duplicates Z: 18 39.608 2.049 1.136 0.938 1.000 0.882 CB 1.527 18 residues pruned to eliminate duplicates Z: 23 44.911 2.109 1.004 0.883 1.000 0.773 CB 1.638 23 residues pruned to eliminate duplicates Z: 35 43.699 2.160 0.942 0.713 0.882 0.706 CB 1.670 35 residues pruned to eliminate duplicates Z: 36 31.589 2.167 0.632 0.540 0.914 0.629 CB 1.587 36 residues pruned to eliminate duplicates Z: 13 25.919 2.042 0.632 0.877 1.000 0.833 CA 1.630 13 residues pruned to eliminate duplicates Z: 12 20.400 1.934 0.526 0.937 1.000 1.000 CB 1.451 12 residues pruned to eliminate duplicates Z: 25 26.088 2.106 0.870 0.513 0.875 0.667 CB 1.525 25 residues pruned to eliminate duplicates Z: 105 73.132 2.240 1.023 0.574 0.942 0.635 CB 1.564 138 residues pruned to eliminate duplicates Z: 130 82.314 2.241 0.955 0.593 0.946 0.690 CB 1.601 95 residues pruned to eliminate duplicates Z: 26 19.132 1.923 0.531 0.503 0.880 0.640 CB 1.473 26 residues pruned to eliminate duplicates Z: 21 53.098 2.193 1.328 0.926 0.950 0.800 CB 1.716 21 residues pruned to eliminate duplicates Z: 24 49.941 2.059 1.256 0.900 1.000 0.826 CB 1.601 24 residues pruned to eliminate duplicates Z: 18 18.708 1.805 0.535 0.872 1.000 0.647 CB 1.194 18 residues pruned to eliminate duplicates Z: 19 32.428 2.074 0.581 0.917 1.000 0.889 CA 1.645 19 residues pruned to eliminate duplicates Z: 34 49.163 2.184 0.902 0.757 0.939 0.636 CB 1.745 34 residues pruned to eliminate duplicates Z: 22 51.385 2.181 1.103 0.916 1.000 0.905 CB 1.728 22 residues pruned to eliminate duplicates Z: 99 79.430 2.346 0.963 0.577 0.929 0.684 CB 1.741 99 residues pruned to eliminate duplicates Z: 17 18.474 2.117 0.961 0.553 0.812 0.562 CB 1.299 17 residues pruned to eliminate duplicates Z: 12 29.641 2.157 0.734 0.905 1.000 0.818 CA 1.702 12 residues pruned to eliminate duplicates Z: 18 18.003 1.878 0.382 0.907 1.000 0.882 CB 1.196 18 residues pruned to eliminate duplicates Z: 12 13.959 2.126 0.812 0.419 0.818 0.545 CB 1.453 12 residues pruned to eliminate duplicates Z: 43 64.937 2.408 1.055 0.680 0.929 0.738 CB 1.849 43 residues pruned to eliminate duplicates Z: 8 17.248 2.064 1.181 0.545 1.000 0.857 CA 1.385 8 residues pruned to eliminate duplicates Z: 11 15.035 1.971 0.862 0.658 0.900 0.600 CB 1.243 8 residues pruned to eliminate duplicates Z: 21 47.446 2.263 0.948 0.891 0.950 0.850 CB 1.821 21 residues pruned to eliminate duplicates Z: 27 26.844 2.104 0.831 0.535 0.885 0.654 CB 1.493 27 residues pruned to eliminate duplicates Z: 126 80.967 2.371 0.821 0.569 0.912 0.672 CB 1.720 126 residues pruned to eliminate duplicates Z: 12 16.679 1.894 0.326 0.912 1.000 0.818 CB 1.418 12 residues pruned to eliminate duplicates Z: 9 15.980 1.986 0.727 0.505 1.000 0.500 CA 1.639 9 residues pruned to eliminate duplicates Z: 72 37.065 2.068 0.534 0.550 0.944 0.704 CB 1.400 72 residues pruned to eliminate duplicates Z: 135 86.697 2.348 0.867 0.598 0.933 0.657 CB 1.668 135 residues pruned to eliminate duplicates Z: 36 20.917 1.946 0.468 0.538 0.914 0.629 CB 1.304 36 residues pruned to eliminate duplicates Z: 50 33.550 2.021 0.728 0.596 0.939 0.653 CB 1.334 50 residues pruned to eliminate duplicates Z: 10 25.785 2.115 0.750 0.857 1.000 1.000 CA 1.711 10 residues pruned to eliminate duplicates Z: 18 15.189 1.789 0.327 0.913 1.000 0.824 CB 1.098 18 residues pruned to eliminate duplicates Z: 6 6.678 1.637 0.801 0.471 1.000 0.400 C 1.044 6 residues pruned to eliminate duplicates Z: 11 18.567 1.971 0.437 0.925 1.000 1.000 CB 1.455 11 residues pruned to eliminate duplicates Z: 48 58.541 2.145 1.178 0.667 0.957 0.723 CB 1.636 48 residues pruned to eliminate duplicates Z: 6 4.270 1.591 0.499 0.754 0.800 0.600 C 0.798 6 residues pruned to eliminate duplicates Z: 18 36.876 2.049 0.962 0.937 1.000 0.706 CB 1.548 18 residues pruned to eliminate duplicates Z: 34 42.903 2.335 0.970 0.560 0.939 0.667 CB 1.630 34 residues pruned to eliminate duplicates Z: 18 17.806 1.807 0.527 0.922 1.000 0.882 CB 1.101 18 residues pruned to eliminate duplicates Z: 10 4.639 1.489 0.481 0.313 0.778 0.444 CB 1.108 6 residues pruned to eliminate duplicates Z: 47 56.759 2.270 0.992 0.691 0.913 0.630 CB 1.702 47 residues pruned to eliminate duplicates Z: 14 17.601 1.730 0.577 0.902 1.000 0.692 CA 1.276 14 residues pruned to eliminate duplicates Z: 6 10.550 2.166 0.416 0.737 0.800 0.400 CB 1.555 6 residues pruned to eliminate duplicates Z: 36 51.121 2.420 1.112 0.531 0.943 0.629 CB 1.739 36 residues pruned to eliminate duplicates Z: 18 14.156 1.904 0.956 0.433 0.765 0.412 CB 1.292 18 residues pruned to eliminate duplicates Z: 10 41.285 2.525 1.348 0.863 1.000 1.000 CB 1.703 10 residues pruned to eliminate duplicates Z: 18 34.022 2.313 0.520 0.908 1.000 0.882 CB 1.668 18 residues pruned to eliminate duplicates Z: 6 15.280 2.220 0.623 0.822 1.000 0.600 CA 1.435 6 residues pruned to eliminate duplicates Z: 61 59.344 2.424 0.921 0.541 0.933 0.683 CB 1.694 61 residues pruned to eliminate duplicates Z: 11 27.235 2.253 0.841 0.824 1.000 0.900 CA 1.569 11 residues pruned to eliminate duplicates Z: 17 16.423 1.790 0.251 0.918 1.000 0.938 CB 1.292 17 residues pruned to eliminate duplicates Z: 22 85.277 2.517 1.607 0.923 1.000 0.762 CB 1.992 22 residues pruned to eliminate duplicates Z: 87 44.972 2.152 0.535 0.527 0.930 0.744 CB 1.537 87 residues pruned to eliminate duplicates Z: 19 19.743 1.764 0.586 0.900 1.000 0.778 CB 1.189 19 residues pruned to eliminate duplicates Z: 51 55.987 2.275 0.984 0.676 0.920 0.760 CB 1.621 51 residues pruned to eliminate duplicates Z: 26 18.424 1.984 0.846 0.509 0.840 0.560 CB 1.187 26 residues pruned to eliminate duplicates Z: 6 8.363 1.503 0.584 0.806 1.000 0.600 N 1.203 6 residues pruned to eliminate duplicates Z: 7 12.999 2.159 0.396 0.790 0.833 0.667 CA 1.638 7 residues pruned to eliminate duplicates Z: 76 63.823 2.362 0.917 0.552 0.933 0.627 CB 1.658 76 residues pruned to eliminate duplicates Z: 35 38.362 2.255 0.818 0.561 0.912 0.706 CB 1.659 35 residues pruned to eliminate duplicates Z: 11 20.688 1.950 0.635 0.928 1.000 0.800 CB 1.438 11 residues pruned to eliminate duplicates Z: 21 31.459 2.229 1.038 0.516 1.000 0.550 CB 1.525 21 residues pruned to eliminate duplicates Z: 6 3.634 1.688 0.293 0.271 0.800 0.600 CB 1.207 6 residues pruned to eliminate duplicates Z: 37 32.276 2.045 0.840 0.581 0.889 0.750 CB 1.488 37 residues pruned to eliminate duplicates Z: 92 78.442 2.325 1.047 0.633 0.934 0.670 CB 1.634 92 residues pruned to eliminate duplicates Z: 32 18.107 1.919 0.474 0.593 0.903 0.710 CB 1.165 32 residues pruned to eliminate duplicates Z: 33 48.328 2.425 0.868 0.559 0.938 0.781 CB 1.901 33 residues pruned to eliminate duplicates Z: 14 16.714 1.775 0.465 0.901 1.000 0.923 CB 1.272 14 residues pruned to eliminate duplicates Z: 11 37.989 2.527 0.887 0.752 1.000 0.700 CB 2.012 11 residues pruned to eliminate duplicates Z: 9 8.098 1.484 0.753 0.800 0.875 0.375 CB 0.968 9 residues pruned to eliminate duplicates Z: 8 29.223 2.388 0.896 0.903 1.000 0.714 CB 1.739 8 residues pruned to eliminate duplicates Z: 20 42.959 2.077 0.921 0.953 1.000 1.000 CB 1.699 20 residues pruned to eliminate duplicates Z: 35 21.680 1.890 0.495 0.597 1.000 0.706 CB 1.200 35 residues pruned to eliminate duplicates Z: 18 20.176 1.867 0.397 0.902 1.000 0.941 CB 1.339 18 residues pruned to eliminate duplicates Z: 13 24.355 2.195 1.091 0.668 0.917 0.750 CB 1.431 13 residues pruned to eliminate duplicates Z: 10 21.317 2.238 0.887 0.877 0.889 0.778 CB 1.375 10 residues pruned to eliminate duplicates Z: 14 13.424 1.848 0.620 0.585 1.000 0.769 CB 1.146 14 residues pruned to eliminate duplicates Z: 41 45.459 2.326 0.853 0.521 0.925 0.650 CB 1.765 41 residues pruned to eliminate duplicates Z: 18 21.363 1.862 0.670 0.913 1.000 0.824 CB 1.180 18 residues pruned to eliminate duplicates Z: 46 45.190 2.280 0.907 0.615 0.822 0.644 CB 1.690 46 residues pruned to eliminate duplicates Z: 125 80.719 2.343 1.034 0.558 0.895 0.694 CB 1.606 125 residues pruned to eliminate duplicates Z: 108 80.980 2.341 0.995 0.580 0.925 0.626 CB 1.677 108 residues pruned to eliminate duplicates Z: 6 2.457 1.663 0.065 0.480 1.000 0.600 CB 0.633 Z: 23 66.224 2.235 1.485 0.933 1.000 0.773 CB 1.773 23 residues pruned to eliminate duplicates Z: 7 17.815 2.168 0.555 0.862 1.000 0.833 CA 1.584 7 residues pruned to eliminate duplicates Z: 16 17.999 2.016 0.715 0.443 0.800 0.667 CB 1.782 16 residues pruned to eliminate duplicates Z: 26 22.060 1.944 0.824 0.575 0.880 0.640 CB 1.315 26 residues pruned to eliminate duplicates Z: 44 60.022 2.356 1.036 0.685 0.907 0.744 CB 1.775 44 residues pruned to eliminate duplicates Z: 12 11.299 1.800 0.519 0.438 1.000 0.455 CB 1.329 12 residues pruned to eliminate duplicates Z: 74 59.579 2.282 0.875 0.586 0.932 0.671 CB 1.611 74 residues pruned to eliminate duplicates Z: 6 9.445 1.865 0.468 0.678 1.000 0.600 CA 1.310 6 residues pruned to eliminate duplicates Z: 12 15.984 2.106 0.802 0.564 1.000 0.636 CB 1.194 12 residues pruned to eliminate duplicates Z: 67 54.600 2.367 0.951 0.508 0.879 0.652 CB 1.643 67 residues pruned to eliminate duplicates Z: 100 80.542 2.321 1.040 0.607 0.929 0.687 CB 1.661 100 residues pruned to eliminate duplicates Z: 47 33.524 2.126 0.753 0.506 0.891 0.609 CB 1.480 47 residues pruned to eliminate duplicates Z: 6 7.685 1.858 0.405 0.432 1.000 1.000 CB 1.412 Z: 6 3.754 1.883 0.395 0.743 0.600 0.400 CB 0.857 6 residues pruned to eliminate duplicates Z: 19 17.461 1.708 0.447 0.906 1.000 0.944 CB 1.185 19 residues pruned to eliminate duplicates Z: 6 13.012 2.198 0.427 0.817 1.000 0.800 CA 1.409 6 residues pruned to eliminate duplicates Z: 6 9.933 1.660 0.299 0.851 1.000 1.000 CA 1.525 6 residues pruned to eliminate duplicates Z: 13 34.646 2.402 0.976 0.725 0.917 0.833 CA 1.877 13 residues pruned to eliminate duplicates Z: 12 13.739 2.088 0.640 0.529 0.818 0.636 CB 1.437 12 residues pruned to eliminate duplicates Z: 20 17.584 1.957 0.678 0.478 0.842 0.579 CB 1.492 20 residues pruned to eliminate duplicates Z: 7 11.485 1.981 0.869 0.700 0.833 0.833 CB 1.266 7 residues pruned to eliminate duplicates Z: 24 27.969 2.064 0.826 0.696 0.913 0.696 CB 1.418 24 residues pruned to eliminate duplicates Z: 17 18.542 1.943 0.250 0.940 1.000 0.875 CB 1.325 17 residues pruned to eliminate duplicates Z: 29 19.889 1.895 0.626 0.496 0.929 0.607 CB 1.319 29 residues pruned to eliminate duplicates 6 1.695 1.862 0.511 0.281 0.600 0.600 CB 0.575 ? Z: 23 26.250 2.106 0.689 0.604 1.000 0.818 CB 1.425 23 residues pruned to eliminate duplicates Z: 39 28.570 2.077 0.757 0.491 0.895 0.711 CB 1.432 39 residues pruned to eliminate duplicates Z: 172 101.819 2.322 1.053 0.602 0.924 0.690 CB 1.605 178 residues pruned to eliminate duplicates Z: 16 17.262 1.876 0.249 0.921 1.000 1.000 CB 1.338 16 residues pruned to eliminate duplicates Z: 7 2.922 1.631 -0.150 0.599 0.833 0.833 CB 0.939 Z: 9 13.060 2.082 1.034 0.675 0.875 0.625 CB 1.060 9 residues pruned to eliminate duplicates Z: 22 53.450 2.221 1.120 0.917 1.000 0.762 CB 1.748 22 residues pruned to eliminate duplicates Z: 16 10.564 1.757 0.427 0.571 0.933 0.733 CB 1.089 11 residues pruned to eliminate duplicates Z: 11 20.487 1.946 0.731 0.927 1.000 0.900 CB 1.348 11 residues pruned to eliminate duplicates Z: 72 53.136 2.307 0.842 0.539 0.901 0.690 CB 1.584 72 residues pruned to eliminate duplicates Z: 28 30.215 2.109 1.079 0.586 0.852 0.556 CB 1.433 28 residues pruned to eliminate duplicates Z: 11 21.058 1.936 0.672 0.935 1.000 1.000 CB 1.434 11 residues pruned to eliminate duplicates Z: 18 40.153 2.296 1.065 0.908 1.000 0.647 CB 1.459 18 residues pruned to eliminate duplicates Z: 32 40.839 2.135 0.974 0.675 0.968 0.613 CB 1.531 32 residues pruned to eliminate duplicates Z: 31 53.083 2.486 1.161 0.604 0.933 0.733 CB 1.751 31 residues pruned to eliminate duplicates Z: 8 40.088 2.555 1.148 0.895 1.000 1.000 CA 1.978 8 residues pruned to eliminate duplicates Z: 10 12.598 1.987 0.655 0.324 1.000 0.556 CB 1.549 10 residues pruned to eliminate duplicates Z: 22 49.706 2.194 1.012 0.922 1.000 0.857 CB 1.728 22 residues pruned to eliminate duplicates Z: 39 28.281 1.961 0.705 0.635 0.974 0.658 CB 1.241 39 residues pruned to eliminate duplicates Z: 75 51.141 2.181 0.800 0.527 0.905 0.703 CB 1.629 75 residues pruned to eliminate duplicates Z: 22 91.225 2.588 1.654 0.912 1.000 0.667 CB 2.052 22 residues pruned to eliminate duplicates Z: 26 25.216 2.010 0.882 0.620 0.880 0.800 CB 1.352 26 residues pruned to eliminate duplicates Z: 9 33.872 2.404 0.967 0.891 1.000 0.875 CB 1.821 9 residues pruned to eliminate duplicates Z: 12 7.155 1.837 0.605 0.324 0.909 0.455 CB 0.976 12 residues pruned to eliminate duplicates Z: 85 71.844 2.331 0.962 0.619 0.952 0.738 CB 1.608 85 residues pruned to eliminate duplicates Z: 24 42.510 2.041 1.117 0.864 0.957 0.652 CB 1.573 24 residues pruned to eliminate duplicates Z: 16 19.726 1.836 0.596 0.936 1.000 0.867 CB 1.211 16 residues pruned to eliminate duplicates 6 1.780 1.230 -0.049 0.849 1.000 0.800 N 0.504 ? Z: 19 48.023 2.183 1.306 0.945 1.000 0.889 CB 1.556 19 residues pruned to eliminate duplicates Z: 20 23.472 2.159 0.894 0.419 0.895 0.579 CB 1.602 20 residues pruned to eliminate duplicates Z: 36 38.878 2.260 0.814 0.572 0.914 0.714 CB 1.635 36 residues pruned to eliminate duplicates Z: 7 20.616 2.115 0.842 0.769 1.000 0.667 CB 1.704 7 residues pruned to eliminate duplicates Z: 97 68.869 2.301 1.001 0.551 0.927 0.667 CB 1.567 97 residues pruned to eliminate duplicates Z: 70 73.775 2.411 1.055 0.655 0.913 0.681 CB 1.699 70 residues pruned to eliminate duplicates Z: 18 23.197 1.848 0.602 0.914 1.000 0.824 CB 1.345 18 residues pruned to eliminate duplicates Z: 6 3.257 1.632 0.127 0.350 0.800 0.400 C 1.164 Z: 43 34.759 2.010 0.954 0.574 0.905 0.595 CB 1.405 43 residues pruned to eliminate duplicates Z: 9 17.080 1.968 0.523 0.874 1.000 1.000 CB 1.466 9 residues pruned to eliminate duplicates Z: 18 33.036 2.085 0.837 0.872 1.000 0.882 CB 1.524 18 residues pruned to eliminate duplicates Z: 11 16.090 1.928 0.305 0.899 1.000 1.000 CB 1.446 11 residues pruned to eliminate duplicates Z: 38 32.726 2.116 0.761 0.540 0.892 0.676 CB 1.556 38 residues pruned to eliminate duplicates Z: 22 55.047 2.216 1.200 0.915 1.000 0.714 CB 1.741 22 residues pruned to eliminate duplicates Z: 44 62.331 2.243 1.151 0.694 1.000 0.744 CB 1.651 44 residues pruned to eliminate duplicates Z: 13 17.286 1.681 0.921 0.878 0.917 0.833 CA 1.223 13 residues pruned to eliminate duplicates Z: 18 35.007 2.349 0.999 0.579 1.000 0.824 CB 1.675 18 residues pruned to eliminate duplicates Z: 7 14.349 2.124 0.946 0.633 0.833 0.667 CB 1.501 7 residues pruned to eliminate duplicates Z: 6 9.022 1.835 0.368 0.578 1.000 0.400 CB 1.492 6 residues pruned to eliminate duplicates Z: 13 17.767 2.056 0.756 0.491 0.917 0.500 CB 1.563 13 residues pruned to eliminate duplicates Z: 18 11.941 1.740 0.508 0.458 0.941 0.765 CB 1.224 18 residues pruned to eliminate duplicates Z: 22 60.262 2.258 1.321 0.920 1.000 0.952 CB 1.767 22 residues pruned to eliminate duplicates Z: 56 72.408 2.313 1.204 0.665 0.964 0.745 CB 1.706 56 residues pruned to eliminate duplicates Z: 6 10.207 2.011 0.623 0.721 0.800 0.600 CB 1.432 6 residues pruned to eliminate duplicates Z: 18 21.092 1.881 0.426 0.924 1.000 0.882 CB 1.339 18 residues pruned to eliminate duplicates Z: 22 51.308 2.222 1.128 0.917 0.952 0.857 CB 1.754 22 residues pruned to eliminate duplicates Z: 113 77.110 2.315 0.906 0.588 0.938 0.670 CB 1.619 113 residues pruned to eliminate duplicates Z: 52 45.536 2.188 0.857 0.652 0.882 0.706 CB 1.543 52 residues pruned to eliminate duplicates Z: 11 21.038 2.082 0.720 0.649 1.000 0.900 CB 1.617 11 residues pruned to eliminate duplicates Z: 17 23.947 2.145 1.115 0.677 0.812 0.688 CB 1.379 17 residues pruned to eliminate duplicates Z: 8 12.906 1.767 0.695 0.786 1.000 0.857 CA 1.267 8 residues pruned to eliminate duplicates Z: 53 47.300 2.310 0.829 0.539 0.923 0.615 CB 1.619 53 residues pruned to eliminate duplicates Z: 71 66.886 2.314 1.078 0.620 0.914 0.671 CB 1.623 71 residues pruned to eliminate duplicates Z: 40 32.068 2.145 0.771 0.544 0.897 0.718 CB 1.442 40 residues pruned to eliminate duplicates Z: 136 93.283 2.347 0.958 0.594 0.933 0.719 CB 1.712 136 residues pruned to eliminate duplicates Z: 38 31.467 2.176 0.795 0.501 0.892 0.757 CB 1.483 38 residues pruned to eliminate duplicates Z: 18 21.413 1.832 0.745 0.908 1.000 0.706 CB 1.153 18 residues pruned to eliminate duplicates Z: 74 61.604 2.281 0.840 0.613 0.959 0.603 CB 1.610 74 residues pruned to eliminate duplicates Z: 15 21.301 2.353 0.817 0.420 0.857 0.643 CA 1.688 15 residues pruned to eliminate duplicates Z: 18 30.834 1.980 0.870 0.937 1.000 0.882 CB 1.406 18 residues pruned to eliminate duplicates Z: 85 69.758 2.254 0.997 0.589 0.952 0.679 CB 1.631 85 residues pruned to eliminate duplicates Z: 10 20.212 1.945 0.878 0.849 1.000 0.778 CB 1.368 10 residues pruned to eliminate duplicates Z: 18 19.918 1.951 0.225 0.939 1.000 0.941 CB 1.405 18 residues pruned to eliminate duplicates Z: 9 34.207 2.393 1.079 0.855 1.000 0.875 CB 1.794 9 residues pruned to eliminate duplicates Z: 14 18.970 1.986 0.851 0.466 0.923 0.692 CB 1.606 14 residues pruned to eliminate duplicates Z: 21 23.514 2.070 0.785 0.553 0.950 0.800 CB 1.422 21 residues pruned to eliminate duplicates Z: 24 76.395 2.355 1.439 0.938 1.000 0.609 CA 1.929 24 residues pruned to eliminate duplicates Z: 56 70.580 2.291 1.164 0.666 0.982 0.727 CB 1.676 56 residues pruned to eliminate duplicates Z: 9 18.208 1.948 0.877 0.789 0.875 0.500 C 1.561 9 residues pruned to eliminate duplicates Z: 99 65.203 2.331 0.947 0.527 0.908 0.684 CB 1.556 99 residues pruned to eliminate duplicates Z: 15 26.548 2.181 0.914 0.541 0.929 0.571 CB 1.759 15 residues pruned to eliminate duplicates Z: 24 36.986 2.236 1.211 0.569 0.913 0.609 CB 1.598 24 residues pruned to eliminate duplicates Z: 18 38.877 1.983 1.144 0.939 1.000 0.647 CB 1.540 18 residues pruned to eliminate duplicates Z: 13 17.213 1.807 0.418 0.924 1.000 1.000 CA 1.362 13 residues pruned to eliminate duplicates Z: 41 32.290 2.122 0.770 0.564 0.925 0.650 CB 1.381 41 residues pruned to eliminate duplicates Z: 17 28.023 1.928 1.022 0.916 1.000 0.688 CB 1.270 17 residues pruned to eliminate duplicates Z: 18 25.034 2.118 0.737 0.564 0.941 0.706 CA 1.647 18 residues pruned to eliminate duplicates Z: 19 20.433 2.171 0.498 0.526 0.833 0.667 CA 1.732 19 residues pruned to eliminate duplicates Z: 18 25.999 1.865 0.863 0.911 1.000 0.765 CB 1.286 18 residues pruned to eliminate duplicates Z: 37 56.209 2.218 1.042 0.786 0.972 0.778 CB 1.653 37 residues pruned to eliminate duplicates Z: 12 14.796 1.814 0.364 0.926 1.000 1.000 CB 1.265 12 residues pruned to eliminate duplicates Z: 46 58.825 2.218 1.055 0.713 1.000 0.778 CB 1.587 46 residues pruned to eliminate duplicates Z: 13 13.387 1.902 0.626 0.538 0.917 0.750 CB 1.313 13 residues pruned to eliminate duplicates Z: 64 37.321 2.088 0.656 0.568 0.937 0.714 CB 1.360 64 residues pruned to eliminate duplicates Z: 17 36.316 2.129 0.933 0.934 1.000 0.938 CB 1.539 17 residues pruned to eliminate duplicates Z: 22 27.761 2.271 0.799 0.516 0.952 0.714 CB 1.532 22 residues pruned to eliminate duplicates Z: 70 63.038 2.260 0.931 0.644 0.942 0.667 CB 1.613 70 residues pruned to eliminate duplicates Z: 56 66.862 2.325 1.074 0.648 0.964 0.709 CB 1.691 56 residues pruned to eliminate duplicates Z: 9 41.313 2.409 1.255 0.904 1.000 0.875 CA 1.915 9 residues pruned to eliminate duplicates Z: 12 30.031 2.203 0.802 0.901 0.909 0.909 CA 1.791 12 residues pruned to eliminate duplicates Z: 13 34.351 2.367 0.975 0.721 1.000 0.667 CA 1.738 13 residues pruned to eliminate duplicates Z: 37 56.714 2.488 0.902 0.709 0.944 0.667 CB 1.750 37 residues pruned to eliminate duplicates Z: 37 43.488 2.362 0.886 0.534 0.944 0.583 CB 1.666 37 residues pruned to eliminate duplicates Z: 6 3.848 1.810 0.178 0.426 1.000 0.600 CA 0.872 6 residues pruned to eliminate duplicates Z: 17 41.901 2.336 1.043 0.887 1.000 0.562 CB 1.583 17 residues pruned to eliminate duplicates Z: 16 18.359 2.115 0.890 0.293 0.867 0.467 CA 1.726 16 residues pruned to eliminate duplicates Z: 11 17.763 1.863 0.661 0.926 1.000 1.000 CB 1.272 11 residues pruned to eliminate duplicates Z: 17 16.450 1.818 0.337 0.929 1.000 0.875 CB 1.185 17 residues pruned to eliminate duplicates Z: 19 31.759 2.256 0.789 0.633 1.000 0.667 CB 1.637 19 residues pruned to eliminate duplicates Z: 90 62.512 2.244 0.834 0.546 0.933 0.674 CB 1.651 90 residues pruned to eliminate duplicates Z: 17 26.354 2.095 1.026 0.603 0.938 0.750 CB 1.500 17 residues pruned to eliminate duplicates Z: 65 62.158 2.237 1.095 0.591 0.938 0.641 CB 1.621 65 residues pruned to eliminate duplicates Z: 90 79.431 2.382 1.059 0.623 0.921 0.697 CB 1.659 90 residues pruned to eliminate duplicates Z: 10 4.874 1.574 0.263 0.269 0.889 0.333 CB 1.195 Z: 76 55.685 2.309 0.928 0.519 0.907 0.693 CB 1.563 76 residues pruned to eliminate duplicates Z: 7 5.726 1.538 0.843 0.474 0.667 0.500 CA 1.270 7 residues pruned to eliminate duplicates Z: 19 26.178 2.116 0.845 0.489 1.000 0.611 CA 1.599 19 residues pruned to eliminate duplicates Z: 43 60.816 2.217 1.163 0.713 0.976 0.762 CB 1.653 43 residues pruned to eliminate duplicates Z: 18 18.540 1.798 0.563 0.869 1.000 0.824 CB 1.169 18 residues pruned to eliminate duplicates Z: 6 2.907 1.283 0.153 0.622 1.000 0.600 CB 0.783 Z: 23 33.337 2.235 0.841 0.577 0.909 0.682 CB 1.763 23 residues pruned to eliminate duplicates Z: 51 52.287 2.197 0.951 0.681 0.920 0.740 CB 1.588 51 residues pruned to eliminate duplicates Z: 28 45.951 2.229 1.107 0.691 1.000 0.889 CB 1.581 28 residues pruned to eliminate duplicates Z: 42 67.070 2.299 1.340 0.738 0.951 0.780 CB 1.653 42 residues pruned to eliminate duplicates Z: 28 39.090 2.193 0.994 0.668 0.963 0.741 CB 1.530 38 residues pruned to eliminate duplicates Z: 47 46.313 2.278 0.940 0.566 0.891 0.717 CB 1.626 47 residues pruned to eliminate duplicates Z: 28 24.448 2.117 0.705 0.538 0.889 0.704 CB 1.413 28 residues pruned to eliminate duplicates Z: 16 23.815 2.178 0.883 0.558 0.933 0.733 CB 1.518 16 residues pruned to eliminate duplicates Z: 6 6.317 1.642 0.480 0.639 0.800 0.800 C 1.276 6 residues pruned to eliminate duplicates Z: 13 23.200 1.806 0.814 0.940 1.000 0.917 CA 1.420 13 residues pruned to eliminate duplicates Z: 29 26.909 2.006 0.896 0.548 0.929 0.571 CB 1.374 29 residues pruned to eliminate duplicates Z: 31 26.792 1.984 0.719 0.631 1.000 0.633 CB 1.268 31 residues pruned to eliminate duplicates Z: 10 13.148 1.893 0.737 0.533 0.889 0.778 CB 1.452 10 residues pruned to eliminate duplicates Z: 9 18.312 1.826 1.118 0.839 1.000 0.750 CB 1.251 9 residues pruned to eliminate duplicates Z: 17 9.801 1.784 0.493 0.485 0.875 0.625 CB 1.068 17 residues pruned to eliminate duplicates Z: 17 19.554 2.012 0.744 0.651 1.000 0.750 CB 1.210 17 residues pruned to eliminate duplicates Z: 10 13.513 1.900 0.675 0.479 0.889 0.556 CA 1.626 10 residues pruned to eliminate duplicates Z: 67 40.346 2.049 0.748 0.528 0.939 0.682 CB 1.436 67 residues pruned to eliminate duplicates Z: 10 7.962 1.730 0.421 0.429 0.778 0.444 N 1.494 10 residues pruned to eliminate duplicates Z: 6 3.091 1.258 0.235 0.455 1.000 0.600 C 0.933 Z: 6 6.598 1.862 0.149 0.604 1.000 0.600 CA 1.250 6 residues pruned to eliminate duplicates Z: 10 11.586 1.937 0.911 0.486 0.778 0.778 CB 1.360 10 residues pruned to eliminate duplicates Z: 13 17.927 1.790 0.557 0.922 1.000 0.917 CA 1.305 13 residues pruned to eliminate duplicates Z: 22 90.205 2.532 1.619 0.939 1.000 0.905 CB 2.064 22 residues pruned to eliminate duplicates Z: 22 56.764 2.427 1.001 0.877 0.952 0.810 CB 1.945 22 residues pruned to eliminate duplicates Z: 38 44.825 2.413 1.044 0.510 0.892 0.622 CB 1.659 38 residues pruned to eliminate duplicates Z: 18 13.823 1.810 0.026 0.931 1.000 0.882 CB 1.261 18 residues pruned to eliminate duplicates Z: 8 13.010 1.975 1.193 0.484 0.857 0.714 CB 1.347 8 residues pruned to eliminate duplicates Z: 11 19.130 1.861 0.711 0.901 1.000 0.800 CB 1.356 11 residues pruned to eliminate duplicates Z: 54 40.433 2.214 0.676 0.575 0.906 0.717 CB 1.538 54 residues pruned to eliminate duplicates Z: 6 6.464 1.630 0.667 0.676 0.800 0.400 O 1.131 6 residues pruned to eliminate duplicates Z: 74 48.881 2.250 0.634 0.539 0.945 0.699 CB 1.585 74 residues pruned to eliminate duplicates Z: 6 5.719 1.588 0.274 0.833 1.000 0.800 CA 0.948 6 residues pruned to eliminate duplicates Z: 6 4.663 1.612 0.161 0.808 0.800 0.800 CB 1.065 6 residues pruned to eliminate duplicates Z: 56 42.929 2.083 0.855 0.619 0.909 0.709 CB 1.473 56 residues pruned to eliminate duplicates Z: 17 15.500 1.811 0.250 0.919 0.938 0.875 CB 1.286 17 residues pruned to eliminate duplicates Z: 21 91.980 2.641 1.778 0.929 0.950 0.900 CB 2.065 21 residues pruned to eliminate duplicates Z: 9 13.896 1.872 0.802 0.694 0.875 0.750 CB 1.393 9 residues pruned to eliminate duplicates Z: 65 52.322 2.208 0.965 0.573 0.922 0.703 CB 1.524 65 residues pruned to eliminate duplicates Z: 6 12.360 2.311 0.585 0.443 1.000 0.800 CA 1.600 6 residues pruned to eliminate duplicates Z: 16 29.331 2.341 1.021 0.552 0.933 0.667 CB 1.631 16 residues pruned to eliminate duplicates Z: 27 34.041 2.256 0.702 0.575 0.962 0.654 CB 1.682 27 residues pruned to eliminate duplicates Z: 21 15.727 1.868 0.703 0.514 0.900 0.650 CB 1.211 21 residues pruned to eliminate duplicates Z: 6 2.662 1.182 0.518 0.455 0.800 0.400 C 0.868 6 residues pruned to eliminate duplicates Z: 60 48.845 2.327 0.931 0.522 0.881 0.627 CB 1.570 60 residues pruned to eliminate duplicates Z: 22 60.243 2.298 1.364 0.903 0.952 0.667 CB 1.812 22 residues pruned to eliminate duplicates Z: 35 40.100 2.293 0.945 0.517 0.912 0.647 CB 1.662 35 residues pruned to eliminate duplicates Z: 19 15.127 1.765 0.322 0.857 1.000 0.667 CB 1.126 19 residues pruned to eliminate duplicates Z: 6 8.958 1.842 0.684 0.742 1.000 1.000 CB 1.040 6 residues pruned to eliminate duplicates Z: 127 89.147 2.393 0.882 0.589 0.944 0.675 CB 1.714 127 residues pruned to eliminate duplicates Z: 24 19.308 2.063 0.752 0.472 0.826 0.696 CB 1.387 24 residues pruned to eliminate duplicates Z: 35 22.877 1.866 0.829 0.589 0.853 0.647 CB 1.238 35 residues pruned to eliminate duplicates 6 1.741 1.484 0.104 0.296 0.800 0.800 CB 0.746 ? Z: 6 13.171 2.239 0.340 0.762 1.000 0.800 CA 1.554 6 residues pruned to eliminate duplicates Z: 43 42.711 2.277 1.010 0.523 0.905 0.714 CB 1.555 43 residues pruned to eliminate duplicates 662 residues left after pruning, divided into chains as follows: A: 138 B: 9 C: 172 D: 172 E: 171 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 39.97 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.501, Connect. = 0.756 for dens.mod. cycle 1 = 0.300, Contrast = 0.576, Connect. = 0.783 for dens.mod. cycle 2 = 0.300, Contrast = 0.698, Connect. = 0.812 for dens.mod. cycle 3 = 0.300, Contrast = 0.715, Connect. = 0.815 for dens.mod. cycle 4 = 0.300, Contrast = 0.733, Connect. = 0.818 for dens.mod. cycle 5 = 0.300, Contrast = 0.743, Connect. = 0.819 for dens.mod. cycle 6 = 0.300, Contrast = 0.752, Connect. = 0.821 for dens.mod. cycle 7 = 0.300, Contrast = 0.758, Connect. = 0.821 for dens.mod. cycle 8 = 0.300, Contrast = 0.764, Connect. = 0.822 for dens.mod. cycle 9 = 0.300, Contrast = 0.768, Connect. = 0.823 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4056 peaks > 0.5 sigma used to seed fragment search Space for about 886 unique residues taking solvent into account 847 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 25 65.264 2.348 1.054 0.922 1.000 0.875 C 1.943 B: 34 46.410 2.506 1.045 0.579 0.818 0.515 CB 1.786 C: 22 77.167 2.712 1.022 0.920 1.000 0.857 CB 2.162 D: 24 76.233 2.528 1.326 0.919 0.957 0.783 CB 1.991 23 residues pruned to eliminate duplicates E: 9 27.390 2.430 0.895 0.765 0.875 0.625 CB 1.900 F: 7 13.423 2.193 0.919 0.578 0.667 0.333 CB 1.811 7 residues pruned to eliminate duplicates G: 10 34.086 2.495 1.282 0.786 0.889 0.667 CB 1.746 H: 24 58.078 2.419 0.908 0.889 0.957 0.783 CA 1.975 24 residues pruned to eliminate duplicates I: 21 76.138 2.621 1.239 0.910 0.950 0.850 CB 2.166 21 residues pruned to eliminate duplicates J: 120 68.674 2.370 0.791 0.531 0.874 0.664 CB 1.646 34 residues pruned to eliminate duplicates K: 22 77.442 2.624 1.069 0.924 1.000 0.762 C 2.186 25 residues pruned to eliminate duplicates L: 24 82.469 2.546 1.282 0.911 1.000 0.783 C 2.097 24 residues pruned to eliminate duplicates M: 11 31.473 2.356 1.031 0.750 0.900 0.500 CB 1.849 10 residues pruned to eliminate duplicates N: 8 33.866 2.629 0.690 0.898 1.000 1.000 CB 2.061 8 residues pruned to eliminate duplicates O: 24 77.569 2.548 1.217 0.923 0.957 0.783 C 2.104 24 residues pruned to eliminate duplicates P: 23 73.502 2.517 1.082 0.938 1.000 0.909 CA 2.080 23 residues pruned to eliminate duplicates Q: 10 27.847 2.321 1.041 0.799 0.889 0.778 CA 1.696 9 residues pruned to eliminate duplicates R: 10 27.484 2.314 1.003 0.767 0.889 0.889 CA 1.755 10 residues pruned to eliminate duplicates S: 10 33.781 2.526 1.241 0.867 0.889 0.667 CB 1.637 11 residues pruned to eliminate duplicates T: 10 32.004 2.574 0.741 0.811 1.000 0.778 CB 1.816 10 residues pruned to eliminate duplicates U: 31 59.972 2.345 0.873 0.825 1.000 0.833 CB 1.882 V: 10 21.925 2.223 0.952 0.728 0.778 0.667 CA 1.763 W: 9 19.179 2.065 0.597 0.817 1.000 0.875 CA 1.562 X: 38 48.819 2.201 0.813 0.754 0.946 0.703 CB 1.696 38 residues pruned to eliminate duplicates Y: 47 55.020 2.497 1.002 0.501 0.913 0.587 CB 1.777 46 residues pruned to eliminate duplicates Z: 12 30.140 2.567 0.477 0.766 1.000 0.909 CB 1.894 12 residues pruned to eliminate duplicates Z: 22 79.990 2.713 1.108 0.923 1.000 0.952 CB 2.145 23 residues pruned to eliminate duplicates Z: 22 69.929 2.684 0.902 0.933 1.000 0.952 CB 2.087 22 residues pruned to eliminate duplicates Z: 20 30.527 2.255 0.992 0.522 0.947 0.474 CB 1.610 Z: 10 17.273 1.953 0.667 0.799 0.889 0.556 C 1.532 11 residues pruned to eliminate duplicates Z: 10 25.346 2.366 0.546 0.861 0.889 0.667 CA 1.908 10 residues pruned to eliminate duplicates Z: 23 66.942 2.594 0.938 0.914 0.955 0.773 CB 2.102 23 residues pruned to eliminate duplicates Z: 22 69.087 2.608 0.853 0.918 1.000 0.810 C 2.200 22 residues pruned to eliminate duplicates Z: 12 38.731 2.394 0.857 0.883 1.000 0.818 CB 1.900 12 residues pruned to eliminate duplicates Z: 67 83.285 2.461 1.110 0.662 0.955 0.712 CB 1.779 32 residues pruned to eliminate duplicates Z: 59 85.935 2.529 1.038 0.628 0.983 0.672 CB 1.976 58 residues pruned to eliminate duplicates Z: 23 48.465 2.524 0.664 0.905 0.864 0.773 CB 2.027 23 residues pruned to eliminate duplicates Z: 10 27.049 2.322 0.710 0.860 0.889 0.778 CA 1.878 10 residues pruned to eliminate duplicates Z: 9 20.260 2.106 0.729 0.775 1.000 0.875 CB 1.542 9 residues pruned to eliminate duplicates Z: 11 31.181 2.470 0.783 0.717 1.000 0.600 CB 1.840 Z: 31 39.097 2.397 0.841 0.502 0.900 0.600 CB 1.794 31 residues pruned to eliminate duplicates Z: 23 59.373 2.486 0.752 0.909 1.000 0.818 CA 2.063 23 residues pruned to eliminate duplicates Z: 63 82.683 2.542 0.985 0.655 0.952 0.645 CB 1.894 63 residues pruned to eliminate duplicates Z: 10 40.343 2.250 1.396 0.912 1.000 1.000 CB 1.766 Z: 47 27.765 2.099 0.445 0.503 0.913 0.630 CB 1.474 Z: 22 74.493 2.721 0.959 0.925 1.000 0.905 CB 2.141 22 residues pruned to eliminate duplicates Z: 14 23.770 2.291 0.467 0.822 0.846 0.769 C 1.753 14 residues pruned to eliminate duplicates Z: 51 64.093 2.421 0.904 0.678 0.940 0.760 CB 1.776 51 residues pruned to eliminate duplicates Z: 23 52.445 2.565 0.608 0.921 0.909 0.864 CB 2.099 23 residues pruned to eliminate duplicates Z: 12 35.270 2.480 0.823 0.828 0.909 0.909 CB 1.948 12 residues pruned to eliminate duplicates Z: 11 26.834 2.198 0.740 0.873 1.000 0.800 CB 1.617 11 residues pruned to eliminate duplicates Z: 11 34.689 2.514 0.826 0.766 1.000 0.800 CB 1.887 11 residues pruned to eliminate duplicates Z: 47 48.766 2.481 0.818 0.501 0.957 0.565 CB 1.665 47 residues pruned to eliminate duplicates Z: 10 20.880 2.361 0.313 0.868 0.889 0.889 CA 1.845 10 residues pruned to eliminate duplicates Z: 22 75.179 2.707 0.973 0.932 1.000 0.952 CB 2.144 22 residues pruned to eliminate duplicates Z: 13 26.095 2.005 0.683 0.866 1.000 0.833 C 1.634 13 residues pruned to eliminate duplicates Z: 23 61.791 2.526 0.825 0.919 0.955 0.864 C 2.109 23 residues pruned to eliminate duplicates Z: 9 20.288 2.103 0.662 0.847 1.000 0.750 CB 1.524 9 residues pruned to eliminate duplicates Z: 12 26.897 2.371 0.869 0.722 0.818 0.545 CB 1.830 Z: 32 51.472 2.480 1.123 0.566 0.935 0.677 CB 1.760 32 residues pruned to eliminate duplicates Z: 19 26.639 2.365 0.221 0.864 1.000 0.889 CB 1.594 19 residues pruned to eliminate duplicates Z: 9 18.581 2.345 0.176 0.871 0.875 0.750 N 1.987 9 residues pruned to eliminate duplicates Z: 8 29.886 2.628 0.543 0.876 1.000 0.857 CB 2.024 8 residues pruned to eliminate duplicates Z: 9 17.308 1.973 0.416 0.855 1.000 0.625 CB 1.616 9 residues pruned to eliminate duplicates Z: 18 35.044 2.401 0.559 0.902 1.000 0.941 CB 1.619 18 residues pruned to eliminate duplicates Z: 24 42.668 2.227 0.668 0.902 0.957 0.870 CB 1.786 Z: 24 72.980 2.433 1.249 0.928 1.000 0.783 CB 1.948 24 residues pruned to eliminate duplicates Z: 9 17.564 2.119 0.608 0.831 0.875 0.750 CB 1.565 Z: 20 52.214 2.487 0.673 0.920 1.000 0.895 CB 2.027 20 residues pruned to eliminate duplicates Z: 39 45.699 2.432 0.935 0.515 0.921 0.553 CB 1.684 39 residues pruned to eliminate duplicates Z: 22 56.164 2.296 1.075 0.908 1.000 0.857 CB 1.827 22 residues pruned to eliminate duplicates Z: 68 80.983 2.493 0.955 0.667 0.970 0.687 CB 1.792 68 residues pruned to eliminate duplicates Z: 23 69.956 2.489 1.251 0.888 0.955 0.773 C 2.009 23 residues pruned to eliminate duplicates Z: 10 29.638 2.268 0.631 0.891 1.000 0.778 CB 1.919 10 residues pruned to eliminate duplicates Z: 7 9.394 2.228 0.419 0.747 0.667 0.667 CA 1.459 7 residues pruned to eliminate duplicates Z: 9 21.128 2.051 0.626 0.836 1.000 0.875 C 1.677 9 residues pruned to eliminate duplicates Z: 14 8.574 1.847 0.531 0.354 0.692 0.615 CB 1.422 Z: 12 32.541 2.500 0.800 0.746 0.909 0.727 CB 1.925 11 residues pruned to eliminate duplicates Z: 66 43.566 2.285 0.566 0.529 0.908 0.631 CB 1.617 63 residues pruned to eliminate duplicates Z: 10 18.579 2.012 0.712 0.790 1.000 0.667 CB 1.394 9 residues pruned to eliminate duplicates Z: 39 38.382 2.264 0.877 0.533 0.895 0.684 CB 1.586 19 residues pruned to eliminate duplicates Z: 91 59.648 2.407 0.721 0.500 0.922 0.633 CB 1.646 91 residues pruned to eliminate duplicates Z: 10 18.874 2.196 0.445 0.811 0.889 0.778 CB 1.700 10 residues pruned to eliminate duplicates Z: 12 29.042 2.217 0.682 0.905 1.000 0.909 CA 1.672 12 residues pruned to eliminate duplicates Z: 11 34.876 2.238 1.362 0.778 1.000 0.600 CB 1.632 10 residues pruned to eliminate duplicates Z: 9 13.415 2.106 0.466 0.762 0.875 0.750 CB 1.391 9 residues pruned to eliminate duplicates Z: 23 76.131 2.605 1.210 0.911 0.955 0.818 CB 2.094 23 residues pruned to eliminate duplicates Z: 9 48.889 2.662 1.581 0.857 1.000 0.875 CB 1.854 9 residues pruned to eliminate duplicates Z: 12 38.572 2.420 0.996 0.756 1.000 0.818 C 1.916 12 residues pruned to eliminate duplicates Z: 134 94.178 2.421 0.848 0.608 0.940 0.737 CB 1.754 79 residues pruned to eliminate duplicates Z: 22 72.917 2.611 0.989 0.924 1.000 0.762 C 2.151 22 residues pruned to eliminate duplicates Z: 18 33.604 2.338 0.496 0.904 0.941 0.941 CB 1.763 18 residues pruned to eliminate duplicates Z: 38 28.470 2.126 0.680 0.557 0.838 0.676 CB 1.480 Z: 7 13.019 2.133 0.387 0.847 0.833 0.667 CB 1.600 7 residues pruned to eliminate duplicates Z: 23 44.516 2.331 0.528 0.920 1.000 0.955 CB 1.877 24 residues pruned to eliminate duplicates Z: 23 55.486 2.307 1.125 0.916 0.955 0.818 CB 1.786 23 residues pruned to eliminate duplicates Z: 9 26.528 2.379 0.641 0.904 1.000 1.000 CB 1.711 9 residues pruned to eliminate duplicates Z: 6 5.789 2.188 0.426 0.776 0.400 0.400 CA 1.626 6 residues pruned to eliminate duplicates Z: 20 38.426 2.184 0.748 0.899 0.947 0.842 CB 1.743 20 residues pruned to eliminate duplicates Z: 9 20.251 2.044 0.697 0.806 1.000 1.000 CA 1.580 9 residues pruned to eliminate duplicates Z: 23 56.189 2.503 0.706 0.910 0.955 0.818 CB 2.084 23 residues pruned to eliminate duplicates Z: 23 50.292 2.316 0.869 0.917 0.955 0.773 CB 1.832 23 residues pruned to eliminate duplicates Z: 23 73.551 2.502 1.124 0.909 1.000 0.773 CB 2.094 23 residues pruned to eliminate duplicates Z: 14 25.673 2.208 0.965 0.720 1.000 0.692 CB 1.345 14 residues pruned to eliminate duplicates Z: 22 47.049 2.281 0.754 0.898 1.000 0.810 CA 1.836 22 residues pruned to eliminate duplicates Z: 22 76.596 2.600 1.257 0.930 0.952 0.857 CB 2.091 22 residues pruned to eliminate duplicates Z: 45 39.805 2.251 0.627 0.554 0.932 0.659 CB 1.668 45 residues pruned to eliminate duplicates Z: 35 46.944 2.443 0.978 0.543 0.912 0.618 CB 1.752 35 residues pruned to eliminate duplicates Z: 75 33.708 2.088 0.538 0.515 0.892 0.716 CB 1.348 10 residues pruned to eliminate duplicates Z: 156 98.504 2.358 0.870 0.598 0.948 0.684 CB 1.723 155 residues pruned to eliminate duplicates Z: 13 33.900 2.160 0.991 0.916 1.000 0.833 CA 1.608 18 residues pruned to eliminate duplicates Z: 23 45.251 2.305 0.711 0.911 0.955 0.864 CB 1.816 23 residues pruned to eliminate duplicates Z: 23 54.688 2.344 0.860 0.922 1.000 0.909 CB 1.882 24 residues pruned to eliminate duplicates Z: 70 60.967 2.306 0.931 0.612 0.899 0.623 CB 1.650 53 residues pruned to eliminate duplicates Z: 66 58.258 2.437 0.797 0.532 0.923 0.646 CB 1.733 66 residues pruned to eliminate duplicates Z: 10 15.845 1.947 0.653 0.788 0.889 0.667 CA 1.434 10 residues pruned to eliminate duplicates Z: 18 35.437 2.475 0.431 0.864 1.000 0.706 CB 1.780 18 residues pruned to eliminate duplicates Z: 11 29.026 2.466 0.555 0.740 1.000 0.900 CB 1.931 11 residues pruned to eliminate duplicates Z: 19 31.285 2.270 0.516 0.831 1.000 0.667 CB 1.611 19 residues pruned to eliminate duplicates Z: 24 74.161 2.503 1.165 0.912 1.000 0.826 CB 2.021 24 residues pruned to eliminate duplicates Z: 10 31.656 2.358 1.127 0.818 0.889 0.889 CA 1.795 10 residues pruned to eliminate duplicates Z: 23 46.427 2.209 0.841 0.918 1.000 0.727 CB 1.717 23 residues pruned to eliminate duplicates Z: 70 73.716 2.371 0.973 0.655 0.942 0.696 CB 1.743 69 residues pruned to eliminate duplicates Z: 11 28.819 2.139 0.844 0.837 1.000 0.700 CA 1.728 11 residues pruned to eliminate duplicates Z: 9 14.507 2.096 0.722 0.735 0.875 0.625 CB 1.315 9 residues pruned to eliminate duplicates Z: 8 17.244 2.304 0.412 0.858 0.857 0.857 CB 1.721 8 residues pruned to eliminate duplicates Z: 10 21.772 2.386 0.262 0.872 0.889 0.889 CA 1.976 10 residues pruned to eliminate duplicates Z: 23 61.078 2.330 1.088 0.923 1.000 0.909 CB 1.881 23 residues pruned to eliminate duplicates Z: 19 35.447 2.394 0.539 0.876 0.944 0.944 CB 1.745 19 residues pruned to eliminate duplicates Z: 25 65.580 2.349 1.159 0.876 1.000 0.750 CB 1.918 25 residues pruned to eliminate duplicates Z: 23 46.681 2.301 0.810 0.909 0.955 0.864 CB 1.776 23 residues pruned to eliminate duplicates Z: 22 65.350 2.565 0.849 0.916 1.000 0.857 C 2.124 22 residues pruned to eliminate duplicates Z: 23 50.387 2.310 0.770 0.939 1.000 0.909 CB 1.825 23 residues pruned to eliminate duplicates Z: 10 20.176 2.202 0.624 0.825 0.778 0.667 CB 1.826 10 residues pruned to eliminate duplicates Z: 85 59.215 2.273 0.724 0.592 0.929 0.631 CB 1.626 88 residues pruned to eliminate duplicates Z: 9 22.270 2.125 0.895 0.821 0.875 0.875 CA 1.691 9 residues pruned to eliminate duplicates Z: 14 30.832 2.320 1.071 0.576 0.923 0.538 CB 1.793 14 residues pruned to eliminate duplicates Z: 129 82.390 2.309 0.862 0.589 0.930 0.680 CB 1.674 119 residues pruned to eliminate duplicates Z: 68 56.462 2.382 0.818 0.493 0.940 0.612 CB 1.706 68 residues pruned to eliminate duplicates Z: 10 19.794 2.028 0.662 0.892 1.000 0.889 CB 1.407 10 residues pruned to eliminate duplicates Z: 64 38.923 2.267 0.451 0.549 0.889 0.571 CB 1.599 64 residues pruned to eliminate duplicates Z: 18 39.817 2.466 0.648 0.874 1.000 0.824 CB 1.729 18 residues pruned to eliminate duplicates Z: 34 36.759 2.219 0.770 0.538 0.939 0.697 CB 1.671 34 residues pruned to eliminate duplicates Z: 108 70.586 2.318 0.861 0.564 0.888 0.701 CB 1.674 109 residues pruned to eliminate duplicates Z: 19 21.850 2.214 1.019 0.493 0.833 0.667 CB 1.393 19 residues pruned to eliminate duplicates Z: 16 21.842 2.302 0.777 0.534 0.800 0.533 CB 1.667 Z: 91 72.128 2.373 0.926 0.571 0.933 0.744 CB 1.664 92 residues pruned to eliminate duplicates Z: 12 34.531 2.381 0.858 0.807 1.000 0.636 CB 1.801 12 residues pruned to eliminate duplicates Z: 25 78.414 2.435 1.344 0.922 1.000 0.875 C 1.972 25 residues pruned to eliminate duplicates Z: 13 24.433 2.112 0.561 0.850 0.917 0.667 CA 1.729 13 residues pruned to eliminate duplicates Z: 13 24.554 2.227 1.224 0.574 0.833 0.750 CB 1.599 16 residues pruned to eliminate duplicates Z: 21 68.412 2.682 0.905 0.918 1.000 0.950 CB 2.112 21 residues pruned to eliminate duplicates Z: 9 15.940 1.924 0.700 0.891 0.875 0.875 CB 1.416 9 residues pruned to eliminate duplicates Z: 69 78.707 2.367 0.989 0.662 0.985 0.765 CB 1.770 55 residues pruned to eliminate duplicates Z: 9 21.467 2.072 0.896 0.802 0.875 0.625 CB 1.696 9 residues pruned to eliminate duplicates Z: 21 28.930 2.040 0.436 0.929 1.000 0.900 CA 1.545 21 residues pruned to eliminate duplicates Z: 9 30.857 2.576 0.825 0.867 0.875 0.875 CA 1.940 9 residues pruned to eliminate duplicates Z: 22 46.216 2.291 0.702 0.902 1.000 0.857 CB 1.844 22 residues pruned to eliminate duplicates Z: 40 46.110 2.222 0.804 0.697 0.974 0.718 CB 1.580 40 residues pruned to eliminate duplicates Z: 45 36.265 2.378 0.660 0.411 0.909 0.568 CB 1.673 45 residues pruned to eliminate duplicates Z: 91 76.262 2.312 0.963 0.632 0.922 0.700 CB 1.696 40 residues pruned to eliminate duplicates Z: 85 74.166 2.486 0.866 0.596 0.929 0.702 CB 1.714 85 residues pruned to eliminate duplicates Z: 9 18.731 2.061 0.757 0.793 1.000 0.750 CB 1.415 9 residues pruned to eliminate duplicates Z: 10 43.970 2.567 1.319 0.796 1.000 0.667 CB 1.900 10 residues pruned to eliminate duplicates Z: 10 16.038 2.077 0.516 0.735 0.778 0.778 CA 1.768 10 residues pruned to eliminate duplicates Z: 57 38.521 2.156 0.600 0.614 0.929 0.786 CB 1.441 57 residues pruned to eliminate duplicates Z: 18 37.502 2.361 0.522 0.932 1.000 0.824 CB 1.767 18 residues pruned to eliminate duplicates Z: 22 52.964 2.382 0.895 0.902 0.952 0.810 CB 1.918 22 residues pruned to eliminate duplicates Z: 34 48.535 2.405 0.911 0.568 0.970 0.727 CB 1.774 33 residues pruned to eliminate duplicates Z: 12 24.165 2.338 0.491 0.782 1.000 0.909 CB 1.629 12 residues pruned to eliminate duplicates Z: 18 31.425 2.447 0.307 0.894 1.000 0.882 CB 1.711 18 residues pruned to eliminate duplicates Z: 9 15.754 1.996 0.491 0.853 0.875 0.875 CA 1.581 9 residues pruned to eliminate duplicates Z: 44 40.385 2.318 0.573 0.539 1.000 0.721 CB 1.625 44 residues pruned to eliminate duplicates Z: 23 45.705 2.293 0.696 0.921 1.000 0.864 CB 1.764 23 residues pruned to eliminate duplicates Z: 20 30.150 2.195 0.677 0.707 0.947 0.842 CB 1.642 20 residues pruned to eliminate duplicates Z: 12 34.828 2.333 0.816 0.911 1.000 0.818 CA 1.757 12 residues pruned to eliminate duplicates Z: 89 55.750 2.223 0.730 0.539 0.943 0.693 CB 1.578 98 residues pruned to eliminate duplicates Z: 7 11.544 1.936 0.493 0.665 1.000 0.667 CA 1.400 7 residues pruned to eliminate duplicates Z: 124 84.709 2.422 0.922 0.545 0.943 0.667 CB 1.665 121 residues pruned to eliminate duplicates Z: 9 18.225 1.996 0.676 0.854 1.000 0.750 CB 1.423 9 residues pruned to eliminate duplicates Z: 42 43.612 2.306 1.052 0.576 0.854 0.683 CB 1.567 34 residues pruned to eliminate duplicates Z: 18 32.781 2.102 0.566 0.929 1.000 0.824 CB 1.690 18 residues pruned to eliminate duplicates Z: 13 26.289 2.124 0.540 0.911 1.000 1.000 CA 1.645 13 residues pruned to eliminate duplicates Z: 22 43.314 2.370 0.504 0.908 1.000 0.905 CB 1.884 22 residues pruned to eliminate duplicates Z: 22 62.195 2.409 1.048 0.913 1.000 0.762 CB 1.948 22 residues pruned to eliminate duplicates Z: 44 40.447 2.356 0.668 0.548 0.907 0.651 CB 1.651 44 residues pruned to eliminate duplicates Z: 40 41.165 2.277 0.750 0.585 0.949 0.769 CB 1.607 40 residues pruned to eliminate duplicates Z: 10 20.030 2.539 0.669 0.654 0.778 0.667 CB 1.754 10 residues pruned to eliminate duplicates Z: 23 56.086 2.325 0.935 0.904 1.000 0.818 CA 1.893 23 residues pruned to eliminate duplicates Z: 18 23.346 2.111 0.260 0.880 0.941 0.941 CB 1.640 18 residues pruned to eliminate duplicates Z: 9 16.011 2.033 0.479 0.888 1.000 0.875 CB 1.356 9 residues pruned to eliminate duplicates Z: 68 84.914 2.405 1.188 0.624 0.955 0.687 CB 1.835 68 residues pruned to eliminate duplicates Z: 9 19.674 2.070 0.750 0.820 1.000 0.875 CB 1.455 9 residues pruned to eliminate duplicates Z: 18 32.694 2.092 0.642 0.927 1.000 1.000 CB 1.618 18 residues pruned to eliminate duplicates Z: 10 17.833 2.145 0.496 0.810 0.778 0.667 CB 1.818 10 residues pruned to eliminate duplicates Z: 10 18.235 2.074 0.965 0.813 0.778 0.667 CB 1.460 10 residues pruned to eliminate duplicates Z: 43 39.908 2.179 1.098 0.557 0.881 0.595 CB 1.446 43 residues pruned to eliminate duplicates Z: 21 43.474 2.245 0.820 0.883 0.950 0.850 CB 1.811 21 residues pruned to eliminate duplicates Z: 23 41.282 2.287 0.648 0.923 0.909 0.773 CB 1.806 23 residues pruned to eliminate duplicates Z: 8 31.040 2.380 0.864 0.898 1.000 1.000 CA 1.892 8 residues pruned to eliminate duplicates Z: 24 42.833 2.122 0.914 0.923 0.957 0.826 CA 1.615 24 residues pruned to eliminate duplicates Z: 32 39.122 2.371 0.844 0.461 0.903 0.677 CB 1.850 32 residues pruned to eliminate duplicates Z: 21 15.247 2.045 0.548 0.473 0.850 0.650 CB 1.302 21 residues pruned to eliminate duplicates Z: 24 40.457 2.202 0.679 0.908 0.957 0.913 CB 1.694 24 residues pruned to eliminate duplicates Z: 34 38.572 2.232 0.654 0.538 0.970 0.727 CB 1.806 34 residues pruned to eliminate duplicates Z: 128 84.599 2.303 0.823 0.619 0.953 0.685 CB 1.677 133 residues pruned to eliminate duplicates Z: 9 17.751 2.007 0.389 0.820 1.000 0.750 C 1.705 9 residues pruned to eliminate duplicates Z: 38 50.651 2.263 0.865 0.748 0.892 0.784 CB 1.773 38 residues pruned to eliminate duplicates Z: 25 38.770 2.407 1.038 0.622 0.875 0.542 CB 1.644 25 residues pruned to eliminate duplicates Z: 34 28.350 2.203 0.688 0.496 0.909 0.727 CB 1.466 34 residues pruned to eliminate duplicates Z: 49 55.966 2.326 0.787 0.671 0.938 0.812 CB 1.770 49 residues pruned to eliminate duplicates Z: 23 63.235 2.572 0.882 0.913 0.955 0.864 CB 2.065 23 residues pruned to eliminate duplicates Z: 33 33.865 2.282 0.691 0.476 0.844 0.625 CA 1.884 33 residues pruned to eliminate duplicates Z: 18 30.153 2.125 0.469 0.910 1.000 0.882 CB 1.662 18 residues pruned to eliminate duplicates Z: 37 52.551 2.307 0.832 0.779 0.917 0.806 CB 1.768 31 residues pruned to eliminate duplicates Z: 10 19.090 2.050 0.794 0.881 0.889 0.778 CB 1.410 10 residues pruned to eliminate duplicates Z: 11 28.824 2.221 1.146 0.879 1.000 0.700 CB 1.387 11 residues pruned to eliminate duplicates Z: 22 47.672 2.384 0.722 0.912 0.952 0.857 CB 1.885 22 residues pruned to eliminate duplicates Z: 22 44.575 2.247 0.729 0.897 1.000 0.810 CB 1.792 22 residues pruned to eliminate duplicates Z: 13 40.480 2.128 1.220 0.920 1.000 0.583 CA 1.741 13 residues pruned to eliminate duplicates Z: 20 60.330 2.589 0.803 0.925 0.947 0.895 CA 2.195 20 residues pruned to eliminate duplicates Z: 24 83.503 2.504 1.419 0.918 1.000 0.783 CB 2.027 24 residues pruned to eliminate duplicates Z: 62 48.187 2.243 0.730 0.531 0.934 0.639 CB 1.650 62 residues pruned to eliminate duplicates Z: 7 30.991 2.559 0.683 0.885 1.000 1.000 CA 2.121 7 residues pruned to eliminate duplicates Z: 23 55.464 2.295 1.122 0.915 0.955 0.818 CB 1.797 23 residues pruned to eliminate duplicates Z: 38 33.235 2.232 0.810 0.572 0.838 0.541 CB 1.506 38 residues pruned to eliminate duplicates Z: 6 9.968 2.190 0.170 0.804 0.800 0.600 CA 1.668 6 residues pruned to eliminate duplicates Z: 13 36.276 2.408 1.052 0.776 0.917 0.833 CB 1.812 13 residues pruned to eliminate duplicates Z: 23 83.401 2.590 1.446 0.905 0.955 0.682 CB 2.094 23 residues pruned to eliminate duplicates Z: 38 42.273 2.223 0.885 0.579 0.919 0.730 CB 1.673 38 residues pruned to eliminate duplicates Z: 65 51.586 2.345 0.677 0.552 0.938 0.703 CB 1.663 65 residues pruned to eliminate duplicates Z: 37 54.484 2.306 0.920 0.747 0.944 0.722 CB 1.742 37 residues pruned to eliminate duplicates Z: 23 39.317 2.319 1.067 0.648 0.909 0.773 CB 1.675 23 residues pruned to eliminate duplicates Z: 10 22.165 2.075 0.723 0.924 1.000 1.000 CB 1.452 10 residues pruned to eliminate duplicates Z: 11 20.898 2.046 0.490 0.925 1.000 1.000 CB 1.521 11 residues pruned to eliminate duplicates Z: 23 56.513 2.499 0.745 0.922 1.000 0.909 CB 1.943 23 residues pruned to eliminate duplicates Z: 18 45.317 2.461 0.797 0.890 1.000 0.706 CB 1.788 18 residues pruned to eliminate duplicates Z: 11 23.075 2.164 1.113 0.753 1.000 0.700 CB 1.274 11 residues pruned to eliminate duplicates Z: 23 44.547 2.179 0.862 0.899 1.000 0.864 CB 1.672 23 residues pruned to eliminate duplicates Z: 9 24.887 2.346 0.557 0.869 1.000 1.000 CB 1.761 9 residues pruned to eliminate duplicates Z: 23 48.655 2.310 0.740 0.924 1.000 0.909 CA 1.812 23 residues pruned to eliminate duplicates Z: 10 22.748 2.143 0.782 0.922 1.000 1.000 CB 1.396 10 residues pruned to eliminate duplicates Z: 24 54.027 2.246 1.054 0.925 0.957 0.826 CB 1.791 24 residues pruned to eliminate duplicates Z: 29 36.523 2.467 0.880 0.464 0.821 0.536 CB 1.879 29 residues pruned to eliminate duplicates Z: 44 45.545 2.111 0.865 0.683 0.977 0.744 CB 1.527 44 residues pruned to eliminate duplicates Z: 37 46.467 2.258 0.695 0.784 0.944 0.833 CB 1.669 37 residues pruned to eliminate duplicates Z: 20 35.332 2.297 0.555 0.859 1.000 0.789 CB 1.670 20 residues pruned to eliminate duplicates Z: 7 6.672 1.653 0.269 0.672 1.000 0.833 CA 1.108 7 residues pruned to eliminate duplicates Z: 18 30.780 2.069 0.577 0.914 1.000 1.000 CB 1.618 18 residues pruned to eliminate duplicates Z: 21 40.404 2.166 0.849 0.893 0.950 0.950 CA 1.705 21 residues pruned to eliminate duplicates Z: 23 48.572 2.326 0.681 0.922 1.000 0.955 CB 1.862 23 residues pruned to eliminate duplicates Z: 20 31.576 2.210 0.547 0.846 0.947 0.842 CB 1.662 20 residues pruned to eliminate duplicates Z: 22 62.863 2.515 1.007 0.886 0.952 0.857 C 2.058 22 residues pruned to eliminate duplicates Z: 18 17.378 1.863 0.135 0.932 1.000 0.824 CB 1.392 18 residues pruned to eliminate duplicates Z: 13 20.073 1.878 0.669 0.905 0.917 0.917 CA 1.435 13 residues pruned to eliminate duplicates Z: 12 11.611 1.944 0.673 0.471 0.909 0.636 CB 1.219 12 residues pruned to eliminate duplicates Z: 23 62.418 2.483 0.874 0.930 1.000 0.818 CB 2.000 23 residues pruned to eliminate duplicates Z: 37 17.755 1.870 0.380 0.473 0.944 0.639 CB 1.247 35 residues pruned to eliminate duplicates Z: 11 11.426 2.188 0.659 0.422 0.700 0.400 CB 1.543 11 residues pruned to eliminate duplicates Z: 13 20.417 1.843 0.600 0.922 1.000 0.917 CA 1.406 13 residues pruned to eliminate duplicates Z: 19 18.595 2.219 0.805 0.460 0.889 0.556 CB 1.282 19 residues pruned to eliminate duplicates Z: 32 35.145 2.418 0.530 0.578 0.935 0.677 CB 1.692 32 residues pruned to eliminate duplicates Z: 33 23.141 1.956 0.637 0.479 0.875 0.594 CB 1.491 33 residues pruned to eliminate duplicates Z: 22 87.798 2.607 1.390 0.933 1.000 0.714 C 2.145 22 residues pruned to eliminate duplicates Z: 22 43.271 2.373 0.566 0.920 0.952 0.905 CB 1.879 22 residues pruned to eliminate duplicates Z: 10 16.798 2.295 0.259 0.833 0.889 0.889 CB 1.635 10 residues pruned to eliminate duplicates Z: 9 24.120 2.241 0.794 0.880 1.000 0.875 CB 1.537 9 residues pruned to eliminate duplicates Z: 43 32.046 2.448 0.534 0.399 0.857 0.619 CB 1.710 43 residues pruned to eliminate duplicates Z: 19 42.612 2.343 0.859 0.878 1.000 0.611 CB 1.673 19 residues pruned to eliminate duplicates Z: 11 21.350 2.044 0.516 0.908 1.000 1.000 CB 1.547 11 residues pruned to eliminate duplicates Z: 22 18.814 2.240 0.748 0.515 0.762 0.571 CB 1.355 22 residues pruned to eliminate duplicates Z: 45 37.071 2.220 0.686 0.479 0.955 0.523 CB 1.597 45 residues pruned to eliminate duplicates Z: 6 10.615 2.315 -0.055 0.799 1.000 0.600 CB 1.670 6 residues pruned to eliminate duplicates Z: 96 73.505 2.371 0.963 0.550 0.926 0.716 CB 1.666 96 residues pruned to eliminate duplicates Z: 64 45.739 2.288 0.551 0.526 0.968 0.587 CB 1.634 64 residues pruned to eliminate duplicates Z: 28 19.991 2.048 0.519 0.562 0.889 0.741 CB 1.310 28 residues pruned to eliminate duplicates Z: 11 20.452 2.017 0.476 0.938 1.000 1.000 CB 1.511 11 residues pruned to eliminate duplicates Z: 72 55.079 2.372 0.591 0.567 0.915 0.634 CB 1.774 72 residues pruned to eliminate duplicates Z: 54 47.009 2.310 0.790 0.528 0.906 0.623 CB 1.677 54 residues pruned to eliminate duplicates Z: 19 33.202 2.320 0.515 0.863 1.000 0.667 CB 1.634 19 residues pruned to eliminate duplicates Z: 10 23.790 2.235 0.427 0.899 1.000 1.000 CB 1.777 10 residues pruned to eliminate duplicates Z: 45 51.502 2.478 0.703 0.558 0.955 0.750 CB 1.822 45 residues pruned to eliminate duplicates Z: 33 45.976 2.413 0.808 0.609 0.969 0.719 CB 1.734 33 residues pruned to eliminate duplicates Z: 65 72.128 2.406 0.874 0.655 0.969 0.688 CB 1.787 65 residues pruned to eliminate duplicates Z: 17 16.089 1.844 0.190 0.903 1.000 0.938 CB 1.306 17 residues pruned to eliminate duplicates Z: 18 27.840 2.161 0.392 0.886 1.000 0.824 CB 1.619 18 residues pruned to eliminate duplicates Z: 37 58.180 2.285 0.910 0.780 1.000 0.806 CB 1.735 37 residues pruned to eliminate duplicates Z: 33 32.768 2.152 0.607 0.621 0.969 0.781 CB 1.541 33 residues pruned to eliminate duplicates Z: 17 14.577 1.926 0.100 0.940 0.938 0.812 CB 1.275 17 residues pruned to eliminate duplicates Z: 43 55.482 2.448 0.902 0.538 0.976 0.643 CB 1.816 43 residues pruned to eliminate duplicates Z: 10 20.371 2.311 0.534 0.854 0.778 0.667 CB 1.819 10 residues pruned to eliminate duplicates Z: 22 63.383 2.410 1.090 0.925 1.000 0.857 CB 1.927 22 residues pruned to eliminate duplicates Z: 41 38.819 2.216 0.807 0.550 0.900 0.725 CB 1.621 41 residues pruned to eliminate duplicates Z: 19 42.051 2.363 0.829 0.891 1.000 0.722 CB 1.648 19 residues pruned to eliminate duplicates Z: 20 24.347 2.124 0.637 0.707 0.895 0.842 CB 1.488 20 residues pruned to eliminate duplicates Z: 76 66.399 2.413 0.892 0.532 0.920 0.613 CB 1.769 76 residues pruned to eliminate duplicates Z: 19 15.577 1.792 0.354 0.841 1.000 0.833 CB 1.129 19 residues pruned to eliminate duplicates Z: 21 38.178 2.327 1.016 0.707 0.900 0.800 CB 1.675 21 residues pruned to eliminate duplicates Z: 6 5.790 1.810 -0.242 0.860 1.000 1.000 CB 1.388 6 residues pruned to eliminate duplicates Z: 38 32.188 2.194 0.772 0.582 0.892 0.649 CB 1.410 38 residues pruned to eliminate duplicates Z: 12 21.108 1.869 0.631 0.903 1.000 0.909 CB 1.488 12 residues pruned to eliminate duplicates Z: 13 18.404 1.851 0.443 0.944 1.000 1.000 CB 1.378 13 residues pruned to eliminate duplicates Z: 18 15.051 1.831 0.241 0.912 1.000 0.882 CB 1.138 18 residues pruned to eliminate duplicates Z: 10 33.337 2.283 1.339 0.866 1.000 0.889 CB 1.523 10 residues pruned to eliminate duplicates Z: 22 50.069 2.254 1.040 0.893 1.000 0.571 CB 1.705 22 residues pruned to eliminate duplicates Z: 10 15.620 1.931 0.690 0.829 0.889 0.778 CB 1.351 10 residues pruned to eliminate duplicates Z: 37 37.942 2.232 0.674 0.565 0.944 0.583 CB 1.682 37 residues pruned to eliminate duplicates Z: 11 20.762 2.064 0.430 0.933 1.000 1.000 CB 1.553 11 residues pruned to eliminate duplicates Z: 9 20.225 2.013 0.767 0.854 1.000 1.000 CB 1.485 9 residues pruned to eliminate duplicates Z: 65 51.516 2.368 0.695 0.524 0.953 0.656 CB 1.644 65 residues pruned to eliminate duplicates Z: 135 95.806 2.443 0.830 0.599 0.940 0.701 CB 1.791 135 residues pruned to eliminate duplicates Z: 10 23.984 2.412 0.296 0.873 1.000 0.778 CA 1.864 10 residues pruned to eliminate duplicates Z: 37 22.123 1.983 0.449 0.552 0.944 0.722 CB 1.291 35 residues pruned to eliminate duplicates Z: 23 77.579 2.485 1.397 0.930 0.955 0.591 CB 2.034 23 residues pruned to eliminate duplicates Z: 16 19.540 2.276 0.627 0.586 0.800 0.733 CB 1.568 16 residues pruned to eliminate duplicates Z: 70 53.851 2.361 0.738 0.520 0.942 0.696 CB 1.644 70 residues pruned to eliminate duplicates Z: 37 30.770 2.268 0.717 0.507 0.833 0.611 CB 1.570 37 residues pruned to eliminate duplicates Z: 14 26.776 2.007 0.761 0.933 1.000 0.923 CA 1.467 14 residues pruned to eliminate duplicates Z: 10 12.235 2.054 0.649 0.771 0.778 0.444 CB 1.219 10 residues pruned to eliminate duplicates Z: 12 17.475 2.108 0.661 0.574 0.909 0.727 CB 1.542 12 residues pruned to eliminate duplicates Z: 7 7.577 1.780 0.307 0.722 1.000 0.667 CA 1.089 7 residues pruned to eliminate duplicates Z: 98 67.301 2.432 0.753 0.531 0.918 0.629 CB 1.694 98 residues pruned to eliminate duplicates Z: 18 16.104 2.268 0.260 0.479 0.824 0.647 CB 1.694 18 residues pruned to eliminate duplicates Z: 22 60.597 2.626 0.782 0.941 0.952 0.905 CB 2.059 22 residues pruned to eliminate duplicates Z: 16 32.926 2.064 0.843 0.911 1.000 0.933 CB 1.584 16 residues pruned to eliminate duplicates Z: 14 22.759 1.860 0.694 0.937 1.000 1.000 CA 1.393 14 residues pruned to eliminate duplicates Z: 6 8.081 2.173 0.351 0.629 0.800 0.400 CA 1.363 6 residues pruned to eliminate duplicates Z: 9 21.161 2.127 0.611 0.887 1.000 1.000 CB 1.574 9 residues pruned to eliminate duplicates Z: 12 23.899 2.164 0.905 0.770 0.909 0.545 CB 1.514 12 residues pruned to eliminate duplicates Z: 23 64.113 2.443 1.068 0.908 0.955 0.818 CB 2.013 23 residues pruned to eliminate duplicates Z: 112 77.229 2.378 0.810 0.557 0.937 0.595 CB 1.719 70 residues pruned to eliminate duplicates Z: 9 24.216 2.338 0.556 0.853 1.000 0.625 CB 1.740 9 residues pruned to eliminate duplicates Z: 134 89.572 2.426 0.782 0.592 0.932 0.699 CB 1.764 134 residues pruned to eliminate duplicates Z: 22 45.029 2.260 0.742 0.908 1.000 0.905 CB 1.773 22 residues pruned to eliminate duplicates Z: 47 60.186 2.306 0.918 0.683 0.935 0.696 CB 1.814 47 residues pruned to eliminate duplicates Z: 13 33.207 2.141 0.922 0.913 1.000 0.833 CA 1.648 13 residues pruned to eliminate duplicates Z: 42 70.711 2.424 0.934 0.737 0.976 0.683 CB 1.951 42 residues pruned to eliminate duplicates Z: 10 20.355 2.129 0.615 0.627 1.000 0.667 CB 1.750 Z: 66 48.445 2.350 0.663 0.528 0.908 0.677 CB 1.648 66 residues pruned to eliminate duplicates Z: 10 24.034 2.378 0.386 0.872 1.000 0.889 CB 1.771 10 residues pruned to eliminate duplicates Z: 19 34.715 2.014 0.876 0.898 1.000 0.667 CB 1.549 19 residues pruned to eliminate duplicates Z: 13 23.455 1.909 0.722 0.921 1.000 1.000 CA 1.450 13 residues pruned to eliminate duplicates Z: 64 69.891 2.498 0.933 0.635 0.873 0.651 CB 1.840 64 residues pruned to eliminate duplicates Z: 64 75.069 2.413 0.952 0.679 0.937 0.698 CB 1.820 64 residues pruned to eliminate duplicates Z: 11 19.984 2.046 0.460 0.907 1.000 0.900 CB 1.504 11 residues pruned to eliminate duplicates Z: 7 12.310 2.212 0.297 0.882 0.833 0.667 CA 1.522 7 residues pruned to eliminate duplicates Z: 19 21.661 1.856 0.437 0.906 1.000 0.833 CB 1.362 19 residues pruned to eliminate duplicates Z: 102 84.059 2.347 0.890 0.618 0.960 0.663 CB 1.755 102 residues pruned to eliminate duplicates Z: 18 15.535 1.876 0.158 0.910 1.000 0.882 CB 1.230 18 residues pruned to eliminate duplicates Z: 7 7.754 1.510 0.382 0.822 1.000 0.500 CA 1.148 7 residues pruned to eliminate duplicates Z: 18 17.735 1.853 0.276 0.938 0.941 0.824 CB 1.344 18 residues pruned to eliminate duplicates Z: 21 52.465 2.395 0.905 0.914 0.950 0.850 CB 1.914 21 residues pruned to eliminate duplicates Z: 100 65.760 2.334 0.885 0.540 0.899 0.626 CB 1.607 100 residues pruned to eliminate duplicates Z: 123 87.305 2.428 0.959 0.562 0.918 0.648 CB 1.705 123 residues pruned to eliminate duplicates Z: 36 39.328 2.303 0.896 0.572 0.914 0.571 CB 1.553 36 residues pruned to eliminate duplicates Z: 28 32.278 2.089 0.755 0.617 0.963 0.778 CB 1.576 28 residues pruned to eliminate duplicates Z: 12 37.247 2.176 1.150 0.872 1.000 0.727 CA 1.750 12 residues pruned to eliminate duplicates Z: 71 48.010 2.316 0.608 0.534 0.871 0.729 CB 1.710 71 residues pruned to eliminate duplicates Z: 22 91.796 2.706 1.435 0.929 1.000 0.762 CB 2.128 22 residues pruned to eliminate duplicates Z: 24 87.044 2.534 1.464 0.911 1.000 0.826 C 2.061 24 residues pruned to eliminate duplicates Z: 18 26.933 2.101 0.306 0.917 1.000 1.000 CB 1.680 18 residues pruned to eliminate duplicates Z: 97 70.349 2.427 0.742 0.526 0.948 0.667 CB 1.746 98 residues pruned to eliminate duplicates Z: 42 33.234 2.207 0.755 0.481 0.854 0.659 CB 1.601 42 residues pruned to eliminate duplicates Z: 9 11.801 1.982 0.913 0.565 0.875 0.625 CB 1.181 9 residues pruned to eliminate duplicates Z: 21 26.709 2.046 0.632 0.711 0.950 0.900 CA 1.555 21 residues pruned to eliminate duplicates Z: 14 20.868 1.872 0.591 0.916 1.000 0.846 CA 1.373 14 residues pruned to eliminate duplicates Z: 21 43.392 2.356 0.582 0.918 0.950 0.750 CB 1.933 21 residues pruned to eliminate duplicates Z: 72 43.703 2.133 0.691 0.551 0.958 0.648 CB 1.428 68 residues pruned to eliminate duplicates Z: 16 18.610 1.908 0.278 0.934 1.000 0.933 CB 1.374 16 residues pruned to eliminate duplicates Z: 17 16.195 1.917 0.246 0.901 1.000 0.875 CB 1.210 17 residues pruned to eliminate duplicates Z: 23 51.497 2.185 1.205 0.897 0.955 0.591 CB 1.708 23 residues pruned to eliminate duplicates Z: 16 15.861 1.867 0.174 0.904 1.000 0.933 CB 1.331 16 residues pruned to eliminate duplicates Z: 10 11.711 2.100 0.698 0.502 0.778 0.556 CA 1.405 10 residues pruned to eliminate duplicates Z: 15 25.340 2.278 0.996 0.599 0.857 0.714 CB 1.581 15 residues pruned to eliminate duplicates Z: 66 45.233 2.270 0.732 0.483 0.892 0.615 CB 1.626 66 residues pruned to eliminate duplicates Z: 6 15.708 2.241 0.373 0.814 1.000 0.400 CB 1.739 6 residues pruned to eliminate duplicates Z: 59 43.953 2.298 0.686 0.532 0.914 0.741 CB 1.580 59 residues pruned to eliminate duplicates Z: 72 39.287 2.132 0.545 0.546 0.915 0.676 CB 1.477 72 residues pruned to eliminate duplicates Z: 24 24.501 2.220 0.926 0.450 0.870 0.652 CB 1.446 24 residues pruned to eliminate duplicates Z: 13 30.722 2.107 0.897 0.900 1.000 0.833 CA 1.585 13 residues pruned to eliminate duplicates Z: 113 80.062 2.379 0.855 0.600 0.902 0.661 CB 1.728 113 residues pruned to eliminate duplicates Z: 92 78.616 2.446 0.839 0.589 0.934 0.626 CB 1.801 98 residues pruned to eliminate duplicates Z: 10 28.224 2.345 0.490 0.914 1.000 1.000 CA 1.905 10 residues pruned to eliminate duplicates Z: 17 20.304 1.916 0.267 0.932 1.000 0.875 CB 1.460 17 residues pruned to eliminate duplicates Z: 84 74.946 2.460 0.898 0.597 0.916 0.675 CB 1.753 84 residues pruned to eliminate duplicates Z: 16 22.885 2.293 0.813 0.603 0.800 0.733 CB 1.610 16 residues pruned to eliminate duplicates Z: 48 38.240 2.081 0.685 0.646 0.957 0.681 CB 1.450 48 residues pruned to eliminate duplicates Z: 37 49.125 2.477 0.788 0.539 0.972 0.639 CB 1.830 37 residues pruned to eliminate duplicates Z: 31 20.460 1.864 0.725 0.667 0.900 0.633 CB 1.106 31 residues pruned to eliminate duplicates Z: 17 15.588 1.955 0.074 0.934 1.000 1.000 CB 1.295 17 residues pruned to eliminate duplicates Z: 18 34.436 2.154 0.680 0.902 1.000 0.941 CB 1.646 18 residues pruned to eliminate duplicates Z: 24 63.002 2.428 1.187 0.891 0.913 0.652 C 1.949 24 residues pruned to eliminate duplicates Z: 15 18.578 1.772 0.512 0.913 1.000 0.929 CA 1.311 15 residues pruned to eliminate duplicates Z: 22 58.497 2.269 1.172 0.911 1.000 0.762 CB 1.836 22 residues pruned to eliminate duplicates Z: 10 21.670 2.026 0.823 0.879 1.000 0.778 CB 1.418 10 residues pruned to eliminate duplicates Z: 21 48.515 2.362 0.603 0.943 1.000 1.000 CA 1.987 21 residues pruned to eliminate duplicates Z: 135 93.644 2.428 0.791 0.599 0.955 0.679 CB 1.771 135 residues pruned to eliminate duplicates Z: 16 14.504 1.894 0.168 0.899 1.000 0.800 CB 1.210 16 residues pruned to eliminate duplicates Z: 22 59.628 2.386 1.013 0.910 1.000 0.857 CB 1.921 22 residues pruned to eliminate duplicates Z: 14 21.586 1.871 0.586 0.929 1.000 0.923 CA 1.411 14 residues pruned to eliminate duplicates Z: 18 34.379 2.103 0.842 0.898 0.941 0.588 CB 1.636 18 residues pruned to eliminate duplicates Z: 33 46.757 2.450 0.829 0.565 0.969 0.562 CB 1.789 33 residues pruned to eliminate duplicates Z: 29 46.967 2.175 0.962 0.773 0.964 0.679 CA 1.694 29 residues pruned to eliminate duplicates Z: 19 45.806 2.304 1.112 0.872 1.000 0.611 CB 1.617 19 residues pruned to eliminate duplicates Z: 39 69.353 2.382 1.151 0.702 0.974 0.737 CB 1.875 39 residues pruned to eliminate duplicates Z: 7 13.132 2.153 0.215 0.862 1.000 0.667 CB 1.505 7 residues pruned to eliminate duplicates Z: 14 7.016 1.663 0.558 0.395 0.692 0.385 CB 1.211 Z: 23 51.332 2.307 0.965 0.913 0.955 0.727 CB 1.790 23 residues pruned to eliminate duplicates Z: 61 52.265 2.331 0.834 0.539 0.900 0.633 CB 1.687 61 residues pruned to eliminate duplicates Z: 7 5.095 1.778 0.102 0.646 0.833 0.667 CB 1.111 7 residues pruned to eliminate duplicates Z: 10 12.257 2.017 0.393 0.422 1.000 0.444 CB 1.577 10 residues pruned to eliminate duplicates Z: 7 9.803 2.013 0.159 0.594 1.000 0.833 CA 1.568 7 residues pruned to eliminate duplicates Z: 6 12.093 1.746 0.796 0.855 1.000 1.000 CB 1.273 5 residues pruned to eliminate duplicates Z: 7 3.915 1.835 0.040 0.424 0.833 0.500 CB 1.087 7 residues pruned to eliminate duplicates Z: 107 79.328 2.399 0.894 0.568 0.915 0.585 CB 1.735 107 residues pruned to eliminate duplicates Z: 16 19.214 1.888 0.493 0.917 1.000 0.867 CB 1.242 16 residues pruned to eliminate duplicates Z: 48 51.248 2.203 0.911 0.650 0.915 0.617 CB 1.687 48 residues pruned to eliminate duplicates Z: 23 45.551 2.180 0.948 0.880 0.955 0.864 CB 1.736 23 residues pruned to eliminate duplicates Z: 15 13.337 1.830 0.676 0.578 0.929 0.786 CB 1.161 15 residues pruned to eliminate duplicates Z: 31 39.117 2.418 0.756 0.541 0.900 0.633 CB 1.796 31 residues pruned to eliminate duplicates Z: 13 28.197 2.356 0.416 0.780 1.000 0.917 CB 1.907 13 residues pruned to eliminate duplicates Z: 17 16.931 1.950 0.137 0.934 1.000 1.000 CB 1.332 17 residues pruned to eliminate duplicates Z: 69 69.872 2.411 0.911 0.607 0.912 0.618 CB 1.822 69 residues pruned to eliminate duplicates Z: 18 19.541 1.871 0.380 0.928 1.000 0.824 CB 1.285 18 residues pruned to eliminate duplicates Z: 76 55.874 2.383 0.655 0.544 0.960 0.707 CB 1.632 76 residues pruned to eliminate duplicates Z: 23 55.314 2.204 1.122 0.917 1.000 0.818 CB 1.780 22 residues pruned to eliminate duplicates Z: 12 20.850 1.883 0.608 0.929 1.000 0.909 CB 1.453 12 residues pruned to eliminate duplicates Z: 96 78.856 2.452 0.904 0.567 0.926 0.674 CB 1.753 96 residues pruned to eliminate duplicates Z: 23 47.428 2.172 0.994 0.898 1.000 0.773 CB 1.670 23 residues pruned to eliminate duplicates Z: 10 28.918 2.554 0.873 0.808 0.889 0.889 CB 1.733 10 residues pruned to eliminate duplicates Z: 101 86.412 2.505 0.896 0.584 0.900 0.680 CB 1.866 101 residues pruned to eliminate duplicates Z: 21 39.338 2.157 0.637 0.942 1.000 1.000 CB 1.728 21 residues pruned to eliminate duplicates Z: 21 63.522 2.503 0.966 0.938 1.000 0.950 CB 2.007 21 residues pruned to eliminate duplicates Z: 19 18.522 2.245 0.820 0.456 0.833 0.611 CB 1.340 19 residues pruned to eliminate duplicates Z: 23 73.819 2.542 1.186 0.917 1.000 0.818 CB 1.998 23 residues pruned to eliminate duplicates Z: 18 15.477 1.772 0.303 0.927 1.000 0.941 CB 1.140 18 residues pruned to eliminate duplicates Z: 13 10.090 2.010 0.424 0.505 0.833 0.667 CB 1.215 13 residues pruned to eliminate duplicates Z: 26 27.230 2.124 0.788 0.568 0.880 0.640 CB 1.525 26 residues pruned to eliminate duplicates Z: 19 24.945 2.001 0.487 0.918 0.944 0.889 CB 1.476 19 residues pruned to eliminate duplicates Z: 71 73.220 2.400 0.976 0.628 0.914 0.643 CB 1.790 71 residues pruned to eliminate duplicates Z: 6 13.646 1.994 0.720 0.858 1.000 0.800 CA 1.310 6 residues pruned to eliminate duplicates Z: 21 46.722 2.455 0.525 0.955 1.000 0.900 CB 1.918 21 residues pruned to eliminate duplicates Z: 16 16.934 1.880 0.214 0.911 0.933 0.867 CB 1.455 16 residues pruned to eliminate duplicates Z: 12 13.232 2.077 0.675 0.538 0.909 0.636 CB 1.215 12 residues pruned to eliminate duplicates Z: 6 7.024 1.762 0.659 0.800 0.800 0.600 CA 1.033 6 residues pruned to eliminate duplicates Z: 62 54.210 2.343 0.633 0.570 0.967 0.672 CB 1.754 62 residues pruned to eliminate duplicates Z: 9 17.553 2.012 0.677 0.830 1.000 0.625 CB 1.383 9 residues pruned to eliminate duplicates Z: 154 79.180 2.305 0.703 0.597 0.915 0.654 CB 1.624 154 residues pruned to eliminate duplicates Z: 20 18.022 2.026 0.421 0.658 0.895 0.737 CB 1.386 20 residues pruned to eliminate duplicates Z: 6 9.018 2.175 0.274 0.849 0.800 0.600 CA 1.349 6 residues pruned to eliminate duplicates Z: 12 31.047 2.368 0.776 0.753 1.000 0.636 CB 1.776 12 residues pruned to eliminate duplicates Z: 19 45.489 2.259 1.219 0.899 1.000 0.611 CB 1.529 19 residues pruned to eliminate duplicates Z: 7 22.022 2.280 0.728 0.861 1.000 0.500 CA 1.677 7 residues pruned to eliminate duplicates Z: 41 32.156 2.250 0.567 0.473 0.925 0.675 CB 1.602 41 residues pruned to eliminate duplicates Z: 47 70.061 2.410 1.157 0.683 0.935 0.739 CB 1.797 47 residues pruned to eliminate duplicates Z: 32 52.516 2.242 0.895 0.801 0.968 0.742 CB 1.764 32 residues pruned to eliminate duplicates Z: 38 40.097 2.165 0.895 0.600 0.946 0.703 CB 1.544 38 residues pruned to eliminate duplicates Z: 22 19.448 2.233 0.405 0.435 0.905 0.667 CB 1.598 22 residues pruned to eliminate duplicates Z: 22 45.241 2.210 0.862 0.923 0.952 0.714 CB 1.770 22 residues pruned to eliminate duplicates Z: 25 14.738 2.021 0.556 0.358 0.792 0.417 CB 1.408 25 residues pruned to eliminate duplicates Z: 11 19.963 1.991 0.443 0.842 1.000 1.000 CB 1.637 11 residues pruned to eliminate duplicates Z: 29 30.938 2.325 0.734 0.491 0.929 0.429 CB 1.577 29 residues pruned to eliminate duplicates Z: 18 19.321 1.865 0.498 0.937 0.941 0.824 CB 1.240 18 residues pruned to eliminate duplicates Z: 18 36.837 2.367 0.624 0.862 1.000 0.706 CB 1.706 18 residues pruned to eliminate duplicates Z: 7 6.549 1.778 0.331 0.640 0.833 0.667 CA 1.190 7 residues pruned to eliminate duplicates Z: 67 34.790 2.109 0.481 0.547 0.894 0.682 CB 1.465 67 residues pruned to eliminate duplicates Z: 10 9.105 2.047 0.195 0.451 1.000 0.778 CB 1.305 10 residues pruned to eliminate duplicates Z: 22 55.230 2.247 1.153 0.911 1.000 0.667 CB 1.766 22 residues pruned to eliminate duplicates Z: 11 26.272 2.244 0.739 0.844 1.000 0.900 CA 1.584 11 residues pruned to eliminate duplicates Z: 10 15.099 1.970 0.626 0.816 0.889 0.778 CA 1.343 10 residues pruned to eliminate duplicates Z: 17 30.029 2.189 0.520 0.914 1.000 0.875 CB 1.595 17 residues pruned to eliminate duplicates Z: 12 3.594 1.825 0.040 0.225 0.727 0.455 CB 1.083 12 residues pruned to eliminate duplicates Z: 7 5.943 1.924 0.327 0.337 0.833 0.333 CB 1.361 Z: 22 98.939 2.707 1.569 0.918 1.000 0.810 CB 2.189 22 residues pruned to eliminate duplicates Z: 18 16.131 1.886 0.094 0.909 1.000 0.824 CB 1.346 18 residues pruned to eliminate duplicates Z: 16 15.934 1.870 0.293 0.933 1.000 0.933 CB 1.188 16 residues pruned to eliminate duplicates Z: 6 6.626 1.570 0.379 0.619 1.000 0.600 CA 1.223 6 residues pruned to eliminate duplicates Z: 6 12.524 1.759 1.122 0.854 1.000 0.800 CB 1.108 6 residues pruned to eliminate duplicates Z: 72 41.149 2.120 0.607 0.579 0.915 0.718 CB 1.452 72 residues pruned to eliminate duplicates Z: 22 52.935 2.385 0.815 0.942 1.000 0.952 CB 1.850 22 residues pruned to eliminate duplicates Z: 66 52.439 2.370 0.682 0.530 0.908 0.723 CB 1.746 66 residues pruned to eliminate duplicates Z: 11 22.889 2.016 0.619 0.926 1.000 0.900 CB 1.555 11 residues pruned to eliminate duplicates Z: 14 21.245 2.006 0.820 0.558 0.923 0.769 CB 1.654 14 residues pruned to eliminate duplicates Z: 6 10.240 2.056 0.409 0.872 0.800 0.600 CA 1.441 6 residues pruned to eliminate duplicates Z: 17 25.324 1.909 0.641 0.919 0.938 0.750 CB 1.519 17 residues pruned to eliminate duplicates Z: 39 37.479 2.152 0.809 0.546 0.895 0.632 CB 1.669 39 residues pruned to eliminate duplicates Z: 20 28.051 2.178 0.507 0.863 1.000 0.842 CB 1.438 20 residues pruned to eliminate duplicates Z: 9 7.849 1.818 0.454 0.523 0.875 0.625 CB 1.172 9 residues pruned to eliminate duplicates Z: 11 16.329 2.015 0.203 0.929 1.000 1.000 CB 1.491 11 residues pruned to eliminate duplicates Z: 24 33.926 2.198 0.819 0.684 0.957 0.826 CB 1.562 24 residues pruned to eliminate duplicates Z: 67 61.642 2.445 0.802 0.547 0.924 0.606 CB 1.780 67 residues pruned to eliminate duplicates Z: 19 18.574 1.832 0.616 0.880 1.000 0.667 CB 1.072 19 residues pruned to eliminate duplicates Z: 36 30.905 2.084 0.555 0.624 0.971 0.743 CB 1.477 36 residues pruned to eliminate duplicates Z: 12 29.157 2.422 0.551 0.797 1.000 0.636 CB 1.805 12 residues pruned to eliminate duplicates Z: 12 16.543 2.162 0.676 0.543 0.818 0.455 CB 1.614 12 residues pruned to eliminate duplicates Z: 12 4.725 1.841 0.550 0.278 0.636 0.545 CB 1.008 12 residues pruned to eliminate duplicates Z: 109 87.635 2.400 0.940 0.615 0.954 0.722 CB 1.703 109 residues pruned to eliminate duplicates Z: 18 37.257 2.304 0.907 0.886 0.941 0.588 CB 1.576 18 residues pruned to eliminate duplicates Z: 130 75.439 2.324 0.733 0.567 0.915 0.643 CB 1.690 100 residues pruned to eliminate duplicates Z: 10 19.654 2.398 0.445 0.580 1.000 0.778 CB 1.749 10 residues pruned to eliminate duplicates Z: 14 20.738 1.750 0.687 0.938 1.000 1.000 CA 1.355 14 residues pruned to eliminate duplicates Z: 6 12.469 1.868 0.807 0.828 1.000 0.800 CB 1.244 6 residues pruned to eliminate duplicates Z: 18 20.233 1.879 0.318 0.909 1.000 0.647 CB 1.406 18 residues pruned to eliminate duplicates Z: 12 11.953 2.217 0.514 0.450 0.818 0.545 CB 1.381 12 residues pruned to eliminate duplicates Z: 25 37.048 2.116 0.619 0.906 0.958 0.792 CB 1.639 25 residues pruned to eliminate duplicates Z: 13 19.655 1.857 0.512 0.942 1.000 1.000 CB 1.402 13 residues pruned to eliminate duplicates Z: 9 12.487 2.032 0.522 0.678 0.875 0.750 CB 1.385 9 residues pruned to eliminate duplicates Z: 38 32.003 2.214 0.661 0.514 0.892 0.676 CB 1.582 38 residues pruned to eliminate duplicates Z: 84 40.572 2.094 0.619 0.547 0.892 0.675 CB 1.406 84 residues pruned to eliminate duplicates Z: 14 22.094 1.825 0.722 0.914 1.000 0.769 CB 1.379 14 residues pruned to eliminate duplicates Z: 38 55.455 2.435 0.821 0.690 0.919 0.784 CB 1.881 38 residues pruned to eliminate duplicates Z: 101 87.298 2.448 0.864 0.615 0.960 0.720 CB 1.788 101 residues pruned to eliminate duplicates Z: 41 42.827 2.407 0.680 0.495 0.900 0.675 CB 1.870 41 residues pruned to eliminate duplicates Z: 97 72.201 2.418 0.811 0.553 0.927 0.667 CB 1.723 97 residues pruned to eliminate duplicates Z: 37 56.546 2.286 0.869 0.785 0.972 0.806 CB 1.765 37 residues pruned to eliminate duplicates Z: 11 16.828 2.006 0.261 0.930 1.000 1.000 CB 1.471 11 residues pruned to eliminate duplicates Z: 11 24.658 2.169 0.742 0.816 1.000 0.800 CB 1.568 11 residues pruned to eliminate duplicates Z: 19 44.608 2.351 0.945 0.868 1.000 0.722 CB 1.681 19 residues pruned to eliminate duplicates Z: 17 10.444 1.688 0.685 0.423 0.812 0.562 CB 1.225 15 residues pruned to eliminate duplicates Z: 82 60.938 2.324 0.805 0.570 0.914 0.642 CB 1.651 82 residues pruned to eliminate duplicates Z: 11 20.691 2.022 0.612 0.899 1.000 0.800 CB 1.435 11 residues pruned to eliminate duplicates Z: 18 17.935 1.768 0.403 0.887 1.000 0.882 CB 1.264 18 residues pruned to eliminate duplicates Z: 27 32.622 2.268 0.867 0.614 0.885 0.731 CB 1.533 27 residues pruned to eliminate duplicates Z: 12 29.330 2.142 0.648 0.896 1.000 0.636 C 1.795 12 residues pruned to eliminate duplicates Z: 39 29.525 1.994 0.777 0.607 0.974 0.737 CB 1.254 40 residues pruned to eliminate duplicates Z: 9 25.811 2.297 0.840 0.844 0.875 0.750 CA 1.837 9 residues pruned to eliminate duplicates Z: 45 36.064 2.338 0.656 0.432 0.886 0.523 CB 1.700 45 residues pruned to eliminate duplicates Z: 13 20.423 1.875 0.805 0.918 0.917 0.917 CA 1.340 13 residues pruned to eliminate duplicates Z: 22 35.791 2.147 0.912 0.756 1.000 0.810 CB 1.514 22 residues pruned to eliminate duplicates Z: 23 45.755 2.183 0.805 0.918 1.000 0.864 CB 1.746 23 residues pruned to eliminate duplicates Z: 26 41.290 2.276 1.084 0.640 0.920 0.600 CB 1.659 26 residues pruned to eliminate duplicates Z: 25 18.247 2.133 0.333 0.454 0.917 0.625 CB 1.499 25 residues pruned to eliminate duplicates Z: 74 59.780 2.353 0.800 0.551 0.918 0.699 CB 1.712 74 residues pruned to eliminate duplicates Z: 7 9.643 1.989 0.055 0.880 1.000 0.833 CA 1.358 7 residues pruned to eliminate duplicates Z: 19 36.949 1.991 1.034 0.897 1.000 0.722 CB 1.540 19 residues pruned to eliminate duplicates Z: 31 21.977 2.033 0.784 0.470 0.867 0.600 CB 1.315 31 residues pruned to eliminate duplicates Z: 17 29.413 2.017 0.776 0.941 1.000 0.938 CB 1.424 17 residues pruned to eliminate duplicates Z: 19 41.501 2.361 0.799 0.868 1.000 0.667 CB 1.683 19 residues pruned to eliminate duplicates Z: 11 13.276 2.073 0.525 0.487 0.800 0.700 CB 1.682 11 residues pruned to eliminate duplicates Z: 6 6.901 1.780 0.407 0.458 1.000 0.400 CA 1.286 6 residues pruned to eliminate duplicates Z: 23 23.928 2.140 0.547 0.571 1.000 0.682 CB 1.439 23 residues pruned to eliminate duplicates Z: 19 29.586 2.342 0.616 0.540 0.944 0.667 CA 1.875 19 residues pruned to eliminate duplicates Z: 56 79.904 2.429 1.180 0.672 0.945 0.764 CB 1.837 56 residues pruned to eliminate duplicates Z: 24 31.044 2.214 0.697 0.644 1.000 0.739 CB 1.506 24 residues pruned to eliminate duplicates Z: 13 31.012 2.115 0.831 0.908 1.000 0.917 CA 1.641 13 residues pruned to eliminate duplicates Z: 14 33.501 2.252 0.758 0.833 1.000 0.769 CB 1.761 14 residues pruned to eliminate duplicates Z: 8 13.227 2.135 0.440 0.816 0.857 0.857 CB 1.441 8 residues pruned to eliminate duplicates Z: 7 11.329 2.078 0.770 0.479 0.833 0.667 CA 1.541 7 residues pruned to eliminate duplicates Z: 22 83.756 2.580 1.336 0.935 1.000 0.810 C 2.113 22 residues pruned to eliminate duplicates Z: 21 29.322 2.185 0.600 0.587 0.950 0.700 CA 1.815 21 residues pruned to eliminate duplicates Z: 16 19.648 2.091 0.628 0.510 0.933 0.667 CB 1.582 17 residues pruned to eliminate duplicates Z: 10 30.544 2.288 1.029 0.895 0.889 0.889 CA 1.769 10 residues pruned to eliminate duplicates Z: 103 68.320 2.332 0.872 0.529 0.882 0.627 CB 1.708 103 residues pruned to eliminate duplicates Z: 71 67.804 2.335 0.942 0.589 0.943 0.686 CB 1.740 71 residues pruned to eliminate duplicates Z: 12 13.419 2.078 0.704 0.537 0.818 0.636 CB 1.346 12 residues pruned to eliminate duplicates Z: 39 45.745 2.286 0.742 0.599 0.974 0.737 CB 1.741 39 residues pruned to eliminate duplicates Z: 8 5.139 1.522 0.031 0.675 0.857 0.571 CB 1.229 Z: 14 15.663 2.091 0.603 0.436 0.846 0.615 CA 1.637 14 residues pruned to eliminate duplicates Z: 18 28.752 2.089 0.432 0.923 1.000 0.882 CB 1.638 18 residues pruned to eliminate duplicates Z: 66 50.473 2.332 0.725 0.527 0.938 0.754 CB 1.615 66 residues pruned to eliminate duplicates Z: 80 74.574 2.337 0.936 0.648 0.937 0.671 CB 1.724 75 residues pruned to eliminate duplicates Z: 24 20.515 1.957 0.819 0.544 0.783 0.565 CB 1.470 24 residues pruned to eliminate duplicates Z: 16 18.761 2.079 0.612 0.614 1.000 0.733 CB 1.298 16 residues pruned to eliminate duplicates Z: 50 55.167 2.291 0.994 0.617 0.939 0.714 CB 1.646 50 residues pruned to eliminate duplicates Z: 12 18.234 2.143 0.677 0.776 0.818 0.818 CA 1.466 12 residues pruned to eliminate duplicates Z: 10 15.733 1.893 0.704 0.746 0.889 0.667 CA 1.469 10 residues pruned to eliminate duplicates Z: 6 9.386 2.040 0.358 0.814 0.800 0.800 CA 1.441 6 residues pruned to eliminate duplicates Z: 7 6.278 1.383 0.444 0.776 1.000 0.667 C 1.006 7 residues pruned to eliminate duplicates Z: 18 28.468 1.905 0.750 0.929 1.000 0.824 CB 1.450 23 residues pruned to eliminate duplicates Z: 43 44.833 2.288 0.690 0.548 0.976 0.714 CB 1.750 43 residues pruned to eliminate duplicates Z: 37 45.726 2.220 0.822 0.770 0.889 0.806 CB 1.669 37 residues pruned to eliminate duplicates Z: 37 56.300 2.308 0.856 0.790 0.944 0.778 CB 1.798 37 residues pruned to eliminate duplicates Z: 21 36.860 2.403 0.831 0.613 0.950 0.800 CB 1.772 21 residues pruned to eliminate duplicates Z: 19 29.895 2.204 0.591 0.848 1.000 0.722 CB 1.490 19 residues pruned to eliminate duplicates Z: 18 35.539 2.336 0.462 0.907 1.000 0.882 CB 1.794 18 residues pruned to eliminate duplicates Z: 48 74.008 2.387 1.051 0.673 0.979 0.745 CB 1.921 48 residues pruned to eliminate duplicates Z: 50 59.943 2.378 0.872 0.591 0.918 0.673 CB 1.921 50 residues pruned to eliminate duplicates Z: 9 25.423 2.248 0.821 0.697 1.000 0.750 C 1.835 11 residues pruned to eliminate duplicates Z: 33 39.853 2.386 0.657 0.639 0.938 0.781 CB 1.670 33 residues pruned to eliminate duplicates Z: 9 19.128 2.053 0.444 0.897 1.000 1.000 CB 1.633 9 residues pruned to eliminate duplicates Z: 89 79.103 2.403 0.993 0.587 0.943 0.727 CB 1.717 89 residues pruned to eliminate duplicates Z: 10 29.127 2.301 0.767 0.906 1.000 0.889 CB 1.698 10 residues pruned to eliminate duplicates Z: 11 21.248 2.034 0.599 0.928 1.000 0.900 CB 1.448 11 residues pruned to eliminate duplicates Z: 25 41.553 2.530 0.935 0.573 0.833 0.583 CB 1.938 25 residues pruned to eliminate duplicates Z: 65 49.570 2.275 0.618 0.542 0.938 0.766 CB 1.723 65 residues pruned to eliminate duplicates Z: 6 5.395 1.617 0.308 0.596 0.800 0.400 N 1.302 6 residues pruned to eliminate duplicates Z: 15 14.324 1.948 0.598 0.433 0.929 0.571 CB 1.420 15 residues pruned to eliminate duplicates Z: 32 64.863 2.468 1.140 0.732 1.000 0.871 CB 1.790 32 residues pruned to eliminate duplicates Z: 37 54.858 2.500 0.995 0.558 0.944 0.639 CB 1.835 37 residues pruned to eliminate duplicates Z: 8 7.962 1.685 0.241 0.752 0.857 0.857 CB 1.341 8 residues pruned to eliminate duplicates Z: 62 56.016 2.342 0.871 0.599 0.885 0.672 CB 1.682 62 residues pruned to eliminate duplicates Z: 6 7.013 1.754 0.233 0.724 1.000 0.800 CB 1.185 6 residues pruned to eliminate duplicates Z: 32 45.322 2.450 0.864 0.543 0.935 0.645 CB 1.827 32 residues pruned to eliminate duplicates 6 1.093 1.160 0.193 0.327 0.600 0.400 N 0.712 ? Z: 9 12.092 1.957 0.354 0.459 1.000 0.625 CB 1.682 9 residues pruned to eliminate duplicates Z: 32 28.870 2.112 0.794 0.645 0.871 0.774 CB 1.372 32 residues pruned to eliminate duplicates Z: 12 17.224 1.923 0.295 0.924 1.000 1.000 CB 1.465 12 residues pruned to eliminate duplicates Z: 39 36.767 2.230 0.801 0.564 0.947 0.763 CB 1.473 39 residues pruned to eliminate duplicates Z: 11 17.199 2.194 0.689 0.434 1.000 0.800 CB 1.571 11 residues pruned to eliminate duplicates Z: 31 50.670 2.471 1.000 0.599 0.933 0.633 CB 1.825 31 residues pruned to eliminate duplicates Z: 42 38.764 2.284 0.844 0.563 0.878 0.659 CB 1.541 42 residues pruned to eliminate duplicates Z: 9 11.877 1.897 0.568 0.485 1.000 0.875 CB 1.434 9 residues pruned to eliminate duplicates Z: 52 68.509 2.480 0.991 0.609 0.902 0.608 CB 1.942 30 residues pruned to eliminate duplicates Z: 21 51.234 2.461 1.233 0.656 1.000 0.750 CB 1.803 21 residues pruned to eliminate duplicates Z: 49 69.269 2.389 1.104 0.713 0.958 0.812 CB 1.711 49 residues pruned to eliminate duplicates Z: 21 23.424 2.271 0.645 0.430 0.950 0.650 CB 1.587 21 residues pruned to eliminate duplicates Z: 13 26.825 2.161 0.517 0.892 1.000 0.833 CA 1.697 13 residues pruned to eliminate duplicates Z: 8 4.245 1.542 0.550 0.309 0.714 0.714 CB 1.162 8 residues pruned to eliminate duplicates Z: 22 51.062 2.302 0.874 0.927 0.952 0.905 CB 1.901 22 residues pruned to eliminate duplicates Z: 11 7.455 1.755 0.682 0.517 0.800 0.600 CB 0.982 11 residues pruned to eliminate duplicates Z: 18 39.427 2.081 1.022 0.928 1.000 0.706 CB 1.591 18 residues pruned to eliminate duplicates Z: 6 2.462 1.537 0.078 0.487 0.800 0.600 O 0.841 Z: 96 68.245 2.465 0.719 0.535 0.926 0.726 CB 1.722 96 residues pruned to eliminate duplicates Z: 29 46.288 2.504 0.990 0.564 0.893 0.607 CB 1.848 29 residues pruned to eliminate duplicates Z: 22 21.781 2.142 0.844 0.512 0.857 0.762 CB 1.387 22 residues pruned to eliminate duplicates Z: 7 11.447 2.162 0.408 0.684 0.833 0.333 CA 1.556 7 residues pruned to eliminate duplicates Z: 51 51.074 2.144 0.954 0.658 0.920 0.640 CB 1.619 51 residues pruned to eliminate duplicates Z: 27 46.980 2.382 0.945 0.667 1.000 0.731 CB 1.704 27 residues pruned to eliminate duplicates Z: 22 39.982 2.235 0.816 0.906 0.905 0.857 CB 1.689 22 residues pruned to eliminate duplicates Z: 32 19.145 1.948 0.332 0.577 0.935 0.710 CB 1.315 32 residues pruned to eliminate duplicates Z: 32 38.282 2.397 0.648 0.608 0.968 0.710 CB 1.623 32 residues pruned to eliminate duplicates 6 1.874 0.954 0.121 0.863 1.000 1.000 N 0.575 ? Z: 10 19.411 1.921 0.635 0.816 1.000 0.556 C 1.565 10 residues pruned to eliminate duplicates Z: 7 3.762 1.642 0.381 0.814 0.833 0.333 CB 0.619 7 residues pruned to eliminate duplicates Z: 95 86.611 2.497 0.922 0.609 0.915 0.723 CB 1.834 95 residues pruned to eliminate duplicates Z: 40 47.057 2.391 0.878 0.536 0.949 0.667 CB 1.707 40 residues pruned to eliminate duplicates Z: 20 25.840 2.480 0.587 0.491 0.842 0.684 CB 1.804 20 residues pruned to eliminate duplicates Z: 24 40.452 2.095 0.959 0.859 0.957 0.696 CB 1.580 24 residues pruned to eliminate duplicates Z: 25 33.554 2.138 0.768 0.667 0.958 0.833 CB 1.620 25 residues pruned to eliminate duplicates Z: 37 32.204 2.213 0.674 0.488 0.889 0.583 CB 1.650 37 residues pruned to eliminate duplicates Z: 45 68.031 2.332 0.995 0.704 1.000 0.727 CB 1.830 16 residues pruned to eliminate duplicates Z: 6 8.016 1.742 0.305 0.849 1.000 0.600 CB 1.168 6 residues pruned to eliminate duplicates Z: 14 25.004 1.839 0.874 0.931 1.000 0.769 CB 1.406 14 residues pruned to eliminate duplicates Z: 63 68.602 2.328 0.986 0.626 0.952 0.726 CB 1.759 63 residues pruned to eliminate duplicates Z: 28 21.863 2.070 0.755 0.438 0.778 0.519 CA 1.587 28 residues pruned to eliminate duplicates Z: 7 9.913 1.818 0.699 0.595 1.000 0.500 CB 1.196 7 residues pruned to eliminate duplicates Z: 11 15.813 2.040 0.116 0.934 1.000 1.000 CB 1.532 11 residues pruned to eliminate duplicates Z: 88 59.478 2.313 0.701 0.570 0.931 0.690 CB 1.627 88 residues pruned to eliminate duplicates Z: 89 79.114 2.381 0.920 0.614 0.920 0.670 CB 1.798 89 residues pruned to eliminate duplicates Z: 17 24.743 2.177 0.914 0.569 0.875 0.688 CB 1.587 17 residues pruned to eliminate duplicates Z: 9 14.924 2.083 0.491 0.618 1.000 0.750 CA 1.520 9 residues pruned to eliminate duplicates Z: 112 76.157 2.406 0.742 0.567 0.928 0.748 CB 1.743 112 residues pruned to eliminate duplicates Z: 17 16.437 1.855 0.192 0.940 1.000 0.875 CB 1.291 17 residues pruned to eliminate duplicates Z: 20 34.047 2.228 0.824 0.850 0.895 0.526 CB 1.591 20 residues pruned to eliminate duplicates Z: 77 86.904 2.496 1.029 0.625 0.947 0.697 CB 1.847 77 residues pruned to eliminate duplicates Z: 26 45.708 2.527 0.913 0.565 0.960 0.760 CB 1.851 26 residues pruned to eliminate duplicates Z: 76 65.089 2.323 0.781 0.613 0.933 0.640 CB 1.749 76 residues pruned to eliminate duplicates Z: 62 88.779 2.488 1.062 0.677 0.967 0.721 CB 1.946 62 residues pruned to eliminate duplicates Z: 19 19.569 2.079 0.447 0.483 1.000 0.667 CB 1.561 19 residues pruned to eliminate duplicates Z: 51 45.368 2.456 0.765 0.509 0.880 0.580 CB 1.667 51 residues pruned to eliminate duplicates Z: 18 36.630 2.087 0.848 0.933 1.000 0.882 CB 1.607 18 residues pruned to eliminate duplicates Z: 57 72.873 2.357 0.980 0.676 0.982 0.750 CB 1.806 56 residues pruned to eliminate duplicates Z: 14 10.801 1.797 0.593 0.403 0.846 0.538 CB 1.369 14 residues pruned to eliminate duplicates Z: 19 19.394 1.841 0.481 0.893 0.944 0.833 CB 1.274 19 residues pruned to eliminate duplicates Z: 6 7.079 1.695 0.168 0.870 1.000 0.600 CA 1.167 6 residues pruned to eliminate duplicates Z: 10 18.582 2.208 0.803 0.567 0.778 0.667 CB 1.875 10 residues pruned to eliminate duplicates Z: 11 29.232 2.179 0.848 0.889 1.000 1.000 CB 1.653 11 residues pruned to eliminate duplicates Z: 9 12.775 2.308 0.366 0.372 1.000 0.625 CA 1.644 9 residues pruned to eliminate duplicates Z: 6 6.199 1.615 0.382 0.495 1.000 0.800 CA 1.248 Z: 50 34.923 2.113 0.542 0.536 0.939 0.714 CB 1.575 50 residues pruned to eliminate duplicates Z: 6 2.320 1.301 0.612 0.476 0.600 0.400 C 0.846 6 residues pruned to eliminate duplicates Z: 67 53.059 2.291 0.788 0.534 0.939 0.636 CB 1.642 67 residues pruned to eliminate duplicates Z: 39 34.729 2.198 0.885 0.592 0.895 0.684 CB 1.392 39 residues pruned to eliminate duplicates Z: 69 61.371 2.478 0.849 0.511 0.882 0.574 CB 1.820 69 residues pruned to eliminate duplicates Z: 12 30.580 2.241 0.685 0.913 1.000 0.909 CA 1.728 12 residues pruned to eliminate duplicates Z: 41 47.045 2.431 0.920 0.548 0.850 0.725 CB 1.790 41 residues pruned to eliminate duplicates Z: 117 84.691 2.435 0.884 0.571 0.922 0.707 CB 1.736 117 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 49 60.874 2.281 0.967 0.658 0.958 0.750 CB 1.766 49 residues pruned to eliminate duplicates Z: 100 83.678 2.390 0.846 0.595 0.949 0.616 CB 1.833 100 residues pruned to eliminate duplicates Z: 137 75.885 2.280 0.763 0.562 0.919 0.654 CB 1.658 137 residues pruned to eliminate duplicates Z: 101 81.211 2.385 0.825 0.588 0.940 0.610 CB 1.824 101 residues pruned to eliminate duplicates Z: 128 81.698 2.307 0.784 0.610 0.953 0.677 CB 1.666 128 residues pruned to eliminate duplicates Z: 100 84.994 2.411 0.885 0.592 0.939 0.646 CB 1.833 100 residues pruned to eliminate duplicates Z: 98 83.795 2.395 0.827 0.618 0.959 0.701 CB 1.815 98 residues pruned to eliminate duplicates Z: 45 60.458 2.361 0.849 0.693 0.909 0.705 C 1.925 45 residues pruned to eliminate duplicates Z: 96 82.509 2.402 0.816 0.614 0.968 0.653 CB 1.799 103 residues pruned to eliminate duplicates Z: 23 64.111 2.516 0.938 0.915 0.955 0.773 CB 2.076 23 residues pruned to eliminate duplicates Z: 45 60.315 2.409 0.871 0.690 0.886 0.773 CB 1.914 45 residues pruned to eliminate duplicates Z: 101 77.206 2.375 0.819 0.562 0.920 0.670 CB 1.829 101 residues pruned to eliminate duplicates Z: 69 72.344 2.389 0.928 0.615 0.926 0.647 CB 1.844 69 residues pruned to eliminate duplicates Z: 75 69.798 2.357 0.903 0.622 0.932 0.676 CB 1.729 75 residues pruned to eliminate duplicates Z: 131 82.006 2.310 0.782 0.608 0.938 0.715 CB 1.680 131 residues pruned to eliminate duplicates Z: 136 76.644 2.272 0.782 0.588 0.919 0.667 CB 1.631 136 residues pruned to eliminate duplicates Z: 97 85.802 2.415 0.884 0.611 0.948 0.698 CB 1.828 97 residues pruned to eliminate duplicates Z: 70 74.347 2.341 0.963 0.656 0.957 0.710 CB 1.762 70 residues pruned to eliminate duplicates Z: 105 85.882 2.354 0.957 0.590 0.942 0.702 CB 1.781 105 residues pruned to eliminate duplicates Z: 70 78.902 2.418 0.978 0.630 0.957 0.667 CB 1.837 70 residues pruned to eliminate duplicates Z: 62 87.463 2.498 1.039 0.672 0.967 0.721 CB 1.940 62 residues pruned to eliminate duplicates Z: 69 74.002 2.438 0.901 0.620 0.941 0.706 CB 1.836 69 residues pruned to eliminate duplicates Z: 64 79.159 2.432 1.049 0.645 0.937 0.667 CB 1.868 64 residues pruned to eliminate duplicates Z: 48 70.743 2.335 1.099 0.707 0.979 0.723 CB 1.783 48 residues pruned to eliminate duplicates Z: 106 83.562 2.341 0.905 0.597 0.943 0.667 CB 1.768 106 residues pruned to eliminate duplicates Z: 102 84.793 2.340 0.937 0.609 0.950 0.604 CB 1.765 102 residues pruned to eliminate duplicates Z: 50 61.436 2.319 1.040 0.662 0.918 0.673 CB 1.738 50 residues pruned to eliminate duplicates Z: 106 77.343 2.307 0.924 0.582 0.905 0.638 CB 1.737 106 residues pruned to eliminate duplicates Z: 45 68.054 2.405 1.032 0.669 0.932 0.750 CB 1.927 45 residues pruned to eliminate duplicates Z: 101 87.953 2.400 0.886 0.607 0.960 0.680 CB 1.828 101 residues pruned to eliminate duplicates Z: 97 89.889 2.411 0.956 0.619 0.948 0.667 CB 1.834 97 residues pruned to eliminate duplicates Z: 89 82.925 2.426 0.986 0.602 0.909 0.659 CB 1.831 89 residues pruned to eliminate duplicates Z: 94 82.574 2.396 0.947 0.602 0.914 0.656 CB 1.823 94 residues pruned to eliminate duplicates Z: 102 88.259 2.367 0.926 0.610 0.970 0.644 CB 1.788 102 residues pruned to eliminate duplicates Z: 30 48.750 2.418 0.928 0.631 0.931 0.759 CB 1.845 30 residues pruned to eliminate duplicates Z: 45 71.200 2.398 1.080 0.687 0.977 0.727 CB 1.855 45 residues pruned to eliminate duplicates Z: 97 89.134 2.384 0.964 0.615 0.958 0.667 CB 1.818 97 residues pruned to eliminate duplicates Z: 128 75.143 2.274 0.785 0.577 0.921 0.654 CB 1.656 128 residues pruned to eliminate duplicates Z: 66 83.005 2.435 1.011 0.658 0.969 0.723 CB 1.874 66 residues pruned to eliminate duplicates Z: 108 78.342 2.317 0.878 0.591 0.925 0.673 CB 1.724 108 residues pruned to eliminate duplicates Z: 135 83.693 2.309 0.829 0.590 0.933 0.679 CB 1.683 135 residues pruned to eliminate duplicates Z: 64 82.126 2.457 0.978 0.664 0.968 0.667 CB 1.888 64 residues pruned to eliminate duplicates Z: 99 85.214 2.405 0.885 0.603 0.939 0.663 CB 1.833 99 residues pruned to eliminate duplicates Z: 100 84.791 2.394 0.958 0.605 0.919 0.677 CB 1.790 100 residues pruned to eliminate duplicates Z: 103 51.879 2.189 0.684 0.516 0.922 0.657 CB 1.489 102 residues pruned to eliminate duplicates Z: 13 32.638 2.323 0.812 0.733 1.000 0.833 CA 1.815 13 residues pruned to eliminate duplicates Z: 101 85.476 2.382 0.854 0.604 0.960 0.640 CB 1.827 101 residues pruned to eliminate duplicates Z: 103 77.475 2.336 0.831 0.604 0.931 0.637 CB 1.745 103 residues pruned to eliminate duplicates Z: 95 56.592 2.238 0.670 0.538 0.947 0.670 CB 1.589 95 residues pruned to eliminate duplicates Z: 26 37.556 2.341 1.033 0.502 0.920 0.560 CB 1.711 26 residues pruned to eliminate duplicates Z: 61 48.408 2.308 0.796 0.517 0.883 0.600 CB 1.678 61 residues pruned to eliminate duplicates Z: 136 81.844 2.284 0.771 0.592 0.963 0.681 CB 1.655 136 residues pruned to eliminate duplicates Z: 23 40.170 2.444 1.010 0.543 0.909 0.636 CB 1.838 23 residues pruned to eliminate duplicates Z: 61 45.742 2.309 0.750 0.497 0.883 0.633 CB 1.659 61 residues pruned to eliminate duplicates Z: 129 80.849 2.306 0.782 0.603 0.938 0.641 CB 1.682 129 residues pruned to eliminate duplicates Z: 105 78.080 2.351 0.850 0.574 0.942 0.625 CB 1.740 105 residues pruned to eliminate duplicates Z: 106 81.949 2.334 0.929 0.602 0.924 0.676 CB 1.745 106 residues pruned to eliminate duplicates Z: 129 80.727 2.297 0.827 0.595 0.945 0.641 CB 1.642 129 residues pruned to eliminate duplicates Z: 15 8.755 2.006 0.529 0.307 0.786 0.643 CB 1.202 15 residues pruned to eliminate duplicates Z: 101 81.684 2.371 0.892 0.595 0.930 0.650 CB 1.788 101 residues pruned to eliminate duplicates Z: 131 81.181 2.287 0.802 0.591 0.962 0.662 CB 1.647 131 residues pruned to eliminate duplicates Z: 80 77.301 2.391 0.967 0.597 0.937 0.696 CB 1.800 80 residues pruned to eliminate duplicates Z: 102 80.455 2.364 0.882 0.586 0.931 0.604 CB 1.781 102 residues pruned to eliminate duplicates Z: 97 78.782 2.378 0.883 0.595 0.917 0.646 CB 1.789 97 residues pruned to eliminate duplicates Z: 36 40.010 2.327 0.729 0.520 0.943 0.629 CB 1.748 36 residues pruned to eliminate duplicates Z: 38 37.273 2.268 0.723 0.501 0.946 0.595 CB 1.656 38 residues pruned to eliminate duplicates Z: 91 38.793 2.049 0.568 0.520 0.911 0.678 CB 1.370 91 residues pruned to eliminate duplicates Z: 39 36.554 2.233 0.717 0.519 0.947 0.737 CB 1.602 39 residues pruned to eliminate duplicates Z: 35 36.563 2.256 0.687 0.560 0.941 0.647 CB 1.651 35 residues pruned to eliminate duplicates Z: 36 39.333 2.293 0.669 0.519 0.971 0.600 CB 1.756 36 residues pruned to eliminate duplicates Z: 35 36.010 2.187 0.772 0.520 0.912 0.618 CB 1.713 35 residues pruned to eliminate duplicates Z: 34 38.439 2.296 0.682 0.578 0.939 0.606 CB 1.710 34 residues pruned to eliminate duplicates Z: 37 41.010 2.273 0.785 0.562 0.944 0.611 CB 1.678 37 residues pruned to eliminate duplicates Z: 30 33.131 2.281 0.706 0.549 0.931 0.621 CB 1.618 30 residues pruned to eliminate duplicates Z: 43 41.726 2.323 0.718 0.505 0.929 0.690 CB 1.730 43 residues pruned to eliminate duplicates Z: 72 39.844 2.146 0.546 0.555 0.944 0.690 CB 1.431 72 residues pruned to eliminate duplicates Z: 44 39.921 2.297 0.644 0.501 0.953 0.628 CB 1.690 44 residues pruned to eliminate duplicates Z: 33 29.914 2.196 0.652 0.508 0.906 0.656 CB 1.595 33 residues pruned to eliminate duplicates Z: 35 34.324 2.150 0.741 0.524 0.912 0.559 CB 1.686 35 residues pruned to eliminate duplicates Z: 48 36.203 2.260 0.657 0.452 0.915 0.617 CB 1.619 48 residues pruned to eliminate duplicates Z: 34 35.798 2.299 0.618 0.546 0.939 0.576 CB 1.706 34 residues pruned to eliminate duplicates Z: 106 77.707 2.303 0.902 0.599 0.924 0.667 CB 1.705 106 residues pruned to eliminate duplicates Z: 37 36.994 2.289 0.598 0.540 0.944 0.667 CB 1.717 37 residues pruned to eliminate duplicates Z: 44 37.604 2.295 0.666 0.496 0.930 0.605 CB 1.618 44 residues pruned to eliminate duplicates Z: 89 55.090 2.246 0.655 0.553 0.943 0.670 CB 1.591 89 residues pruned to eliminate duplicates Z: 34 38.116 2.301 0.651 0.558 0.939 0.727 CB 1.757 34 residues pruned to eliminate duplicates Z: 89 49.260 2.228 0.604 0.549 0.909 0.693 CB 1.540 89 residues pruned to eliminate duplicates Z: 141 85.007 2.266 0.850 0.604 0.943 0.714 CB 1.647 141 residues pruned to eliminate duplicates Z: 73 36.800 2.129 0.488 0.554 0.903 0.722 CB 1.438 73 residues pruned to eliminate duplicates Z: 44 33.317 2.243 0.699 0.465 0.837 0.605 CB 1.651 44 residues pruned to eliminate duplicates Z: 31 34.855 2.259 0.725 0.547 0.933 0.667 CB 1.671 31 residues pruned to eliminate duplicates Z: 43 41.120 2.332 0.668 0.503 0.952 0.667 CB 1.707 43 residues pruned to eliminate duplicates Z: 69 38.756 2.109 0.576 0.525 0.912 0.676 CB 1.513 69 residues pruned to eliminate duplicates Z: 45 40.977 2.245 0.741 0.507 0.955 0.727 CB 1.644 45 residues pruned to eliminate duplicates Z: 39 37.649 2.243 0.709 0.535 0.947 0.632 CB 1.625 39 residues pruned to eliminate duplicates Z: 37 24.008 1.980 0.485 0.565 0.944 0.778 CB 1.353 37 residues pruned to eliminate duplicates Z: 25 22.985 2.183 0.668 0.383 0.875 0.708 CB 1.668 25 residues pruned to eliminate duplicates Z: 43 36.419 2.298 0.599 0.516 0.929 0.643 CB 1.620 43 residues pruned to eliminate duplicates Z: 12 17.831 2.224 0.837 0.400 0.909 0.455 CB 1.608 12 residues pruned to eliminate duplicates Z: 16 12.897 1.845 0.738 0.328 0.933 0.400 CB 1.343 16 residues pruned to eliminate duplicates Z: 44 40.099 2.262 0.790 0.504 0.907 0.721 CB 1.658 44 residues pruned to eliminate duplicates Z: 38 18.318 1.986 0.384 0.491 0.892 0.676 CB 1.240 38 residues pruned to eliminate duplicates Z: 45 36.881 2.244 0.729 0.484 0.886 0.682 CB 1.643 45 residues pruned to eliminate duplicates Z: 34 23.099 1.989 0.596 0.605 0.970 0.727 CB 1.182 34 residues pruned to eliminate duplicates Z: 33 20.376 1.839 0.550 0.603 0.969 0.688 CB 1.183 33 residues pruned to eliminate duplicates Z: 34 22.222 1.952 0.505 0.622 0.970 0.758 CB 1.210 34 residues pruned to eliminate duplicates Z: 34 21.333 1.961 0.439 0.602 0.970 0.667 CB 1.232 34 residues pruned to eliminate duplicates Z: 64 43.766 2.198 0.595 0.564 0.952 0.762 CB 1.552 64 residues pruned to eliminate duplicates Z: 24 16.481 1.864 0.417 0.657 0.913 0.783 CB 1.231 24 residues pruned to eliminate duplicates Z: 25 15.406 1.864 0.356 0.647 0.917 0.750 CB 1.182 25 residues pruned to eliminate duplicates Z: 73 42.774 2.128 0.660 0.542 0.944 0.653 CB 1.451 73 residues pruned to eliminate duplicates Z: 37 19.650 1.966 0.462 0.550 0.861 0.583 CB 1.260 37 residues pruned to eliminate duplicates Z: 73 43.944 2.125 0.712 0.558 0.931 0.681 CB 1.447 73 residues pruned to eliminate duplicates Z: 37 20.938 1.863 0.706 0.539 0.889 0.722 CB 1.188 37 residues pruned to eliminate duplicates Z: 40 24.031 1.971 0.588 0.561 0.949 0.564 CB 1.221 40 residues pruned to eliminate duplicates Z: 64 42.318 2.126 0.678 0.578 0.937 0.619 CB 1.481 64 residues pruned to eliminate duplicates Z: 48 26.421 2.009 0.607 0.513 0.872 0.596 CB 1.351 48 residues pruned to eliminate duplicates Z: 38 27.557 1.987 0.686 0.559 0.919 0.595 CB 1.390 38 residues pruned to eliminate duplicates Z: 140 79.624 2.259 0.799 0.593 0.928 0.676 CB 1.638 140 residues pruned to eliminate duplicates Z: 34 25.278 1.945 0.819 0.602 0.879 0.636 CB 1.284 34 residues pruned to eliminate duplicates Z: 65 40.834 2.107 0.680 0.589 0.906 0.641 CB 1.461 65 residues pruned to eliminate duplicates Z: 40 29.205 1.973 0.818 0.584 0.949 0.692 CB 1.267 40 residues pruned to eliminate duplicates Z: 38 22.385 1.927 0.633 0.489 0.919 0.486 CB 1.287 38 residues pruned to eliminate duplicates Z: 38 28.651 1.983 0.726 0.545 0.946 0.595 CB 1.392 38 residues pruned to eliminate duplicates Z: 66 40.212 2.121 0.691 0.541 0.938 0.677 CB 1.424 66 residues pruned to eliminate duplicates Z: 32 25.254 2.024 0.630 0.611 0.903 0.742 CB 1.370 32 residues pruned to eliminate duplicates Z: 37 16.844 1.908 0.387 0.490 0.861 0.639 CB 1.244 37 residues pruned to eliminate duplicates Z: 6 2.081 1.626 0.104 0.238 0.800 0.600 CB 0.878 6 residues pruned to eliminate duplicates Z: 77 48.647 2.118 0.737 0.592 0.961 0.697 CB 1.446 77 residues pruned to eliminate duplicates Z: 40 28.465 1.964 0.828 0.585 0.923 0.590 CB 1.268 40 residues pruned to eliminate duplicates Z: 7 8.187 1.905 0.454 0.567 0.833 0.833 CB 1.357 7 residues pruned to eliminate duplicates Z: 6 8.524 2.122 0.282 0.560 1.000 0.800 CB 1.322 7 residues pruned to eliminate duplicates Z: 6 3.709 1.424 0.439 0.412 1.000 0.800 C 0.888 6 residues pruned to eliminate duplicates Z: 25 13.112 1.805 0.702 0.392 0.833 0.625 CB 1.172 42 residues pruned to eliminate duplicates Z: 10 5.572 1.815 0.479 0.335 0.667 0.222 CB 1.243 Z: 6 4.086 1.660 0.693 0.296 0.800 0.800 CA 1.022 6 residues pruned to eliminate duplicates Z: 37 58.716 2.296 0.978 0.780 0.972 0.722 CB 1.731 37 residues pruned to eliminate duplicates Z: 6 3.495 1.815 0.567 0.203 0.800 0.400 CA 0.977 6 residues pruned to eliminate duplicates Z: 32 57.441 2.313 0.916 0.786 0.968 0.806 CA 1.871 32 residues pruned to eliminate duplicates Z: 35 49.641 2.231 0.847 0.702 0.941 0.706 CB 1.826 35 residues pruned to eliminate duplicates Z: 37 58.962 2.301 0.934 0.772 1.000 0.778 CB 1.737 37 residues pruned to eliminate duplicates Z: 32 55.943 2.288 1.025 0.784 0.935 0.645 CB 1.805 32 residues pruned to eliminate duplicates Z: 38 55.490 2.248 0.937 0.758 0.973 0.649 CB 1.712 38 residues pruned to eliminate duplicates Z: 33 54.137 2.260 0.828 0.774 1.000 0.812 CB 1.818 33 residues pruned to eliminate duplicates Z: 32 54.339 2.298 0.855 0.791 0.968 0.774 CA 1.832 32 residues pruned to eliminate duplicates Z: 32 58.539 2.287 0.928 0.811 1.000 0.774 CB 1.819 32 residues pruned to eliminate duplicates Z: 47 56.723 2.242 0.859 0.726 0.978 0.739 CB 1.674 47 residues pruned to eliminate duplicates Z: 23 49.043 2.201 1.018 0.878 1.000 0.682 CB 1.709 23 residues pruned to eliminate duplicates Z: 31 60.928 2.343 0.899 0.824 1.000 0.867 CA 1.888 31 residues pruned to eliminate duplicates Z: 31 61.490 2.331 0.946 0.816 1.000 0.800 CB 1.881 31 residues pruned to eliminate duplicates Z: 32 59.935 2.318 0.964 0.800 0.968 0.806 CA 1.879 32 residues pruned to eliminate duplicates Z: 32 57.562 2.285 1.020 0.807 0.968 0.871 CB 1.771 32 residues pruned to eliminate duplicates Z: 45 54.059 2.221 0.853 0.701 0.955 0.818 CB 1.727 45 residues pruned to eliminate duplicates Z: 37 59.173 2.283 0.935 0.787 1.000 0.722 CB 1.734 37 residues pruned to eliminate duplicates Z: 46 60.250 2.203 1.009 0.707 0.978 0.689 CB 1.720 221 residues pruned to eliminate duplicates Z: 37 58.893 2.304 0.974 0.778 0.972 0.778 CB 1.736 Z: 24 47.089 2.149 0.875 0.903 1.000 0.739 CB 1.736 24 residues pruned to eliminate duplicates Z: 23 54.052 2.213 1.061 0.901 1.000 0.864 CB 1.802 23 residues pruned to eliminate duplicates Z: 32 58.646 2.270 1.028 0.782 0.968 0.806 CB 1.844 32 residues pruned to eliminate duplicates Z: 65 70.756 2.366 0.976 0.642 0.906 0.609 CB 1.829 32 residues pruned to eliminate duplicates Z: 22 47.404 2.161 1.028 0.912 1.000 0.857 CB 1.672 22 residues pruned to eliminate duplicates Z: 134 87.241 2.359 0.825 0.614 0.947 0.632 CB 1.665 70 residues pruned to eliminate duplicates Z: 9 27.830 2.366 0.990 0.709 0.875 0.750 CA 1.976 9 residues pruned to eliminate duplicates Z: 97 68.132 2.459 0.753 0.536 0.917 0.667 CB 1.698 97 residues pruned to eliminate duplicates Z: 23 24.898 2.017 0.691 0.723 0.864 0.773 CB 1.474 23 residues pruned to eliminate duplicates Z: 98 67.431 2.408 0.766 0.553 0.907 0.649 CB 1.685 98 residues pruned to eliminate duplicates Z: 100 67.538 2.401 0.771 0.528 0.919 0.697 CB 1.689 100 residues pruned to eliminate duplicates Z: 43 51.712 2.507 0.897 0.569 0.905 0.643 CB 1.735 43 residues pruned to eliminate duplicates Z: 48 44.183 2.474 0.832 0.483 0.872 0.596 CB 1.659 48 residues pruned to eliminate duplicates Z: 81 58.607 2.412 0.825 0.491 0.900 0.575 CB 1.670 81 residues pruned to eliminate duplicates Z: 42 55.114 2.541 0.937 0.565 0.927 0.634 CB 1.771 42 residues pruned to eliminate duplicates Z: 129 84.941 2.396 0.876 0.589 0.914 0.664 CB 1.677 129 residues pruned to eliminate duplicates Z: 33 50.907 2.546 1.030 0.532 0.906 0.656 CB 1.862 33 residues pruned to eliminate duplicates Z: 33 57.500 2.530 1.163 0.565 0.938 0.625 CB 1.860 33 residues pruned to eliminate duplicates Z: 98 68.939 2.413 0.752 0.549 0.918 0.670 CB 1.721 97 residues pruned to eliminate duplicates Z: 12 33.547 2.638 0.927 0.685 0.909 0.818 CB 1.847 12 residues pruned to eliminate duplicates Z: 34 49.876 2.497 1.032 0.552 0.909 0.606 CB 1.790 34 residues pruned to eliminate duplicates Z: 37 41.085 2.487 0.918 0.490 0.861 0.694 CB 1.683 37 residues pruned to eliminate duplicates Z: 72 71.272 2.465 0.920 0.572 0.958 0.606 CB 1.741 72 residues pruned to eliminate duplicates Z: 47 45.241 2.441 0.821 0.482 0.913 0.543 CB 1.674 47 residues pruned to eliminate duplicates Z: 67 58.785 2.394 0.885 0.533 0.939 0.545 CB 1.653 67 residues pruned to eliminate duplicates Z: 94 73.414 2.459 0.796 0.571 0.935 0.656 CB 1.720 97 residues pruned to eliminate duplicates Z: 14 23.830 2.225 0.778 0.657 0.923 0.615 CA 1.564 14 residues pruned to eliminate duplicates Z: 34 51.561 2.526 1.071 0.538 0.909 0.545 CB 1.818 34 residues pruned to eliminate duplicates Z: 99 66.581 2.413 0.787 0.520 0.918 0.663 CB 1.666 95 residues pruned to eliminate duplicates Z: 6 10.716 2.151 1.328 0.295 0.800 0.800 CA 1.504 6 residues pruned to eliminate duplicates Z: 100 64.984 2.411 0.709 0.534 0.939 0.727 CB 1.632 100 residues pruned to eliminate duplicates Z: 48 50.437 2.432 0.873 0.474 0.936 0.511 CB 1.772 48 residues pruned to eliminate duplicates Z: 91 64.890 2.426 0.739 0.528 0.933 0.644 CB 1.689 91 residues pruned to eliminate duplicates Z: 26 28.471 2.326 0.973 0.424 0.880 0.600 CB 1.526 26 residues pruned to eliminate duplicates Z: 33 54.464 2.562 0.995 0.561 0.938 0.625 CB 1.895 33 residues pruned to eliminate duplicates Z: 137 81.990 2.386 0.852 0.545 0.919 0.610 CB 1.655 98 residues pruned to eliminate duplicates Z: 6 3.458 1.904 0.340 0.344 0.800 0.600 CB 0.898 6 residues pruned to eliminate duplicates Z: 58 57.421 2.444 0.871 0.515 0.930 0.632 CB 1.762 58 residues pruned to eliminate duplicates Z: 36 35.429 2.309 0.735 0.488 0.914 0.686 CB 1.655 36 residues pruned to eliminate duplicates Z: 67 51.046 2.358 0.708 0.502 0.955 0.697 CB 1.631 67 residues pruned to eliminate duplicates Z: 36 34.085 2.253 0.645 0.522 0.914 0.686 CB 1.663 36 residues pruned to eliminate duplicates Z: 46 46.972 2.516 0.754 0.503 0.889 0.644 CB 1.779 46 residues pruned to eliminate duplicates Z: 70 54.554 2.398 0.679 0.533 0.928 0.696 CB 1.702 70 residues pruned to eliminate duplicates Z: 42 29.019 2.213 0.686 0.432 0.829 0.537 CB 1.571 42 residues pruned to eliminate duplicates Z: 56 55.558 2.446 0.893 0.526 0.909 0.636 CB 1.735 56 residues pruned to eliminate duplicates Z: 81 42.915 2.305 0.562 0.513 0.838 0.663 CB 1.571 81 residues pruned to eliminate duplicates Z: 65 66.322 2.445 0.903 0.565 0.938 0.734 CB 1.784 65 residues pruned to eliminate duplicates Z: 37 34.570 2.252 0.711 0.521 0.889 0.583 CB 1.647 37 residues pruned to eliminate duplicates Z: 84 71.194 2.489 0.871 0.523 0.928 0.651 CB 1.767 84 residues pruned to eliminate duplicates Z: 57 46.857 2.345 0.649 0.545 0.929 0.750 CB 1.668 57 residues pruned to eliminate duplicates Z: 76 51.055 2.367 0.786 0.479 0.867 0.587 CB 1.644 76 residues pruned to eliminate duplicates Z: 56 30.940 2.149 0.765 0.407 0.818 0.509 CB 1.483 56 residues pruned to eliminate duplicates Z: 68 46.170 2.308 0.627 0.489 0.925 0.552 CB 1.641 68 residues pruned to eliminate duplicates Z: 97 75.663 2.471 0.815 0.546 0.938 0.719 CB 1.755 97 residues pruned to eliminate duplicates Z: 38 24.686 2.081 0.684 0.447 0.838 0.595 CB 1.460 38 residues pruned to eliminate duplicates Z: 32 31.224 2.238 0.676 0.469 0.903 0.645 CB 1.709 32 residues pruned to eliminate duplicates Z: 66 58.478 2.396 0.901 0.532 0.908 0.662 CB 1.700 66 residues pruned to eliminate duplicates Z: 99 75.240 2.435 0.822 0.523 0.949 0.694 CB 1.765 99 residues pruned to eliminate duplicates Z: 72 52.065 2.371 0.669 0.500 0.930 0.704 CB 1.679 72 residues pruned to eliminate duplicates Z: 99 76.090 2.447 0.874 0.539 0.929 0.694 CB 1.738 99 residues pruned to eliminate duplicates Z: 65 53.475 2.403 0.654 0.536 0.969 0.734 CB 1.675 65 residues pruned to eliminate duplicates Z: 98 68.530 2.425 0.739 0.541 0.918 0.670 CB 1.728 98 residues pruned to eliminate duplicates Z: 36 36.322 2.430 0.501 0.521 0.914 0.629 CB 1.803 36 residues pruned to eliminate duplicates Z: 79 56.807 2.366 0.765 0.496 0.923 0.705 CB 1.676 79 residues pruned to eliminate duplicates Z: 40 31.311 2.281 0.544 0.496 0.872 0.692 CB 1.640 40 residues pruned to eliminate duplicates Z: 43 48.354 2.362 0.753 0.602 0.976 0.690 CB 1.674 43 residues pruned to eliminate duplicates Z: 44 42.256 2.352 0.778 0.499 0.953 0.605 CB 1.618 44 residues pruned to eliminate duplicates Z: 96 63.266 2.379 0.749 0.524 0.895 0.653 CB 1.703 96 residues pruned to eliminate duplicates Z: 33 40.049 2.434 0.687 0.620 0.938 0.812 CB 1.643 33 residues pruned to eliminate duplicates Z: 34 41.887 2.470 0.767 0.586 0.909 0.758 CB 1.692 34 residues pruned to eliminate duplicates Z: 88 67.228 2.435 0.800 0.540 0.908 0.655 CB 1.741 88 residues pruned to eliminate duplicates Z: 96 73.571 2.444 0.841 0.554 0.926 0.684 CB 1.719 96 residues pruned to eliminate duplicates Z: 73 51.348 2.350 0.698 0.497 0.903 0.667 CB 1.686 73 residues pruned to eliminate duplicates Z: 89 59.876 2.356 0.804 0.527 0.909 0.670 CB 1.608 89 residues pruned to eliminate duplicates Z: 59 52.768 2.385 0.754 0.559 0.931 0.759 CB 1.680 59 residues pruned to eliminate duplicates Z: 96 72.397 2.473 0.758 0.548 0.937 0.684 CB 1.739 96 residues pruned to eliminate duplicates Z: 39 45.373 2.417 0.737 0.545 0.974 0.632 CB 1.724 39 residues pruned to eliminate duplicates Z: 56 45.391 2.265 0.750 0.554 0.964 0.673 CB 1.520 56 residues pruned to eliminate duplicates Z: 21 35.034 2.438 0.546 0.755 0.950 0.800 CB 1.743 21 residues pruned to eliminate duplicates Z: 66 51.813 2.376 0.711 0.524 0.923 0.600 CB 1.673 66 residues pruned to eliminate duplicates Z: 34 38.890 2.460 0.635 0.587 0.909 0.606 CB 1.703 34 residues pruned to eliminate duplicates Z: 96 83.413 2.484 0.948 0.556 0.947 0.663 CB 1.769 96 residues pruned to eliminate duplicates Z: 37 42.787 2.301 0.885 0.578 0.917 0.639 CB 1.665 37 residues pruned to eliminate duplicates Z: 65 55.448 2.367 0.904 0.548 0.938 0.688 CB 1.565 65 residues pruned to eliminate duplicates Z: 91 75.232 2.430 0.923 0.542 0.933 0.711 CB 1.745 91 residues pruned to eliminate duplicates Z: 75 64.853 2.369 0.841 0.604 0.946 0.703 CB 1.656 75 residues pruned to eliminate duplicates Z: 25 39.499 2.355 0.761 0.683 1.000 0.625 CB 1.643 25 residues pruned to eliminate duplicates Z: 66 59.449 2.385 0.874 0.558 0.923 0.677 CB 1.689 66 residues pruned to eliminate duplicates Z: 55 61.959 2.357 1.107 0.594 0.907 0.704 CB 1.711 55 residues pruned to eliminate duplicates Z: 131 95.684 2.381 1.001 0.600 0.931 0.638 CB 1.721 131 residues pruned to eliminate duplicates Z: 72 56.045 2.333 0.906 0.526 0.901 0.676 CB 1.618 72 residues pruned to eliminate duplicates Z: 26 33.757 2.270 0.950 0.634 0.880 0.560 CB 1.529 26 residues pruned to eliminate duplicates Z: 35 40.671 2.347 0.873 0.574 0.912 0.647 CB 1.620 35 residues pruned to eliminate duplicates Z: 36 43.421 2.329 0.805 0.600 0.943 0.686 CB 1.683 36 residues pruned to eliminate duplicates Z: 123 88.348 2.437 0.951 0.577 0.910 0.656 CB 1.717 123 residues pruned to eliminate duplicates Z: 125 84.081 2.396 0.983 0.549 0.911 0.677 CB 1.663 125 residues pruned to eliminate duplicates Z: 25 32.086 2.270 0.993 0.570 0.875 0.625 CB 1.547 25 residues pruned to eliminate duplicates Z: 92 72.141 2.363 0.961 0.555 0.934 0.670 CB 1.657 92 residues pruned to eliminate duplicates Z: 118 87.857 2.442 0.950 0.559 0.915 0.658 CB 1.760 118 residues pruned to eliminate duplicates Z: 96 68.554 2.332 0.922 0.538 0.916 0.579 CB 1.652 116 residues pruned to eliminate duplicates Z: 19 21.868 2.020 0.744 0.613 0.944 0.611 CB 1.392 19 residues pruned to eliminate duplicates Z: 91 68.048 2.375 0.883 0.555 0.922 0.667 CB 1.650 86 residues pruned to eliminate duplicates Z: 16 32.665 2.187 0.857 0.770 1.000 0.667 CB 1.635 16 residues pruned to eliminate duplicates Z: 124 86.517 2.419 0.930 0.542 0.935 0.699 CB 1.716 123 residues pruned to eliminate duplicates Z: 13 26.165 2.140 0.564 0.912 1.000 0.917 CA 1.598 13 residues pruned to eliminate duplicates Z: 29 33.580 2.342 0.891 0.538 0.857 0.643 CB 1.611 29 residues pruned to eliminate duplicates Z: 65 63.512 2.355 0.963 0.590 0.953 0.641 CB 1.653 65 residues pruned to eliminate duplicates Z: 59 55.540 2.348 0.934 0.589 0.931 0.603 CB 1.584 59 residues pruned to eliminate duplicates Z: 26 27.410 2.161 0.924 0.505 0.800 0.560 CB 1.639 26 residues pruned to eliminate duplicates Z: 33 40.030 2.368 1.015 0.588 0.812 0.562 CB 1.678 33 residues pruned to eliminate duplicates Z: 28 30.503 2.281 0.800 0.502 0.889 0.630 CB 1.606 28 residues pruned to eliminate duplicates Z: 27 30.191 2.239 0.862 0.576 0.885 0.615 CB 1.492 27 residues pruned to eliminate duplicates Z: 21 26.077 2.175 0.963 0.560 0.850 0.750 CB 1.516 21 residues pruned to eliminate duplicates Z: 82 57.750 2.301 0.786 0.566 0.901 0.580 CB 1.625 82 residues pruned to eliminate duplicates Z: 80 63.145 2.367 0.861 0.576 0.911 0.684 CB 1.644 80 residues pruned to eliminate duplicates Z: 103 80.647 2.397 1.037 0.553 0.951 0.598 CB 1.634 105 residues pruned to eliminate duplicates Z: 6 6.656 1.792 0.650 0.355 0.800 0.400 CA 1.473 6 residues pruned to eliminate duplicates Z: 62 66.327 2.427 1.005 0.606 0.951 0.672 CB 1.658 47 residues pruned to eliminate duplicates Z: 6 5.709 1.707 0.737 0.364 1.000 1.000 CB 0.997 6 residues pruned to eliminate duplicates Z: 18 18.835 2.106 0.812 0.524 0.824 0.647 CB 1.420 18 residues pruned to eliminate duplicates Z: 15 29.946 2.417 0.885 0.616 0.929 0.786 CB 1.695 15 residues pruned to eliminate duplicates Z: 16 29.412 2.343 1.001 0.601 0.867 0.667 CB 1.696 16 residues pruned to eliminate duplicates Z: 80 63.917 2.381 0.980 0.548 0.899 0.620 CB 1.620 80 residues pruned to eliminate duplicates Z: 106 76.587 2.396 0.985 0.559 0.895 0.676 CB 1.659 106 residues pruned to eliminate duplicates Z: 22 20.533 2.182 0.785 0.559 0.762 0.667 CB 1.425 22 residues pruned to eliminate duplicates Z: 38 43.109 2.357 0.960 0.526 0.892 0.568 CB 1.676 38 residues pruned to eliminate duplicates Z: 69 79.583 2.470 1.005 0.635 0.941 0.721 CB 1.824 69 residues pruned to eliminate duplicates Z: 80 54.883 2.385 0.734 0.527 0.861 0.722 CB 1.688 80 residues pruned to eliminate duplicates Z: 68 74.832 2.493 0.928 0.650 0.925 0.761 CB 1.787 68 residues pruned to eliminate duplicates Z: 49 64.348 2.438 0.973 0.693 0.917 0.729 CB 1.765 49 residues pruned to eliminate duplicates Z: 68 82.142 2.505 0.996 0.654 0.940 0.746 CB 1.849 68 residues pruned to eliminate duplicates Z: 18 18.608 1.988 0.766 0.541 0.941 0.706 CB 1.313 18 residues pruned to eliminate duplicates Z: 128 89.766 2.436 0.780 0.597 0.937 0.685 CB 1.787 128 residues pruned to eliminate duplicates Z: 67 77.406 2.506 0.872 0.652 0.970 0.742 CB 1.819 67 residues pruned to eliminate duplicates Z: 131 86.023 2.432 0.743 0.589 0.915 0.731 CB 1.785 131 residues pruned to eliminate duplicates Z: 64 73.943 2.547 0.833 0.642 0.905 0.714 CB 1.931 64 residues pruned to eliminate duplicates Z: 114 88.702 2.494 0.857 0.587 0.929 0.664 CB 1.784 114 residues pruned to eliminate duplicates Z: 136 89.719 2.441 0.742 0.588 0.933 0.704 CB 1.788 136 residues pruned to eliminate duplicates Z: 134 92.836 2.445 0.787 0.607 0.947 0.707 CB 1.757 134 residues pruned to eliminate duplicates Z: 68 79.355 2.503 0.951 0.658 0.955 0.731 CB 1.794 68 residues pruned to eliminate duplicates Z: 67 77.861 2.515 0.895 0.663 0.970 0.773 CB 1.783 67 residues pruned to eliminate duplicates Z: 48 68.072 2.402 0.993 0.717 0.957 0.787 CB 1.781 48 residues pruned to eliminate duplicates Z: 48 60.735 2.434 0.922 0.662 0.915 0.787 CB 1.781 48 residues pruned to eliminate duplicates Z: 53 59.692 2.360 0.984 0.654 0.923 0.750 CB 1.659 53 residues pruned to eliminate duplicates Z: 63 77.811 2.536 0.969 0.655 0.919 0.742 CB 1.863 63 residues pruned to eliminate duplicates Z: 45 65.328 2.424 0.947 0.689 0.955 0.682 CB 1.839 45 residues pruned to eliminate duplicates Z: 62 78.990 2.558 0.956 0.656 0.918 0.705 CB 1.905 62 residues pruned to eliminate duplicates Z: 63 80.007 2.534 0.991 0.653 0.935 0.742 CB 1.868 63 residues pruned to eliminate duplicates Z: 62 80.953 2.554 1.045 0.639 0.918 0.705 CB 1.898 62 residues pruned to eliminate duplicates Z: 68 76.932 2.493 1.003 0.643 0.925 0.716 CB 1.779 68 residues pruned to eliminate duplicates Z: 69 74.194 2.475 0.950 0.653 0.926 0.765 CB 1.745 69 residues pruned to eliminate duplicates Z: 69 78.243 2.488 0.965 0.627 0.956 0.721 CB 1.802 69 residues pruned to eliminate duplicates Z: 131 93.396 2.446 0.813 0.595 0.938 0.731 CB 1.798 131 residues pruned to eliminate duplicates Z: 106 91.570 2.477 0.917 0.605 0.943 0.705 CB 1.807 106 residues pruned to eliminate duplicates Z: 66 83.001 2.498 1.122 0.643 0.923 0.769 CB 1.841 66 residues pruned to eliminate duplicates Z: 68 83.111 2.491 1.063 0.653 0.955 0.761 CB 1.795 68 residues pruned to eliminate duplicates Z: 68 79.705 2.467 1.012 0.649 0.955 0.716 CB 1.787 68 residues pruned to eliminate duplicates Z: 62 92.004 2.559 1.122 0.651 0.967 0.770 CB 1.949 62 residues pruned to eliminate duplicates Z: 64 59.860 2.311 1.067 0.604 0.873 0.635 CB 1.638 64 residues pruned to eliminate duplicates Z: 75 78.793 2.461 1.056 0.611 0.905 0.635 CB 1.799 75 residues pruned to eliminate duplicates Z: 129 99.910 2.469 0.880 0.607 0.945 0.688 CB 1.818 129 residues pruned to eliminate duplicates Z: 51 66.515 2.393 1.124 0.676 0.920 0.720 CB 1.711 51 residues pruned to eliminate duplicates Z: 142 93.273 2.385 0.798 0.592 0.943 0.688 CB 1.778 142 residues pruned to eliminate duplicates Z: 68 85.252 2.501 1.106 0.654 0.940 0.731 CB 1.822 68 residues pruned to eliminate duplicates Z: 85 79.814 2.489 0.975 0.604 0.929 0.726 CB 1.728 85 residues pruned to eliminate duplicates Z: 68 79.201 2.491 1.025 0.655 0.940 0.776 CB 1.766 68 residues pruned to eliminate duplicates Z: 97 68.693 2.421 0.677 0.534 0.938 0.667 CB 1.780 97 residues pruned to eliminate duplicates Z: 70 74.641 2.446 0.971 0.637 0.928 0.754 CB 1.768 70 residues pruned to eliminate duplicates Z: 100 64.797 2.391 0.617 0.536 0.929 0.646 CB 1.750 100 residues pruned to eliminate duplicates Z: 25 29.068 2.193 0.876 0.502 0.875 0.625 CB 1.645 25 residues pruned to eliminate duplicates Z: 67 84.203 2.508 1.101 0.665 0.924 0.758 CB 1.827 67 residues pruned to eliminate duplicates Z: 68 82.008 2.485 1.014 0.669 0.940 0.746 CB 1.821 68 residues pruned to eliminate duplicates Z: 70 81.742 2.457 1.052 0.636 0.957 0.725 CB 1.795 70 residues pruned to eliminate duplicates Z: 134 93.809 2.435 0.859 0.590 0.925 0.699 CB 1.783 134 residues pruned to eliminate duplicates Z: 61 93.429 2.592 1.141 0.672 0.950 0.733 CB 1.952 67 residues pruned to eliminate duplicates Z: 11 43.005 2.798 0.703 0.769 1.000 0.800 CB 2.249 11 residues pruned to eliminate duplicates Z: 39 43.286 2.481 0.824 0.480 0.895 0.579 CB 1.769 39 residues pruned to eliminate duplicates Z: 134 88.487 2.438 0.749 0.594 0.925 0.692 CB 1.778 134 residues pruned to eliminate duplicates Z: 89 65.887 2.419 0.672 0.530 0.932 0.670 CB 1.808 89 residues pruned to eliminate duplicates Z: 85 81.017 2.473 0.963 0.595 0.964 0.643 CB 1.726 85 residues pruned to eliminate duplicates Z: 69 78.970 2.469 1.017 0.637 0.956 0.735 CB 1.769 69 residues pruned to eliminate duplicates Z: 22 37.102 2.558 0.797 0.537 0.905 0.714 CB 1.877 22 residues pruned to eliminate duplicates Z: 135 92.439 2.422 0.819 0.600 0.940 0.694 CB 1.752 135 residues pruned to eliminate duplicates Z: 105 102.789 2.476 1.040 0.626 0.962 0.644 CB 1.842 105 residues pruned to eliminate duplicates Z: 63 84.540 2.541 1.078 0.644 0.935 0.661 CB 1.900 63 residues pruned to eliminate duplicates Z: 24 37.271 2.553 0.794 0.482 0.870 0.652 CB 1.987 24 residues pruned to eliminate duplicates Z: 70 82.445 2.501 0.936 0.665 0.957 0.754 CB 1.839 70 residues pruned to eliminate duplicates Z: 135 87.221 2.422 0.792 0.596 0.903 0.679 CB 1.753 129 residues pruned to eliminate duplicates Z: 6 5.673 1.952 0.263 0.377 0.800 0.800 CA 1.467 6 residues pruned to eliminate duplicates Z: 25 39.662 2.511 0.887 0.525 0.917 0.583 CB 1.819 25 residues pruned to eliminate duplicates Z: 68 77.812 2.459 0.930 0.655 0.970 0.776 CB 1.788 68 residues pruned to eliminate duplicates Z: 35 33.469 2.306 0.745 0.404 0.912 0.559 CB 1.731 35 residues pruned to eliminate duplicates Z: 93 56.100 2.286 0.618 0.541 0.913 0.652 CB 1.663 93 residues pruned to eliminate duplicates Z: 70 61.920 2.379 0.756 0.550 0.957 0.696 CB 1.777 70 residues pruned to eliminate duplicates Z: 103 93.344 2.514 0.950 0.598 0.931 0.686 CB 1.844 103 residues pruned to eliminate duplicates Z: 88 54.266 2.344 0.562 0.517 0.920 0.621 CB 1.700 88 residues pruned to eliminate duplicates Z: 73 55.101 2.332 0.665 0.542 0.917 0.736 CB 1.752 73 residues pruned to eliminate duplicates Z: 143 95.705 2.406 0.842 0.570 0.944 0.690 CB 1.795 143 residues pruned to eliminate duplicates Z: 50 46.399 2.423 0.725 0.524 0.857 0.694 CB 1.806 50 residues pruned to eliminate duplicates Z: 86 79.776 2.448 0.939 0.602 0.976 0.694 CB 1.694 86 residues pruned to eliminate duplicates Z: 50 47.564 2.417 0.758 0.479 0.918 0.612 CB 1.779 50 residues pruned to eliminate duplicates Z: 23 17.841 2.255 0.553 0.327 0.818 0.500 CB 1.605 23 residues pruned to eliminate duplicates Z: 72 57.475 2.361 0.714 0.532 0.944 0.718 CB 1.732 72 residues pruned to eliminate duplicates Z: 32 42.395 2.420 0.815 0.538 0.935 0.645 CB 1.786 32 residues pruned to eliminate duplicates Z: 42 44.288 2.421 0.653 0.527 0.927 0.561 CB 1.816 42 residues pruned to eliminate duplicates Z: 117 85.550 2.457 0.849 0.559 0.914 0.647 CB 1.806 117 residues pruned to eliminate duplicates Z: 111 83.814 2.422 0.870 0.560 0.909 0.682 CB 1.830 111 residues pruned to eliminate duplicates Z: 131 96.127 2.409 0.849 0.585 0.969 0.608 CB 1.800 131 residues pruned to eliminate duplicates Z: 74 51.129 2.187 0.711 0.556 0.932 0.712 CB 1.626 74 residues pruned to eliminate duplicates Z: 71 54.343 2.340 0.596 0.561 0.943 0.700 CB 1.739 71 residues pruned to eliminate duplicates Z: 71 54.075 2.324 0.618 0.535 0.943 0.643 CB 1.762 71 residues pruned to eliminate duplicates Z: 55 44.675 2.277 0.628 0.570 0.907 0.685 CB 1.690 55 residues pruned to eliminate duplicates Z: 26 41.139 2.361 0.802 0.568 0.920 0.600 C 1.969 26 residues pruned to eliminate duplicates Z: 55 48.811 2.331 0.645 0.564 0.926 0.648 CB 1.757 55 residues pruned to eliminate duplicates Z: 60 44.240 2.330 0.668 0.486 0.847 0.576 CB 1.773 60 residues pruned to eliminate duplicates Z: 134 93.926 2.435 0.821 0.601 0.955 0.737 CB 1.746 134 residues pruned to eliminate duplicates Z: 72 48.655 2.336 0.515 0.541 0.930 0.690 CB 1.686 72 residues pruned to eliminate duplicates Z: 41 44.384 2.413 0.644 0.528 0.925 0.650 CB 1.860 41 residues pruned to eliminate duplicates Z: 71 50.626 2.343 0.585 0.545 0.886 0.671 CB 1.761 71 residues pruned to eliminate duplicates Z: 133 86.901 2.387 0.821 0.596 0.917 0.674 CB 1.731 133 residues pruned to eliminate duplicates Z: 67 47.056 2.315 0.494 0.538 0.924 0.727 CB 1.745 67 residues pruned to eliminate duplicates Z: 46 35.496 2.240 0.497 0.522 0.933 0.733 CB 1.655 46 residues pruned to eliminate duplicates Z: 70 50.717 2.356 0.579 0.553 0.913 0.739 CB 1.706 70 residues pruned to eliminate duplicates Z: 49 41.768 2.228 0.676 0.516 0.938 0.708 CB 1.694 49 residues pruned to eliminate duplicates Z: 70 54.086 2.351 0.619 0.540 0.928 0.652 CB 1.772 70 residues pruned to eliminate duplicates Z: 71 52.930 2.319 0.635 0.552 0.914 0.714 CB 1.736 71 residues pruned to eliminate duplicates Z: 64 55.028 2.383 0.598 0.560 0.968 0.698 CB 1.774 64 residues pruned to eliminate duplicates Z: 70 54.855 2.367 0.691 0.553 0.913 0.681 CB 1.716 70 residues pruned to eliminate duplicates Z: 71 58.425 2.382 0.678 0.526 0.943 0.743 CB 1.806 71 residues pruned to eliminate duplicates Z: 133 94.520 2.429 0.829 0.597 0.947 0.705 CB 1.783 133 residues pruned to eliminate duplicates Z: 72 60.154 2.402 0.701 0.548 0.930 0.648 CB 1.794 72 residues pruned to eliminate duplicates Z: 34 32.291 2.182 0.543 0.599 0.970 0.848 CB 1.566 34 residues pruned to eliminate duplicates Z: 134 97.593 2.443 0.854 0.609 0.940 0.737 CB 1.793 134 residues pruned to eliminate duplicates Z: 112 89.348 2.479 0.879 0.577 0.919 0.703 CB 1.839 112 residues pruned to eliminate duplicates Z: 87 58.501 2.263 0.701 0.564 0.942 0.674 CB 1.635 87 residues pruned to eliminate duplicates Z: 35 31.956 2.142 0.548 0.568 0.971 0.706 CB 1.595 35 residues pruned to eliminate duplicates Z: 35 34.288 2.191 0.693 0.597 0.941 0.735 CB 1.536 35 residues pruned to eliminate duplicates Z: 97 70.611 2.420 0.739 0.545 0.917 0.729 CB 1.789 97 residues pruned to eliminate duplicates Z: 72 59.634 2.363 0.762 0.549 0.915 0.732 CB 1.770 72 residues pruned to eliminate duplicates Z: 134 97.917 2.445 0.833 0.606 0.955 0.684 CB 1.795 134 residues pruned to eliminate duplicates Z: 32 33.036 2.233 0.695 0.609 0.903 0.710 CB 1.565 32 residues pruned to eliminate duplicates Z: 133 95.239 2.426 0.865 0.582 0.932 0.667 CB 1.818 133 residues pruned to eliminate duplicates Z: 35 33.868 2.177 0.697 0.609 0.941 0.794 CB 1.507 35 residues pruned to eliminate duplicates Z: 133 83.498 2.338 0.824 0.603 0.902 0.689 CB 1.714 133 residues pruned to eliminate duplicates Z: 57 52.151 2.292 0.792 0.603 0.875 0.750 CB 1.758 57 residues pruned to eliminate duplicates Z: 34 30.796 2.156 0.671 0.600 0.909 0.727 CB 1.489 34 residues pruned to eliminate duplicates Z: 35 33.397 2.081 0.753 0.560 0.971 0.559 CB 1.526 35 residues pruned to eliminate duplicates Z: 29 38.316 2.258 0.790 0.665 0.929 0.643 CB 1.656 29 residues pruned to eliminate duplicates Z: 32 41.839 2.219 0.893 0.632 0.968 0.742 CB 1.633 32 residues pruned to eliminate duplicates Z: 34 36.490 2.153 0.780 0.598 0.970 0.697 CB 1.557 34 residues pruned to eliminate duplicates Z: 35 36.722 2.169 0.879 0.602 0.912 0.676 CB 1.539 35 residues pruned to eliminate duplicates Z: 70 63.496 2.375 0.884 0.555 0.928 0.652 CB 1.745 70 residues pruned to eliminate duplicates Z: 34 36.063 2.206 0.822 0.610 0.909 0.727 CB 1.548 34 residues pruned to eliminate duplicates Z: 70 59.067 2.373 0.765 0.550 0.928 0.681 CB 1.744 70 residues pruned to eliminate duplicates Z: 33 39.012 2.171 0.846 0.609 0.969 0.719 CB 1.602 33 residues pruned to eliminate duplicates Z: 22 33.746 2.172 0.887 0.710 0.952 0.762 CB 1.559 22 residues pruned to eliminate duplicates Z: 37 34.394 2.143 0.804 0.541 0.917 0.556 CB 1.554 37 residues pruned to eliminate duplicates Z: 28 24.101 1.983 0.770 0.622 0.926 0.630 CB 1.272 28 residues pruned to eliminate duplicates Z: 91 64.603 2.318 0.821 0.571 0.922 0.667 CB 1.633 91 residues pruned to eliminate duplicates Z: 40 44.982 2.265 0.926 0.591 0.923 0.590 CB 1.639 40 residues pruned to eliminate duplicates Z: 66 50.801 2.216 0.786 0.573 0.892 0.615 CB 1.663 66 residues pruned to eliminate duplicates Z: 21 30.062 2.202 0.665 0.681 1.000 0.750 CB 1.552 21 residues pruned to eliminate duplicates Z: 22 29.057 2.117 0.704 0.665 0.952 0.762 CB 1.584 22 residues pruned to eliminate duplicates Z: 26 25.231 2.128 0.820 0.562 0.840 0.640 CB 1.461 26 residues pruned to eliminate duplicates Z: 22 31.673 2.112 0.752 0.673 1.000 0.905 CB 1.592 22 residues pruned to eliminate duplicates Z: 22 31.274 2.089 0.755 0.693 1.000 0.714 CB 1.559 22 residues pruned to eliminate duplicates Z: 22 29.526 2.053 0.809 0.672 0.952 0.714 CB 1.555 22 residues pruned to eliminate duplicates Z: 23 29.920 2.087 0.833 0.624 1.000 0.773 CB 1.484 23 residues pruned to eliminate duplicates Z: 22 26.983 2.088 0.689 0.628 1.000 0.619 CB 1.481 22 residues pruned to eliminate duplicates Z: 92 64.522 2.305 0.770 0.582 0.912 0.670 CB 1.680 92 residues pruned to eliminate duplicates Z: 22 26.389 2.111 0.758 0.632 0.952 0.714 CB 1.440 22 residues pruned to eliminate duplicates Z: 23 15.974 2.006 0.580 0.565 0.818 0.682 CB 1.233 23 residues pruned to eliminate duplicates Z: 15 15.534 1.940 0.613 0.687 0.857 0.714 CB 1.303 15 residues pruned to eliminate duplicates Z: 21 27.409 2.075 0.799 0.656 0.950 0.750 CB 1.496 21 residues pruned to eliminate duplicates Z: 24 30.836 2.069 0.799 0.656 1.000 0.696 CB 1.494 24 residues pruned to eliminate duplicates Z: 25 34.104 2.221 0.891 0.616 0.958 0.667 CB 1.550 25 residues pruned to eliminate duplicates Z: 21 30.994 2.117 0.844 0.685 0.950 0.750 CB 1.577 21 residues pruned to eliminate duplicates Z: 160 103.996 2.389 0.930 0.603 0.943 0.648 CB 1.720 160 residues pruned to eliminate duplicates Z: 22 22.109 2.024 0.781 0.584 0.905 0.762 CB 1.364 22 residues pruned to eliminate duplicates Z: 84 59.649 2.259 0.800 0.565 0.952 0.663 CB 1.589 84 residues pruned to eliminate duplicates Z: 27 24.884 2.147 0.725 0.560 0.885 0.577 CB 1.405 27 residues pruned to eliminate duplicates Z: 6 6.645 1.859 1.356 0.421 0.600 0.400 CB 1.228 6 residues pruned to eliminate duplicates Z: 11 6.429 2.040 0.658 0.332 0.700 0.300 CB 1.031 11 residues pruned to eliminate duplicates Z: 61 43.039 2.167 0.772 0.621 0.900 0.683 CB 1.434 61 residues pruned to eliminate duplicates Z: 10 7.484 1.985 0.674 0.340 0.778 0.333 CB 1.149 10 residues pruned to eliminate duplicates Z: 29 25.919 2.182 0.755 0.572 0.893 0.607 CB 1.337 29 residues pruned to eliminate duplicates Z: 111 66.085 2.297 0.769 0.571 0.909 0.655 CB 1.593 111 residues pruned to eliminate duplicates Z: 40 30.555 2.147 0.771 0.566 0.872 0.615 CB 1.385 40 residues pruned to eliminate duplicates Z: 38 36.743 2.206 0.856 0.610 0.919 0.703 CB 1.446 38 residues pruned to eliminate duplicates Z: 39 35.238 2.168 0.803 0.606 0.921 0.605 CB 1.436 39 residues pruned to eliminate duplicates Z: 14 21.010 2.168 0.833 0.600 0.923 0.615 CB 1.443 14 residues pruned to eliminate duplicates Z: 20 16.638 2.152 0.916 0.451 0.789 0.579 CB 1.232 20 residues pruned to eliminate duplicates Z: 14 18.226 2.193 0.779 0.617 0.769 0.692 CB 1.508 14 residues pruned to eliminate duplicates Z: 10 23.952 2.179 1.251 0.720 0.889 0.778 CB 1.501 10 residues pruned to eliminate duplicates Z: 6 4.487 1.767 0.838 0.345 0.600 0.400 CA 1.218 6 residues pruned to eliminate duplicates Z: 70 65.366 2.390 0.888 0.615 0.899 0.652 CB 1.740 70 residues pruned to eliminate duplicates Z: 70 69.801 2.377 0.867 0.642 0.957 0.710 CB 1.733 70 residues pruned to eliminate duplicates Z: 65 73.880 2.416 0.966 0.646 0.938 0.688 CB 1.810 65 residues pruned to eliminate duplicates Z: 64 73.165 2.413 0.939 0.660 0.968 0.667 CB 1.754 64 residues pruned to eliminate duplicates Z: 73 64.458 2.385 0.842 0.600 0.903 0.611 CB 1.741 73 residues pruned to eliminate duplicates Z: 48 53.360 2.276 0.953 0.657 0.915 0.702 CB 1.654 48 residues pruned to eliminate duplicates Z: 135 78.379 2.317 0.755 0.598 0.925 0.701 CB 1.639 135 residues pruned to eliminate duplicates Z: 55 46.707 2.239 0.709 0.650 0.944 0.667 CB 1.530 55 residues pruned to eliminate duplicates Z: 79 75.266 2.414 0.884 0.589 0.974 0.679 CB 1.766 79 residues pruned to eliminate duplicates Z: 75 64.315 2.352 0.858 0.619 0.919 0.703 CB 1.665 75 residues pruned to eliminate duplicates Z: 48 55.120 2.267 0.896 0.709 0.957 0.787 CB 1.617 48 residues pruned to eliminate duplicates Z: 69 72.062 2.388 0.887 0.663 0.941 0.706 CB 1.771 69 residues pruned to eliminate duplicates Z: 56 55.636 2.213 0.850 0.694 0.927 0.709 CB 1.655 56 residues pruned to eliminate duplicates Z: 22 52.573 2.343 0.831 0.922 1.000 0.857 CB 1.880 22 residues pruned to eliminate duplicates Z: 65 73.253 2.400 0.964 0.646 0.938 0.703 CB 1.808 65 residues pruned to eliminate duplicates Z: 63 79.416 2.413 1.075 0.669 0.968 0.613 CB 1.780 63 residues pruned to eliminate duplicates Z: 134 80.037 2.314 0.757 0.597 0.925 0.617 CB 1.682 134 residues pruned to eliminate duplicates Z: 66 63.127 2.359 0.947 0.616 0.892 0.662 CB 1.712 66 residues pruned to eliminate duplicates Z: 72 68.015 2.333 0.961 0.628 0.930 0.634 CB 1.683 72 residues pruned to eliminate duplicates Z: 44 53.781 2.277 0.923 0.683 0.930 0.744 CB 1.701 44 residues pruned to eliminate duplicates Z: 39 55.864 2.232 1.020 0.744 1.000 0.789 CB 1.617 39 residues pruned to eliminate duplicates Z: 23 57.871 2.301 1.215 0.900 0.955 0.727 CB 1.812 23 residues pruned to eliminate duplicates Z: 140 80.968 2.307 0.824 0.574 0.914 0.640 CB 1.664 140 residues pruned to eliminate duplicates Z: 23 58.735 2.325 1.165 0.921 0.955 0.864 CB 1.834 23 residues pruned to eliminate duplicates Z: 70 74.851 2.367 0.997 0.658 0.957 0.696 CB 1.721 70 residues pruned to eliminate duplicates Z: 24 57.266 2.226 1.240 0.920 0.957 0.565 CB 1.764 24 residues pruned to eliminate duplicates Z: 103 83.641 2.408 0.931 0.590 0.902 0.647 CB 1.812 103 residues pruned to eliminate duplicates Z: 65 77.354 2.411 1.017 0.654 0.953 0.734 CB 1.807 65 residues pruned to eliminate duplicates Z: 76 68.057 2.346 0.887 0.626 0.947 0.693 CB 1.666 76 residues pruned to eliminate duplicates Z: 11 17.468 2.171 0.577 0.635 0.900 0.600 CB 1.579 11 residues pruned to eliminate duplicates Z: 35 46.184 2.407 0.901 0.520 0.941 0.618 CB 1.802 35 residues pruned to eliminate duplicates Z: 128 80.723 2.339 0.820 0.563 0.937 0.622 CB 1.689 128 residues pruned to eliminate duplicates Z: 45 54.390 2.307 0.933 0.678 0.932 0.750 CB 1.676 45 residues pruned to eliminate duplicates Z: 80 67.559 2.391 0.868 0.580 0.924 0.696 CB 1.705 80 residues pruned to eliminate duplicates Z: 89 87.547 2.427 1.027 0.615 0.943 0.648 CB 1.803 89 residues pruned to eliminate duplicates Z: 76 61.167 2.446 0.776 0.491 0.920 0.533 CB 1.783 76 residues pruned to eliminate duplicates Z: 62 71.579 2.399 0.992 0.625 0.951 0.705 CB 1.793 62 residues pruned to eliminate duplicates Z: 33 46.648 2.449 0.905 0.577 0.906 0.656 CB 1.811 33 residues pruned to eliminate duplicates Z: 32 49.269 2.473 0.979 0.548 0.935 0.581 CB 1.845 32 residues pruned to eliminate duplicates Z: 34 42.788 2.453 0.872 0.547 0.879 0.606 CB 1.762 34 residues pruned to eliminate duplicates Z: 70 44.735 2.364 0.738 0.418 0.841 0.580 CB 1.699 70 residues pruned to eliminate duplicates Z: 33 41.353 2.463 0.744 0.536 0.906 0.625 CB 1.813 33 residues pruned to eliminate duplicates Z: 66 64.005 2.500 0.831 0.548 0.938 0.662 CB 1.763 66 residues pruned to eliminate duplicates Z: 105 78.437 2.391 0.890 0.575 0.923 0.644 CB 1.714 105 residues pruned to eliminate duplicates Z: 12 33.016 2.450 0.759 0.785 1.000 0.909 CB 1.797 12 residues pruned to eliminate duplicates Z: 66 70.957 2.392 0.937 0.646 0.923 0.708 CB 1.796 66 residues pruned to eliminate duplicates Z: 34 46.234 2.426 0.969 0.531 0.879 0.606 CB 1.858 34 residues pruned to eliminate duplicates Z: 34 45.645 2.416 0.859 0.512 0.939 0.515 CB 1.861 34 residues pruned to eliminate duplicates Z: 24 39.624 2.438 0.926 0.576 0.913 0.609 CB 1.791 24 residues pruned to eliminate duplicates Z: 107 79.622 2.395 0.825 0.589 0.943 0.651 CB 1.722 107 residues pruned to eliminate duplicates Z: 50 39.863 2.257 0.818 0.463 0.898 0.592 CB 1.605 50 residues pruned to eliminate duplicates Z: 76 63.476 2.471 0.810 0.503 0.920 0.520 CB 1.776 76 residues pruned to eliminate duplicates Z: 130 81.059 2.322 0.813 0.579 0.938 0.612 CB 1.676 130 residues pruned to eliminate duplicates Z: 134 81.949 2.338 0.778 0.590 0.932 0.647 CB 1.681 134 residues pruned to eliminate duplicates Z: 58 52.587 2.453 0.805 0.491 0.895 0.491 CB 1.774 58 residues pruned to eliminate duplicates Z: 64 76.665 2.415 1.001 0.659 0.968 0.683 CB 1.781 64 residues pruned to eliminate duplicates Z: 32 47.091 2.433 0.958 0.555 0.935 0.613 CB 1.799 32 residues pruned to eliminate duplicates Z: 23 40.646 2.460 0.996 0.539 0.955 0.682 CB 1.780 23 residues pruned to eliminate duplicates Z: 39 37.960 2.304 0.849 0.474 0.895 0.658 CB 1.658 39 residues pruned to eliminate duplicates Z: 99 62.041 2.302 0.694 0.530 0.939 0.622 CB 1.662 99 residues pruned to eliminate duplicates Z: 31 43.915 2.509 0.858 0.491 0.933 0.533 CB 1.860 31 residues pruned to eliminate duplicates Z: 44 41.989 2.402 0.707 0.467 0.907 0.605 CB 1.780 44 residues pruned to eliminate duplicates Z: 66 46.223 2.278 0.592 0.540 0.923 0.615 CB 1.646 66 residues pruned to eliminate duplicates Z: 24 32.369 2.428 0.793 0.489 0.826 0.696 CB 1.897 24 residues pruned to eliminate duplicates Z: 33 39.618 2.429 0.843 0.494 0.906 0.625 CB 1.737 33 residues pruned to eliminate duplicates Z: 33 48.279 2.540 0.918 0.561 0.906 0.625 CB 1.822 33 residues pruned to eliminate duplicates Z: 34 47.123 2.493 0.866 0.538 0.939 0.636 CB 1.807 34 residues pruned to eliminate duplicates Z: 67 61.106 2.447 0.871 0.531 0.879 0.606 CB 1.813 67 residues pruned to eliminate duplicates Z: 62 36.520 2.221 0.542 0.531 0.836 0.656 CB 1.583 62 residues pruned to eliminate duplicates Z: 42 46.539 2.478 0.782 0.469 0.951 0.634 CB 1.785 42 residues pruned to eliminate duplicates Z: 16 11.175 2.303 0.376 0.334 0.800 0.600 CB 1.365 16 residues pruned to eliminate duplicates Z: 37 37.909 2.356 0.763 0.462 0.889 0.611 CB 1.780 37 residues pruned to eliminate duplicates Z: 36 42.604 2.486 0.733 0.502 0.914 0.657 CB 1.825 36 residues pruned to eliminate duplicates Z: 36 41.253 2.467 0.759 0.485 0.914 0.629 CB 1.785 36 residues pruned to eliminate duplicates Z: 36 49.608 2.515 0.771 0.526 0.971 0.657 CB 1.890 36 residues pruned to eliminate duplicates Z: 28 34.760 2.393 0.861 0.450 0.926 0.593 CB 1.707 28 residues pruned to eliminate duplicates Z: 33 53.685 2.561 0.862 0.572 0.969 0.594 CB 1.917 33 residues pruned to eliminate duplicates Z: 65 42.223 2.280 0.526 0.547 0.875 0.703 CB 1.656 65 residues pruned to eliminate duplicates Z: 43 43.738 2.400 0.731 0.474 0.952 0.619 CB 1.751 43 residues pruned to eliminate duplicates Z: 53 39.899 2.357 0.613 0.490 0.885 0.538 CB 1.662 53 residues pruned to eliminate duplicates Z: 44 41.617 2.424 0.787 0.459 0.884 0.581 CB 1.728 44 residues pruned to eliminate duplicates Z: 42 49.162 2.510 0.762 0.531 0.902 0.659 CB 1.865 42 residues pruned to eliminate duplicates Z: 36 47.647 2.494 0.906 0.522 0.914 0.657 CB 1.813 36 residues pruned to eliminate duplicates Z: 43 46.105 2.457 0.792 0.463 0.952 0.619 CB 1.761 43 residues pruned to eliminate duplicates Z: 35 41.404 2.432 0.883 0.507 0.882 0.706 CB 1.745 35 residues pruned to eliminate duplicates Z: 64 48.294 2.289 0.653 0.578 0.921 0.730 CB 1.620 64 residues pruned to eliminate duplicates Z: 67 46.924 2.277 0.582 0.554 0.939 0.697 CB 1.619 67 residues pruned to eliminate duplicates Z: 35 44.869 2.434 0.783 0.526 0.941 0.559 CB 1.837 35 residues pruned to eliminate duplicates Z: 6 8.949 2.074 1.095 0.590 0.600 0.400 CB 1.408 6 residues pruned to eliminate duplicates Z: 68 46.968 2.245 0.650 0.517 0.940 0.687 CB 1.619 68 residues pruned to eliminate duplicates Z: 44 43.119 2.418 0.773 0.478 0.907 0.651 CB 1.729 44 residues pruned to eliminate duplicates Z: 37 42.435 2.316 0.880 0.496 0.917 0.583 CB 1.780 37 residues pruned to eliminate duplicates Z: 36 40.583 2.489 0.683 0.500 0.914 0.657 CB 1.790 36 residues pruned to eliminate duplicates Z: 44 41.315 2.416 0.654 0.469 0.953 0.721 CB 1.707 44 residues pruned to eliminate duplicates Z: 36 18.231 2.005 0.235 0.508 0.914 0.657 CB 1.350 36 residues pruned to eliminate duplicates Z: 65 43.324 2.280 0.555 0.546 0.906 0.641 CB 1.612 65 residues pruned to eliminate duplicates Z: 42 51.592 2.498 0.781 0.535 0.951 0.756 CB 1.840 42 residues pruned to eliminate duplicates Z: 65 49.473 2.280 0.716 0.553 0.922 0.625 CB 1.628 65 residues pruned to eliminate duplicates Z: 42 48.911 2.438 0.827 0.511 0.976 0.659 CB 1.738 42 residues pruned to eliminate duplicates Z: 67 59.582 2.446 0.923 0.500 0.879 0.561 CB 1.775 67 residues pruned to eliminate duplicates Z: 109 67.707 2.240 0.789 0.600 0.907 0.667 CB 1.628 109 residues pruned to eliminate duplicates Z: 57 46.554 2.230 0.687 0.590 0.911 0.732 CB 1.666 57 residues pruned to eliminate duplicates Z: 38 23.189 1.988 0.425 0.541 0.919 0.649 CB 1.407 38 residues pruned to eliminate duplicates Z: 32 20.239 1.973 0.331 0.647 0.935 0.742 CB 1.290 32 residues pruned to eliminate duplicates Z: 24 16.941 1.947 0.242 0.706 0.913 0.739 CB 1.327 24 residues pruned to eliminate duplicates Z: 36 24.360 2.010 0.484 0.572 0.914 0.686 CB 1.408 36 residues pruned to eliminate duplicates Z: 37 24.025 2.002 0.486 0.539 0.917 0.639 CB 1.413 37 residues pruned to eliminate duplicates Z: 37 18.946 2.031 0.353 0.454 0.889 0.611 CB 1.356 37 residues pruned to eliminate duplicates Z: 47 32.680 2.114 0.593 0.608 0.848 0.457 CB 1.523 47 residues pruned to eliminate duplicates Z: 65 51.259 2.239 0.767 0.582 0.938 0.688 CB 1.597 65 residues pruned to eliminate duplicates Z: 66 48.757 2.257 0.792 0.549 0.908 0.662 CB 1.571 66 residues pruned to eliminate duplicates Z: 64 49.640 2.285 0.787 0.564 0.921 0.698 CB 1.564 64 residues pruned to eliminate duplicates Z: 38 28.204 2.039 0.682 0.614 0.892 0.622 CB 1.361 38 residues pruned to eliminate duplicates Z: 23 18.799 1.971 0.567 0.664 0.909 0.636 CB 1.226 23 residues pruned to eliminate duplicates Z: 23 22.928 1.941 0.622 0.667 0.955 0.636 CB 1.394 23 residues pruned to eliminate duplicates Z: 66 50.197 2.253 0.838 0.558 0.892 0.615 CB 1.593 66 residues pruned to eliminate duplicates Z: 65 45.917 2.232 0.701 0.552 0.891 0.609 CB 1.614 65 residues pruned to eliminate duplicates Z: 37 17.730 1.998 0.368 0.465 0.861 0.611 CB 1.301 37 residues pruned to eliminate duplicates Z: 36 27.571 1.999 0.727 0.544 0.914 0.543 CB 1.414 36 residues pruned to eliminate duplicates Z: 24 17.129 1.925 0.458 0.673 0.826 0.435 CB 1.313 24 residues pruned to eliminate duplicates Z: 23 21.871 1.919 0.691 0.695 0.909 0.636 CB 1.323 23 residues pruned to eliminate duplicates Z: 48 33.521 2.054 0.609 0.629 0.936 0.702 CB 1.400 48 residues pruned to eliminate duplicates Z: 25 22.696 1.903 0.691 0.613 0.917 0.458 CB 1.412 25 residues pruned to eliminate duplicates Z: 43 34.358 2.208 0.735 0.478 0.905 0.571 CB 1.565 43 residues pruned to eliminate duplicates Z: 36 27.018 2.069 0.687 0.533 0.886 0.714 CB 1.430 36 residues pruned to eliminate duplicates Z: 27 28.922 2.185 0.564 0.604 0.962 0.885 CB 1.564 27 residues pruned to eliminate duplicates Z: 27 27.983 2.099 0.814 0.551 0.885 0.692 CB 1.550 27 residues pruned to eliminate duplicates Z: 10 15.791 2.182 0.912 0.457 0.778 0.556 CB 1.696 10 residues pruned to eliminate duplicates Z: 28 28.833 2.136 0.755 0.591 0.926 0.741 CB 1.465 28 residues pruned to eliminate duplicates Z: 62 41.157 2.105 0.713 0.605 0.934 0.689 CB 1.415 62 residues pruned to eliminate duplicates Z: 23 29.451 2.151 0.672 0.618 1.000 0.773 CB 1.561 23 residues pruned to eliminate duplicates Z: 27 29.230 2.099 0.832 0.598 0.923 0.731 CB 1.471 27 residues pruned to eliminate duplicates Z: 25 32.461 2.194 0.829 0.604 0.917 0.750 CB 1.631 25 residues pruned to eliminate duplicates Z: 26 23.801 2.072 0.710 0.572 0.880 0.720 CB 1.423 26 residues pruned to eliminate duplicates Z: 90 55.750 2.233 0.797 0.545 0.899 0.685 CB 1.568 90 residues pruned to eliminate duplicates Z: 49 31.760 2.050 0.557 0.600 0.917 0.708 CB 1.424 49 residues pruned to eliminate duplicates Z: 20 27.028 2.174 0.619 0.663 0.895 0.842 CB 1.694 20 residues pruned to eliminate duplicates Z: 20 28.636 2.167 0.677 0.659 0.947 0.737 CB 1.647 20 residues pruned to eliminate duplicates Z: 76 50.917 2.159 0.814 0.561 0.920 0.613 CB 1.538 76 residues pruned to eliminate duplicates Z: 26 29.653 2.109 0.778 0.584 0.920 0.800 CB 1.585 26 residues pruned to eliminate duplicates Z: 26 27.575 2.120 0.839 0.587 0.840 0.800 CB 1.549 26 residues pruned to eliminate duplicates Z: 86 59.133 2.244 0.762 0.578 0.953 0.647 CB 1.578 86 residues pruned to eliminate duplicates Z: 60 45.789 2.143 0.830 0.612 0.915 0.644 CB 1.493 60 residues pruned to eliminate duplicates Z: 37 44.875 2.301 0.899 0.593 0.944 0.694 CB 1.658 37 residues pruned to eliminate duplicates Z: 26 36.931 2.192 0.912 0.623 0.960 0.800 CB 1.635 26 residues pruned to eliminate duplicates Z: 24 20.280 2.038 0.686 0.513 0.826 0.652 CB 1.470 24 residues pruned to eliminate duplicates Z: 36 28.227 2.053 0.713 0.533 0.914 0.771 CB 1.436 36 residues pruned to eliminate duplicates Z: 83 47.057 2.142 0.741 0.507 0.915 0.622 CB 1.513 83 residues pruned to eliminate duplicates Z: 19 29.678 2.411 1.037 0.476 0.833 0.667 CB 1.752 19 residues pruned to eliminate duplicates Z: 20 25.293 2.300 0.893 0.436 0.895 0.579 CB 1.592 20 residues pruned to eliminate duplicates Z: 21 26.504 2.215 1.035 0.443 0.850 0.550 CB 1.641 21 residues pruned to eliminate duplicates Z: 38 39.823 2.250 0.815 0.555 0.946 0.649 CB 1.607 38 residues pruned to eliminate duplicates Z: 19 27.259 2.290 0.843 0.461 0.944 0.611 CB 1.678 19 residues pruned to eliminate duplicates Z: 38 36.752 2.214 0.848 0.459 0.946 0.703 CB 1.628 38 residues pruned to eliminate duplicates Z: 15 21.046 2.250 0.819 0.519 0.857 0.571 CB 1.573 15 residues pruned to eliminate duplicates Z: 38 39.988 2.260 0.800 0.591 0.919 0.676 CB 1.613 38 residues pruned to eliminate duplicates Z: 37 32.202 2.188 0.762 0.485 0.889 0.639 CB 1.590 37 residues pruned to eliminate duplicates Z: 15 22.804 2.241 0.881 0.564 0.857 0.571 CB 1.585 14 residues pruned to eliminate duplicates Z: 6 3.128 1.633 0.351 0.185 1.000 0.800 CB 0.926 6 residues pruned to eliminate duplicates Z: 20 26.236 2.239 0.818 0.450 0.947 0.684 CB 1.644 20 residues pruned to eliminate duplicates 651 residues left after pruning, divided into chains as follows: A: 128 B: 10 C: 174 D: 172 E: 154 F: 13 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 39.19 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.508, Connect. = 0.753 for dens.mod. cycle 1 = 0.300, Contrast = 0.580, Connect. = 0.781 for dens.mod. cycle 2 = 0.300, Contrast = 0.700, Connect. = 0.812 for dens.mod. cycle 3 = 0.300, Contrast = 0.715, Connect. = 0.814 for dens.mod. cycle 4 = 0.300, Contrast = 0.732, Connect. = 0.817 for dens.mod. cycle 5 = 0.300, Contrast = 0.741, Connect. = 0.819 for dens.mod. cycle 6 = 0.300, Contrast = 0.751, Connect. = 0.820 for dens.mod. cycle 7 = 0.300, Contrast = 0.756, Connect. = 0.821 for dens.mod. cycle 8 = 0.300, Contrast = 0.762, Connect. = 0.822 for dens.mod. cycle 9 = 0.300, Contrast = 0.766, Connect. = 0.822 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4152 peaks > 0.5 sigma used to seed fragment search Space for about 886 unique residues taking solvent into account 860 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 23 65.806 2.523 1.001 0.894 0.955 0.727 C 2.088 B: 31 55.048 2.534 1.101 0.538 0.967 0.633 CB 1.883 C: 23 72.156 2.624 0.966 0.916 1.000 0.818 CB 2.106 D: 24 79.496 2.570 1.195 0.914 1.000 0.783 C 2.078 24 residues pruned to eliminate duplicates E: 9 39.201 2.475 1.138 0.863 1.000 0.750 CB 1.922 F: 11 15.781 1.851 0.529 0.773 1.000 0.800 CB 1.385 12 residues pruned to eliminate duplicates G: 12 40.289 2.648 0.824 0.766 1.000 0.909 CA 1.987 H: 20 71.291 2.580 1.191 0.862 1.000 0.842 CB 2.126 21 residues pruned to eliminate duplicates I: 11 34.555 2.397 1.112 0.789 1.000 0.600 CB 1.675 J: 11 34.041 2.185 1.215 0.843 1.000 0.900 CB 1.656 10 residues pruned to eliminate duplicates K: 23 66.932 2.543 0.891 0.927 1.000 0.955 C 2.080 24 residues pruned to eliminate duplicates L: 23 71.430 2.533 1.042 0.900 1.000 0.727 C 2.104 23 residues pruned to eliminate duplicates M: 10 40.947 2.523 1.467 0.836 1.000 0.667 CB 1.641 11 residues pruned to eliminate duplicates N: 24 61.533 2.426 1.041 0.910 0.913 0.739 CB 2.013 24 residues pruned to eliminate duplicates O: 92 67.543 2.400 0.789 0.538 0.945 0.703 CB 1.681 24 residues pruned to eliminate duplicates P: 44 29.923 2.304 0.729 0.394 0.791 0.488 CB 1.621 44 residues pruned to eliminate duplicates Q: 22 77.469 2.751 0.970 0.923 1.000 0.905 CB 2.191 22 residues pruned to eliminate duplicates R: 14 36.017 2.323 0.763 0.798 1.000 0.769 CA 1.880 14 residues pruned to eliminate duplicates S: 8 30.484 2.660 0.538 0.868 1.000 0.857 CB 2.060 8 residues pruned to eliminate duplicates T: 23 71.841 2.637 0.921 0.908 1.000 0.864 CB 2.148 23 residues pruned to eliminate duplicates U: 10 35.126 2.497 0.894 0.855 1.000 0.778 CA 1.827 10 residues pruned to eliminate duplicates V: 24 69.233 2.502 1.021 0.903 1.000 0.739 CB 2.036 23 residues pruned to eliminate duplicates W: 32 61.037 2.300 1.034 0.785 0.968 0.806 CB 1.885 X: 24 68.758 2.511 0.942 0.930 1.000 0.957 CB 2.056 24 residues pruned to eliminate duplicates Y: 22 65.818 2.711 0.787 0.945 0.952 0.905 CB 2.155 22 residues pruned to eliminate duplicates Z: 11 20.827 2.102 1.030 0.837 0.800 0.700 CB 1.444 11 residues pruned to eliminate duplicates Z: 9 18.414 2.068 0.487 0.807 1.000 0.750 CB 1.620 Z: 24 71.338 2.450 1.159 0.868 1.000 0.826 C 2.056 24 residues pruned to eliminate duplicates Z: 86 75.234 2.478 0.910 0.591 0.906 0.718 CB 1.745 35 residues pruned to eliminate duplicates Z: 19 34.856 2.416 0.465 0.896 1.000 0.889 CB 1.663 23 residues pruned to eliminate duplicates Z: 23 81.907 2.520 1.304 0.932 1.000 0.864 C 2.100 22 residues pruned to eliminate duplicates Z: 13 37.305 2.501 0.866 0.777 1.000 0.917 CA 1.806 13 residues pruned to eliminate duplicates Z: 24 69.472 2.519 0.984 0.916 1.000 0.870 CB 2.048 24 residues pruned to eliminate duplicates Z: 63 90.465 2.515 1.128 0.654 0.968 0.710 CB 1.922 67 residues pruned to eliminate duplicates Z: 25 66.714 2.379 1.102 0.904 1.000 0.750 CB 1.940 25 residues pruned to eliminate duplicates Z: 12 18.643 2.060 1.006 0.559 0.909 0.545 CB 1.413 Z: 13 28.627 2.332 0.655 0.734 1.000 0.750 CB 1.735 Z: 23 76.279 2.619 1.026 0.926 1.000 0.818 CB 2.150 23 residues pruned to eliminate duplicates Z: 23 66.797 2.619 0.907 0.929 0.955 0.864 CB 2.090 23 residues pruned to eliminate duplicates Z: 11 37.126 2.725 0.576 0.779 1.000 0.900 CB 2.137 12 residues pruned to eliminate duplicates Z: 10 45.990 2.555 1.298 0.851 1.000 0.889 CA 1.933 10 residues pruned to eliminate duplicates Z: 21 58.185 2.430 0.879 0.941 1.000 1.000 CB 1.977 21 residues pruned to eliminate duplicates Z: 48 43.320 2.462 0.699 0.460 0.894 0.574 CB 1.760 49 residues pruned to eliminate duplicates Z: 9 17.982 2.051 0.597 0.800 1.000 0.875 CA 1.493 9 residues pruned to eliminate duplicates Z: 20 27.259 2.216 0.369 0.869 1.000 0.842 CB 1.506 20 residues pruned to eliminate duplicates Z: 10 17.054 2.364 0.323 0.749 0.778 0.556 CB 1.872 10 residues pruned to eliminate duplicates Z: 24 58.213 2.519 0.831 0.935 0.913 0.783 CB 2.008 24 residues pruned to eliminate duplicates Z: 67 74.840 2.494 0.929 0.642 0.909 0.712 CB 1.844 64 residues pruned to eliminate duplicates Z: 63 77.665 2.453 1.007 0.628 0.935 0.645 CB 1.900 32 residues pruned to eliminate duplicates Z: 13 26.875 2.322 0.745 0.742 0.833 0.500 C 1.849 13 residues pruned to eliminate duplicates Z: 23 56.925 2.498 0.667 0.904 1.000 0.773 CA 2.076 23 residues pruned to eliminate duplicates Z: 14 31.936 2.131 0.929 0.724 1.000 0.692 CA 1.761 14 residues pruned to eliminate duplicates Z: 11 26.203 2.249 0.544 0.849 1.000 0.900 CA 1.769 Z: 23 71.543 2.616 0.939 0.931 1.000 0.955 CB 2.103 23 residues pruned to eliminate duplicates Z: 10 31.824 2.258 0.854 0.878 1.000 0.778 CB 1.840 10 residues pruned to eliminate duplicates Z: 21 83.051 2.722 1.224 0.919 1.000 0.750 CB 2.161 21 residues pruned to eliminate duplicates Z: 10 32.509 2.254 1.081 0.887 0.889 0.889 C 1.873 10 residues pruned to eliminate duplicates Z: 12 44.299 2.533 1.037 0.797 1.000 0.818 CB 1.997 12 residues pruned to eliminate duplicates Z: 12 41.870 2.620 0.880 0.810 0.909 0.727 CB 2.151 12 residues pruned to eliminate duplicates Z: 44 41.614 2.394 0.664 0.471 0.884 0.651 CB 1.856 33 residues pruned to eliminate duplicates Z: 23 78.684 2.513 1.240 0.931 1.000 0.909 C 2.082 23 residues pruned to eliminate duplicates Z: 61 76.299 2.521 0.971 0.601 0.917 0.683 CB 1.963 63 residues pruned to eliminate duplicates Z: 23 70.170 2.620 1.044 0.884 0.955 0.818 CB 2.114 23 residues pruned to eliminate duplicates Z: 23 77.980 2.624 1.114 0.906 1.000 0.727 CB 2.132 23 residues pruned to eliminate duplicates Z: 22 54.296 2.416 0.842 0.922 1.000 0.857 CB 1.873 Z: 11 13.151 1.837 0.496 0.772 0.900 0.800 C 1.322 11 residues pruned to eliminate duplicates Z: 9 15.114 2.121 0.555 0.771 0.750 0.625 CB 1.700 Z: 48 42.667 2.339 0.733 0.450 0.957 0.638 CB 1.688 10 residues pruned to eliminate duplicates Z: 13 23.616 2.325 0.571 0.767 0.917 0.750 CB 1.608 13 residues pruned to eliminate duplicates Z: 23 52.351 2.444 0.691 0.868 0.955 0.864 CA 2.068 23 residues pruned to eliminate duplicates Z: 21 55.136 2.434 0.793 0.942 1.000 0.950 C 1.960 21 residues pruned to eliminate duplicates Z: 7 19.751 2.338 0.459 0.800 1.000 0.667 CA 1.818 7 residues pruned to eliminate duplicates Z: 8 19.860 2.162 0.543 0.846 1.000 0.857 CA 1.672 8 residues pruned to eliminate duplicates Z: 9 16.526 2.066 0.502 0.766 1.000 0.750 CB 1.487 9 residues pruned to eliminate duplicates Z: 139 93.498 2.417 0.773 0.583 0.957 0.674 CB 1.792 101 residues pruned to eliminate duplicates Z: 9 20.660 2.328 0.185 0.829 1.000 0.875 CA 1.993 9 residues pruned to eliminate duplicates Z: 25 50.366 2.319 0.671 0.916 0.958 0.958 CA 1.956 25 residues pruned to eliminate duplicates Z: 23 62.678 2.510 0.920 0.898 0.955 0.727 C 2.077 23 residues pruned to eliminate duplicates Z: 7 10.896 1.994 0.209 0.804 0.833 0.667 CB 1.699 7 residues pruned to eliminate duplicates Z: 20 32.513 2.414 0.409 0.839 0.947 0.789 CB 1.729 20 residues pruned to eliminate duplicates Z: 100 80.161 2.366 0.937 0.600 0.919 0.667 CB 1.738 100 residues pruned to eliminate duplicates Z: 10 24.970 2.126 1.067 0.799 0.889 0.667 C 1.640 10 residues pruned to eliminate duplicates Z: 9 17.582 2.331 0.108 0.855 1.000 0.750 CB 1.776 9 residues pruned to eliminate duplicates Z: 113 93.316 2.476 0.870 0.597 0.964 0.732 CB 1.800 110 residues pruned to eliminate duplicates Z: 9 25.716 2.321 0.719 0.855 0.875 0.750 N 1.922 9 residues pruned to eliminate duplicates Z: 23 46.798 2.322 0.742 0.890 0.955 0.773 CA 1.859 23 residues pruned to eliminate duplicates Z: 20 24.312 2.229 0.811 0.436 0.947 0.684 CB 1.558 11 residues pruned to eliminate duplicates Z: 24 66.511 2.520 0.939 0.914 1.000 0.783 CB 2.007 24 residues pruned to eliminate duplicates Z: 24 49.805 2.241 0.910 0.918 0.957 0.739 CB 1.789 23 residues pruned to eliminate duplicates Z: 18 35.457 2.438 0.463 0.888 1.000 0.882 CB 1.737 19 residues pruned to eliminate duplicates Z: 12 34.792 2.343 0.758 0.913 1.000 0.909 CA 1.802 Z: 9 20.552 2.157 0.553 0.862 1.000 0.875 CB 1.593 9 residues pruned to eliminate duplicates Z: 18 35.158 2.349 0.586 0.870 1.000 0.824 CB 1.671 18 residues pruned to eliminate duplicates Z: 20 25.454 2.229 0.946 0.457 0.895 0.474 CB 1.571 21 residues pruned to eliminate duplicates Z: 59 60.329 2.457 0.902 0.503 0.931 0.534 CB 1.815 52 residues pruned to eliminate duplicates Z: 20 66.153 2.617 0.993 0.961 1.000 1.000 CB 1.991 20 residues pruned to eliminate duplicates Z: 10 25.524 2.144 1.213 0.768 0.889 0.667 C 1.591 10 residues pruned to eliminate duplicates Z: 75 46.087 2.333 0.602 0.495 0.878 0.649 CB 1.640 75 residues pruned to eliminate duplicates Z: 9 28.971 2.378 0.688 0.879 1.000 1.000 CB 1.851 9 residues pruned to eliminate duplicates Z: 33 49.481 2.457 0.970 0.550 0.969 0.531 CB 1.777 30 residues pruned to eliminate duplicates Z: 21 38.119 2.216 0.591 0.911 0.950 0.800 CB 1.804 21 residues pruned to eliminate duplicates Z: 32 27.637 2.101 0.710 0.600 0.903 0.645 CB 1.391 3 residues pruned to eliminate duplicates Z: 23 49.437 2.313 0.873 0.892 0.955 0.818 CB 1.831 23 residues pruned to eliminate duplicates Z: 23 52.295 2.218 1.040 0.911 1.000 0.864 CA 1.747 23 residues pruned to eliminate duplicates Z: 135 70.906 2.290 0.630 0.587 0.940 0.664 CB 1.607 102 residues pruned to eliminate duplicates Z: 16 30.106 2.303 0.781 0.682 0.800 0.600 CB 2.004 16 residues pruned to eliminate duplicates Z: 23 52.216 2.321 0.866 0.904 1.000 0.909 CA 1.831 23 residues pruned to eliminate duplicates Z: 87 63.158 2.438 0.566 0.533 0.953 0.651 CB 1.810 87 residues pruned to eliminate duplicates Z: 108 83.224 2.425 0.857 0.581 0.925 0.617 CB 1.786 130 residues pruned to eliminate duplicates Z: 26 28.476 2.163 0.828 0.594 0.840 0.720 CB 1.568 26 residues pruned to eliminate duplicates Z: 9 47.665 2.657 1.511 0.817 1.000 0.875 CB 1.918 9 residues pruned to eliminate duplicates Z: 13 21.488 2.296 0.745 0.705 0.833 0.750 CB 1.543 13 residues pruned to eliminate duplicates Z: 10 22.266 2.170 0.531 0.861 0.889 0.667 CA 1.847 10 residues pruned to eliminate duplicates Z: 22 51.268 2.403 0.783 0.912 0.952 0.857 CB 1.942 22 residues pruned to eliminate duplicates Z: 22 61.392 2.409 1.035 0.927 1.000 0.905 CB 1.915 22 residues pruned to eliminate duplicates Z: 8 23.821 2.280 0.595 0.880 1.000 0.857 CA 1.794 8 residues pruned to eliminate duplicates Z: 23 85.050 2.631 1.214 0.927 1.000 0.727 CA 2.182 23 residues pruned to eliminate duplicates Z: 73 52.556 2.320 0.606 0.545 0.903 0.708 CB 1.762 73 residues pruned to eliminate duplicates Z: 22 45.271 2.252 0.829 0.903 0.952 0.905 CA 1.795 22 residues pruned to eliminate duplicates Z: 12 38.373 2.300 0.951 0.916 1.000 0.818 CA 1.820 11 residues pruned to eliminate duplicates Z: 89 53.676 2.259 0.663 0.550 0.920 0.659 CB 1.577 34 residues pruned to eliminate duplicates Z: 116 80.620 2.404 0.809 0.579 0.922 0.635 CB 1.738 113 residues pruned to eliminate duplicates Z: 34 35.991 2.297 0.657 0.543 0.939 0.667 CB 1.680 34 residues pruned to eliminate duplicates Z: 18 35.088 2.380 0.540 0.886 0.941 0.824 CB 1.779 18 residues pruned to eliminate duplicates Z: 13 28.976 2.408 0.861 0.812 0.917 0.667 CB 1.552 13 residues pruned to eliminate duplicates Z: 15 21.887 2.168 0.941 0.526 0.857 0.500 CB 1.581 15 residues pruned to eliminate duplicates Z: 30 48.874 2.485 0.928 0.574 0.931 0.621 CB 1.895 30 residues pruned to eliminate duplicates Z: 23 55.832 2.328 1.107 0.918 0.955 0.864 CB 1.793 23 residues pruned to eliminate duplicates Z: 10 25.916 2.108 1.235 0.820 0.889 0.889 CB 1.563 10 residues pruned to eliminate duplicates Z: 11 33.575 2.491 0.745 0.789 1.000 0.700 CB 1.896 11 residues pruned to eliminate duplicates Z: 10 16.809 1.878 0.722 0.817 1.000 0.556 CB 1.316 10 residues pruned to eliminate duplicates Z: 77 75.423 2.486 0.880 0.587 0.921 0.697 CB 1.848 77 residues pruned to eliminate duplicates Z: 22 91.860 2.742 1.312 0.925 1.000 0.857 CB 2.219 22 residues pruned to eliminate duplicates Z: 22 45.604 2.374 0.553 0.913 1.000 0.905 CA 1.909 22 residues pruned to eliminate duplicates Z: 38 33.783 2.209 0.749 0.565 0.892 0.676 CB 1.514 38 residues pruned to eliminate duplicates Z: 23 52.690 2.595 0.643 0.930 0.909 0.864 CB 2.026 23 residues pruned to eliminate duplicates Z: 19 29.597 2.381 0.380 0.857 0.944 0.833 CB 1.656 19 residues pruned to eliminate duplicates Z: 20 67.819 2.659 1.001 0.923 1.000 0.947 CB 2.055 20 residues pruned to eliminate duplicates Z: 22 74.796 2.619 1.074 0.929 0.952 0.810 CA 2.208 22 residues pruned to eliminate duplicates Z: 23 51.178 2.312 0.918 0.924 0.955 0.682 CB 1.810 23 residues pruned to eliminate duplicates Z: 22 60.491 2.451 0.967 0.913 1.000 0.810 CA 1.938 22 residues pruned to eliminate duplicates Z: 10 24.360 2.268 0.475 0.873 1.000 0.778 C 1.768 10 residues pruned to eliminate duplicates Z: 43 38.989 2.323 0.923 0.541 0.833 0.619 CB 1.552 13 residues pruned to eliminate duplicates Z: 9 19.755 2.216 0.654 0.875 0.875 0.875 CB 1.583 9 residues pruned to eliminate duplicates Z: 11 18.920 1.901 0.722 0.895 1.000 1.000 CB 1.310 11 residues pruned to eliminate duplicates Z: 23 77.593 2.515 1.175 0.931 1.000 0.818 C 2.114 23 residues pruned to eliminate duplicates Z: 32 23.499 2.105 0.490 0.556 0.871 0.645 CB 1.462 10 residues pruned to eliminate duplicates Z: 22 43.440 2.275 0.738 0.900 0.952 0.905 CB 1.798 22 residues pruned to eliminate duplicates Z: 43 41.552 2.418 0.652 0.491 0.881 0.571 CB 1.839 43 residues pruned to eliminate duplicates Z: 18 34.110 2.443 0.410 0.890 1.000 0.765 CB 1.727 18 residues pruned to eliminate duplicates Z: 24 63.348 2.481 0.891 0.920 1.000 0.826 CB 1.982 24 residues pruned to eliminate duplicates Z: 28 24.899 2.030 0.686 0.601 0.889 0.815 CB 1.431 30 residues pruned to eliminate duplicates Z: 11 27.983 2.131 0.699 0.873 1.000 0.800 CB 1.779 11 residues pruned to eliminate duplicates Z: 10 22.953 2.208 0.532 0.908 0.889 0.778 CB 1.808 10 residues pruned to eliminate duplicates Z: 23 40.801 2.297 0.652 0.916 0.909 0.818 CB 1.780 23 residues pruned to eliminate duplicates Z: 73 41.820 2.140 0.553 0.552 0.958 0.694 CB 1.470 67 residues pruned to eliminate duplicates Z: 15 32.330 2.471 0.911 0.633 0.929 0.786 CB 1.740 16 residues pruned to eliminate duplicates Z: 24 42.065 2.414 0.986 0.554 0.957 0.609 CB 1.814 24 residues pruned to eliminate duplicates Z: 57 81.713 2.497 1.129 0.655 0.929 0.696 CB 1.915 57 residues pruned to eliminate duplicates Z: 22 37.346 2.279 0.941 0.656 0.952 0.810 CB 1.674 23 residues pruned to eliminate duplicates Z: 8 21.927 2.353 0.493 0.822 1.000 0.714 CB 1.785 8 residues pruned to eliminate duplicates Z: 19 34.938 2.375 0.660 0.876 0.944 0.778 CB 1.607 18 residues pruned to eliminate duplicates Z: 6 15.427 2.347 0.299 0.819 1.000 0.800 CB 1.715 6 residues pruned to eliminate duplicates Z: 23 52.107 2.331 1.024 0.918 0.909 0.909 CB 1.825 23 residues pruned to eliminate duplicates Z: 23 79.421 2.609 1.171 0.931 1.000 0.818 CB 2.089 23 residues pruned to eliminate duplicates Z: 21 45.127 2.223 0.893 0.956 0.950 0.850 CA 1.734 21 residues pruned to eliminate duplicates Z: 15 12.419 2.030 0.638 0.365 0.786 0.429 CB 1.469 15 residues pruned to eliminate duplicates Z: 22 43.179 2.373 0.512 0.929 0.952 0.810 CA 1.929 22 residues pruned to eliminate duplicates Z: 12 15.601 2.165 0.753 0.373 0.909 0.636 CB 1.562 12 residues pruned to eliminate duplicates Z: 10 31.548 2.396 1.164 0.865 0.889 0.889 CB 1.671 10 residues pruned to eliminate duplicates Z: 13 20.835 2.119 0.441 0.830 0.917 0.833 CA 1.615 13 residues pruned to eliminate duplicates Z: 22 50.354 2.391 0.678 0.922 1.000 0.810 CB 1.926 22 residues pruned to eliminate duplicates Z: 18 26.008 2.082 0.241 0.923 1.000 0.941 CB 1.716 18 residues pruned to eliminate duplicates Z: 10 22.795 2.216 0.424 0.854 1.000 1.000 CA 1.778 10 residues pruned to eliminate duplicates Z: 9 19.751 2.014 0.590 0.905 1.000 0.875 CB 1.552 9 residues pruned to eliminate duplicates Z: 18 32.581 2.099 0.551 0.909 1.000 0.824 CB 1.723 18 residues pruned to eliminate duplicates Z: 22 85.833 2.623 1.269 0.939 1.000 0.905 C 2.188 31 residues pruned to eliminate duplicates Z: 9 45.877 2.434 1.433 0.927 1.000 0.750 CB 1.920 9 residues pruned to eliminate duplicates Z: 74 69.082 2.466 0.953 0.514 0.945 0.616 CB 1.751 74 residues pruned to eliminate duplicates Z: 6 10.157 2.318 0.031 0.820 0.800 0.600 CA 1.800 6 residues pruned to eliminate duplicates Z: 50 52.267 2.252 0.910 0.664 0.939 0.673 CB 1.589 50 residues pruned to eliminate duplicates Z: 18 30.509 2.113 0.435 0.930 1.000 1.000 CB 1.706 18 residues pruned to eliminate duplicates Z: 14 21.003 2.140 0.934 0.526 0.923 0.692 CB 1.487 14 residues pruned to eliminate duplicates Z: 22 43.319 2.272 0.616 0.924 1.000 0.905 CB 1.808 22 residues pruned to eliminate duplicates Z: 16 12.256 2.277 0.461 0.255 0.867 0.400 CB 1.454 16 residues pruned to eliminate duplicates Z: 9 14.265 2.140 0.434 0.801 0.875 0.750 CB 1.444 9 residues pruned to eliminate duplicates Z: 20 33.542 2.200 0.749 0.702 1.000 0.789 CB 1.663 20 residues pruned to eliminate duplicates Z: 18 27.471 2.259 0.383 0.905 1.000 0.941 CB 1.518 18 residues pruned to eliminate duplicates Z: 91 67.105 2.359 0.910 0.550 0.922 0.600 CB 1.621 90 residues pruned to eliminate duplicates Z: 12 28.224 2.435 0.460 0.763 1.000 0.727 CB 1.894 12 residues pruned to eliminate duplicates Z: 13 26.761 2.120 0.650 0.895 1.000 0.833 CA 1.583 13 residues pruned to eliminate duplicates Z: 18 31.137 2.117 0.508 0.912 1.000 0.882 CB 1.675 18 residues pruned to eliminate duplicates Z: 9 11.830 1.958 0.139 0.800 0.875 0.625 CB 1.649 9 residues pruned to eliminate duplicates Z: 44 33.759 2.218 0.656 0.487 0.907 0.605 CB 1.565 44 residues pruned to eliminate duplicates Z: 22 59.480 2.400 0.960 0.929 1.000 0.762 CB 1.931 22 residues pruned to eliminate duplicates Z: 13 21.836 2.339 0.455 0.668 0.833 0.667 CA 1.903 13 residues pruned to eliminate duplicates Z: 122 76.421 2.328 0.778 0.578 0.934 0.636 CB 1.667 110 residues pruned to eliminate duplicates Z: 40 54.933 2.398 0.940 0.608 0.949 0.692 CB 1.800 40 residues pruned to eliminate duplicates Z: 9 25.405 2.128 0.899 0.884 1.000 0.875 CB 1.606 9 residues pruned to eliminate duplicates Z: 22 59.156 2.503 0.864 0.922 0.952 0.857 C 2.044 22 residues pruned to eliminate duplicates Z: 7 7.890 2.027 0.466 0.752 0.667 0.667 CA 1.298 7 residues pruned to eliminate duplicates Z: 12 16.083 1.932 0.698 0.543 0.909 0.727 CB 1.559 12 residues pruned to eliminate duplicates Z: 11 19.931 2.139 1.086 0.562 0.900 0.800 CB 1.478 11 residues pruned to eliminate duplicates Z: 7 9.625 1.775 0.746 0.768 1.000 0.667 CB 1.000 7 residues pruned to eliminate duplicates Z: 22 48.077 2.253 0.897 0.908 0.952 0.857 CB 1.830 22 residues pruned to eliminate duplicates Z: 12 30.354 2.403 0.720 0.782 1.000 0.727 CB 1.727 12 residues pruned to eliminate duplicates Z: 10 18.010 1.901 0.527 0.861 1.000 0.889 C 1.520 10 residues pruned to eliminate duplicates Z: 98 67.616 2.353 0.889 0.555 0.907 0.660 CB 1.614 98 residues pruned to eliminate duplicates Z: 12 20.708 2.017 0.527 0.826 0.909 0.727 C 1.681 12 residues pruned to eliminate duplicates Z: 23 39.420 2.283 0.551 0.896 0.955 0.864 CB 1.780 23 residues pruned to eliminate duplicates Z: 22 46.561 2.401 0.509 0.943 1.000 0.905 CB 1.943 22 residues pruned to eliminate duplicates Z: 9 27.857 2.353 0.724 0.889 1.000 0.875 CB 1.748 9 residues pruned to eliminate duplicates Z: 11 35.550 2.601 0.832 0.744 0.900 0.700 CB 2.106 11 residues pruned to eliminate duplicates Z: 23 46.937 2.308 0.659 0.924 1.000 0.909 CA 1.836 23 residues pruned to eliminate duplicates Z: 19 35.108 2.405 0.473 0.883 1.000 0.778 CB 1.689 19 residues pruned to eliminate duplicates Z: 18 25.718 2.124 0.253 0.886 1.000 0.941 CB 1.691 18 residues pruned to eliminate duplicates Z: 13 31.061 2.158 0.773 0.904 1.000 1.000 CA 1.669 13 residues pruned to eliminate duplicates Z: 18 31.147 2.099 0.529 0.911 1.000 0.882 CB 1.669 18 residues pruned to eliminate duplicates Z: 9 23.768 2.093 0.910 0.790 1.000 0.750 CB 1.629 9 residues pruned to eliminate duplicates Z: 134 85.531 2.375 0.797 0.604 0.932 0.684 CB 1.688 129 residues pruned to eliminate duplicates Z: 33 47.884 2.205 0.852 0.768 0.938 0.812 CB 1.744 33 residues pruned to eliminate duplicates Z: 22 49.255 2.272 0.855 0.905 1.000 0.857 CB 1.816 22 residues pruned to eliminate duplicates Z: 112 87.532 2.492 0.818 0.575 0.928 0.739 CB 1.840 112 residues pruned to eliminate duplicates Z: 7 8.276 1.703 0.441 0.651 0.833 0.667 CA 1.436 7 residues pruned to eliminate duplicates Z: 17 21.470 2.000 0.305 0.903 1.000 0.812 CB 1.467 17 residues pruned to eliminate duplicates Z: 8 32.274 2.615 0.587 0.902 1.000 1.000 CB 2.096 8 residues pruned to eliminate duplicates Z: 49 54.879 2.354 0.914 0.638 0.958 0.646 CB 1.611 49 residues pruned to eliminate duplicates Z: 11 18.639 2.026 0.425 0.915 1.000 0.900 CB 1.442 11 residues pruned to eliminate duplicates Z: 122 84.462 2.418 0.879 0.563 0.934 0.686 CB 1.702 122 residues pruned to eliminate duplicates Z: 9 23.113 2.553 0.332 0.867 0.875 0.875 CB 2.009 9 residues pruned to eliminate duplicates Z: 7 7.341 1.921 0.111 0.681 0.833 0.667 CB 1.427 7 residues pruned to eliminate duplicates Z: 8 25.974 2.162 0.937 0.886 1.000 0.857 CB 1.692 8 residues pruned to eliminate duplicates Z: 22 47.509 2.293 0.752 0.914 1.000 0.905 CB 1.825 22 residues pruned to eliminate duplicates Z: 123 91.991 2.436 0.984 0.576 0.926 0.705 CB 1.730 123 residues pruned to eliminate duplicates Z: 9 25.833 2.108 0.833 0.894 1.000 0.750 CA 1.696 9 residues pruned to eliminate duplicates Z: 23 52.097 2.283 0.896 0.914 1.000 0.909 CB 1.815 23 residues pruned to eliminate duplicates Z: 97 85.655 2.422 0.916 0.604 0.927 0.688 CB 1.842 88 residues pruned to eliminate duplicates Z: 9 24.251 2.154 0.662 0.894 1.000 0.750 CA 1.718 9 residues pruned to eliminate duplicates Z: 22 46.833 2.369 0.860 0.858 0.905 0.905 CB 1.888 22 residues pruned to eliminate duplicates Z: 15 17.311 1.754 0.427 0.942 1.000 1.000 CB 1.282 15 residues pruned to eliminate duplicates Z: 12 43.542 2.647 1.148 0.792 0.909 0.818 CA 1.964 12 residues pruned to eliminate duplicates Z: 23 41.998 2.388 0.894 0.656 0.955 0.773 CB 1.794 23 residues pruned to eliminate duplicates Z: 19 26.000 2.130 0.286 0.863 1.000 0.833 CB 1.642 19 residues pruned to eliminate duplicates Z: 73 40.072 2.116 0.503 0.564 0.931 0.694 CB 1.500 72 residues pruned to eliminate duplicates Z: 33 29.438 2.238 0.647 0.528 0.875 0.656 CB 1.569 33 residues pruned to eliminate duplicates Z: 23 41.370 2.168 0.766 0.917 1.000 0.773 CB 1.627 23 residues pruned to eliminate duplicates Z: 22 50.599 2.258 0.955 0.913 1.000 0.762 CB 1.769 22 residues pruned to eliminate duplicates Z: 10 22.895 2.318 0.513 0.822 0.889 0.667 CB 1.852 10 residues pruned to eliminate duplicates Z: 9 24.372 2.307 0.681 0.830 1.000 0.750 CB 1.671 9 residues pruned to eliminate duplicates Z: 18 48.852 2.484 0.904 0.884 1.000 0.647 CB 1.810 18 residues pruned to eliminate duplicates Z: 113 72.415 2.370 0.837 0.545 0.911 0.589 CB 1.651 113 residues pruned to eliminate duplicates Z: 20 16.587 1.787 0.269 0.838 1.000 0.684 CB 1.255 20 residues pruned to eliminate duplicates Z: 24 59.414 2.474 0.935 0.909 0.957 0.783 CB 1.919 24 residues pruned to eliminate duplicates Z: 24 35.886 2.178 0.492 0.898 0.957 0.783 CB 1.723 24 residues pruned to eliminate duplicates Z: 69 30.904 2.011 0.469 0.489 0.912 0.676 CB 1.407 69 residues pruned to eliminate duplicates Z: 23 56.504 2.318 1.079 0.916 0.955 0.773 CB 1.849 23 residues pruned to eliminate duplicates Z: 19 28.973 2.310 0.400 0.893 0.944 0.889 CB 1.605 19 residues pruned to eliminate duplicates Z: 6 10.774 2.046 0.600 0.572 1.000 0.800 CA 1.373 6 residues pruned to eliminate duplicates Z: 67 66.937 2.422 0.999 0.582 0.924 0.667 CB 1.701 67 residues pruned to eliminate duplicates Z: 7 29.406 2.528 0.649 0.890 1.000 1.000 CA 2.071 7 residues pruned to eliminate duplicates Z: 16 22.700 2.266 0.769 0.576 0.867 0.733 CB 1.568 15 residues pruned to eliminate duplicates Z: 22 102.737 2.719 1.614 0.928 1.000 0.810 CB 2.208 22 residues pruned to eliminate duplicates Z: 10 19.786 2.241 0.231 0.879 1.000 1.000 CB 1.733 10 residues pruned to eliminate duplicates Z: 24 80.270 2.431 1.407 0.936 1.000 0.870 C 1.991 24 residues pruned to eliminate duplicates Z: 8 17.175 2.133 0.573 0.606 1.000 0.714 CB 1.749 8 residues pruned to eliminate duplicates Z: 37 25.122 2.166 0.738 0.460 0.806 0.694 CB 1.437 37 residues pruned to eliminate duplicates Z: 8 29.484 2.288 0.846 0.897 1.000 1.000 CB 1.889 8 residues pruned to eliminate duplicates Z: 7 14.737 2.253 0.392 0.735 0.833 0.667 C 1.864 7 residues pruned to eliminate duplicates Z: 22 36.284 2.376 0.874 0.531 0.952 0.667 CB 1.812 22 residues pruned to eliminate duplicates Z: 10 18.917 1.991 0.878 0.810 0.889 0.556 CB 1.449 10 residues pruned to eliminate duplicates Z: 14 23.445 1.874 0.754 0.925 1.000 0.923 CA 1.387 14 residues pruned to eliminate duplicates Z: 135 91.778 2.421 0.802 0.593 0.933 0.709 CB 1.782 135 residues pruned to eliminate duplicates Z: 26 28.433 2.124 0.857 0.581 0.880 0.760 CB 1.516 26 residues pruned to eliminate duplicates Z: 173 83.566 2.280 0.738 0.573 0.919 0.622 CB 1.632 173 residues pruned to eliminate duplicates Z: 32 33.092 2.400 0.504 0.597 0.903 0.677 CB 1.661 32 residues pruned to eliminate duplicates Z: 23 40.893 2.312 0.580 0.892 0.955 0.864 CB 1.796 23 residues pruned to eliminate duplicates Z: 8 21.659 2.197 0.620 0.833 1.000 0.714 CB 1.725 8 residues pruned to eliminate duplicates Z: 22 14.674 1.907 0.630 0.393 0.810 0.476 CB 1.425 22 residues pruned to eliminate duplicates Z: 19 50.332 2.388 1.113 0.904 1.000 0.611 CB 1.674 19 residues pruned to eliminate duplicates Z: 11 17.047 2.004 0.329 0.932 1.000 1.000 CB 1.414 11 residues pruned to eliminate duplicates Z: 6 13.152 2.240 0.175 0.815 1.000 0.800 CB 1.699 6 residues pruned to eliminate duplicates Z: 8 26.519 2.373 0.687 0.847 1.000 0.857 CA 1.859 8 residues pruned to eliminate duplicates Z: 12 14.179 2.025 0.667 0.490 0.818 0.636 CB 1.564 12 residues pruned to eliminate duplicates Z: 33 53.696 2.540 0.936 0.563 0.969 0.656 CB 1.875 33 residues pruned to eliminate duplicates Z: 37 33.964 2.238 0.660 0.547 0.861 0.639 CB 1.689 37 residues pruned to eliminate duplicates Z: 19 13.752 1.767 0.206 0.890 0.944 0.889 CB 1.158 19 residues pruned to eliminate duplicates Z: 23 71.731 2.473 1.220 0.905 1.000 0.455 C 1.983 23 residues pruned to eliminate duplicates Z: 10 17.247 1.911 0.693 0.803 0.889 0.667 CA 1.534 10 residues pruned to eliminate duplicates Z: 12 18.871 1.903 0.509 0.919 0.909 0.818 CB 1.536 12 residues pruned to eliminate duplicates Z: 50 46.549 2.234 0.805 0.664 0.898 0.633 CB 1.577 50 residues pruned to eliminate duplicates Z: 113 90.272 2.482 0.856 0.599 0.920 0.759 CB 1.832 113 residues pruned to eliminate duplicates Z: 19 37.041 2.310 0.805 0.877 1.000 0.444 CB 1.520 19 residues pruned to eliminate duplicates Z: 18 16.498 1.935 0.257 0.894 1.000 0.882 CB 1.181 18 residues pruned to eliminate duplicates Z: 20 21.436 2.103 1.015 0.526 0.842 0.579 CB 1.343 20 residues pruned to eliminate duplicates Z: 47 54.520 2.500 0.897 0.505 0.935 0.696 CB 1.805 47 residues pruned to eliminate duplicates Z: 23 40.181 2.598 1.108 0.506 0.864 0.636 CB 1.800 23 residues pruned to eliminate duplicates Z: 63 79.758 2.559 1.009 0.645 0.919 0.710 CB 1.872 63 residues pruned to eliminate duplicates Z: 17 16.396 1.996 0.673 0.585 0.938 0.750 CB 1.207 17 residues pruned to eliminate duplicates Z: 27 24.762 2.003 0.740 0.611 0.846 0.654 CB 1.481 27 residues pruned to eliminate duplicates Z: 40 35.051 2.203 0.611 0.526 0.923 0.564 CB 1.670 40 residues pruned to eliminate duplicates Z: 18 34.923 2.116 0.673 0.937 1.000 0.941 CB 1.664 18 residues pruned to eliminate duplicates Z: 11 14.232 1.898 0.186 0.929 1.000 1.000 CB 1.400 11 residues pruned to eliminate duplicates Z: 10 26.307 2.215 0.902 0.847 1.000 0.889 CB 1.544 10 residues pruned to eliminate duplicates Z: 7 17.510 2.268 0.764 0.879 0.833 0.667 CA 1.554 7 residues pruned to eliminate duplicates Z: 50 35.606 2.258 0.780 0.469 0.837 0.653 CB 1.561 50 residues pruned to eliminate duplicates Z: 12 19.804 1.954 0.496 0.911 1.000 0.909 CA 1.447 12 residues pruned to eliminate duplicates Z: 66 41.381 2.239 0.504 0.534 0.892 0.631 CB 1.652 66 residues pruned to eliminate duplicates Z: 18 24.261 2.069 0.213 0.925 1.000 1.000 CB 1.644 18 residues pruned to eliminate duplicates Z: 24 72.130 2.417 1.353 0.922 0.957 0.739 C 1.943 24 residues pruned to eliminate duplicates Z: 18 14.782 1.820 0.093 0.885 1.000 0.824 CB 1.302 18 residues pruned to eliminate duplicates Z: 6 10.361 1.873 0.602 0.640 1.000 0.800 N 1.355 6 residues pruned to eliminate duplicates Z: 18 28.171 2.111 0.355 0.912 1.000 0.941 CB 1.692 18 residues pruned to eliminate duplicates Z: 8 4.588 1.468 0.400 0.313 0.857 0.286 CB 1.211 8 residues pruned to eliminate duplicates Z: 13 24.117 2.141 0.656 0.809 0.917 0.667 CA 1.636 13 residues pruned to eliminate duplicates Z: 13 25.559 1.907 0.864 0.913 1.000 0.917 CA 1.469 13 residues pruned to eliminate duplicates Z: 22 51.880 2.280 0.996 0.900 1.000 0.619 CB 1.776 22 residues pruned to eliminate duplicates Z: 13 17.955 2.154 0.636 0.555 0.833 0.750 CB 1.674 13 residues pruned to eliminate duplicates Z: 21 20.603 2.171 0.718 0.474 0.850 0.600 CB 1.491 21 residues pruned to eliminate duplicates Z: 66 62.782 2.413 0.939 0.563 0.892 0.708 CB 1.754 66 residues pruned to eliminate duplicates Z: 9 26.876 2.191 1.053 0.870 1.000 0.875 CB 1.542 9 residues pruned to eliminate duplicates Z: 48 52.245 2.355 0.855 0.672 0.915 0.702 CB 1.627 48 residues pruned to eliminate duplicates Z: 24 54.701 2.226 1.128 0.926 0.957 0.739 CB 1.766 24 residues pruned to eliminate duplicates Z: 9 26.609 2.164 0.818 0.874 1.000 1.000 CB 1.741 9 residues pruned to eliminate duplicates Z: 13 25.705 2.146 0.691 0.865 0.917 0.750 CA 1.634 13 residues pruned to eliminate duplicates Z: 13 14.049 2.130 0.537 0.487 0.833 0.583 CB 1.506 13 residues pruned to eliminate duplicates Z: 124 82.673 2.405 0.813 0.576 0.919 0.659 CB 1.730 125 residues pruned to eliminate duplicates Z: 9 28.084 2.476 0.424 0.885 1.000 0.750 CB 2.033 9 residues pruned to eliminate duplicates Z: 64 70.017 2.413 0.875 0.656 0.937 0.667 CB 1.800 64 residues pruned to eliminate duplicates Z: 23 48.224 2.192 0.968 0.906 1.000 0.909 CB 1.695 23 residues pruned to eliminate duplicates Z: 25 28.138 2.156 0.732 0.622 0.875 0.708 CB 1.567 25 residues pruned to eliminate duplicates Z: 133 87.174 2.361 0.821 0.594 0.917 0.705 CB 1.760 133 residues pruned to eliminate duplicates Z: 15 21.987 1.777 0.769 0.928 1.000 0.929 CA 1.309 15 residues pruned to eliminate duplicates Z: 13 19.209 1.901 0.721 0.898 0.917 0.917 CA 1.323 13 residues pruned to eliminate duplicates Z: 23 56.205 2.297 1.094 0.915 1.000 0.727 CB 1.761 23 residues pruned to eliminate duplicates Z: 23 81.250 2.537 1.284 0.925 1.000 0.864 C 2.098 31 residues pruned to eliminate duplicates Z: 64 55.638 2.350 0.769 0.587 0.873 0.635 CB 1.776 64 residues pruned to eliminate duplicates Z: 18 17.735 1.879 0.247 0.878 1.000 0.765 CB 1.332 18 residues pruned to eliminate duplicates Z: 50 49.398 2.246 0.749 0.686 0.939 0.714 CB 1.614 50 residues pruned to eliminate duplicates Z: 18 20.458 1.889 0.485 0.889 1.000 0.882 CB 1.273 18 residues pruned to eliminate duplicates Z: 96 82.680 2.392 1.010 0.566 0.916 0.684 CB 1.806 87 residues pruned to eliminate duplicates Z: 10 17.630 2.094 0.335 0.818 0.889 0.778 C 1.794 10 residues pruned to eliminate duplicates Z: 12 30.745 2.221 0.765 0.910 1.000 0.909 CA 1.677 12 residues pruned to eliminate duplicates Z: 20 24.619 1.974 0.694 0.659 0.947 0.737 CB 1.538 20 residues pruned to eliminate duplicates Z: 19 20.911 1.830 0.418 0.878 1.000 0.500 CB 1.379 19 residues pruned to eliminate duplicates Z: 17 20.261 1.885 0.420 0.932 0.938 0.875 CB 1.410 17 residues pruned to eliminate duplicates Z: 8 16.352 2.034 0.364 0.892 1.000 0.714 CA 1.600 8 residues pruned to eliminate duplicates Z: 22 22.588 2.291 0.785 0.482 0.762 0.667 CB 1.610 22 residues pruned to eliminate duplicates Z: 21 25.596 1.976 0.609 0.681 1.000 0.850 CA 1.524 21 residues pruned to eliminate duplicates Z: 6 8.467 2.110 0.364 0.689 0.800 0.600 CA 1.383 6 residues pruned to eliminate duplicates Z: 18 19.181 1.840 0.326 0.894 1.000 0.882 CB 1.368 18 residues pruned to eliminate duplicates Z: 23 81.870 2.629 1.295 0.920 0.955 0.818 CB 2.133 23 residues pruned to eliminate duplicates Z: 16 19.330 2.220 0.745 0.552 0.867 0.600 CB 1.413 16 residues pruned to eliminate duplicates Z: 25 30.592 2.306 0.661 0.615 0.917 0.792 CB 1.595 25 residues pruned to eliminate duplicates Z: 83 73.370 2.409 0.868 0.606 0.927 0.695 CB 1.757 83 residues pruned to eliminate duplicates Z: 24 57.524 2.441 1.012 0.881 0.957 0.739 CB 1.848 24 residues pruned to eliminate duplicates Z: 47 40.045 2.150 0.818 0.640 0.913 0.652 CB 1.451 47 residues pruned to eliminate duplicates Z: 12 21.070 1.938 0.596 0.931 1.000 0.909 CB 1.436 12 residues pruned to eliminate duplicates Z: 12 28.500 2.207 0.575 0.907 1.000 1.000 CA 1.757 12 residues pruned to eliminate duplicates Z: 100 91.628 2.485 0.992 0.606 0.909 0.636 CB 1.851 100 residues pruned to eliminate duplicates Z: 9 7.025 1.990 0.227 0.685 0.750 0.500 CB 1.145 9 residues pruned to eliminate duplicates Z: 7 8.304 1.701 0.667 0.579 0.833 0.667 CA 1.329 7 residues pruned to eliminate duplicates Z: 71 77.945 2.427 1.052 0.591 0.929 0.657 CB 1.847 71 residues pruned to eliminate duplicates Z: 35 42.718 2.416 0.792 0.571 0.853 0.676 CB 1.852 35 residues pruned to eliminate duplicates Z: 32 17.536 1.952 0.264 0.587 0.903 0.613 CB 1.300 32 residues pruned to eliminate duplicates Z: 71 46.251 2.153 0.689 0.561 0.957 0.686 CB 1.497 72 residues pruned to eliminate duplicates Z: 6 6.430 1.835 0.164 0.831 1.000 1.000 CB 1.012 6 residues pruned to eliminate duplicates Z: 46 49.790 2.481 0.943 0.502 0.844 0.578 CB 1.819 46 residues pruned to eliminate duplicates Z: 13 20.428 1.901 0.543 0.902 1.000 0.917 CA 1.434 13 residues pruned to eliminate duplicates Z: 44 70.041 2.395 1.129 0.685 0.930 0.698 CB 1.901 44 residues pruned to eliminate duplicates Z: 72 69.485 2.459 0.965 0.556 0.915 0.775 CB 1.766 72 residues pruned to eliminate duplicates Z: 7 8.001 1.737 0.247 0.700 1.000 0.500 CA 1.257 7 residues pruned to eliminate duplicates Z: 37 51.329 2.204 0.841 0.778 0.972 0.722 CB 1.696 37 residues pruned to eliminate duplicates Z: 13 22.823 1.891 0.700 0.934 1.000 0.833 CA 1.429 13 residues pruned to eliminate duplicates Z: 18 17.350 1.877 0.334 0.914 1.000 0.941 CB 1.189 18 residues pruned to eliminate duplicates Z: 61 49.801 2.254 0.628 0.575 0.967 0.717 CB 1.686 61 residues pruned to eliminate duplicates Z: 51 53.564 2.425 0.877 0.635 0.880 0.700 CB 1.667 51 residues pruned to eliminate duplicates Z: 97 81.729 2.391 0.881 0.609 0.917 0.677 CB 1.825 97 residues pruned to eliminate duplicates Z: 22 82.819 2.658 1.353 0.898 0.952 0.762 CB 2.169 22 residues pruned to eliminate duplicates Z: 21 56.291 2.423 0.829 0.936 1.000 0.900 CA 1.978 21 residues pruned to eliminate duplicates Z: 11 25.033 2.179 0.658 0.877 1.000 0.800 CA 1.591 11 residues pruned to eliminate duplicates Z: 37 29.545 2.122 0.899 0.514 0.806 0.611 CB 1.496 37 residues pruned to eliminate duplicates Z: 36 40.927 2.341 0.771 0.522 0.914 0.714 CB 1.786 36 residues pruned to eliminate duplicates Z: 21 19.292 2.055 0.954 0.510 0.850 0.650 CB 1.251 20 residues pruned to eliminate duplicates Z: 17 38.300 2.222 0.790 0.937 1.000 0.812 CB 1.676 17 residues pruned to eliminate duplicates Z: 16 28.419 2.337 1.073 0.605 0.800 0.667 CB 1.714 16 residues pruned to eliminate duplicates Z: 23 50.474 2.192 1.060 0.894 1.000 0.591 CB 1.709 23 residues pruned to eliminate duplicates Z: 22 90.789 2.606 1.516 0.932 1.000 0.714 C 2.110 22 residues pruned to eliminate duplicates Z: 21 52.957 2.194 1.200 0.926 1.000 0.800 CB 1.721 21 residues pruned to eliminate duplicates Z: 44 42.841 2.399 0.685 0.483 0.930 0.628 CB 1.768 44 residues pruned to eliminate duplicates Z: 9 21.803 2.159 0.797 0.829 0.875 0.250 C 1.709 9 residues pruned to eliminate duplicates Z: 18 11.805 1.793 -0.026 0.929 1.000 1.000 CB 1.147 18 residues pruned to eliminate duplicates Z: 6 16.068 2.345 0.280 0.810 1.000 0.800 CA 1.827 6 residues pruned to eliminate duplicates Z: 13 17.523 2.229 0.897 0.632 0.750 0.750 CB 1.410 14 residues pruned to eliminate duplicates Z: 46 43.735 2.288 0.720 0.652 0.889 0.667 CB 1.617 46 residues pruned to eliminate duplicates Z: 20 14.835 1.759 0.122 0.873 1.000 0.842 CB 1.256 20 residues pruned to eliminate duplicates Z: 85 72.994 2.491 0.811 0.603 0.917 0.714 CB 1.746 85 residues pruned to eliminate duplicates Z: 16 14.730 1.970 0.553 0.580 0.867 0.733 CB 1.329 16 residues pruned to eliminate duplicates Z: 33 48.831 2.500 0.916 0.586 0.906 0.688 CB 1.831 33 residues pruned to eliminate duplicates Z: 9 35.515 2.358 1.130 0.908 1.000 1.000 C 1.775 9 residues pruned to eliminate duplicates Z: 22 57.106 2.257 1.165 0.914 1.000 0.810 CB 1.804 22 residues pruned to eliminate duplicates Z: 12 21.246 1.987 0.529 0.924 1.000 0.909 CB 1.481 12 residues pruned to eliminate duplicates Z: 9 7.094 1.807 0.196 0.556 0.875 0.750 CB 1.256 9 residues pruned to eliminate duplicates Z: 9 28.021 2.236 0.984 0.869 1.000 0.750 CB 1.632 9 residues pruned to eliminate duplicates Z: 19 15.814 1.803 0.452 0.869 0.944 0.889 CB 1.101 19 residues pruned to eliminate duplicates Z: 23 63.168 2.324 1.182 0.934 1.000 0.818 CB 1.851 23 residues pruned to eliminate duplicates Z: 29 23.749 2.054 0.722 0.542 0.893 0.714 CB 1.364 29 residues pruned to eliminate duplicates Z: 19 12.561 1.777 0.078 0.941 0.944 0.833 CB 1.135 19 residues pruned to eliminate duplicates Z: 12 35.345 2.460 0.770 0.792 1.000 0.727 CB 1.895 12 residues pruned to eliminate duplicates Z: 7 8.138 1.817 0.494 0.779 0.833 0.667 CB 1.149 7 residues pruned to eliminate duplicates Z: 71 62.534 2.449 0.739 0.554 0.929 0.671 CB 1.794 71 residues pruned to eliminate duplicates Z: 9 6.995 2.181 0.221 0.415 0.875 0.750 CB 1.160 9 residues pruned to eliminate duplicates Z: 27 18.822 2.016 0.559 0.456 0.846 0.577 CB 1.451 27 residues pruned to eliminate duplicates Z: 13 15.602 2.017 0.477 0.569 1.000 0.667 CB 1.415 13 residues pruned to eliminate duplicates Z: 12 27.296 2.367 0.733 0.707 0.909 0.455 CB 1.829 12 residues pruned to eliminate duplicates Z: 26 35.815 2.309 0.937 0.591 0.880 0.720 CB 1.668 26 residues pruned to eliminate duplicates Z: 23 51.398 2.289 1.035 0.891 0.909 0.864 CA 1.860 23 residues pruned to eliminate duplicates Z: 13 19.345 1.886 0.477 0.916 1.000 0.917 CA 1.416 13 residues pruned to eliminate duplicates Z: 24 41.571 2.114 0.917 0.888 0.957 0.739 CB 1.612 24 residues pruned to eliminate duplicates Z: 61 80.566 2.425 1.043 0.663 0.933 0.617 CB 1.934 61 residues pruned to eliminate duplicates Z: 64 76.172 2.424 0.958 0.648 0.952 0.714 CB 1.850 64 residues pruned to eliminate duplicates Z: 37 50.276 2.274 0.888 0.770 0.889 0.778 CB 1.728 37 residues pruned to eliminate duplicates Z: 12 33.179 2.460 0.915 0.764 0.909 0.727 CB 1.849 12 residues pruned to eliminate duplicates Z: 32 19.525 1.949 0.348 0.630 0.935 0.742 CB 1.263 32 residues pruned to eliminate duplicates Z: 6 4.901 1.672 0.594 0.513 0.600 0.400 O 1.352 6 residues pruned to eliminate duplicates Z: 18 41.969 2.440 0.728 0.891 1.000 0.647 CB 1.735 18 residues pruned to eliminate duplicates Z: 11 14.454 2.012 0.768 0.642 0.800 0.700 CB 1.406 10 residues pruned to eliminate duplicates Z: 15 11.008 1.775 0.770 0.461 0.786 0.571 CB 1.240 Z: 104 96.998 2.469 1.053 0.613 0.942 0.689 CB 1.798 104 residues pruned to eliminate duplicates Z: 24 42.877 2.098 1.020 0.865 1.000 0.696 CB 1.546 24 residues pruned to eliminate duplicates Z: 13 14.909 1.774 0.280 0.889 1.000 0.917 CB 1.365 13 residues pruned to eliminate duplicates Z: 24 43.722 2.123 0.884 0.910 1.000 0.913 CA 1.616 24 residues pruned to eliminate duplicates Z: 73 59.497 2.317 0.799 0.555 0.944 0.681 CB 1.688 73 residues pruned to eliminate duplicates Z: 7 15.438 1.881 0.693 0.866 1.000 1.000 CB 1.449 7 residues pruned to eliminate duplicates Z: 18 38.692 2.122 0.839 0.906 1.000 0.765 CB 1.710 18 residues pruned to eliminate duplicates Z: 44 66.374 2.439 0.975 0.669 0.907 0.605 CB 1.981 44 residues pruned to eliminate duplicates Z: 53 54.266 2.336 0.967 0.627 0.865 0.673 CB 1.679 53 residues pruned to eliminate duplicates Z: 11 20.724 2.017 0.577 0.925 1.000 1.000 CB 1.446 11 residues pruned to eliminate duplicates Z: 10 28.255 2.230 0.722 0.856 1.000 0.889 CB 1.809 10 residues pruned to eliminate duplicates Z: 17 9.943 1.833 0.569 0.461 0.812 0.562 CB 1.107 17 residues pruned to eliminate duplicates Z: 16 18.196 1.957 0.826 0.678 1.000 0.867 CB 1.115 16 residues pruned to eliminate duplicates Z: 20 17.541 1.994 0.425 0.582 0.895 0.737 CB 1.464 20 residues pruned to eliminate duplicates Z: 21 52.638 2.261 1.034 0.912 1.000 0.800 CB 1.813 21 residues pruned to eliminate duplicates Z: 20 33.530 2.367 0.657 0.548 1.000 0.737 CB 1.871 20 residues pruned to eliminate duplicates Z: 9 22.303 2.191 0.822 0.872 0.875 0.875 CB 1.645 9 residues pruned to eliminate duplicates Z: 72 64.479 2.477 0.826 0.559 0.901 0.648 CB 1.772 72 residues pruned to eliminate duplicates Z: 18 19.322 1.859 0.427 0.953 1.000 0.941 CB 1.215 18 residues pruned to eliminate duplicates Z: 12 15.732 2.168 0.603 0.525 0.818 0.727 CB 1.627 12 residues pruned to eliminate duplicates Z: 35 36.980 2.355 0.765 0.538 0.824 0.706 CB 1.785 35 residues pruned to eliminate duplicates Z: 23 34.539 2.093 0.684 0.914 0.955 0.727 CB 1.548 23 residues pruned to eliminate duplicates Z: 22 61.189 2.380 1.159 0.931 0.952 0.952 CB 1.906 22 residues pruned to eliminate duplicates Z: 10 31.502 2.337 0.858 0.906 1.000 1.000 CB 1.720 10 residues pruned to eliminate duplicates Z: 32 47.712 2.463 0.838 0.565 0.968 0.581 CB 1.836 32 residues pruned to eliminate duplicates Z: 37 46.532 2.212 0.762 0.782 0.917 0.778 CB 1.694 37 residues pruned to eliminate duplicates Z: 11 15.058 2.194 0.682 0.431 0.900 0.400 CB 1.541 11 residues pruned to eliminate duplicates Z: 18 33.300 2.123 0.641 0.891 1.000 0.824 CB 1.667 18 residues pruned to eliminate duplicates Z: 23 49.927 2.195 1.077 0.900 1.000 0.773 CB 1.668 23 residues pruned to eliminate duplicates Z: 35 33.008 2.181 0.684 0.548 0.941 0.676 CB 1.562 35 residues pruned to eliminate duplicates Z: 16 12.606 2.166 0.224 0.373 0.867 0.600 CB 1.622 16 residues pruned to eliminate duplicates Z: 17 24.480 1.952 0.697 0.942 1.000 0.938 CB 1.281 17 residues pruned to eliminate duplicates Z: 65 37.139 2.246 0.441 0.521 0.891 0.656 CB 1.579 65 residues pruned to eliminate duplicates Z: 130 75.461 2.333 0.706 0.583 0.915 0.643 CB 1.685 130 residues pruned to eliminate duplicates Z: 10 11.750 1.909 0.424 0.824 0.778 0.556 CA 1.399 10 residues pruned to eliminate duplicates Z: 29 24.991 2.131 0.476 0.614 0.893 0.786 CB 1.510 29 residues pruned to eliminate duplicates Z: 24 22.236 2.039 0.484 0.616 1.000 0.652 CB 1.373 19 residues pruned to eliminate duplicates Z: 97 83.260 2.399 0.934 0.600 0.917 0.656 CB 1.816 97 residues pruned to eliminate duplicates Z: 72 54.860 2.292 0.680 0.546 0.944 0.648 CB 1.712 72 residues pruned to eliminate duplicates Z: 28 39.398 2.417 0.891 0.534 0.926 0.667 CB 1.732 28 residues pruned to eliminate duplicates Z: 11 13.394 2.347 0.530 0.287 0.900 0.600 CA 1.665 11 residues pruned to eliminate duplicates Z: 31 38.524 2.446 0.688 0.548 0.867 0.733 CB 1.876 31 residues pruned to eliminate duplicates Z: 93 65.828 2.386 0.821 0.539 0.946 0.652 CB 1.608 93 residues pruned to eliminate duplicates Z: 6 8.674 2.164 0.302 0.832 0.800 0.800 CA 1.293 6 residues pruned to eliminate duplicates Z: 12 31.387 2.382 0.678 0.796 1.000 0.727 CB 1.828 12 residues pruned to eliminate duplicates Z: 6 4.684 1.787 0.168 0.556 0.800 0.800 CA 1.189 6 residues pruned to eliminate duplicates Z: 31 56.370 2.383 1.022 0.732 1.000 0.700 CB 1.734 31 residues pruned to eliminate duplicates Z: 58 41.668 2.323 0.767 0.480 0.877 0.702 CB 1.565 58 residues pruned to eliminate duplicates Z: 6 8.980 1.982 0.260 0.807 1.000 0.400 CA 1.230 6 residues pruned to eliminate duplicates Z: 9 16.749 2.118 0.374 0.799 1.000 0.625 CB 1.567 9 residues pruned to eliminate duplicates Z: 8 3.982 1.488 0.240 0.391 0.714 0.286 C 1.282 8 residues pruned to eliminate duplicates Z: 11 16.012 1.970 0.207 0.916 1.000 0.900 CB 1.503 11 residues pruned to eliminate duplicates Z: 19 35.467 2.368 0.603 0.905 0.944 0.778 CB 1.660 19 residues pruned to eliminate duplicates Z: 37 49.876 2.461 0.912 0.578 0.944 0.722 CB 1.735 37 residues pruned to eliminate duplicates Z: 26 26.524 2.082 0.640 0.601 0.920 0.760 CB 1.534 26 residues pruned to eliminate duplicates Z: 14 36.368 2.263 0.903 0.826 1.000 0.769 CA 1.767 14 residues pruned to eliminate duplicates Z: 14 19.360 1.828 0.478 0.930 1.000 1.000 CA 1.390 14 residues pruned to eliminate duplicates Z: 9 14.568 2.035 0.592 0.582 1.000 0.875 CA 1.469 10 residues pruned to eliminate duplicates Z: 14 18.580 1.752 0.576 0.917 1.000 0.923 CA 1.316 14 residues pruned to eliminate duplicates Z: 8 9.398 2.335 0.157 0.239 1.000 0.429 CB 1.779 8 residues pruned to eliminate duplicates Z: 18 26.663 1.894 0.845 0.907 1.000 0.824 CB 1.315 18 residues pruned to eliminate duplicates Z: 41 40.199 2.319 0.931 0.506 0.875 0.625 CB 1.613 41 residues pruned to eliminate duplicates Z: 28 21.295 2.004 0.605 0.572 0.852 0.630 CB 1.395 28 residues pruned to eliminate duplicates Z: 9 13.335 2.009 0.788 0.581 0.875 0.500 CB 1.388 10 residues pruned to eliminate duplicates Z: 18 39.062 2.388 0.630 0.934 1.000 1.000 CB 1.698 18 residues pruned to eliminate duplicates Z: 88 63.046 2.413 0.697 0.529 0.920 0.678 CB 1.745 88 residues pruned to eliminate duplicates Z: 22 51.587 2.256 0.984 0.922 1.000 0.952 CB 1.768 22 residues pruned to eliminate duplicates Z: 18 17.187 1.889 0.228 0.889 0.941 0.941 CB 1.375 18 residues pruned to eliminate duplicates Z: 36 32.574 2.135 0.830 0.560 0.829 0.543 CB 1.604 36 residues pruned to eliminate duplicates Z: 56 45.981 2.307 0.767 0.516 0.891 0.655 CB 1.681 56 residues pruned to eliminate duplicates Z: 17 21.218 1.933 0.476 0.951 1.000 0.938 CB 1.281 17 residues pruned to eliminate duplicates Z: 19 18.012 1.830 0.297 0.883 1.000 0.778 CB 1.292 19 residues pruned to eliminate duplicates Z: 52 58.084 2.516 0.841 0.535 0.922 0.588 CB 1.840 52 residues pruned to eliminate duplicates Z: 11 9.559 1.885 0.885 0.625 0.800 0.600 CB 0.945 10 residues pruned to eliminate duplicates Z: 39 27.581 1.936 0.753 0.624 0.974 0.711 CB 1.205 39 residues pruned to eliminate duplicates Z: 8 19.444 2.233 0.358 0.896 1.000 1.000 CB 1.736 8 residues pruned to eliminate duplicates Z: 11 21.443 1.981 0.616 0.937 1.000 1.000 CB 1.475 11 residues pruned to eliminate duplicates Z: 21 47.164 2.452 0.973 0.739 1.000 0.550 CB 1.760 21 residues pruned to eliminate duplicates Z: 24 30.271 2.132 0.802 0.684 0.913 0.652 CB 1.519 24 residues pruned to eliminate duplicates Z: 40 35.572 2.383 0.527 0.522 0.923 0.744 CB 1.659 40 residues pruned to eliminate duplicates Z: 29 29.516 2.267 0.673 0.545 0.893 0.643 CB 1.577 29 residues pruned to eliminate duplicates Z: 11 10.004 1.990 0.261 0.559 0.900 0.800 CB 1.323 11 residues pruned to eliminate duplicates Z: 39 31.858 2.170 0.555 0.554 0.921 0.842 CB 1.577 39 residues pruned to eliminate duplicates Z: 25 52.716 2.325 0.750 0.918 0.958 0.792 C 1.946 25 residues pruned to eliminate duplicates Z: 16 17.083 1.901 0.285 0.947 1.000 0.733 CB 1.248 16 residues pruned to eliminate duplicates Z: 10 15.964 1.932 0.578 0.734 0.889 0.889 N 1.591 10 residues pruned to eliminate duplicates Z: 29 16.942 1.851 0.340 0.657 0.857 0.643 CB 1.302 29 residues pruned to eliminate duplicates Z: 23 40.618 2.513 0.986 0.546 0.909 0.636 CB 1.825 23 residues pruned to eliminate duplicates Z: 45 44.554 2.398 0.693 0.480 0.932 0.750 CB 1.812 45 residues pruned to eliminate duplicates Z: 21 30.009 1.947 0.874 0.808 0.950 0.650 CA 1.481 21 residues pruned to eliminate duplicates Z: 121 89.452 2.416 0.917 0.583 0.950 0.667 CB 1.714 121 residues pruned to eliminate duplicates Z: 10 4.482 1.831 0.016 0.311 0.778 0.556 CB 1.274 10 residues pruned to eliminate duplicates Z: 24 38.213 2.318 0.806 0.628 0.957 0.826 CB 1.763 24 residues pruned to eliminate duplicates Z: 24 31.951 2.145 0.545 0.880 0.913 0.652 CB 1.596 24 residues pruned to eliminate duplicates Z: 7 7.805 1.682 0.388 0.560 1.000 0.667 CB 1.287 Z: 15 31.859 2.452 0.842 0.681 0.929 0.786 CB 1.719 16 residues pruned to eliminate duplicates Z: 10 37.366 2.372 1.087 0.894 1.000 0.889 CB 1.804 10 residues pruned to eliminate duplicates Z: 11 4.767 1.669 0.162 0.603 0.900 0.900 CB 0.782 Z: 31 59.747 2.526 0.963 0.714 0.967 0.800 CB 1.874 31 residues pruned to eliminate duplicates Z: 9 4.992 1.633 0.492 0.367 0.625 0.625 CB 1.337 9 residues pruned to eliminate duplicates Z: 10 3.891 1.745 0.419 0.338 0.667 0.556 CB 0.937 10 residues pruned to eliminate duplicates Z: 36 61.701 2.332 0.893 0.799 1.000 0.800 CB 1.819 36 residues pruned to eliminate duplicates Z: 26 27.549 2.121 0.736 0.613 0.920 0.680 CB 1.461 26 residues pruned to eliminate duplicates Z: 37 52.615 2.293 0.835 0.764 0.944 0.806 CB 1.746 37 residues pruned to eliminate duplicates Z: 23 52.003 2.282 1.193 0.864 0.909 0.818 CB 1.787 23 residues pruned to eliminate duplicates Z: 87 54.592 2.214 0.771 0.550 0.907 0.663 CB 1.576 87 residues pruned to eliminate duplicates Z: 52 73.912 2.433 1.085 0.629 0.961 0.686 CB 1.880 52 residues pruned to eliminate duplicates Z: 23 21.971 2.207 0.573 0.431 0.818 0.409 CB 1.771 23 residues pruned to eliminate duplicates Z: 24 25.049 2.055 0.701 0.533 0.913 0.652 CB 1.584 24 residues pruned to eliminate duplicates Z: 63 79.102 2.546 0.942 0.623 0.968 0.758 CB 1.869 63 residues pruned to eliminate duplicates Z: 6 6.466 1.486 0.466 0.828 0.800 0.800 CA 1.250 6 residues pruned to eliminate duplicates Z: 33 42.353 2.400 0.747 0.534 0.906 0.594 CB 1.905 33 residues pruned to eliminate duplicates Z: 6 7.654 1.817 0.250 0.729 1.000 0.600 CA 1.226 6 residues pruned to eliminate duplicates Z: 17 27.950 2.000 0.678 0.942 1.000 0.938 CB 1.444 17 residues pruned to eliminate duplicates Z: 7 9.675 1.746 0.633 0.761 0.833 0.833 CA 1.318 7 residues pruned to eliminate duplicates Z: 33 51.062 2.508 0.922 0.569 0.938 0.781 CB 1.869 33 residues pruned to eliminate duplicates Z: 19 38.292 2.242 0.699 0.918 0.944 0.833 CB 1.769 19 residues pruned to eliminate duplicates Z: 20 29.126 2.158 0.617 0.871 1.000 0.895 CB 1.397 20 residues pruned to eliminate duplicates Z: 18 39.135 2.105 0.907 0.932 1.000 0.706 CB 1.651 18 residues pruned to eliminate duplicates Z: 20 18.516 2.051 0.605 0.468 1.000 0.632 CB 1.333 20 residues pruned to eliminate duplicates Z: 14 13.305 2.115 0.658 0.571 0.769 0.538 CB 1.277 14 residues pruned to eliminate duplicates 6 0.926 1.194 0.689 0.296 0.600 0.400 CA 0.430 ? Z: 15 6.435 1.607 0.476 0.370 0.714 0.429 CB 1.166 15 residues pruned to eliminate duplicates Z: 19 34.164 2.084 0.734 0.898 1.000 0.778 CB 1.594 19 residues pruned to eliminate duplicates Z: 11 18.084 2.154 0.590 0.601 1.000 0.700 CB 1.517 11 residues pruned to eliminate duplicates Z: 9 43.047 2.533 1.235 0.895 1.000 1.000 CA 1.927 9 residues pruned to eliminate duplicates Z: 21 44.242 2.616 1.076 0.557 0.950 0.550 CB 1.815 21 residues pruned to eliminate duplicates Z: 7 2.325 1.451 0.209 0.346 1.000 0.667 CB 0.640 7 residues pruned to eliminate duplicates Z: 17 17.252 2.130 0.565 0.413 0.938 0.625 CB 1.511 17 residues pruned to eliminate duplicates Z: 6 9.011 2.126 0.068 0.797 1.000 0.600 CA 1.369 6 residues pruned to eliminate duplicates Z: 6 5.622 1.712 0.646 0.615 0.800 0.600 CA 1.001 6 residues pruned to eliminate duplicates Z: 18 26.137 2.089 0.262 0.940 1.000 0.941 CB 1.671 18 residues pruned to eliminate duplicates Z: 6 9.869 1.929 0.315 0.731 1.000 0.600 CB 1.413 6 residues pruned to eliminate duplicates Z: 23 40.365 2.112 0.788 0.912 1.000 0.955 CB 1.614 23 residues pruned to eliminate duplicates Z: 30 37.309 2.228 0.907 0.563 0.931 0.586 CB 1.648 30 residues pruned to eliminate duplicates Z: 14 31.606 2.021 0.901 0.912 1.000 0.923 CA 1.616 14 residues pruned to eliminate duplicates Z: 17 16.091 2.081 0.614 0.435 0.938 0.500 CB 1.366 17 residues pruned to eliminate duplicates Z: 18 26.464 1.887 0.827 0.895 0.941 0.706 CB 1.418 18 residues pruned to eliminate duplicates Z: 11 14.604 2.177 0.854 0.310 0.900 0.500 CA 1.569 11 residues pruned to eliminate duplicates Z: 39 61.801 2.302 1.104 0.658 0.974 0.711 CB 1.837 39 residues pruned to eliminate duplicates Z: 64 40.790 2.183 0.534 0.567 0.937 0.730 CB 1.536 64 residues pruned to eliminate duplicates Z: 7 7.796 1.954 0.522 0.303 0.833 0.667 CB 1.599 7 residues pruned to eliminate duplicates Z: 99 70.204 2.414 0.803 0.542 0.929 0.663 CB 1.684 99 residues pruned to eliminate duplicates Z: 30 56.233 2.493 1.061 0.627 0.931 0.690 CB 1.936 30 residues pruned to eliminate duplicates Z: 19 43.700 2.359 0.927 0.883 1.000 0.833 CB 1.638 19 residues pruned to eliminate duplicates Z: 18 17.192 1.879 0.203 0.913 0.941 0.706 CB 1.386 18 residues pruned to eliminate duplicates Z: 18 11.606 1.830 -0.136 0.888 1.000 0.941 CB 1.282 18 residues pruned to eliminate duplicates Z: 9 31.391 2.459 0.841 0.859 1.000 0.875 CA 1.805 9 residues pruned to eliminate duplicates Z: 6 8.787 2.285 -0.053 0.790 0.800 0.800 CA 1.761 6 residues pruned to eliminate duplicates Z: 22 23.613 1.948 0.539 0.745 1.000 0.619 CB 1.380 22 residues pruned to eliminate duplicates Z: 11 23.550 2.098 0.781 0.643 1.000 0.800 C 1.743 11 residues pruned to eliminate duplicates Z: 46 24.583 1.966 0.460 0.488 0.956 0.689 CB 1.352 46 residues pruned to eliminate duplicates Z: 63 48.269 2.306 0.594 0.549 0.952 0.742 CB 1.672 63 residues pruned to eliminate duplicates Z: 6 3.197 1.475 0.352 0.456 0.800 0.800 CB 0.937 6 residues pruned to eliminate duplicates Z: 12 43.466 2.723 1.082 0.651 0.909 0.545 CB 2.210 12 residues pruned to eliminate duplicates Z: 64 40.383 2.200 0.591 0.499 0.921 0.587 CB 1.580 64 residues pruned to eliminate duplicates Z: 25 29.377 2.411 0.640 0.436 0.917 0.708 CB 1.768 25 residues pruned to eliminate duplicates Z: 9 18.847 2.228 0.481 0.834 0.875 0.625 CA 1.730 9 residues pruned to eliminate duplicates Z: 10 16.740 1.967 0.516 0.798 1.000 0.667 CB 1.441 10 residues pruned to eliminate duplicates Z: 19 20.925 2.310 0.457 0.483 0.944 0.667 CB 1.578 19 residues pruned to eliminate duplicates Z: 6 2.901 1.330 0.088 0.841 1.000 0.800 CB 0.669 Z: 75 70.361 2.514 0.765 0.572 0.919 0.649 CB 1.871 75 residues pruned to eliminate duplicates Z: 13 19.304 1.853 0.513 0.916 1.000 0.917 CA 1.403 13 residues pruned to eliminate duplicates Z: 6 3.408 1.624 0.546 0.635 0.800 0.600 CB 0.669 Z: 40 72.311 2.488 1.009 0.695 0.974 0.667 CB 1.989 40 residues pruned to eliminate duplicates Z: 7 7.299 1.792 0.258 0.450 1.000 0.167 CA 1.392 7 residues pruned to eliminate duplicates Z: 23 52.034 2.266 1.065 0.915 0.955 0.636 CB 1.756 23 residues pruned to eliminate duplicates Z: 64 70.410 2.493 0.931 0.619 0.889 0.651 CB 1.853 71 residues pruned to eliminate duplicates Z: 24 56.493 2.457 1.038 0.715 0.957 0.696 CA 2.023 24 residues pruned to eliminate duplicates Z: 13 10.551 2.021 0.347 0.576 0.833 0.750 CB 1.248 13 residues pruned to eliminate duplicates Z: 22 59.846 2.461 0.938 0.893 0.952 0.714 CB 2.063 22 residues pruned to eliminate duplicates Z: 6 7.054 1.822 0.342 0.699 0.800 0.800 CA 1.345 6 residues pruned to eliminate duplicates Z: 9 20.315 2.041 0.567 0.877 1.000 1.000 CB 1.631 9 residues pruned to eliminate duplicates Z: 6 7.832 1.687 0.314 0.830 1.000 0.600 CB 1.189 6 residues pruned to eliminate duplicates Z: 108 87.936 2.476 0.823 0.589 0.925 0.729 CB 1.869 108 residues pruned to eliminate duplicates Z: 56 48.273 2.366 0.777 0.524 0.945 0.618 CB 1.599 56 residues pruned to eliminate duplicates Z: 6 3.552 1.770 -0.467 0.605 1.000 0.600 CA 1.522 6 residues pruned to eliminate duplicates Z: 28 49.269 2.333 1.019 0.676 1.000 0.704 CB 1.712 28 residues pruned to eliminate duplicates Z: 9 17.171 2.001 0.458 0.856 1.000 0.750 CB 1.534 9 residues pruned to eliminate duplicates Z: 23 37.560 2.229 0.581 0.902 0.955 0.864 CB 1.698 23 residues pruned to eliminate duplicates Z: 8 28.009 2.541 0.964 0.767 0.857 0.429 CB 1.953 8 residues pruned to eliminate duplicates Z: 55 44.577 2.334 0.521 0.588 0.963 0.704 CB 1.632 55 residues pruned to eliminate duplicates Z: 34 32.944 2.413 0.462 0.530 0.970 0.636 CB 1.628 34 residues pruned to eliminate duplicates Z: 14 25.422 2.404 0.934 0.473 0.846 0.692 CA 1.842 14 residues pruned to eliminate duplicates Z: 7 6.531 1.603 0.678 0.388 0.833 0.500 CA 1.340 7 residues pruned to eliminate duplicates Z: 13 14.701 2.168 0.443 0.622 0.917 0.833 CB 1.319 13 residues pruned to eliminate duplicates Z: 27 31.520 2.387 0.593 0.518 0.962 0.577 CB 1.660 27 residues pruned to eliminate duplicates Z: 9 13.315 2.161 0.402 0.776 0.750 0.625 CB 1.625 9 residues pruned to eliminate duplicates Z: 50 65.411 2.347 0.912 0.674 0.980 0.755 CB 1.811 56 residues pruned to eliminate duplicates Z: 9 25.588 2.350 0.534 0.902 1.000 0.875 CB 1.789 9 residues pruned to eliminate duplicates Z: 50 72.769 2.460 0.983 0.666 0.939 0.551 CB 1.947 50 residues pruned to eliminate duplicates Z: 18 22.283 1.834 0.725 0.921 1.000 0.765 CB 1.202 18 residues pruned to eliminate duplicates Z: 6 6.219 1.920 0.284 0.340 1.000 0.800 CB 1.343 Z: 6 6.006 2.067 0.164 0.375 1.000 0.800 CB 1.275 12 residues pruned to eliminate duplicates Z: 72 67.037 2.455 0.851 0.604 0.901 0.662 CB 1.760 72 residues pruned to eliminate duplicates Z: 19 23.183 2.174 0.687 0.570 0.944 0.611 CB 1.475 19 residues pruned to eliminate duplicates Z: 29 36.349 2.369 0.679 0.534 0.893 0.679 CB 1.871 29 residues pruned to eliminate duplicates Z: 11 13.125 2.088 0.671 0.501 0.900 0.700 CB 1.320 11 residues pruned to eliminate duplicates Z: 64 51.600 2.273 0.795 0.548 0.921 0.587 CB 1.652 64 residues pruned to eliminate duplicates Z: 6 8.629 2.131 -0.045 0.832 1.000 0.800 CA 1.423 6 residues pruned to eliminate duplicates Z: 21 42.209 2.405 0.900 0.666 0.950 0.550 CA 1.865 21 residues pruned to eliminate duplicates Z: 12 12.117 2.022 0.491 0.776 0.818 0.636 CB 1.161 12 residues pruned to eliminate duplicates Z: 21 81.914 2.627 1.458 0.891 0.950 0.900 CB 2.147 21 residues pruned to eliminate duplicates Z: 8 6.088 1.589 0.441 0.528 0.857 0.429 CA 1.141 8 residues pruned to eliminate duplicates Z: 44 56.461 2.503 0.880 0.584 0.930 0.744 CB 1.815 44 residues pruned to eliminate duplicates Z: 38 32.373 2.168 0.738 0.556 0.946 0.622 CB 1.414 38 residues pruned to eliminate duplicates Z: 19 20.522 2.244 0.582 0.521 0.889 0.611 CB 1.501 19 residues pruned to eliminate duplicates Z: 8 10.988 1.958 0.569 0.562 1.000 0.571 CA 1.272 8 residues pruned to eliminate duplicates Z: 15 25.293 2.330 0.797 0.640 0.857 0.786 CB 1.653 16 residues pruned to eliminate duplicates Z: 24 54.379 2.352 0.806 0.892 1.000 0.739 CB 1.917 24 residues pruned to eliminate duplicates Z: 7 8.630 1.992 0.222 0.849 0.833 0.833 CB 1.288 7 residues pruned to eliminate duplicates Z: 40 53.033 2.239 0.915 0.699 0.974 0.744 CB 1.695 40 residues pruned to eliminate duplicates Z: 18 26.667 1.878 0.775 0.933 1.000 0.706 CB 1.354 18 residues pruned to eliminate duplicates Z: 9 19.276 2.224 0.744 0.828 1.000 0.875 CB 1.323 9 residues pruned to eliminate duplicates Z: 15 14.032 1.844 0.574 0.483 0.857 0.500 CA 1.534 15 residues pruned to eliminate duplicates Z: 20 25.062 2.252 0.557 0.508 1.000 0.789 CB 1.628 20 residues pruned to eliminate duplicates Z: 20 18.381 2.359 0.745 0.376 0.842 0.526 CB 1.388 20 residues pruned to eliminate duplicates Z: 13 21.033 2.375 0.680 0.481 0.833 0.500 CB 1.862 13 residues pruned to eliminate duplicates Z: 17 53.028 2.437 1.083 0.909 0.938 0.750 C 1.978 17 residues pruned to eliminate duplicates Z: 97 68.460 2.432 0.698 0.544 0.938 0.740 CB 1.728 97 residues pruned to eliminate duplicates Z: 37 53.942 2.293 0.742 0.788 0.972 0.806 CB 1.797 37 residues pruned to eliminate duplicates Z: 36 34.942 2.418 0.679 0.519 0.829 0.629 CB 1.723 36 residues pruned to eliminate duplicates Z: 9 23.023 2.267 0.676 0.851 1.000 0.875 CB 1.586 9 residues pruned to eliminate duplicates Z: 12 13.264 2.029 0.536 0.526 0.818 0.636 CA 1.529 12 residues pruned to eliminate duplicates Z: 12 18.257 1.962 0.399 0.908 1.000 0.909 CB 1.424 12 residues pruned to eliminate duplicates Z: 24 46.860 2.088 1.119 0.882 1.000 0.565 CB 1.599 24 residues pruned to eliminate duplicates Z: 26 14.666 1.840 0.294 0.673 0.960 0.800 CB 1.094 26 residues pruned to eliminate duplicates Z: 88 58.556 2.265 0.772 0.547 0.920 0.563 CB 1.625 88 residues pruned to eliminate duplicates Z: 38 33.660 2.094 0.616 0.583 0.919 0.649 CB 1.644 38 residues pruned to eliminate duplicates Z: 28 18.756 2.116 0.441 0.411 0.815 0.481 CB 1.596 28 residues pruned to eliminate duplicates Z: 6 5.242 1.777 0.474 0.299 0.800 0.800 O 1.400 Z: 15 37.393 2.525 1.069 0.596 0.929 0.643 CA 1.879 15 residues pruned to eliminate duplicates Z: 41 38.289 2.295 0.813 0.473 0.825 0.625 CB 1.813 41 residues pruned to eliminate duplicates Z: 18 28.534 2.193 0.968 0.491 0.941 0.647 CB 1.719 18 residues pruned to eliminate duplicates Z: 13 13.329 2.037 0.575 0.412 0.833 0.667 CA 1.578 13 residues pruned to eliminate duplicates Z: 18 22.746 1.895 0.373 0.934 1.000 0.765 CB 1.478 18 residues pruned to eliminate duplicates Z: 24 38.266 2.100 0.831 0.821 0.913 0.870 CA 1.720 24 residues pruned to eliminate duplicates Z: 14 19.170 2.114 0.727 0.514 0.846 0.538 CA 1.697 14 residues pruned to eliminate duplicates Z: 36 35.332 2.214 0.750 0.532 0.943 0.629 CB 1.584 36 residues pruned to eliminate duplicates Z: 9 22.299 2.028 0.836 0.836 1.000 0.750 CB 1.586 9 residues pruned to eliminate duplicates Z: 7 5.401 1.735 0.504 0.446 0.667 0.167 CB 1.340 7 residues pruned to eliminate duplicates Z: 13 28.547 2.121 1.063 0.771 1.000 0.667 CB 1.483 13 residues pruned to eliminate duplicates Z: 26 21.040 2.145 0.594 0.378 0.800 0.520 CB 1.752 26 residues pruned to eliminate duplicates Z: 6 6.874 1.671 0.185 0.825 1.000 0.600 CB 1.171 6 residues pruned to eliminate duplicates Z: 18 17.183 1.900 0.642 0.702 0.882 0.647 CB 1.259 18 residues pruned to eliminate duplicates Z: 42 78.429 2.471 1.157 0.670 0.976 0.707 CB 2.014 42 residues pruned to eliminate duplicates Z: 55 77.010 2.402 1.045 0.664 0.963 0.704 CB 1.903 55 residues pruned to eliminate duplicates Z: 38 41.898 2.226 0.981 0.596 0.892 0.676 CB 1.598 39 residues pruned to eliminate duplicates Z: 33 35.334 2.201 0.770 0.571 0.906 0.656 CB 1.652 15 residues pruned to eliminate duplicates Z: 98 66.355 2.446 0.711 0.547 0.907 0.639 CB 1.695 98 residues pruned to eliminate duplicates Z: 11 31.495 2.181 0.854 0.839 1.000 0.800 C 1.840 11 residues pruned to eliminate duplicates Z: 7 7.469 1.954 0.417 0.363 1.000 0.500 CB 1.276 7 residues pruned to eliminate duplicates Z: 13 15.259 1.927 0.696 0.509 1.000 0.917 CA 1.336 13 residues pruned to eliminate duplicates Z: 40 35.993 2.209 0.708 0.504 0.923 0.744 CB 1.647 40 residues pruned to eliminate duplicates Z: 74 46.066 2.245 0.597 0.521 0.918 0.644 CB 1.605 74 residues pruned to eliminate duplicates Z: 26 47.577 2.384 1.021 0.658 1.000 0.880 CB 1.705 26 residues pruned to eliminate duplicates Z: 11 11.077 1.776 0.342 0.596 1.000 0.600 CB 1.341 11 residues pruned to eliminate duplicates Z: 81 74.953 2.372 0.876 0.601 0.963 0.700 CB 1.777 81 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 130 78.711 2.319 0.729 0.582 0.930 0.643 CB 1.718 130 residues pruned to eliminate duplicates Z: 62 87.304 2.499 1.066 0.657 0.951 0.639 CB 1.968 62 residues pruned to eliminate duplicates Z: 130 75.560 2.304 0.702 0.580 0.930 0.667 CB 1.688 130 residues pruned to eliminate duplicates Z: 44 59.923 2.385 0.864 0.659 0.930 0.721 CB 1.906 44 residues pruned to eliminate duplicates Z: 78 68.916 2.407 0.791 0.594 0.935 0.649 CB 1.781 78 residues pruned to eliminate duplicates Z: 134 82.769 2.314 0.763 0.599 0.947 0.647 CB 1.689 134 residues pruned to eliminate duplicates Z: 62 81.658 2.469 0.978 0.645 0.951 0.689 CB 1.967 62 residues pruned to eliminate duplicates Z: 128 77.050 2.289 0.757 0.587 0.937 0.646 CB 1.669 128 residues pruned to eliminate duplicates Z: 64 79.472 2.428 0.960 0.637 0.968 0.651 CB 1.910 64 residues pruned to eliminate duplicates Z: 40 66.718 2.431 0.912 0.716 0.949 0.744 CB 1.992 40 residues pruned to eliminate duplicates Z: 106 82.578 2.371 0.870 0.588 0.933 0.657 CB 1.790 106 residues pruned to eliminate duplicates Z: 43 57.095 2.328 1.096 0.623 0.881 0.667 CB 1.825 43 residues pruned to eliminate duplicates Z: 64 81.717 2.458 1.070 0.637 0.937 0.587 CB 1.900 64 residues pruned to eliminate duplicates Z: 90 87.737 2.454 0.959 0.599 0.944 0.652 CB 1.864 90 residues pruned to eliminate duplicates Z: 128 72.226 2.281 0.730 0.573 0.921 0.654 CB 1.643 128 residues pruned to eliminate duplicates Z: 46 59.171 2.384 0.973 0.639 0.889 0.667 CB 1.853 46 residues pruned to eliminate duplicates Z: 64 83.509 2.439 1.095 0.646 0.952 0.587 CB 1.888 64 residues pruned to eliminate duplicates Z: 62 81.090 2.468 1.033 0.647 0.934 0.689 CB 1.931 62 residues pruned to eliminate duplicates Z: 68 75.139 2.427 1.037 0.598 0.910 0.597 CB 1.857 68 residues pruned to eliminate duplicates Z: 121 81.059 2.357 0.735 0.577 0.950 0.642 CB 1.768 121 residues pruned to eliminate duplicates Z: 49 61.680 2.286 0.946 0.667 0.958 0.729 CB 1.790 49 residues pruned to eliminate duplicates Z: 37 72.629 2.464 1.181 0.702 0.972 0.806 CB 1.928 37 residues pruned to eliminate duplicates Z: 96 79.481 2.404 0.939 0.594 0.884 0.674 CB 1.809 96 residues pruned to eliminate duplicates Z: 97 85.233 2.395 0.925 0.605 0.927 0.698 CB 1.842 97 residues pruned to eliminate duplicates Z: 56 86.744 2.515 1.101 0.663 0.945 0.745 CB 2.014 56 residues pruned to eliminate duplicates Z: 38 72.874 2.515 1.259 0.698 0.919 0.622 CB 1.915 38 residues pruned to eliminate duplicates Z: 65 71.725 2.412 0.964 0.626 0.906 0.578 CB 1.853 65 residues pruned to eliminate duplicates Z: 106 78.634 2.394 0.834 0.563 0.914 0.590 CB 1.799 106 residues pruned to eliminate duplicates Z: 41 71.974 2.421 1.079 0.710 0.950 0.675 CB 1.968 41 residues pruned to eliminate duplicates Z: 56 86.863 2.514 1.114 0.670 0.945 0.655 CB 1.991 56 residues pruned to eliminate duplicates Z: 69 72.525 2.426 0.990 0.608 0.912 0.603 CB 1.804 69 residues pruned to eliminate duplicates Z: 135 80.306 2.284 0.795 0.590 0.948 0.701 CB 1.638 135 residues pruned to eliminate duplicates Z: 63 80.899 2.466 1.034 0.647 0.919 0.694 CB 1.943 63 residues pruned to eliminate duplicates Z: 99 82.250 2.384 0.919 0.601 0.908 0.694 CB 1.815 99 residues pruned to eliminate duplicates Z: 108 75.674 2.375 0.835 0.542 0.907 0.589 CB 1.776 108 residues pruned to eliminate duplicates Z: 33 38.929 2.307 0.829 0.574 0.875 0.531 CB 1.736 33 residues pruned to eliminate duplicates Z: 101 84.452 2.380 0.925 0.600 0.920 0.700 CB 1.822 101 residues pruned to eliminate duplicates Z: 64 79.445 2.426 1.054 0.628 0.952 0.651 CB 1.871 64 residues pruned to eliminate duplicates Z: 63 84.311 2.472 1.028 0.670 0.968 0.661 CB 1.886 63 residues pruned to eliminate duplicates Z: 63 74.540 2.443 1.029 0.618 0.935 0.629 CB 1.825 63 residues pruned to eliminate duplicates Z: 67 52.587 2.369 0.773 0.508 0.909 0.591 CB 1.682 67 residues pruned to eliminate duplicates Z: 129 78.933 2.300 0.765 0.581 0.938 0.648 CB 1.696 129 residues pruned to eliminate duplicates Z: 62 86.187 2.472 1.065 0.649 0.984 0.721 CB 1.913 62 residues pruned to eliminate duplicates Z: 85 59.093 2.278 0.747 0.520 0.940 0.631 CB 1.689 85 residues pruned to eliminate duplicates Z: 25 40.076 2.428 0.982 0.527 0.917 0.583 CB 1.806 25 residues pruned to eliminate duplicates Z: 131 82.082 2.318 0.817 0.583 0.938 0.638 CB 1.682 131 residues pruned to eliminate duplicates Z: 62 85.760 2.494 1.055 0.654 0.951 0.656 CB 1.953 62 residues pruned to eliminate duplicates Z: 101 84.607 2.383 0.894 0.589 0.950 0.630 CB 1.812 101 residues pruned to eliminate duplicates Z: 66 50.691 2.342 0.798 0.486 0.877 0.538 CB 1.727 66 residues pruned to eliminate duplicates Z: 69 78.119 2.422 1.022 0.624 0.941 0.603 CB 1.829 69 residues pruned to eliminate duplicates Z: 92 83.013 2.410 0.896 0.604 0.945 0.626 CB 1.825 92 residues pruned to eliminate duplicates Z: 24 44.858 2.394 1.087 0.571 0.957 0.609 CB 1.827 24 residues pruned to eliminate duplicates Z: 27 39.982 2.293 0.922 0.523 0.923 0.615 CB 1.885 27 residues pruned to eliminate duplicates Z: 99 82.715 2.379 0.881 0.590 0.939 0.663 CB 1.826 99 residues pruned to eliminate duplicates Z: 23 41.135 2.441 1.000 0.533 0.955 0.545 CB 1.821 23 residues pruned to eliminate duplicates Z: 132 76.120 2.289 0.741 0.583 0.939 0.649 CB 1.642 132 residues pruned to eliminate duplicates Z: 60 51.619 2.347 0.809 0.520 0.898 0.678 CB 1.728 60 residues pruned to eliminate duplicates Z: 135 79.191 2.296 0.820 0.593 0.903 0.642 CB 1.658 135 residues pruned to eliminate duplicates Z: 39 33.883 2.196 0.682 0.516 0.921 0.579 CB 1.589 39 residues pruned to eliminate duplicates Z: 74 33.393 2.090 0.436 0.519 0.904 0.699 CB 1.413 74 residues pruned to eliminate duplicates Z: 61 38.519 2.186 0.503 0.565 0.933 0.650 CB 1.522 61 residues pruned to eliminate duplicates Z: 33 38.559 2.287 0.681 0.565 0.969 0.656 CB 1.719 33 residues pruned to eliminate duplicates Z: 44 36.789 2.293 0.626 0.473 0.930 0.628 CB 1.664 44 residues pruned to eliminate duplicates Z: 57 50.814 2.367 0.784 0.553 0.893 0.589 CB 1.711 57 residues pruned to eliminate duplicates Z: 38 34.653 2.157 0.652 0.495 0.946 0.568 CB 1.698 38 residues pruned to eliminate duplicates Z: 34 36.780 2.266 0.756 0.539 0.909 0.727 CB 1.703 34 residues pruned to eliminate duplicates Z: 34 36.519 2.281 0.679 0.542 0.939 0.697 CB 1.696 34 residues pruned to eliminate duplicates Z: 97 85.171 2.398 0.962 0.601 0.917 0.677 CB 1.832 97 residues pruned to eliminate duplicates Z: 35 34.927 2.219 0.706 0.545 0.912 0.706 CB 1.661 35 residues pruned to eliminate duplicates Z: 37 35.616 2.238 0.713 0.512 0.917 0.694 CB 1.668 37 residues pruned to eliminate duplicates Z: 38 34.895 2.208 0.578 0.530 0.946 0.649 CB 1.690 38 residues pruned to eliminate duplicates Z: 36 34.138 2.240 0.606 0.567 0.914 0.571 CB 1.644 36 residues pruned to eliminate duplicates Z: 38 34.869 2.270 0.576 0.525 0.946 0.676 CB 1.653 38 residues pruned to eliminate duplicates Z: 66 39.882 2.164 0.488 0.542 0.938 0.692 CB 1.572 66 residues pruned to eliminate duplicates Z: 44 41.038 2.299 0.679 0.487 0.953 0.581 CB 1.722 44 residues pruned to eliminate duplicates Z: 36 38.677 2.352 0.600 0.546 0.943 0.629 CB 1.761 36 residues pruned to eliminate duplicates Z: 73 39.047 2.142 0.473 0.546 0.931 0.667 CB 1.499 73 residues pruned to eliminate duplicates Z: 73 41.973 2.165 0.527 0.531 0.931 0.667 CB 1.560 73 residues pruned to eliminate duplicates Z: 41 36.786 2.237 0.729 0.531 0.900 0.700 CB 1.622 41 residues pruned to eliminate duplicates Z: 74 37.181 2.098 0.487 0.529 0.945 0.685 CB 1.435 74 residues pruned to eliminate duplicates Z: 58 40.650 2.227 0.547 0.569 0.930 0.649 CB 1.572 58 residues pruned to eliminate duplicates Z: 67 36.784 2.134 0.512 0.543 0.939 0.682 CB 1.432 67 residues pruned to eliminate duplicates Z: 35 37.093 2.217 0.701 0.562 0.941 0.765 CB 1.687 35 residues pruned to eliminate duplicates Z: 135 78.716 2.288 0.777 0.588 0.925 0.642 CB 1.661 135 residues pruned to eliminate duplicates Z: 22 25.147 2.247 0.679 0.421 0.952 0.571 CB 1.659 22 residues pruned to eliminate duplicates Z: 68 36.660 2.146 0.473 0.539 0.925 0.731 CB 1.473 68 residues pruned to eliminate duplicates Z: 72 40.027 2.143 0.595 0.515 0.915 0.690 CB 1.496 72 residues pruned to eliminate duplicates Z: 37 38.816 2.253 0.659 0.523 0.972 0.694 CB 1.741 37 residues pruned to eliminate duplicates Z: 37 34.447 2.295 0.636 0.512 0.917 0.667 CB 1.648 37 residues pruned to eliminate duplicates Z: 97 54.026 2.224 0.646 0.532 0.927 0.677 CB 1.575 97 residues pruned to eliminate duplicates Z: 136 78.267 2.286 0.791 0.575 0.941 0.689 CB 1.627 136 residues pruned to eliminate duplicates Z: 122 79.250 2.321 0.737 0.595 0.950 0.678 CB 1.718 122 residues pruned to eliminate duplicates Z: 32 20.672 1.964 0.460 0.620 0.935 0.806 CB 1.235 32 residues pruned to eliminate duplicates Z: 37 17.405 1.906 0.357 0.515 0.833 0.611 CB 1.327 37 residues pruned to eliminate duplicates Z: 48 36.507 2.206 0.719 0.478 0.915 0.574 CB 1.569 48 residues pruned to eliminate duplicates Z: 72 39.090 2.116 0.606 0.566 0.930 0.718 CB 1.377 72 residues pruned to eliminate duplicates Z: 40 24.879 1.988 0.490 0.594 0.949 0.769 CB 1.296 40 residues pruned to eliminate duplicates Z: 12 16.543 2.209 0.779 0.373 0.909 0.727 CB 1.599 12 residues pruned to eliminate duplicates Z: 40 21.932 1.972 0.417 0.602 0.923 0.718 CB 1.236 40 residues pruned to eliminate duplicates Z: 47 22.542 1.888 0.499 0.573 0.913 0.761 CB 1.199 47 residues pruned to eliminate duplicates Z: 39 24.856 2.038 0.511 0.569 0.947 0.789 CB 1.293 39 residues pruned to eliminate duplicates Z: 126 81.616 2.319 0.758 0.606 0.952 0.728 CB 1.701 126 residues pruned to eliminate duplicates Z: 53 28.577 2.081 0.480 0.519 0.923 0.673 CB 1.368 53 residues pruned to eliminate duplicates Z: 40 21.860 1.953 0.502 0.601 0.897 0.769 CB 1.208 40 residues pruned to eliminate duplicates Z: 22 21.157 2.127 0.519 0.535 0.952 0.762 CB 1.449 22 residues pruned to eliminate duplicates Z: 73 41.057 2.138 0.564 0.562 0.944 0.736 CB 1.442 73 residues pruned to eliminate duplicates Z: 25 24.287 2.146 0.454 0.626 0.958 0.792 CB 1.473 25 residues pruned to eliminate duplicates Z: 25 24.378 2.048 0.639 0.652 0.958 0.750 CB 1.343 25 residues pruned to eliminate duplicates Z: 73 41.462 2.142 0.567 0.547 0.917 0.750 CB 1.518 73 residues pruned to eliminate duplicates Z: 32 25.281 1.999 0.659 0.603 0.903 0.677 CB 1.374 32 residues pruned to eliminate duplicates Z: 40 26.343 1.984 0.664 0.598 0.949 0.718 CB 1.226 40 residues pruned to eliminate duplicates Z: 78 41.539 2.082 0.648 0.530 0.896 0.662 CB 1.494 78 residues pruned to eliminate duplicates Z: 71 45.705 2.166 0.671 0.564 0.943 0.714 CB 1.505 71 residues pruned to eliminate duplicates Z: 27 15.223 1.842 0.616 0.598 0.846 0.538 CB 1.080 27 residues pruned to eliminate duplicates Z: 95 51.234 2.196 0.698 0.539 0.904 0.649 CB 1.508 95 residues pruned to eliminate duplicates Z: 37 24.716 1.941 0.718 0.578 0.917 0.667 CB 1.250 37 residues pruned to eliminate duplicates Z: 73 43.456 2.135 0.645 0.558 0.944 0.653 CB 1.459 73 residues pruned to eliminate duplicates Z: 73 39.602 2.085 0.675 0.522 0.944 0.681 CB 1.385 73 residues pruned to eliminate duplicates Z: 36 24.579 1.946 0.775 0.571 0.914 0.629 CB 1.229 36 residues pruned to eliminate duplicates Z: 26 18.097 1.857 0.692 0.650 0.920 0.560 CB 1.089 26 residues pruned to eliminate duplicates Z: 29 18.309 1.850 0.549 0.637 0.929 0.679 CB 1.144 28 residues pruned to eliminate duplicates Z: 6 3.265 1.449 0.248 0.374 1.000 0.600 CA 0.924 5 residues pruned to eliminate duplicates Z: 6 3.313 1.671 0.423 0.366 0.600 0.400 CA 1.199 6 residues pruned to eliminate duplicates Z: 33 53.707 2.265 0.873 0.766 0.969 0.781 CB 1.825 33 residues pruned to eliminate duplicates Z: 37 61.442 2.305 0.962 0.778 1.000 0.750 CB 1.772 38 residues pruned to eliminate duplicates Z: 26 43.869 2.148 0.887 0.793 0.960 0.760 CA 1.744 26 residues pruned to eliminate duplicates Z: 37 59.725 2.310 0.958 0.779 1.000 0.806 CB 1.720 37 residues pruned to eliminate duplicates Z: 33 56.606 2.274 0.902 0.780 1.000 0.781 CA 1.807 33 residues pruned to eliminate duplicates Z: 37 54.931 2.291 0.769 0.782 1.000 0.833 CB 1.762 37 residues pruned to eliminate duplicates Z: 22 48.226 2.282 0.812 0.893 1.000 0.714 CB 1.828 22 residues pruned to eliminate duplicates Z: 33 48.538 2.225 0.748 0.776 0.969 0.844 CA 1.784 33 residues pruned to eliminate duplicates Z: 35 53.830 2.269 0.819 0.781 0.971 0.794 CB 1.799 35 residues pruned to eliminate duplicates Z: 34 51.344 2.257 0.788 0.793 0.970 0.818 CB 1.767 34 residues pruned to eliminate duplicates Z: 37 60.410 2.299 0.926 0.795 1.000 0.833 CB 1.756 37 residues pruned to eliminate duplicates Z: 37 56.847 2.298 0.890 0.785 1.000 0.750 CB 1.698 37 residues pruned to eliminate duplicates Z: 31 62.531 2.322 1.018 0.815 1.000 0.667 CB 1.852 31 residues pruned to eliminate duplicates Z: 72 56.150 2.250 0.841 0.596 0.930 0.620 CB 1.579 72 residues pruned to eliminate duplicates Z: 38 55.261 2.259 0.868 0.765 1.000 0.838 CB 1.703 38 residues pruned to eliminate duplicates Z: 23 48.862 2.204 1.001 0.909 1.000 0.909 CB 1.676 23 residues pruned to eliminate duplicates Z: 31 63.936 2.330 1.017 0.823 1.000 0.733 CB 1.877 31 residues pruned to eliminate duplicates Z: 37 60.811 2.302 0.974 0.791 1.000 0.722 CB 1.727 37 residues pruned to eliminate duplicates Z: 37 61.338 2.292 0.964 0.798 1.000 0.750 CB 1.749 37 residues pruned to eliminate duplicates Z: 36 59.229 2.322 0.951 0.780 1.000 0.800 CB 1.726 36 residues pruned to eliminate duplicates Z: 38 55.236 2.236 0.947 0.754 0.973 0.730 CB 1.709 38 residues pruned to eliminate duplicates Z: 31 58.615 2.307 0.985 0.765 1.000 0.700 CB 1.847 31 residues pruned to eliminate duplicates Z: 36 60.984 2.284 1.054 0.791 1.000 0.714 CB 1.702 36 residues pruned to eliminate duplicates Z: 31 54.078 2.268 0.977 0.785 0.967 0.700 CB 1.772 31 residues pruned to eliminate duplicates Z: 78 71.814 2.354 0.906 0.644 0.909 0.662 CB 1.755 78 residues pruned to eliminate duplicates Z: 133 87.396 2.397 0.857 0.602 0.939 0.667 CB 1.651 133 residues pruned to eliminate duplicates Z: 75 60.957 2.428 0.846 0.525 0.919 0.662 CB 1.678 75 residues pruned to eliminate duplicates Z: 77 75.321 2.446 0.913 0.607 0.921 0.632 CB 1.811 77 residues pruned to eliminate duplicates Z: 85 64.095 2.466 0.826 0.527 0.893 0.619 CB 1.693 85 residues pruned to eliminate duplicates Z: 117 75.607 2.403 0.804 0.565 0.931 0.655 CB 1.633 117 residues pruned to eliminate duplicates Z: 68 57.520 2.426 0.764 0.526 0.925 0.597 CB 1.730 68 residues pruned to eliminate duplicates Z: 46 50.788 2.540 0.892 0.506 0.911 0.667 CB 1.719 46 residues pruned to eliminate duplicates Z: 77 79.619 2.456 1.009 0.604 0.947 0.697 CB 1.770 77 residues pruned to eliminate duplicates Z: 45 55.188 2.519 1.004 0.546 0.886 0.636 CB 1.778 45 residues pruned to eliminate duplicates Z: 47 51.532 2.532 0.910 0.482 0.935 0.587 CB 1.712 47 residues pruned to eliminate duplicates Z: 44 54.197 2.549 0.918 0.522 0.884 0.628 CB 1.873 44 residues pruned to eliminate duplicates Z: 46 53.732 2.547 0.890 0.490 0.933 0.622 CB 1.801 46 residues pruned to eliminate duplicates Z: 96 70.008 2.463 0.746 0.522 0.947 0.663 CB 1.724 96 residues pruned to eliminate duplicates Z: 96 69.491 2.448 0.734 0.551 0.937 0.621 CB 1.705 96 residues pruned to eliminate duplicates Z: 98 69.861 2.453 0.744 0.548 0.938 0.701 CB 1.687 98 residues pruned to eliminate duplicates Z: 96 70.603 2.444 0.791 0.546 0.937 0.653 CB 1.689 96 residues pruned to eliminate duplicates Z: 146 86.584 2.348 0.793 0.598 0.945 0.703 CB 1.647 305 residues pruned to eliminate duplicates Z: 11 20.262 2.178 0.835 0.696 0.800 0.600 CA 1.677 11 residues pruned to eliminate duplicates Z: 43 55.228 2.578 0.924 0.534 0.905 0.619 CB 1.836 43 residues pruned to eliminate duplicates Z: 98 64.176 2.416 0.727 0.523 0.918 0.629 CB 1.665 98 residues pruned to eliminate duplicates Z: 29 57.625 2.651 1.071 0.562 0.929 0.714 CB 2.010 29 residues pruned to eliminate duplicates Z: 98 65.906 2.392 0.744 0.537 0.907 0.608 CB 1.705 98 residues pruned to eliminate duplicates Z: 97 73.181 2.475 0.783 0.562 0.917 0.708 CB 1.738 97 residues pruned to eliminate duplicates Z: 62 56.502 2.394 0.897 0.497 0.934 0.623 CB 1.709 62 residues pruned to eliminate duplicates Z: 98 65.962 2.424 0.740 0.527 0.907 0.639 CB 1.703 98 residues pruned to eliminate duplicates Z: 91 66.596 2.432 0.779 0.523 0.922 0.644 CB 1.721 91 residues pruned to eliminate duplicates Z: 46 53.787 2.544 0.939 0.506 0.911 0.644 CB 1.774 46 residues pruned to eliminate duplicates Z: 38 57.504 2.552 1.004 0.524 0.919 0.649 CB 1.964 38 residues pruned to eliminate duplicates Z: 54 59.543 2.517 0.901 0.525 0.906 0.604 CB 1.841 54 residues pruned to eliminate duplicates Z: 34 39.905 2.356 0.935 0.510 0.879 0.515 CB 1.717 34 residues pruned to eliminate duplicates Z: 98 66.408 2.434 0.712 0.527 0.928 0.619 CB 1.698 98 residues pruned to eliminate duplicates Z: 41 38.450 2.492 0.814 0.441 0.825 0.525 CB 1.733 41 residues pruned to eliminate duplicates Z: 48 49.282 2.490 0.865 0.473 0.915 0.532 CB 1.740 48 residues pruned to eliminate duplicates Z: 66 50.899 2.374 0.639 0.541 0.985 0.708 CB 1.583 66 residues pruned to eliminate duplicates Z: 84 68.052 2.479 0.823 0.532 0.916 0.602 CB 1.750 84 residues pruned to eliminate duplicates Z: 45 52.228 2.497 0.983 0.517 0.886 0.591 CB 1.764 45 residues pruned to eliminate duplicates Z: 123 73.689 2.384 0.784 0.521 0.926 0.598 CB 1.658 123 residues pruned to eliminate duplicates Z: 45 48.084 2.482 0.925 0.513 0.864 0.636 CB 1.734 45 residues pruned to eliminate duplicates Z: 49 35.625 2.282 0.735 0.449 0.896 0.646 CB 1.528 49 residues pruned to eliminate duplicates Z: 118 81.867 2.445 0.826 0.570 0.940 0.701 CB 1.685 118 residues pruned to eliminate duplicates Z: 47 55.694 2.516 0.923 0.492 0.935 0.587 CB 1.830 47 residues pruned to eliminate duplicates Z: 76 63.843 2.412 0.912 0.499 0.933 0.693 CB 1.715 76 residues pruned to eliminate duplicates Z: 65 60.221 2.443 0.869 0.538 0.906 0.672 CB 1.754 65 residues pruned to eliminate duplicates Z: 66 49.858 2.390 0.595 0.543 0.938 0.708 CB 1.657 66 residues pruned to eliminate duplicates Z: 45 31.299 2.292 0.585 0.428 0.864 0.659 CB 1.620 45 residues pruned to eliminate duplicates Z: 72 50.647 2.360 0.669 0.527 0.915 0.732 CB 1.623 72 residues pruned to eliminate duplicates Z: 96 67.968 2.432 0.782 0.529 0.916 0.684 CB 1.708 96 residues pruned to eliminate duplicates Z: 71 46.918 2.380 0.524 0.533 0.914 0.743 CB 1.637 71 residues pruned to eliminate duplicates Z: 32 31.087 2.245 0.711 0.550 0.871 0.710 CB 1.589 32 residues pruned to eliminate duplicates Z: 21 28.631 2.240 0.638 0.642 0.950 0.700 CB 1.608 21 residues pruned to eliminate duplicates Z: 98 67.364 2.444 0.753 0.545 0.897 0.670 CB 1.704 98 residues pruned to eliminate duplicates Z: 122 78.918 2.426 0.779 0.553 0.926 0.678 CB 1.706 122 residues pruned to eliminate duplicates Z: 65 51.501 2.386 0.647 0.562 0.953 0.672 CB 1.619 65 residues pruned to eliminate duplicates Z: 76 55.189 2.372 0.703 0.501 0.933 0.600 CB 1.688 76 residues pruned to eliminate duplicates Z: 42 36.409 2.232 0.767 0.492 0.902 0.732 CB 1.610 42 residues pruned to eliminate duplicates Z: 43 43.419 2.365 0.668 0.588 0.976 0.786 CB 1.600 43 residues pruned to eliminate duplicates Z: 97 74.672 2.471 0.809 0.552 0.927 0.698 CB 1.748 97 residues pruned to eliminate duplicates Z: 66 47.071 2.352 0.620 0.570 0.923 0.769 CB 1.552 66 residues pruned to eliminate duplicates Z: 45 39.746 2.325 0.602 0.541 0.955 0.659 CB 1.620 45 residues pruned to eliminate duplicates Z: 92 63.053 2.376 0.772 0.527 0.934 0.670 CB 1.636 91 residues pruned to eliminate duplicates Z: 6 7.269 1.826 1.171 0.404 0.800 0.400 CA 1.133 6 residues pruned to eliminate duplicates Z: 33 38.756 2.285 0.821 0.567 0.938 0.719 CB 1.646 33 residues pruned to eliminate duplicates Z: 38 36.166 2.348 0.528 0.549 0.946 0.703 CB 1.670 38 residues pruned to eliminate duplicates Z: 36 37.570 2.346 0.786 0.574 0.914 0.657 CB 1.543 36 residues pruned to eliminate duplicates Z: 36 36.289 2.389 0.648 0.572 0.943 0.714 CB 1.541 36 residues pruned to eliminate duplicates Z: 22 29.991 2.494 0.679 0.505 0.905 0.667 CB 1.718 22 residues pruned to eliminate duplicates Z: 46 43.246 2.324 0.725 0.544 0.933 0.689 CB 1.651 46 residues pruned to eliminate duplicates Z: 74 67.217 2.458 0.858 0.533 0.945 0.712 CB 1.764 74 residues pruned to eliminate duplicates Z: 95 76.670 2.476 0.865 0.548 0.926 0.649 CB 1.765 95 residues pruned to eliminate duplicates Z: 76 56.283 2.350 0.879 0.452 0.907 0.627 CB 1.706 76 residues pruned to eliminate duplicates Z: 42 32.144 2.245 0.874 0.397 0.878 0.610 CB 1.516 42 residues pruned to eliminate duplicates Z: 81 44.403 2.208 0.664 0.509 0.825 0.600 CB 1.623 81 residues pruned to eliminate duplicates Z: 127 89.961 2.399 0.956 0.541 0.944 0.603 CB 1.738 262 residues pruned to eliminate duplicates Z: 22 30.274 2.509 0.546 0.582 0.905 0.667 CB 1.741 22 residues pruned to eliminate duplicates Z: 72 48.915 2.324 0.720 0.483 0.915 0.606 CB 1.613 72 residues pruned to eliminate duplicates Z: 24 32.451 2.382 0.497 0.654 1.000 0.739 CB 1.644 24 residues pruned to eliminate duplicates Z: 85 71.393 2.469 0.844 0.552 0.940 0.714 CB 1.730 85 residues pruned to eliminate duplicates Z: 25 31.959 2.303 0.573 0.639 0.958 0.750 CB 1.649 25 residues pruned to eliminate duplicates Z: 38 41.718 2.403 0.817 0.586 0.892 0.703 CB 1.621 38 residues pruned to eliminate duplicates Z: 55 52.088 2.354 0.856 0.589 0.926 0.685 CB 1.609 55 residues pruned to eliminate duplicates Z: 32 31.417 2.274 0.555 0.575 0.903 0.613 CB 1.644 32 residues pruned to eliminate duplicates Z: 100 65.126 2.393 0.824 0.520 0.869 0.646 CB 1.693 100 residues pruned to eliminate duplicates Z: 25 40.144 2.386 0.785 0.674 1.000 0.667 CB 1.640 25 residues pruned to eliminate duplicates Z: 43 50.372 2.391 0.922 0.593 0.976 0.643 CB 1.585 43 residues pruned to eliminate duplicates Z: 130 94.653 2.388 0.957 0.591 0.938 0.698 CB 1.742 130 residues pruned to eliminate duplicates Z: 37 45.976 2.495 0.811 0.566 0.944 0.778 CB 1.684 37 residues pruned to eliminate duplicates Z: 37 48.028 2.390 0.987 0.574 0.944 0.611 CB 1.662 37 residues pruned to eliminate duplicates Z: 65 58.758 2.398 0.858 0.547 0.938 0.688 CB 1.679 65 residues pruned to eliminate duplicates Z: 37 32.639 2.332 0.645 0.543 0.944 0.611 CB 1.440 37 residues pruned to eliminate duplicates Z: 70 60.287 2.391 0.870 0.554 0.957 0.710 CB 1.610 70 residues pruned to eliminate duplicates Z: 24 33.703 2.308 0.798 0.685 0.913 0.522 CB 1.565 24 residues pruned to eliminate duplicates Z: 39 41.107 2.333 0.871 0.531 0.947 0.526 CB 1.563 39 residues pruned to eliminate duplicates Z: 91 70.262 2.427 0.935 0.537 0.889 0.700 CB 1.711 91 residues pruned to eliminate duplicates Z: 121 76.590 2.357 0.938 0.524 0.883 0.600 CB 1.691 121 residues pruned to eliminate duplicates Z: 92 66.722 2.355 0.866 0.567 0.912 0.725 CB 1.636 92 residues pruned to eliminate duplicates Z: 22 37.293 2.307 0.962 0.607 0.905 0.667 CB 1.796 23 residues pruned to eliminate duplicates Z: 6 6.815 1.774 0.726 0.283 1.000 0.400 CA 1.272 Z: 16 28.479 2.160 0.633 0.771 1.000 0.600 CB 1.640 16 residues pruned to eliminate duplicates Z: 94 66.456 2.339 0.830 0.554 0.914 0.688 CB 1.670 94 residues pruned to eliminate duplicates Z: 13 35.892 2.132 1.074 0.898 1.000 0.833 CA 1.676 18 residues pruned to eliminate duplicates Z: 13 30.625 2.124 0.839 0.832 1.000 0.917 CA 1.699 13 residues pruned to eliminate duplicates Z: 83 59.070 2.341 0.866 0.564 0.878 0.634 CB 1.599 83 residues pruned to eliminate duplicates Z: 27 32.073 2.356 0.723 0.556 0.923 0.615 CB 1.589 27 residues pruned to eliminate duplicates Z: 21 42.872 2.366 1.018 0.640 0.950 0.600 CB 1.853 21 residues pruned to eliminate duplicates Z: 27 37.942 2.292 0.989 0.576 0.885 0.577 CA 1.714 27 residues pruned to eliminate duplicates Z: 50 52.338 2.351 0.893 0.625 0.918 0.592 CB 1.626 50 residues pruned to eliminate duplicates Z: 42 44.698 2.366 0.910 0.563 0.902 0.659 CB 1.610 42 residues pruned to eliminate duplicates Z: 26 34.839 2.357 0.985 0.561 0.880 0.560 CB 1.595 26 residues pruned to eliminate duplicates Z: 29 30.181 2.240 0.897 0.542 0.857 0.643 CB 1.503 29 residues pruned to eliminate duplicates Z: 91 65.036 2.376 0.792 0.549 0.933 0.622 CB 1.644 91 residues pruned to eliminate duplicates Z: 101 71.723 2.371 0.885 0.547 0.930 0.640 CB 1.648 101 residues pruned to eliminate duplicates Z: 36 42.160 2.386 1.049 0.544 0.857 0.571 CB 1.628 31 residues pruned to eliminate duplicates Z: 7 10.940 1.617 1.108 0.503 1.000 0.833 CB 1.307 Z: 6 6.020 1.709 1.048 0.232 0.800 0.600 CA 1.313 Z: 6 4.605 1.750 0.528 0.387 0.800 0.600 CB 1.085 Z: 6 4.726 1.637 0.604 0.379 0.800 0.600 CA 1.145 6 residues pruned to eliminate duplicates Z: 84 71.885 2.458 0.768 0.584 0.940 0.675 CB 1.783 84 residues pruned to eliminate duplicates Z: 66 73.307 2.468 0.968 0.603 0.938 0.723 CB 1.809 66 residues pruned to eliminate duplicates Z: 50 64.192 2.457 0.941 0.685 0.918 0.755 CB 1.767 50 residues pruned to eliminate duplicates Z: 67 81.017 2.499 1.064 0.632 0.939 0.682 CB 1.819 67 residues pruned to eliminate duplicates Z: 68 77.699 2.519 0.876 0.651 0.940 0.731 CB 1.856 68 residues pruned to eliminate duplicates Z: 135 89.261 2.425 0.719 0.602 0.955 0.701 CB 1.758 135 residues pruned to eliminate duplicates Z: 60 77.636 2.550 0.928 0.633 0.949 0.678 CB 1.913 60 residues pruned to eliminate duplicates Z: 80 76.302 2.523 0.859 0.578 0.924 0.734 CB 1.838 80 residues pruned to eliminate duplicates Z: 63 85.233 2.537 0.986 0.659 0.984 0.758 CB 1.884 63 residues pruned to eliminate duplicates Z: 86 80.515 2.472 0.892 0.587 0.976 0.694 CB 1.760 86 residues pruned to eliminate duplicates Z: 67 77.744 2.536 0.870 0.659 0.939 0.727 CB 1.854 67 residues pruned to eliminate duplicates Z: 59 82.537 2.568 0.969 0.637 0.948 0.707 CB 1.988 59 residues pruned to eliminate duplicates Z: 84 80.061 2.501 0.918 0.598 0.928 0.699 CB 1.798 84 residues pruned to eliminate duplicates Z: 68 82.277 2.505 1.022 0.646 0.955 0.731 CB 1.813 68 residues pruned to eliminate duplicates Z: 136 89.398 2.423 0.814 0.574 0.911 0.719 CB 1.790 136 residues pruned to eliminate duplicates Z: 66 82.140 2.526 1.017 0.653 0.938 0.708 CB 1.848 66 residues pruned to eliminate duplicates Z: 47 71.114 2.447 1.081 0.656 0.957 0.674 CB 1.863 47 residues pruned to eliminate duplicates Z: 58 59.141 2.278 0.984 0.627 0.947 0.632 CB 1.624 58 residues pruned to eliminate duplicates Z: 105 88.391 2.484 0.899 0.605 0.923 0.721 CB 1.802 105 residues pruned to eliminate duplicates Z: 135 96.051 2.426 0.836 0.590 0.955 0.716 CB 1.790 135 residues pruned to eliminate duplicates Z: 49 75.496 2.410 1.049 0.718 1.000 0.750 CB 1.812 49 residues pruned to eliminate duplicates Z: 68 84.542 2.525 1.042 0.641 0.955 0.716 CB 1.838 68 residues pruned to eliminate duplicates Z: 42 81.108 2.537 1.148 0.735 0.976 0.829 CB 1.928 42 residues pruned to eliminate duplicates Z: 67 81.159 2.501 0.990 0.629 0.955 0.788 CB 1.863 67 residues pruned to eliminate duplicates Z: 61 72.837 2.501 0.931 0.596 0.933 0.617 CB 1.903 36 residues pruned to eliminate duplicates Z: 23 91.818 2.649 1.407 0.922 1.000 0.818 CB 2.159 3 residues pruned to eliminate duplicates Z: 25 73.419 2.622 1.204 0.840 0.958 0.792 CB 2.020 25 residues pruned to eliminate duplicates Z: 102 94.369 2.493 0.958 0.610 0.941 0.713 CB 1.843 93 residues pruned to eliminate duplicates Z: 11 19.055 2.121 0.456 0.665 1.000 0.800 CB 1.676 11 residues pruned to eliminate duplicates Z: 64 82.935 2.541 1.059 0.626 0.937 0.698 CB 1.893 64 residues pruned to eliminate duplicates Z: 99 89.217 2.483 0.913 0.606 0.929 0.755 CB 1.847 94 residues pruned to eliminate duplicates Z: 10 21.688 2.027 0.834 0.782 1.000 0.333 CB 1.517 10 residues pruned to eliminate duplicates Z: 33 39.084 2.425 0.838 0.509 0.875 0.594 CB 1.756 33 residues pruned to eliminate duplicates Z: 113 93.541 2.476 0.887 0.595 0.955 0.714 CB 1.808 113 residues pruned to eliminate duplicates Z: 9 13.260 1.990 0.337 0.872 0.875 0.750 C 1.468 9 residues pruned to eliminate duplicates Z: 60 83.620 2.510 1.059 0.683 0.966 0.814 CB 1.844 60 residues pruned to eliminate duplicates Z: 76 81.235 2.451 1.040 0.604 0.960 0.680 CB 1.769 76 residues pruned to eliminate duplicates Z: 68 85.899 2.511 1.050 0.656 0.955 0.731 CB 1.845 68 residues pruned to eliminate duplicates Z: 85 82.375 2.498 0.969 0.598 0.929 0.702 CB 1.793 85 residues pruned to eliminate duplicates Z: 68 85.738 2.481 1.144 0.653 0.925 0.731 CB 1.846 68 residues pruned to eliminate duplicates Z: 82 79.675 2.462 0.927 0.614 0.938 0.741 CB 1.785 82 residues pruned to eliminate duplicates Z: 67 85.482 2.529 1.063 0.668 0.939 0.758 CB 1.837 67 residues pruned to eliminate duplicates Z: 102 86.846 2.474 0.929 0.572 0.921 0.703 CB 1.834 102 residues pruned to eliminate duplicates Z: 61 87.514 2.557 0.988 0.655 0.967 0.767 CB 1.990 61 residues pruned to eliminate duplicates Z: 87 61.002 2.424 0.561 0.523 0.942 0.640 CB 1.804 87 residues pruned to eliminate duplicates Z: 69 82.092 2.490 0.999 0.640 0.956 0.735 CB 1.835 69 residues pruned to eliminate duplicates Z: 68 88.957 2.513 1.102 0.651 0.955 0.731 CB 1.871 68 residues pruned to eliminate duplicates Z: 134 95.541 2.448 0.803 0.599 0.955 0.714 CB 1.788 134 residues pruned to eliminate duplicates Z: 80 78.713 2.512 0.933 0.582 0.949 0.671 CB 1.775 80 residues pruned to eliminate duplicates Z: 68 84.121 2.500 1.089 0.641 0.955 0.716 CB 1.806 68 residues pruned to eliminate duplicates Z: 109 85.969 2.486 0.840 0.565 0.917 0.667 CB 1.853 109 residues pruned to eliminate duplicates Z: 22 36.383 2.551 0.732 0.487 0.905 0.524 CB 2.012 22 residues pruned to eliminate duplicates Z: 105 91.345 2.473 0.932 0.590 0.942 0.702 CB 1.824 105 residues pruned to eliminate duplicates Z: 135 96.055 2.445 0.807 0.607 0.948 0.709 CB 1.789 135 residues pruned to eliminate duplicates Z: 65 82.911 2.484 1.066 0.625 0.953 0.641 CB 1.884 65 residues pruned to eliminate duplicates Z: 85 82.463 2.454 0.991 0.595 0.940 0.679 CB 1.788 85 residues pruned to eliminate duplicates Z: 52 45.448 2.360 0.685 0.492 0.922 0.706 CB 1.750 52 residues pruned to eliminate duplicates Z: 70 55.518 2.338 0.672 0.550 0.913 0.652 CB 1.784 70 residues pruned to eliminate duplicates Z: 72 53.617 2.326 0.649 0.519 0.930 0.662 CB 1.751 72 residues pruned to eliminate duplicates Z: 71 78.272 2.463 0.980 0.598 0.943 0.686 CB 1.852 71 residues pruned to eliminate duplicates Z: 70 51.340 2.314 0.587 0.549 0.928 0.725 CB 1.730 70 residues pruned to eliminate duplicates Z: 70 52.594 2.329 0.613 0.551 0.928 0.667 CB 1.729 70 residues pruned to eliminate duplicates Z: 71 53.579 2.316 0.605 0.540 0.943 0.614 CB 1.756 71 residues pruned to eliminate duplicates Z: 134 94.322 2.428 0.822 0.615 0.932 0.729 CB 1.778 134 residues pruned to eliminate duplicates Z: 130 92.583 2.453 0.821 0.593 0.907 0.736 CB 1.840 130 residues pruned to eliminate duplicates Z: 86 57.998 2.305 0.698 0.540 0.894 0.682 CB 1.728 86 residues pruned to eliminate duplicates Z: 50 47.574 2.465 0.746 0.466 0.878 0.571 CB 1.862 50 residues pruned to eliminate duplicates Z: 51 45.626 2.405 0.678 0.463 0.880 0.600 CB 1.887 51 residues pruned to eliminate duplicates Z: 135 95.055 2.437 0.828 0.590 0.933 0.731 CB 1.813 135 residues pruned to eliminate duplicates Z: 42 39.992 2.398 0.752 0.469 0.854 0.561 CB 1.798 42 residues pruned to eliminate duplicates Z: 22 20.462 2.278 0.528 0.371 0.857 0.571 CB 1.718 22 residues pruned to eliminate duplicates Z: 134 99.214 2.448 0.840 0.612 0.940 0.714 CB 1.827 134 residues pruned to eliminate duplicates Z: 67 46.206 2.335 0.503 0.528 0.909 0.697 CB 1.734 67 residues pruned to eliminate duplicates Z: 44 45.424 2.451 0.599 0.510 0.907 0.698 CB 1.930 44 residues pruned to eliminate duplicates Z: 66 54.005 2.363 0.666 0.549 0.923 0.646 CB 1.757 66 residues pruned to eliminate duplicates Z: 85 57.349 2.321 0.623 0.572 0.917 0.690 CB 1.690 85 residues pruned to eliminate duplicates Z: 129 94.944 2.449 0.802 0.598 0.945 0.703 CB 1.832 129 residues pruned to eliminate duplicates Z: 113 90.942 2.474 0.909 0.585 0.929 0.679 CB 1.807 113 residues pruned to eliminate duplicates Z: 43 44.280 2.407 0.698 0.510 0.881 0.619 CB 1.878 43 residues pruned to eliminate duplicates Z: 73 53.729 2.357 0.598 0.550 0.917 0.694 CB 1.746 73 residues pruned to eliminate duplicates Z: 105 88.832 2.478 0.868 0.606 0.923 0.740 CB 1.844 105 residues pruned to eliminate duplicates Z: 134 95.726 2.442 0.839 0.592 0.925 0.729 CB 1.830 134 residues pruned to eliminate duplicates Z: 45 37.832 2.271 0.543 0.549 0.932 0.682 CB 1.665 45 residues pruned to eliminate duplicates Z: 134 93.887 2.430 0.820 0.599 0.932 0.692 CB 1.796 134 residues pruned to eliminate duplicates Z: 95 56.959 2.257 0.578 0.568 0.947 0.691 CB 1.631 95 residues pruned to eliminate duplicates Z: 69 52.806 2.365 0.611 0.534 0.926 0.632 CB 1.755 69 residues pruned to eliminate duplicates Z: 71 56.348 2.358 0.740 0.549 0.900 0.657 CB 1.739 71 residues pruned to eliminate duplicates Z: 101 94.690 2.497 0.969 0.594 0.940 0.670 CB 1.873 101 residues pruned to eliminate duplicates Z: 65 56.287 2.349 0.663 0.573 0.953 0.703 CB 1.761 65 residues pruned to eliminate duplicates Z: 65 49.380 2.359 0.612 0.563 0.875 0.719 CB 1.746 65 residues pruned to eliminate duplicates Z: 37 31.926 2.155 0.563 0.560 0.917 0.778 CB 1.627 37 residues pruned to eliminate duplicates Z: 71 54.801 2.339 0.622 0.563 0.929 0.729 CB 1.748 71 residues pruned to eliminate duplicates Z: 71 53.274 2.304 0.659 0.547 0.929 0.700 CB 1.713 71 residues pruned to eliminate duplicates Z: 71 53.874 2.352 0.629 0.550 0.900 0.714 CB 1.778 71 residues pruned to eliminate duplicates Z: 109 61.740 2.269 0.623 0.526 0.935 0.694 CB 1.682 109 residues pruned to eliminate duplicates Z: 32 34.440 2.229 0.588 0.624 0.968 0.710 CB 1.606 32 residues pruned to eliminate duplicates Z: 135 99.255 2.443 0.859 0.606 0.940 0.694 CB 1.816 135 residues pruned to eliminate duplicates Z: 32 34.493 2.223 0.553 0.619 0.968 0.710 CB 1.657 32 residues pruned to eliminate duplicates Z: 32 33.225 2.222 0.515 0.624 0.968 0.710 CB 1.630 32 residues pruned to eliminate duplicates Z: 122 91.093 2.456 0.872 0.571 0.917 0.702 CB 1.834 122 residues pruned to eliminate duplicates Z: 70 55.847 2.367 0.633 0.561 0.913 0.725 CB 1.796 70 residues pruned to eliminate duplicates Z: 85 57.058 2.288 0.720 0.550 0.917 0.643 CB 1.644 85 residues pruned to eliminate duplicates Z: 44 41.382 2.274 0.645 0.571 0.907 0.698 CB 1.736 44 residues pruned to eliminate duplicates Z: 77 51.155 2.281 0.700 0.521 0.882 0.684 CB 1.682 77 residues pruned to eliminate duplicates Z: 33 33.968 2.181 0.605 0.600 0.969 0.719 CB 1.609 33 residues pruned to eliminate duplicates Z: 90 53.396 2.293 0.609 0.546 0.888 0.629 CB 1.653 90 residues pruned to eliminate duplicates Z: 40 37.932 2.215 0.647 0.578 0.923 0.667 CB 1.673 40 residues pruned to eliminate duplicates Z: 73 56.053 2.316 0.716 0.552 0.917 0.708 CB 1.723 73 residues pruned to eliminate duplicates Z: 134 98.979 2.437 0.833 0.625 0.947 0.707 CB 1.803 134 residues pruned to eliminate duplicates Z: 32 34.957 2.213 0.692 0.626 0.903 0.710 CB 1.649 32 residues pruned to eliminate duplicates Z: 72 52.806 2.313 0.712 0.536 0.915 0.662 CB 1.668 72 residues pruned to eliminate duplicates Z: 129 101.035 2.464 0.929 0.607 0.922 0.734 CB 1.841 129 residues pruned to eliminate duplicates Z: 35 35.761 2.163 0.735 0.600 0.941 0.735 CB 1.579 35 residues pruned to eliminate duplicates Z: 37 35.038 2.186 0.733 0.550 0.917 0.639 CB 1.601 37 residues pruned to eliminate duplicates Z: 25 31.039 2.066 0.919 0.655 0.958 0.750 CB 1.444 25 residues pruned to eliminate duplicates Z: 36 36.508 2.079 0.866 0.600 0.943 0.686 CB 1.534 36 residues pruned to eliminate duplicates Z: 32 39.783 2.222 0.902 0.630 0.935 0.677 CB 1.600 32 residues pruned to eliminate duplicates Z: 23 31.959 2.097 0.903 0.693 0.955 0.682 CB 1.500 23 residues pruned to eliminate duplicates Z: 23 34.915 2.120 0.891 0.721 1.000 0.682 CB 1.521 23 residues pruned to eliminate duplicates Z: 72 61.289 2.356 0.821 0.557 0.930 0.676 CB 1.725 72 residues pruned to eliminate duplicates Z: 36 37.627 2.097 0.910 0.605 0.943 0.714 CB 1.524 36 residues pruned to eliminate duplicates Z: 23 34.400 2.100 0.801 0.711 1.000 0.727 CB 1.601 23 residues pruned to eliminate duplicates Z: 83 62.584 2.311 0.765 0.576 0.939 0.671 CB 1.677 83 residues pruned to eliminate duplicates Z: 43 37.943 2.114 0.619 0.668 0.976 0.738 CB 1.500 43 residues pruned to eliminate duplicates Z: 57 48.286 2.189 0.809 0.614 0.946 0.661 CB 1.545 57 residues pruned to eliminate duplicates Z: 26 28.680 2.110 1.053 0.573 0.840 0.640 CB 1.469 26 residues pruned to eliminate duplicates Z: 26 29.017 2.061 0.900 0.551 0.920 0.640 CB 1.533 26 residues pruned to eliminate duplicates Z: 33 20.821 2.043 0.665 0.481 0.844 0.656 CB 1.308 33 residues pruned to eliminate duplicates Z: 93 64.386 2.268 0.793 0.576 0.902 0.707 CB 1.700 93 residues pruned to eliminate duplicates Z: 27 24.457 2.007 0.654 0.613 0.885 0.731 CB 1.467 27 residues pruned to eliminate duplicates Z: 26 28.461 2.157 0.878 0.572 0.840 0.680 CB 1.561 26 residues pruned to eliminate duplicates Z: 25 34.855 2.227 1.001 0.593 0.917 0.667 CB 1.592 25 residues pruned to eliminate duplicates Z: 21 29.147 2.067 0.861 0.620 0.900 0.700 CA 1.681 21 residues pruned to eliminate duplicates Z: 14 19.880 1.899 0.650 0.774 0.923 0.846 CA 1.496 14 residues pruned to eliminate duplicates Z: 22 29.663 2.099 0.752 0.649 0.952 0.667 CB 1.610 22 residues pruned to eliminate duplicates Z: 52 48.680 2.182 0.841 0.627 0.961 0.706 CB 1.567 52 residues pruned to eliminate duplicates Z: 21 26.738 2.162 0.631 0.629 0.950 0.700 CB 1.582 21 residues pruned to eliminate duplicates Z: 159 101.984 2.402 0.906 0.577 0.924 0.665 CB 1.781 159 residues pruned to eliminate duplicates Z: 22 22.818 2.076 0.605 0.610 0.905 0.714 CB 1.489 22 residues pruned to eliminate duplicates Z: 21 25.231 2.028 0.822 0.641 0.900 0.700 CB 1.487 21 residues pruned to eliminate duplicates Z: 58 50.081 2.222 0.896 0.588 0.930 0.667 CB 1.557 58 residues pruned to eliminate duplicates Z: 96 63.910 2.313 0.791 0.554 0.905 0.684 CB 1.660 96 residues pruned to eliminate duplicates Z: 20 18.416 2.001 0.761 0.584 0.842 0.737 CB 1.313 20 residues pruned to eliminate duplicates Z: 39 32.782 2.118 0.912 0.558 0.868 0.711 CB 1.429 39 residues pruned to eliminate duplicates Z: 10 7.560 1.899 1.004 0.267 0.667 0.444 CB 1.295 10 residues pruned to eliminate duplicates Z: 7 10.393 1.936 1.117 0.330 0.833 0.667 CB 1.496 7 residues pruned to eliminate duplicates Z: 28 22.672 2.082 0.790 0.522 0.815 0.630 CB 1.407 28 residues pruned to eliminate duplicates Z: 19 23.741 2.271 0.989 0.523 0.833 0.611 CB 1.453 19 residues pruned to eliminate duplicates Z: 39 38.753 2.209 0.898 0.582 0.921 0.684 CB 1.505 39 residues pruned to eliminate duplicates Z: 6 9.317 1.898 0.741 0.352 1.000 0.800 CA 1.479 6 residues pruned to eliminate duplicates Z: 20 15.856 2.193 0.710 0.469 0.789 0.632 CB 1.268 20 residues pruned to eliminate duplicates Z: 6 6.585 1.628 0.686 0.469 1.000 0.400 C 1.107 7 residues pruned to eliminate duplicates Z: 6 3.446 1.400 0.614 0.351 0.800 0.400 CB 1.002 5 residues pruned to eliminate duplicates Z: 7 4.628 1.584 0.050 0.516 1.000 0.333 CB 1.118 Z: 6 5.447 1.875 0.185 0.384 1.000 0.400 CA 1.241 Z: 7 7.969 1.796 1.314 0.360 0.833 0.667 CA 1.091 4 residues pruned to eliminate duplicates Z: 11 41.643 2.577 1.106 0.674 1.000 0.900 CA 2.067 5 residues pruned to eliminate duplicates Z: 11 33.924 2.409 1.194 0.708 0.900 0.500 CA 1.867 11 residues pruned to eliminate duplicates Z: 33 50.209 2.520 0.868 0.579 0.938 0.719 CB 1.864 15 residues pruned to eliminate duplicates Z: 9 33.894 2.646 1.106 0.790 0.875 0.625 CB 1.905 9 residues pruned to eliminate duplicates Z: 34 45.316 2.494 0.760 0.559 0.939 0.667 CB 1.807 34 residues pruned to eliminate duplicates Z: 61 48.091 2.279 0.685 0.572 0.933 0.683 CB 1.616 30 residues pruned to eliminate duplicates Z: 9 48.305 2.680 1.493 0.836 1.000 0.750 CB 1.914 9 residues pruned to eliminate duplicates Z: 100 85.965 2.424 0.890 0.611 0.960 0.646 CB 1.768 164 residues pruned to eliminate duplicates Z: 35 38.373 2.494 0.761 0.487 0.853 0.647 CB 1.780 Z: 17 32.271 2.300 0.835 0.739 0.812 0.562 CA 1.898 17 residues pruned to eliminate duplicates Z: 38 42.923 2.398 0.723 0.505 0.919 0.595 CB 1.849 35 residues pruned to eliminate duplicates Z: 7 10.101 2.126 0.259 0.787 0.833 0.500 CA 1.437 7 residues pruned to eliminate duplicates Z: 34 51.644 2.488 0.932 0.549 0.970 0.667 CB 1.838 38 residues pruned to eliminate duplicates Z: 10 19.070 2.050 0.947 0.611 0.889 0.556 CB 1.612 10 residues pruned to eliminate duplicates Z: 70 44.425 2.262 0.557 0.524 0.942 0.623 CB 1.574 39 residues pruned to eliminate duplicates Z: 6 4.486 1.709 0.653 0.451 0.800 0.400 CB 0.933 6 residues pruned to eliminate duplicates Z: 35 44.590 2.413 0.867 0.528 0.912 0.706 CB 1.811 35 residues pruned to eliminate duplicates Z: 99 66.275 2.359 0.648 0.532 0.969 0.571 CB 1.722 65 residues pruned to eliminate duplicates Z: 8 11.120 1.940 0.760 0.438 1.000 0.571 CA 1.313 8 residues pruned to eliminate duplicates Z: 34 20.074 2.017 0.328 0.565 0.879 0.697 CB 1.394 34 residues pruned to eliminate duplicates Z: 44 48.552 2.437 0.827 0.499 0.930 0.628 CB 1.789 44 residues pruned to eliminate duplicates Z: 66 42.660 2.239 0.576 0.565 0.892 0.615 CB 1.579 66 residues pruned to eliminate duplicates Z: 128 88.897 2.362 0.832 0.616 0.945 0.677 CB 1.729 227 residues pruned to eliminate duplicates Z: 33 19.365 2.001 0.304 0.587 0.875 0.719 CB 1.380 Z: 19 16.967 1.972 0.147 0.827 0.944 0.778 CB 1.411 19 residues pruned to eliminate duplicates Z: 22 15.943 1.944 0.187 0.700 0.905 0.810 CB 1.389 22 residues pruned to eliminate duplicates Z: 21 18.770 1.997 0.251 0.744 0.950 0.800 CB 1.421 21 residues pruned to eliminate duplicates Z: 65 51.527 2.285 0.723 0.556 0.969 0.734 CB 1.598 33 residues pruned to eliminate duplicates Z: 18 23.526 1.912 0.446 0.914 1.000 0.882 CB 1.460 28 residues pruned to eliminate duplicates Z: 19 17.564 1.835 0.198 0.862 1.000 0.778 CB 1.383 19 residues pruned to eliminate duplicates Z: 34 20.471 1.950 0.478 0.579 0.879 0.697 CB 1.303 34 residues pruned to eliminate duplicates Z: 22 16.823 1.953 0.165 0.687 1.000 0.810 CB 1.359 22 residues pruned to eliminate duplicates Z: 88 62.129 2.298 0.779 0.550 0.954 0.632 CB 1.626 66 residues pruned to eliminate duplicates Z: 10 17.350 1.966 0.489 0.873 0.889 0.667 CB 1.619 10 residues pruned to eliminate duplicates Z: 37 23.392 2.030 0.514 0.488 0.861 0.639 CB 1.491 26 residues pruned to eliminate duplicates Z: 18 20.121 1.905 0.252 0.920 1.000 0.882 CB 1.440 18 residues pruned to eliminate duplicates Z: 36 16.411 1.965 0.254 0.459 0.886 0.657 CB 1.325 36 residues pruned to eliminate duplicates Z: 66 52.200 2.256 0.757 0.560 0.954 0.692 CB 1.615 66 residues pruned to eliminate duplicates Z: 36 24.325 2.027 0.525 0.564 0.886 0.657 CB 1.411 36 residues pruned to eliminate duplicates Z: 20 27.242 1.995 0.696 0.773 1.000 0.579 CB 1.451 28 residues pruned to eliminate duplicates Z: 18 24.509 1.842 0.844 0.884 1.000 0.765 CB 1.265 18 residues pruned to eliminate duplicates Z: 64 52.379 2.306 0.758 0.570 0.905 0.698 CB 1.681 64 residues pruned to eliminate duplicates Z: 32 24.161 1.949 0.686 0.580 0.839 0.581 CB 1.457 32 residues pruned to eliminate duplicates Z: 43 27.038 1.953 0.621 0.558 0.881 0.548 CB 1.414 43 residues pruned to eliminate duplicates Z: 73 53.926 2.291 0.742 0.566 0.903 0.653 CB 1.656 64 residues pruned to eliminate duplicates Z: 7 6.240 1.931 0.040 0.372 1.000 0.167 CB 1.455 6 residues pruned to eliminate duplicates Z: 13 10.939 1.758 0.286 0.773 0.833 0.583 CB 1.317 3 residues pruned to eliminate duplicates Z: 15 21.277 1.928 0.585 0.776 1.000 0.786 CB 1.458 14 residues pruned to eliminate duplicates Z: 16 16.421 1.769 0.435 0.790 1.000 0.733 CB 1.295 16 residues pruned to eliminate duplicates Z: 24 35.248 2.212 0.903 0.628 0.957 0.739 CB 1.619 20 residues pruned to eliminate duplicates Z: 12 21.406 1.850 0.815 0.869 1.000 0.727 CB 1.403 12 residues pruned to eliminate duplicates Z: 30 30.406 2.155 0.920 0.567 0.862 0.690 CB 1.484 26 residues pruned to eliminate duplicates Z: 11 21.808 1.915 0.834 0.926 1.000 0.800 CB 1.377 11 residues pruned to eliminate duplicates Z: 25 31.884 2.119 0.863 0.648 0.917 0.708 CB 1.567 25 residues pruned to eliminate duplicates Z: 25 32.953 2.132 0.938 0.644 0.917 0.750 CB 1.552 25 residues pruned to eliminate duplicates Z: 28 33.570 2.074 0.968 0.591 0.963 0.778 CB 1.507 28 residues pruned to eliminate duplicates Z: 29 25.473 1.975 0.799 0.503 0.893 0.607 CB 1.512 29 residues pruned to eliminate duplicates Z: 26 31.108 2.102 1.030 0.592 0.880 0.600 CB 1.517 26 residues pruned to eliminate duplicates Z: 25 30.272 2.140 0.861 0.642 0.917 0.667 CB 1.482 25 residues pruned to eliminate duplicates Z: 100 61.773 2.213 0.759 0.562 0.939 0.616 CB 1.599 94 residues pruned to eliminate duplicates Z: 6 7.001 1.877 0.765 0.487 1.000 0.800 CB 0.958 6 residues pruned to eliminate duplicates Z: 39 41.533 2.225 0.842 0.583 0.947 0.763 CB 1.602 35 residues pruned to eliminate duplicates Z: 6 6.378 1.817 0.766 0.365 0.800 0.600 CA 1.285 6 residues pruned to eliminate duplicates Z: 81 68.026 2.394 0.875 0.568 0.938 0.613 CB 1.693 212 residues pruned to eliminate duplicates Z: 6 6.072 1.930 0.585 0.327 0.800 0.600 CA 1.341 6 residues pruned to eliminate duplicates Z: 65 65.358 2.421 0.858 0.635 0.875 0.641 CB 1.828 65 residues pruned to eliminate duplicates Z: 129 71.335 2.317 0.689 0.549 0.898 0.594 CB 1.709 129 residues pruned to eliminate duplicates Z: 98 82.090 2.440 0.843 0.612 0.938 0.608 CB 1.777 98 residues pruned to eliminate duplicates Z: 51 50.678 2.239 0.863 0.672 0.920 0.740 CB 1.593 46 residues pruned to eliminate duplicates Z: 23 49.298 2.310 0.895 0.920 0.955 0.773 CB 1.771 23 residues pruned to eliminate duplicates Z: 100 82.284 2.415 0.911 0.605 0.929 0.657 CB 1.745 100 residues pruned to eliminate duplicates Z: 23 41.692 2.303 0.564 0.920 0.955 0.818 CB 1.822 23 residues pruned to eliminate duplicates Z: 99 79.225 2.414 0.866 0.572 0.918 0.714 CB 1.804 99 residues pruned to eliminate duplicates Z: 70 67.107 2.361 0.856 0.656 0.957 0.696 CB 1.667 70 residues pruned to eliminate duplicates Z: 67 69.636 2.389 0.842 0.647 0.955 0.712 CB 1.779 67 residues pruned to eliminate duplicates Z: 130 76.697 2.333 0.695 0.564 0.946 0.651 CB 1.697 130 residues pruned to eliminate duplicates Z: 130 77.292 2.328 0.699 0.566 0.946 0.651 CB 1.707 130 residues pruned to eliminate duplicates Z: 65 71.803 2.440 0.890 0.657 0.922 0.719 CB 1.825 65 residues pruned to eliminate duplicates Z: 70 68.424 2.351 0.899 0.658 0.928 0.667 CB 1.717 70 residues pruned to eliminate duplicates Z: 23 54.749 2.325 1.017 0.910 0.955 0.682 CB 1.849 23 residues pruned to eliminate duplicates Z: 44 52.024 2.341 0.826 0.689 0.907 0.767 CB 1.722 44 residues pruned to eliminate duplicates Z: 99 83.975 2.443 0.881 0.611 0.918 0.633 CB 1.810 99 residues pruned to eliminate duplicates Z: 101 83.221 2.432 0.826 0.591 0.960 0.670 CB 1.788 101 residues pruned to eliminate duplicates Z: 100 79.347 2.420 0.881 0.601 0.919 0.677 CB 1.731 100 residues pruned to eliminate duplicates Z: 108 84.107 2.429 0.853 0.569 0.944 0.542 CB 1.790 108 residues pruned to eliminate duplicates Z: 65 74.965 2.426 0.969 0.661 0.922 0.750 CB 1.834 65 residues pruned to eliminate duplicates Z: 63 75.192 2.460 0.895 0.658 0.952 0.694 CB 1.860 69 residues pruned to eliminate duplicates Z: 24 56.761 2.256 1.122 0.930 0.957 0.870 CB 1.808 24 residues pruned to eliminate duplicates Z: 66 64.614 2.419 0.842 0.647 0.892 0.692 CB 1.758 66 residues pruned to eliminate duplicates Z: 65 72.627 2.415 0.948 0.652 0.969 0.688 CB 1.730 63 residues pruned to eliminate duplicates Z: 12 18.941 2.117 0.600 0.552 1.000 0.455 CB 1.603 Z: 10 18.722 2.040 0.786 0.673 0.889 0.556 CA 1.643 10 residues pruned to eliminate duplicates Z: 34 47.101 2.452 0.895 0.548 0.939 0.606 CB 1.793 12 residues pruned to eliminate duplicates Z: 9 25.104 2.174 0.856 0.837 1.000 0.750 CB 1.646 9 residues pruned to eliminate duplicates Z: 50 51.833 2.279 0.847 0.677 0.918 0.755 CB 1.627 80 residues pruned to eliminate duplicates Z: 9 20.288 2.019 0.726 0.824 1.000 0.750 CB 1.554 Z: 9 16.719 2.101 0.607 0.749 0.875 0.500 CB 1.602 9 residues pruned to eliminate duplicates Z: 9 19.951 2.406 0.707 0.695 0.875 0.375 CB 1.642 9 residues pruned to eliminate duplicates Z: 16 23.029 2.316 0.609 0.597 0.867 0.600 CB 1.680 9 residues pruned to eliminate duplicates Z: 34 39.720 2.409 0.778 0.545 0.879 0.545 CB 1.758 19 residues pruned to eliminate duplicates Z: 13 31.821 2.548 0.652 0.699 0.917 0.667 CB 1.986 13 residues pruned to eliminate duplicates Z: 65 76.182 2.416 0.982 0.650 0.953 0.719 CB 1.813 96 residues pruned to eliminate duplicates Z: 33 49.871 2.519 0.820 0.567 0.969 0.594 CB 1.860 Z: 13 32.993 2.402 0.861 0.740 0.917 0.667 CA 1.874 13 residues pruned to eliminate duplicates Z: 101 85.653 2.441 0.904 0.595 0.940 0.660 CB 1.791 139 residues pruned to eliminate duplicates Z: 10 16.153 2.255 0.292 0.744 0.778 0.667 CB 1.911 Z: 10 17.385 2.300 0.283 0.792 0.778 0.667 N 1.954 10 residues pruned to eliminate duplicates Z: 12 28.941 2.515 0.614 0.728 0.909 0.727 CB 1.925 10 residues pruned to eliminate duplicates Z: 11 43.077 2.747 0.780 0.789 1.000 0.800 CB 2.162 12 residues pruned to eliminate duplicates Z: 10 26.008 2.230 0.841 0.805 0.889 0.667 CB 1.820 9 residues pruned to eliminate duplicates Z: 13 27.672 2.338 0.935 0.582 0.833 0.417 CB 1.958 11 residues pruned to eliminate duplicates Z: 11 30.484 2.579 1.124 0.641 0.800 0.700 CB 1.927 11 residues pruned to eliminate duplicates Z: 65 74.214 2.426 0.881 0.660 0.953 0.703 CB 1.838 79 residues pruned to eliminate duplicates Z: 7 10.631 1.811 1.445 0.405 0.833 0.667 C 1.300 Z: 6 3.245 2.047 0.611 0.100 0.600 0.600 CB 1.223 Z: 6 5.730 2.006 0.782 0.290 0.800 0.400 CB 1.135 371 residues left after pruning, divided into chains as follows: A: 15 B: 8 C: 165 D: 177 E: 6 CC for partial structure against native data = 22.18 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.536, Connect. = 0.717 for dens.mod. cycle 1 = 0.300, Contrast = 0.622, Connect. = 0.755 for dens.mod. cycle 2 = 0.300, Contrast = 0.711, Connect. = 0.792 for dens.mod. cycle 3 = 0.300, Contrast = 0.719, Connect. = 0.799 for dens.mod. cycle 4 = 0.300, Contrast = 0.730, Connect. = 0.805 for dens.mod. cycle 5 = 0.300, Contrast = 0.738, Connect. = 0.810 for dens.mod. cycle 6 = 0.300, Contrast = 0.746, Connect. = 0.813 for dens.mod. cycle 7 = 0.300, Contrast = 0.751, Connect. = 0.815 for dens.mod. cycle 8 = 0.300, Contrast = 0.756, Connect. = 0.817 for dens.mod. cycle 9 = 0.300, Contrast = 0.761, Connect. = 0.819 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4442 peaks > 0.5 sigma used to seed fragment search Space for about 886 unique residues taking solvent into account 850 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 8 25.859 2.438 0.548 0.814 1.000 0.714 C 1.971 B: 22 70.417 2.842 0.587 0.941 1.000 0.905 CB 2.364 C: 23 99.846 2.730 1.341 0.935 1.000 0.909 CA 2.321 22 residues pruned to eliminate duplicates D: 22 98.414 2.858 1.209 0.928 1.000 0.857 CB 2.382 22 residues pruned to eliminate duplicates E: 12 31.919 2.612 0.685 0.720 0.909 0.636 CB 1.972 F: 47 54.817 2.620 0.828 0.469 0.935 0.587 CB 1.863 10 residues pruned to eliminate duplicates G: 54 53.670 2.559 0.850 0.511 0.849 0.623 CB 1.815 46 residues pruned to eliminate duplicates H: 99 92.056 2.522 0.840 0.603 0.949 0.663 CB 1.914 53 residues pruned to eliminate duplicates I: 10 30.174 2.416 0.845 0.820 0.889 0.778 CB 1.923 J: 26 29.300 2.533 0.721 0.398 0.880 0.600 CB 1.700 26 residues pruned to eliminate duplicates K: 23 76.334 2.745 0.820 0.915 1.000 0.909 CA 2.302 23 residues pruned to eliminate duplicates L: 23 79.480 2.692 1.104 0.904 0.955 0.818 CB 2.232 23 residues pruned to eliminate duplicates M: 24 76.605 2.606 1.070 0.899 0.957 0.826 CA 2.213 24 residues pruned to eliminate duplicates N: 8 26.001 2.418 0.514 0.887 1.000 0.714 C 1.935 8 residues pruned to eliminate duplicates O: 12 41.144 2.617 0.816 0.739 1.000 0.909 CB 2.107 12 residues pruned to eliminate duplicates P: 11 32.323 2.324 0.857 0.866 1.000 0.700 CA 1.734 11 residues pruned to eliminate duplicates Q: 10 37.587 2.342 1.031 0.913 1.000 1.000 C 1.863 10 residues pruned to eliminate duplicates R: 10 25.105 2.411 0.519 0.846 0.889 0.667 CB 1.909 10 residues pruned to eliminate duplicates S: 9 33.914 2.608 0.672 0.905 1.000 0.875 CB 1.956 9 residues pruned to eliminate duplicates T: 135 95.610 2.517 0.699 0.594 0.925 0.731 CB 1.908 45 residues pruned to eliminate duplicates U: 24 56.783 2.567 0.631 0.893 0.957 0.870 CA 2.122 24 residues pruned to eliminate duplicates V: 23 69.776 2.743 0.699 0.916 1.000 0.955 CA 2.254 23 residues pruned to eliminate duplicates W: 10 30.860 2.420 0.874 0.827 0.889 0.667 CA 1.924 10 residues pruned to eliminate duplicates X: 22 77.409 2.814 0.813 0.931 1.000 1.000 CB 2.315 22 residues pruned to eliminate duplicates Y: 42 65.696 2.707 0.920 0.556 0.951 0.659 CB 1.965 42 residues pruned to eliminate duplicates Z: 13 40.687 2.557 0.738 0.772 1.000 0.833 CB 2.077 13 residues pruned to eliminate duplicates Z: 22 96.325 2.849 1.202 0.912 1.000 0.857 CA 2.373 22 residues pruned to eliminate duplicates Z: 24 83.362 2.634 1.091 0.925 1.000 0.739 CB 2.215 24 residues pruned to eliminate duplicates Z: 10 19.656 2.032 0.629 0.816 0.889 0.667 C 1.692 10 residues pruned to eliminate duplicates Z: 86 86.057 2.585 0.849 0.594 0.918 0.741 CB 1.946 86 residues pruned to eliminate duplicates Z: 23 76.850 2.753 0.856 0.915 1.000 0.909 CA 2.266 23 residues pruned to eliminate duplicates Z: 10 24.743 2.457 0.766 0.788 0.778 0.667 CB 1.898 10 residues pruned to eliminate duplicates Z: 38 56.553 2.340 0.849 0.774 0.946 0.811 CB 1.783 38 residues pruned to eliminate duplicates Z: 23 82.713 2.695 1.085 0.940 0.955 0.727 CB 2.283 23 residues pruned to eliminate duplicates Z: 23 86.372 2.714 1.122 0.878 1.000 0.773 CB 2.320 23 residues pruned to eliminate duplicates Z: 24 59.557 2.609 0.773 0.862 0.913 0.826 CA 2.159 24 residues pruned to eliminate duplicates Z: 24 78.413 2.659 1.041 0.919 0.957 0.826 CB 2.220 24 residues pruned to eliminate duplicates Z: 23 85.657 2.706 1.096 0.915 1.000 0.818 CA 2.276 23 residues pruned to eliminate duplicates Z: 21 46.427 2.368 0.653 0.906 1.000 0.900 CA 1.886 21 residues pruned to eliminate duplicates Z: 18 44.609 2.502 0.464 0.931 1.000 0.941 CB 2.065 Z: 23 97.485 2.739 1.320 0.928 1.000 0.818 CA 2.290 37 residues pruned to eliminate duplicates Z: 23 75.289 2.706 1.032 0.922 0.909 0.864 CB 2.259 23 residues pruned to eliminate duplicates Z: 12 27.345 2.156 0.782 0.836 0.909 0.818 C 1.767 12 residues pruned to eliminate duplicates Z: 22 76.056 2.818 0.770 0.923 1.000 0.905 CB 2.337 22 residues pruned to eliminate duplicates Z: 12 26.134 2.240 0.545 0.851 0.909 0.909 C 1.853 12 residues pruned to eliminate duplicates Z: 135 100.002 2.520 0.753 0.595 0.940 0.664 CB 1.899 121 residues pruned to eliminate duplicates Z: 17 41.694 2.437 0.475 0.917 1.000 0.875 CB 2.047 17 residues pruned to eliminate duplicates Z: 88 56.306 2.364 0.535 0.551 0.897 0.667 CB 1.765 86 residues pruned to eliminate duplicates Z: 13 34.663 2.575 0.648 0.795 1.000 0.917 CA 1.820 13 residues pruned to eliminate duplicates Z: 18 38.435 2.410 0.490 0.939 1.000 1.000 CB 1.804 18 residues pruned to eliminate duplicates Z: 24 55.300 2.595 0.624 0.912 0.913 0.826 CB 2.123 24 residues pruned to eliminate duplicates Z: 10 35.903 2.455 1.177 0.848 0.889 0.778 CB 1.868 10 residues pruned to eliminate duplicates Z: 11 22.657 2.333 0.392 0.846 0.900 0.900 CA 1.821 11 residues pruned to eliminate duplicates Z: 22 40.909 2.349 0.581 0.909 0.905 0.762 CB 1.885 22 residues pruned to eliminate duplicates Z: 137 102.404 2.503 0.809 0.596 0.941 0.669 CB 1.881 137 residues pruned to eliminate duplicates Z: 9 17.375 2.011 0.607 0.820 1.000 0.750 CA 1.441 9 residues pruned to eliminate duplicates Z: 134 108.108 2.537 0.842 0.600 0.947 0.669 CB 1.924 137 residues pruned to eliminate duplicates Z: 11 31.649 2.318 1.021 0.741 0.900 0.700 CB 1.913 11 residues pruned to eliminate duplicates Z: 138 105.186 2.525 0.791 0.578 0.942 0.701 CB 1.958 128 residues pruned to eliminate duplicates Z: 24 68.254 2.614 1.012 0.874 0.913 0.870 CB 2.158 24 residues pruned to eliminate duplicates Z: 23 65.703 2.702 0.742 0.933 0.955 0.864 CB 2.176 23 residues pruned to eliminate duplicates Z: 23 78.790 2.740 0.926 0.918 1.000 0.955 CA 2.246 23 residues pruned to eliminate duplicates Z: 20 20.070 2.124 0.814 0.458 0.842 0.579 CB 1.481 Z: 19 23.051 2.172 1.002 0.485 0.833 0.500 CB 1.522 20 residues pruned to eliminate duplicates Z: 10 14.424 2.132 0.507 0.655 0.778 0.778 CA 1.666 Z: 13 31.561 2.248 0.655 0.911 1.000 0.917 CA 1.735 Z: 22 48.687 2.379 0.648 0.926 1.000 0.952 CB 1.900 22 residues pruned to eliminate duplicates Z: 135 106.584 2.539 0.806 0.595 0.940 0.687 CB 1.949 135 residues pruned to eliminate duplicates Z: 23 45.700 2.293 0.835 0.896 0.955 0.818 CB 1.737 23 residues pruned to eliminate duplicates Z: 18 39.401 2.472 0.379 0.913 1.000 0.824 CB 1.985 18 residues pruned to eliminate duplicates Z: 16 10.187 1.821 0.778 0.355 0.733 0.467 CB 1.296 16 residues pruned to eliminate duplicates Z: 19 41.476 2.462 0.511 0.883 1.000 0.889 CB 1.900 19 residues pruned to eliminate duplicates Z: 77 58.674 2.441 0.688 0.518 0.921 0.632 CB 1.742 66 residues pruned to eliminate duplicates Z: 23 59.276 2.595 0.836 0.850 0.955 0.909 CA 2.058 23 residues pruned to eliminate duplicates Z: 32 30.356 2.250 0.419 0.594 0.903 0.710 CB 1.728 32 residues pruned to eliminate duplicates Z: 23 81.602 2.732 1.087 0.903 0.955 0.909 CB 2.278 23 residues pruned to eliminate duplicates Z: 13 33.890 2.248 0.981 0.899 0.917 0.917 CA 1.713 13 residues pruned to eliminate duplicates Z: 9 25.528 2.130 0.736 0.871 1.000 0.875 CB 1.780 9 residues pruned to eliminate duplicates Z: 12 40.199 2.672 0.777 0.792 1.000 0.818 CA 1.975 12 residues pruned to eliminate duplicates Z: 19 35.664 2.332 0.505 0.887 0.944 0.889 CB 1.829 19 residues pruned to eliminate duplicates Z: 11 23.910 2.275 0.503 0.888 0.800 0.800 CA 1.992 11 residues pruned to eliminate duplicates Z: 10 21.565 2.360 0.377 0.788 0.889 0.556 CB 1.931 10 residues pruned to eliminate duplicates Z: 10 16.584 2.106 0.700 0.817 0.778 0.778 CB 1.508 10 residues pruned to eliminate duplicates Z: 24 52.670 2.437 0.793 0.870 0.913 0.870 CB 2.009 24 residues pruned to eliminate duplicates Z: 13 28.969 2.237 0.687 0.867 0.917 0.750 CA 1.768 13 residues pruned to eliminate duplicates Z: 24 68.401 2.611 0.812 0.910 1.000 0.783 CA 2.137 24 residues pruned to eliminate duplicates Z: 18 35.921 2.537 0.244 0.899 1.000 0.882 CB 1.973 18 residues pruned to eliminate duplicates Z: 134 101.497 2.554 0.751 0.601 0.925 0.699 CB 1.932 134 residues pruned to eliminate duplicates Z: 22 53.950 2.369 0.874 0.910 1.000 0.952 CB 1.881 22 residues pruned to eliminate duplicates Z: 44 45.794 2.389 0.637 0.584 0.930 0.721 CB 1.771 44 residues pruned to eliminate duplicates Z: 24 67.769 2.642 0.749 0.908 1.000 0.870 CB 2.171 24 residues pruned to eliminate duplicates Z: 21 46.837 2.343 0.726 0.910 1.000 0.900 CB 1.837 21 residues pruned to eliminate duplicates Z: 28 34.560 2.317 0.906 0.553 0.889 0.556 CB 1.609 20 residues pruned to eliminate duplicates Z: 11 18.263 2.034 1.060 0.498 0.900 0.700 CA 1.534 11 residues pruned to eliminate duplicates Z: 22 55.046 2.391 0.863 0.909 1.000 0.857 CB 1.913 22 residues pruned to eliminate duplicates Z: 19 39.212 2.382 0.475 0.867 1.000 0.778 CB 1.924 19 residues pruned to eliminate duplicates Z: 13 35.857 2.263 0.750 0.895 1.000 0.833 CA 1.874 13 residues pruned to eliminate duplicates Z: 23 73.406 2.682 0.834 0.916 1.000 0.864 C 2.248 23 residues pruned to eliminate duplicates Z: 39 39.566 2.265 0.966 0.592 0.842 0.632 CB 1.568 19 residues pruned to eliminate duplicates Z: 22 45.729 2.338 0.648 0.905 1.000 0.952 CB 1.844 22 residues pruned to eliminate duplicates Z: 10 34.157 2.479 0.835 0.818 0.889 0.556 C 2.136 10 residues pruned to eliminate duplicates Z: 18 54.419 2.470 0.813 0.930 1.000 0.765 CB 2.062 18 residues pruned to eliminate duplicates Z: 23 51.002 2.247 0.997 0.894 0.955 0.818 CA 1.822 Z: 9 33.600 2.537 0.809 0.883 1.000 0.875 CB 1.872 9 residues pruned to eliminate duplicates Z: 20 29.451 2.092 0.436 0.900 1.000 1.000 CB 1.607 20 residues pruned to eliminate duplicates Z: 18 41.502 2.503 0.581 0.861 1.000 0.588 CB 1.869 18 residues pruned to eliminate duplicates Z: 134 100.974 2.542 0.708 0.596 0.947 0.729 CB 1.942 134 residues pruned to eliminate duplicates Z: 20 44.448 2.297 0.841 0.907 0.947 0.842 CA 1.808 20 residues pruned to eliminate duplicates Z: 24 41.089 2.225 0.680 0.860 0.957 0.826 CB 1.763 24 residues pruned to eliminate duplicates Z: 70 63.212 2.492 0.766 0.528 0.928 0.609 CB 1.814 70 residues pruned to eliminate duplicates Z: 23 50.302 2.231 0.957 0.895 0.955 0.773 CA 1.844 23 residues pruned to eliminate duplicates Z: 19 31.638 2.159 0.426 0.896 1.000 0.889 CB 1.735 19 residues pruned to eliminate duplicates Z: 8 22.311 2.269 0.411 0.881 1.000 0.714 C 1.907 8 residues pruned to eliminate duplicates Z: 18 47.774 2.468 0.649 0.912 1.000 0.824 CB 2.017 18 residues pruned to eliminate duplicates Z: 10 33.754 2.296 1.156 0.856 1.000 1.000 CA 1.676 Z: 8 32.427 2.476 0.751 0.885 1.000 0.857 CA 2.042 8 residues pruned to eliminate duplicates Z: 23 53.815 2.294 0.973 0.890 1.000 0.773 CA 1.824 23 residues pruned to eliminate duplicates Z: 11 34.501 2.277 1.054 0.813 1.000 0.900 CA 1.776 11 residues pruned to eliminate duplicates Z: 73 54.532 2.464 0.619 0.501 0.903 0.653 CB 1.782 73 residues pruned to eliminate duplicates Z: 23 53.776 2.234 0.983 0.922 1.000 0.773 CB 1.821 23 residues pruned to eliminate duplicates Z: 32 54.755 2.401 0.726 0.793 0.968 0.806 CB 1.897 32 residues pruned to eliminate duplicates Z: 18 32.492 2.534 0.223 0.894 0.941 0.882 CB 1.938 18 residues pruned to eliminate duplicates Z: 12 29.021 2.281 0.629 0.916 0.909 0.818 CA 1.830 12 residues pruned to eliminate duplicates Z: 50 54.682 2.291 0.765 0.699 0.939 0.653 CB 1.715 31 residues pruned to eliminate duplicates Z: 24 52.091 2.178 1.017 0.912 1.000 0.739 CA 1.751 24 residues pruned to eliminate duplicates Z: 69 84.762 2.583 0.985 0.629 0.926 0.691 CB 1.917 69 residues pruned to eliminate duplicates Z: 63 56.277 2.377 0.839 0.556 0.903 0.629 CB 1.715 63 residues pruned to eliminate duplicates Z: 35 33.199 2.151 0.966 0.532 0.882 0.529 CB 1.478 Z: 19 29.789 2.110 0.448 0.897 1.000 0.944 CB 1.645 19 residues pruned to eliminate duplicates Z: 18 30.639 2.185 0.323 0.925 1.000 1.000 CB 1.805 18 residues pruned to eliminate duplicates Z: 8 18.494 2.084 0.691 0.848 1.000 0.571 CB 1.471 8 residues pruned to eliminate duplicates Z: 63 52.610 2.249 0.827 0.662 0.903 0.694 CB 1.550 63 residues pruned to eliminate duplicates Z: 18 32.417 2.195 0.421 0.923 1.000 0.941 CB 1.771 18 residues pruned to eliminate duplicates Z: 9 14.061 1.797 0.752 0.823 1.000 0.875 CB 1.193 9 residues pruned to eliminate duplicates Z: 21 54.583 2.342 0.960 0.922 1.000 0.900 C 1.870 22 residues pruned to eliminate duplicates Z: 11 16.665 1.955 0.821 0.546 1.000 0.600 CB 1.416 11 residues pruned to eliminate duplicates Z: 8 14.669 2.072 0.423 0.820 1.000 0.857 CA 1.424 8 residues pruned to eliminate duplicates Z: 8 20.475 2.197 0.420 0.835 1.000 0.714 CB 1.857 8 residues pruned to eliminate duplicates Z: 9 20.354 2.097 0.506 0.894 1.000 0.875 C 1.635 9 residues pruned to eliminate duplicates Z: 13 37.338 2.245 0.898 0.895 1.000 0.833 CA 1.814 13 residues pruned to eliminate duplicates Z: 17 20.390 2.079 0.837 0.548 0.812 0.625 CB 1.568 Z: 9 14.588 2.006 0.362 0.821 0.875 0.625 CA 1.632 9 residues pruned to eliminate duplicates Z: 24 44.258 2.211 0.709 0.903 1.000 0.826 CB 1.741 24 residues pruned to eliminate duplicates Z: 9 15.216 1.789 0.885 0.786 1.000 0.625 CB 1.241 9 residues pruned to eliminate duplicates Z: 129 96.615 2.523 0.774 0.602 0.922 0.688 CB 1.878 129 residues pruned to eliminate duplicates Z: 9 20.362 2.306 0.481 0.896 0.875 0.750 CA 1.726 9 residues pruned to eliminate duplicates Z: 38 33.413 2.032 0.873 0.558 0.919 0.649 CB 1.485 19 residues pruned to eliminate duplicates Z: 19 27.643 2.104 0.306 0.934 1.000 0.944 CB 1.654 19 residues pruned to eliminate duplicates Z: 23 47.403 2.212 0.826 0.930 1.000 0.864 CA 1.750 23 residues pruned to eliminate duplicates Z: 20 39.018 2.298 0.846 0.849 0.895 0.579 CB 1.748 20 residues pruned to eliminate duplicates Z: 18 29.211 2.170 0.276 0.919 1.000 0.941 CB 1.803 18 residues pruned to eliminate duplicates Z: 65 56.535 2.236 0.846 0.644 0.922 0.625 CB 1.623 65 residues pruned to eliminate duplicates Z: 17 21.842 2.242 0.980 0.536 0.812 0.562 CB 1.462 17 residues pruned to eliminate duplicates Z: 18 38.343 2.216 0.585 0.924 1.000 0.941 CA 1.860 18 residues pruned to eliminate duplicates Z: 19 27.814 2.114 0.335 0.874 1.000 0.944 CB 1.691 19 residues pruned to eliminate duplicates Z: 22 58.036 2.384 0.978 0.920 1.000 0.714 CB 1.892 22 residues pruned to eliminate duplicates Z: 69 61.756 2.481 0.667 0.545 0.897 0.691 CB 1.930 69 residues pruned to eliminate duplicates Z: 138 100.188 2.514 0.930 0.570 0.905 0.701 CB 1.821 134 residues pruned to eliminate duplicates Z: 23 52.768 2.244 1.047 0.924 0.955 0.773 CA 1.802 23 residues pruned to eliminate duplicates Z: 22 112.309 2.855 1.477 0.936 1.000 0.857 CB 2.412 22 residues pruned to eliminate duplicates Z: 23 39.769 2.300 0.521 0.904 1.000 0.955 CB 1.726 23 residues pruned to eliminate duplicates Z: 13 24.641 2.020 0.742 0.798 1.000 0.583 C 1.558 Z: 18 55.725 2.423 1.104 0.902 0.941 0.529 CB 2.009 18 residues pruned to eliminate duplicates Z: 18 33.428 2.189 0.431 0.923 1.000 0.941 CB 1.819 18 residues pruned to eliminate duplicates Z: 10 24.881 2.082 0.899 0.870 1.000 0.889 CB 1.531 10 residues pruned to eliminate duplicates Z: 10 29.484 2.302 1.133 0.823 0.889 0.778 CA 1.702 10 residues pruned to eliminate duplicates Z: 19 23.298 2.072 0.125 0.905 1.000 0.944 CB 1.676 19 residues pruned to eliminate duplicates Z: 11 23.055 1.900 1.077 0.857 1.000 1.000 CB 1.361 Z: 7 9.501 1.875 0.638 0.706 1.000 0.833 CA 1.047 7 residues pruned to eliminate duplicates Z: 6 4.810 2.009 -0.132 0.555 0.800 0.600 CB 1.461 6 residues pruned to eliminate duplicates Z: 31 20.081 1.955 0.586 0.574 0.833 0.667 CB 1.321 31 residues pruned to eliminate duplicates Z: 160 112.676 2.477 0.943 0.601 0.943 0.660 CB 1.788 160 residues pruned to eliminate duplicates Z: 7 18.151 2.085 0.745 0.812 1.000 1.000 C 1.553 Z: 22 50.798 2.236 0.985 0.887 1.000 0.857 CA 1.800 22 residues pruned to eliminate duplicates Z: 23 44.856 2.287 0.626 0.911 1.000 0.909 CB 1.822 23 residues pruned to eliminate duplicates Z: 8 18.182 1.982 0.860 0.829 1.000 0.857 CA 1.404 8 residues pruned to eliminate duplicates Z: 10 27.301 2.084 1.006 0.865 1.000 0.889 CB 1.594 10 residues pruned to eliminate duplicates Z: 42 35.657 2.177 0.810 0.491 0.927 0.610 CB 1.538 10 residues pruned to eliminate duplicates Z: 59 64.982 2.210 1.102 0.633 0.983 0.672 CB 1.649 57 residues pruned to eliminate duplicates Z: 14 23.511 1.923 0.687 0.924 1.000 0.846 CA 1.412 14 residues pruned to eliminate duplicates Z: 19 20.472 2.083 0.806 0.600 0.889 0.611 CB 1.312 19 residues pruned to eliminate duplicates Z: 18 21.260 2.209 1.007 0.528 0.824 0.588 CB 1.373 18 residues pruned to eliminate duplicates Z: 6 8.681 2.430 -0.144 0.810 0.800 0.600 CA 1.781 6 residues pruned to eliminate duplicates Z: 48 75.360 2.533 0.963 0.722 0.979 0.745 CB 1.848 48 residues pruned to eliminate duplicates Z: 24 89.209 2.639 1.263 0.871 1.000 0.696 CB 2.272 24 residues pruned to eliminate duplicates Z: 12 24.817 2.180 0.340 0.843 1.000 0.636 CA 1.907 12 residues pruned to eliminate duplicates Z: 8 27.183 2.274 0.774 0.881 1.000 0.857 C 1.845 8 residues pruned to eliminate duplicates Z: 13 22.326 2.018 0.739 0.745 0.917 0.750 CB 1.609 13 residues pruned to eliminate duplicates Z: 23 48.440 2.245 0.836 0.895 1.000 0.773 CA 1.796 23 residues pruned to eliminate duplicates Z: 22 42.224 2.309 0.626 0.910 0.952 0.952 CB 1.827 22 residues pruned to eliminate duplicates Z: 20 41.856 2.207 0.753 0.946 1.000 0.947 CA 1.716 20 residues pruned to eliminate duplicates Z: 9 29.996 2.356 1.328 0.816 0.875 0.750 CB 1.680 9 residues pruned to eliminate duplicates Z: 85 87.373 2.597 0.891 0.582 0.940 0.714 CB 1.907 85 residues pruned to eliminate duplicates Z: 18 30.066 2.242 0.272 0.872 1.000 0.941 CB 1.864 18 residues pruned to eliminate duplicates Z: 12 24.385 2.092 0.532 0.938 1.000 1.000 CA 1.596 12 residues pruned to eliminate duplicates Z: 18 61.241 2.441 1.140 0.929 1.000 0.706 CB 1.991 18 residues pruned to eliminate duplicates Z: 22 41.184 2.211 0.773 0.905 0.905 0.714 CA 1.804 22 residues pruned to eliminate duplicates Z: 25 31.750 2.335 1.051 0.441 0.875 0.542 CB 1.644 25 residues pruned to eliminate duplicates Z: 25 22.626 1.824 0.665 0.600 1.000 0.750 CB 1.382 22 residues pruned to eliminate duplicates Z: 10 36.316 2.461 0.848 0.876 1.000 0.889 CB 1.935 10 residues pruned to eliminate duplicates Z: 9 16.037 1.951 0.537 0.881 1.000 0.875 CB 1.369 7 residues pruned to eliminate duplicates Z: 6 8.402 1.798 0.113 0.844 1.000 1.000 CA 1.397 6 residues pruned to eliminate duplicates Z: 71 55.311 2.128 0.908 0.633 0.957 0.671 CB 1.502 84 residues pruned to eliminate duplicates Z: 13 37.183 2.250 1.023 0.889 0.917 0.750 CA 1.853 13 residues pruned to eliminate duplicates Z: 11 23.627 2.183 0.521 0.938 1.000 0.900 CB 1.564 11 residues pruned to eliminate duplicates Z: 134 107.543 2.543 0.751 0.613 0.962 0.722 CB 1.955 134 residues pruned to eliminate duplicates Z: 9 29.371 2.320 0.843 0.879 1.000 0.875 CB 1.762 9 residues pruned to eliminate duplicates Z: 22 46.631 2.154 1.012 0.905 1.000 0.714 CB 1.672 22 residues pruned to eliminate duplicates Z: 9 13.355 1.902 0.593 0.875 0.875 0.875 CB 1.295 9 residues pruned to eliminate duplicates Z: 9 42.424 2.586 1.019 0.872 1.000 0.750 C 2.094 9 residues pruned to eliminate duplicates Z: 8 29.765 2.374 0.747 0.888 1.000 1.000 C 1.955 8 residues pruned to eliminate duplicates Z: 9 15.161 2.108 0.209 0.891 1.000 1.000 CB 1.512 Z: 22 51.208 2.217 0.974 0.915 1.000 0.810 CB 1.804 22 residues pruned to eliminate duplicates Z: 43 49.628 2.445 0.772 0.508 0.929 0.571 CB 1.889 43 residues pruned to eliminate duplicates Z: 24 36.968 2.030 0.702 0.920 1.000 0.913 CB 1.572 24 residues pruned to eliminate duplicates Z: 40 39.561 2.257 0.802 0.604 0.923 0.615 CB 1.528 40 residues pruned to eliminate duplicates Z: 12 17.406 1.867 0.698 0.831 1.000 0.727 CB 1.244 12 residues pruned to eliminate duplicates Z: 8 23.620 2.100 0.976 0.854 1.000 0.857 CB 1.589 8 residues pruned to eliminate duplicates Z: 20 70.348 2.745 0.752 0.958 1.000 1.000 CB 2.302 20 residues pruned to eliminate duplicates Z: 9 23.190 2.153 0.758 0.893 1.000 0.750 CB 1.554 9 residues pruned to eliminate duplicates Z: 70 54.233 2.402 0.588 0.544 0.899 0.725 CB 1.824 70 residues pruned to eliminate duplicates Z: 10 14.054 1.952 0.566 0.787 0.778 0.667 CB 1.531 9 residues pruned to eliminate duplicates Z: 37 39.380 2.346 0.813 0.570 0.917 0.778 CB 1.573 37 residues pruned to eliminate duplicates Z: 22 62.723 2.333 1.190 0.919 1.000 0.762 C 1.888 22 residues pruned to eliminate duplicates Z: 80 64.669 2.428 0.674 0.562 0.924 0.658 CB 1.824 80 residues pruned to eliminate duplicates Z: 63 30.119 1.947 0.548 0.560 0.903 0.710 CB 1.325 11 residues pruned to eliminate duplicates Z: 10 16.828 1.922 0.539 0.896 1.000 0.667 CB 1.358 11 residues pruned to eliminate duplicates Z: 26 30.649 2.229 0.925 0.583 0.840 0.680 CB 1.571 26 residues pruned to eliminate duplicates Z: 9 33.808 2.228 1.440 0.879 1.000 1.000 CA 1.595 9 residues pruned to eliminate duplicates Z: 32 62.605 2.428 0.906 0.802 1.000 0.742 CA 1.866 32 residues pruned to eliminate duplicates Z: 11 20.125 1.926 0.633 0.831 0.900 0.800 CA 1.689 9 residues pruned to eliminate duplicates Z: 55 40.542 2.137 0.882 0.505 0.907 0.574 CB 1.505 55 residues pruned to eliminate duplicates Z: 9 14.577 1.948 0.359 0.782 1.000 0.750 C 1.519 9 residues pruned to eliminate duplicates Z: 7 9.972 2.057 0.095 0.790 0.833 0.667 C 1.681 7 residues pruned to eliminate duplicates Z: 155 111.142 2.481 0.883 0.610 0.955 0.675 CB 1.809 155 residues pruned to eliminate duplicates Z: 7 15.943 1.968 0.625 0.772 1.000 0.667 CB 1.600 7 residues pruned to eliminate duplicates Z: 23 40.785 2.088 0.795 0.909 1.000 0.909 CA 1.647 23 residues pruned to eliminate duplicates Z: 9 27.207 2.204 1.038 0.860 1.000 0.875 CB 1.574 9 residues pruned to eliminate duplicates Z: 19 28.602 2.164 1.021 0.512 0.944 0.722 CB 1.614 19 residues pruned to eliminate duplicates Z: 96 81.368 2.358 0.990 0.593 0.947 0.663 CB 1.719 218 residues pruned to eliminate duplicates Z: 13 16.104 2.277 0.304 0.460 1.000 0.583 CB 1.631 13 residues pruned to eliminate duplicates Z: 28 17.079 1.921 0.426 0.506 0.926 0.667 CB 1.287 Z: 35 29.677 2.258 0.402 0.550 0.853 0.706 CB 1.795 35 residues pruned to eliminate duplicates Z: 44 46.967 2.133 0.864 0.669 0.930 0.651 CB 1.657 Z: 12 21.501 2.369 0.701 0.647 0.909 0.727 CB 1.543 12 residues pruned to eliminate duplicates Z: 24 96.766 2.604 1.524 0.911 1.000 0.739 CA 2.177 24 residues pruned to eliminate duplicates Z: 6 11.851 2.142 0.662 0.770 0.800 0.400 CA 1.465 6 residues pruned to eliminate duplicates Z: 20 47.360 2.336 1.074 0.832 0.947 0.737 CB 1.777 20 residues pruned to eliminate duplicates Z: 23 46.098 2.116 1.064 0.917 0.955 0.773 CA 1.663 23 residues pruned to eliminate duplicates Z: 22 41.744 2.166 0.761 0.908 1.000 0.810 CB 1.696 22 residues pruned to eliminate duplicates Z: 53 33.897 2.105 0.685 0.540 0.865 0.596 CB 1.474 42 residues pruned to eliminate duplicates Z: 137 100.402 2.527 0.698 0.608 0.956 0.728 CB 1.893 137 residues pruned to eliminate duplicates Z: 23 42.927 2.110 0.896 0.909 1.000 0.818 CB 1.624 23 residues pruned to eliminate duplicates Z: 47 42.259 2.233 0.906 0.500 0.913 0.609 CB 1.603 33 residues pruned to eliminate duplicates Z: 10 27.294 2.089 0.973 0.879 1.000 0.778 C 1.601 10 residues pruned to eliminate duplicates Z: 9 30.530 2.374 0.763 0.808 1.000 0.875 CA 1.971 Z: 16 12.724 1.793 0.653 0.558 0.867 0.467 CB 1.209 Z: 9 28.922 2.099 1.321 0.902 1.000 0.875 CB 1.497 Z: 107 59.977 2.172 0.784 0.606 0.896 0.623 CB 1.518 185 residues pruned to eliminate duplicates Z: 6 9.660 2.182 0.376 0.696 0.800 0.400 CB 1.504 Z: 34 32.725 2.157 0.786 0.515 0.939 0.485 CB 1.551 9 residues pruned to eliminate duplicates Z: 8 13.626 1.989 0.677 0.752 0.857 0.714 CB 1.438 8 residues pruned to eliminate duplicates Z: 14 27.645 1.954 0.853 0.923 1.000 0.769 CA 1.488 14 residues pruned to eliminate duplicates Z: 113 79.802 2.428 0.780 0.556 0.929 0.661 CB 1.779 113 residues pruned to eliminate duplicates Z: 43 55.017 2.622 0.877 0.536 0.881 0.619 CB 1.889 43 residues pruned to eliminate duplicates Z: 9 14.368 2.048 0.478 0.836 0.875 0.750 CA 1.436 9 residues pruned to eliminate duplicates Z: 18 44.096 2.237 0.873 0.915 1.000 1.000 CB 1.804 18 residues pruned to eliminate duplicates Z: 24 40.324 2.024 1.008 0.868 0.957 0.565 CA 1.581 24 residues pruned to eliminate duplicates Z: 14 17.485 2.169 0.807 0.565 0.769 0.692 CB 1.511 14 residues pruned to eliminate duplicates Z: 9 5.788 1.702 0.697 0.375 0.750 0.625 CB 1.080 9 residues pruned to eliminate duplicates Z: 22 42.206 2.168 0.767 0.934 1.000 0.905 CB 1.676 22 residues pruned to eliminate duplicates Z: 67 52.217 2.408 0.434 0.556 0.909 0.712 CB 1.939 67 residues pruned to eliminate duplicates Z: 34 48.718 2.566 0.958 0.550 0.848 0.636 CB 1.893 34 residues pruned to eliminate duplicates Z: 33 47.854 2.271 0.772 0.730 0.938 0.688 CA 1.824 33 residues pruned to eliminate duplicates Z: 84 81.932 2.598 0.795 0.592 0.904 0.687 CB 1.954 84 residues pruned to eliminate duplicates Z: 10 19.081 1.979 0.806 0.791 0.889 0.667 C 1.551 10 residues pruned to eliminate duplicates Z: 36 30.283 2.102 0.966 0.538 0.886 0.714 CB 1.348 36 residues pruned to eliminate duplicates Z: 27 31.672 2.195 0.837 0.599 0.923 0.731 CB 1.519 27 residues pruned to eliminate duplicates Z: 11 13.560 1.927 0.904 0.508 0.800 0.800 CB 1.448 15 residues pruned to eliminate duplicates Z: 32 52.807 2.331 0.807 0.806 0.968 0.677 CB 1.782 32 residues pruned to eliminate duplicates Z: 10 14.057 1.962 0.410 0.831 0.889 0.778 CA 1.432 9 residues pruned to eliminate duplicates Z: 9 11.137 1.894 0.247 0.814 0.875 0.875 CA 1.450 9 residues pruned to eliminate duplicates Z: 42 37.910 2.209 0.754 0.522 0.951 0.659 CB 1.572 6 residues pruned to eliminate duplicates Z: 8 19.654 2.112 0.639 0.845 1.000 0.857 CA 1.595 8 residues pruned to eliminate duplicates Z: 11 23.758 1.951 1.068 0.915 1.000 0.800 CB 1.316 11 residues pruned to eliminate duplicates Z: 115 97.782 2.551 0.874 0.591 0.921 0.711 CB 1.906 115 residues pruned to eliminate duplicates Z: 23 51.908 2.299 1.048 0.892 0.955 0.727 CB 1.769 23 residues pruned to eliminate duplicates Z: 11 28.798 2.306 0.853 0.758 1.000 0.800 CB 1.694 11 residues pruned to eliminate duplicates Z: 13 38.485 2.238 0.990 0.886 1.000 0.750 CA 1.800 13 residues pruned to eliminate duplicates Z: 13 23.911 1.990 0.835 0.909 0.917 0.833 CA 1.463 13 residues pruned to eliminate duplicates Z: 23 43.889 2.087 1.085 0.917 0.955 0.727 CB 1.589 23 residues pruned to eliminate duplicates Z: 18 48.162 2.433 0.841 0.896 1.000 0.647 CB 1.868 18 residues pruned to eliminate duplicates Z: 10 20.803 1.888 0.823 0.882 1.000 0.889 CA 1.458 9 residues pruned to eliminate duplicates Z: 12 8.705 1.889 0.585 0.570 0.727 0.455 CB 1.127 12 residues pruned to eliminate duplicates Z: 10 32.593 2.512 0.596 0.906 1.000 1.000 CA 1.926 10 residues pruned to eliminate duplicates Z: 17 39.416 2.323 0.618 0.936 1.000 0.875 CB 1.827 17 residues pruned to eliminate duplicates Z: 23 39.915 2.050 0.825 0.917 1.000 0.864 CB 1.604 23 residues pruned to eliminate duplicates Z: 123 90.672 2.515 0.840 0.556 0.926 0.656 CB 1.813 123 residues pruned to eliminate duplicates Z: 24 35.704 2.031 0.632 0.919 1.000 0.870 CB 1.583 24 residues pruned to eliminate duplicates Z: 11 23.706 2.248 0.753 0.716 0.900 0.600 CB 1.738 10 residues pruned to eliminate duplicates Z: 14 25.294 1.940 0.722 0.923 1.000 0.923 CA 1.476 14 residues pruned to eliminate duplicates Z: 11 13.556 2.015 0.652 0.608 0.900 0.600 CB 1.292 11 residues pruned to eliminate duplicates Z: 23 30.754 2.211 0.937 0.565 0.909 0.636 CB 1.583 16 residues pruned to eliminate duplicates Z: 9 25.052 2.496 0.758 0.825 0.875 0.250 CB 1.740 9 residues pruned to eliminate duplicates Z: 36 53.868 2.507 1.042 0.583 0.914 0.629 CB 1.797 36 residues pruned to eliminate duplicates Z: 53 43.955 2.472 0.704 0.438 0.904 0.596 CB 1.706 53 residues pruned to eliminate duplicates Z: 22 51.343 2.331 0.926 0.861 1.000 0.619 CB 1.834 22 residues pruned to eliminate duplicates Z: 13 24.039 1.972 0.624 0.929 1.000 0.917 CA 1.516 13 residues pruned to eliminate duplicates Z: 112 74.807 2.389 0.787 0.549 0.910 0.667 CB 1.743 112 residues pruned to eliminate duplicates Z: 64 61.759 2.239 0.916 0.654 0.952 0.698 CB 1.651 104 residues pruned to eliminate duplicates Z: 9 17.815 2.048 0.535 0.843 1.000 0.750 CB 1.492 Z: 29 19.478 1.885 0.673 0.538 0.821 0.679 CB 1.369 29 residues pruned to eliminate duplicates Z: 14 11.304 1.810 0.152 0.884 1.000 0.769 CB 1.086 13 residues pruned to eliminate duplicates Z: 34 33.887 2.445 0.507 0.576 0.879 0.667 CB 1.694 34 residues pruned to eliminate duplicates Z: 72 64.873 2.477 0.718 0.557 0.958 0.746 CB 1.788 72 residues pruned to eliminate duplicates Z: 9 20.416 2.063 0.609 0.874 1.000 1.000 CB 1.583 9 residues pruned to eliminate duplicates Z: 24 41.394 2.044 0.956 0.895 0.957 0.870 CA 1.618 24 residues pruned to eliminate duplicates Z: 6 5.306 1.824 0.598 0.285 0.800 0.800 CA 1.296 6 residues pruned to eliminate duplicates Z: 12 25.378 2.286 0.761 0.724 0.909 0.727 CB 1.708 9 residues pruned to eliminate duplicates Z: 13 32.537 2.228 0.697 0.915 1.000 0.833 CA 1.755 13 residues pruned to eliminate duplicates Z: 23 33.519 2.081 0.631 0.850 0.955 0.818 CA 1.634 23 residues pruned to eliminate duplicates Z: 23 47.980 2.090 1.051 0.924 1.000 0.955 CA 1.676 23 residues pruned to eliminate duplicates Z: 21 18.463 1.905 0.582 0.589 0.800 0.550 CA 1.572 21 residues pruned to eliminate duplicates Z: 9 14.201 1.922 0.638 0.859 1.000 1.000 CB 1.174 Z: 22 56.910 2.377 0.989 0.904 1.000 0.810 CB 1.871 22 residues pruned to eliminate duplicates Z: 8 22.048 2.205 0.830 0.887 0.857 0.857 C 1.736 8 residues pruned to eliminate duplicates Z: 24 36.812 2.020 0.754 0.912 1.000 0.783 CB 1.535 24 residues pruned to eliminate duplicates Z: 37 51.405 2.675 0.903 0.489 0.889 0.694 CB 1.915 37 residues pruned to eliminate duplicates Z: 21 44.160 2.199 0.859 0.916 1.000 0.700 CB 1.707 21 residues pruned to eliminate duplicates Z: 7 7.924 1.764 0.480 0.501 1.000 0.833 CB 1.238 7 residues pruned to eliminate duplicates Z: 58 46.254 2.206 0.869 0.532 0.895 0.544 CB 1.608 45 residues pruned to eliminate duplicates Z: 44 16.569 1.747 0.406 0.563 0.930 0.698 CB 1.040 25 residues pruned to eliminate duplicates Z: 44 40.657 2.130 0.747 0.678 0.907 0.698 CB 1.560 53 residues pruned to eliminate duplicates Z: 10 14.005 2.201 0.441 0.575 0.889 0.778 CB 1.541 10 residues pruned to eliminate duplicates Z: 10 20.255 2.033 0.704 0.887 0.889 0.667 C 1.581 10 residues pruned to eliminate duplicates Z: 9 7.242 1.877 0.357 0.420 0.750 0.500 CB 1.457 9 residues pruned to eliminate duplicates Z: 12 22.516 2.198 0.583 0.736 0.909 0.818 CB 1.737 12 residues pruned to eliminate duplicates Z: 23 43.416 2.103 1.028 0.881 0.955 0.773 CA 1.646 23 residues pruned to eliminate duplicates Z: 18 43.168 2.222 0.886 0.910 1.000 0.882 CB 1.771 18 residues pruned to eliminate duplicates Z: 13 13.105 1.798 0.435 0.872 1.000 0.833 CB 1.069 13 residues pruned to eliminate duplicates Z: 7 9.860 1.692 0.532 0.722 1.000 0.833 CA 1.270 7 residues pruned to eliminate duplicates Z: 21 44.386 2.209 0.860 0.908 0.950 0.800 CA 1.806 21 residues pruned to eliminate duplicates Z: 6 3.189 1.718 0.195 0.475 0.600 0.600 CA 1.187 Z: 11 11.661 1.842 0.156 0.880 1.000 0.800 CB 1.256 11 residues pruned to eliminate duplicates Z: 36 35.958 2.432 0.523 0.573 0.914 0.743 CB 1.673 36 residues pruned to eliminate duplicates Z: 72 69.361 2.555 0.763 0.540 0.944 0.662 CB 1.862 72 residues pruned to eliminate duplicates Z: 9 16.638 2.112 0.905 0.559 0.875 0.750 CA 1.577 9 residues pruned to eliminate duplicates Z: 46 57.700 2.355 0.804 0.697 0.933 0.644 CB 1.812 46 residues pruned to eliminate duplicates Z: 57 30.136 1.990 0.521 0.556 0.946 0.661 CB 1.331 39 residues pruned to eliminate duplicates Z: 12 25.845 2.361 0.471 0.827 0.909 0.909 CB 1.860 12 residues pruned to eliminate duplicates Z: 130 100.140 2.545 0.732 0.592 0.930 0.705 CB 1.968 130 residues pruned to eliminate duplicates Z: 9 20.711 2.179 0.596 0.870 1.000 0.875 CB 1.537 9 residues pruned to eliminate duplicates Z: 82 95.186 2.596 0.896 0.629 0.963 0.753 CB 1.976 82 residues pruned to eliminate duplicates Z: 12 10.304 1.855 0.744 0.468 0.818 0.545 CB 1.212 12 residues pruned to eliminate duplicates Z: 22 29.321 1.988 0.673 0.904 0.857 0.667 CB 1.598 Z: 23 55.125 2.286 1.110 0.916 1.000 0.591 CB 1.720 23 residues pruned to eliminate duplicates Z: 24 51.587 2.141 1.118 0.911 1.000 0.696 CB 1.681 24 residues pruned to eliminate duplicates Z: 14 21.861 2.151 0.764 0.659 0.923 0.769 CB 1.493 14 residues pruned to eliminate duplicates Z: 23 55.258 2.310 1.013 0.915 1.000 0.773 CB 1.790 23 residues pruned to eliminate duplicates Z: 17 20.536 2.130 0.806 0.591 0.812 0.688 CB 1.505 19 residues pruned to eliminate duplicates Z: 153 101.483 2.435 0.882 0.586 0.908 0.638 CB 1.822 153 residues pruned to eliminate duplicates Z: 52 43.325 2.067 0.857 0.623 0.902 0.647 CB 1.561 85 residues pruned to eliminate duplicates Z: 24 44.774 2.029 1.027 0.929 1.000 0.870 CA 1.589 24 residues pruned to eliminate duplicates Z: 9 14.132 2.448 0.346 0.531 0.750 0.625 CB 1.962 9 residues pruned to eliminate duplicates Z: 13 24.145 1.969 0.711 0.906 1.000 0.917 CA 1.472 13 residues pruned to eliminate duplicates Z: 23 20.468 1.890 0.699 0.630 0.909 0.818 CB 1.323 23 residues pruned to eliminate duplicates Z: 131 91.552 2.471 0.839 0.598 0.923 0.700 CB 1.743 131 residues pruned to eliminate duplicates Z: 13 21.161 2.037 0.816 0.856 0.750 0.750 CA 1.624 13 residues pruned to eliminate duplicates Z: 23 44.615 2.125 1.029 0.913 0.955 0.773 CA 1.636 23 residues pruned to eliminate duplicates Z: 22 58.757 2.387 0.980 0.917 1.000 0.952 CB 1.915 22 residues pruned to eliminate duplicates Z: 36 51.610 2.344 0.781 0.711 0.943 0.657 CA 1.830 36 residues pruned to eliminate duplicates Z: 24 45.485 2.193 0.953 0.859 1.000 0.478 CB 1.630 24 residues pruned to eliminate duplicates Z: 6 10.734 2.067 0.326 0.826 1.000 0.400 CB 1.321 6 residues pruned to eliminate duplicates Z: 54 49.231 2.210 0.687 0.654 0.962 0.717 CB 1.634 54 residues pruned to eliminate duplicates Z: 23 43.037 2.093 1.089 0.859 0.955 0.727 CA 1.618 23 residues pruned to eliminate duplicates Z: 29 32.871 2.362 0.746 0.485 0.857 0.679 CB 1.785 29 residues pruned to eliminate duplicates Z: 93 110.011 2.644 0.931 0.626 0.967 0.685 CB 2.063 93 residues pruned to eliminate duplicates Z: 23 39.734 2.094 0.871 0.912 0.955 0.818 CB 1.604 23 residues pruned to eliminate duplicates Z: 13 22.868 1.966 0.635 0.908 1.000 0.917 CA 1.459 13 residues pruned to eliminate duplicates Z: 69 74.667 2.581 0.770 0.643 0.926 0.735 CB 1.872 69 residues pruned to eliminate duplicates Z: 10 11.458 1.747 0.241 0.908 1.000 1.000 CB 1.250 10 residues pruned to eliminate duplicates Z: 12 26.697 2.458 0.755 0.623 0.909 0.727 CA 1.827 12 residues pruned to eliminate duplicates Z: 16 13.254 1.782 0.455 0.898 1.000 0.800 CB 0.944 16 residues pruned to eliminate duplicates Z: 22 26.441 2.224 0.830 0.531 0.810 0.524 CB 1.698 22 residues pruned to eliminate duplicates Z: 12 21.600 1.963 0.718 0.911 1.000 0.909 CB 1.368 12 residues pruned to eliminate duplicates Z: 17 15.090 1.690 0.300 0.934 1.000 1.000 CB 1.197 Z: 23 63.303 2.242 1.306 0.919 1.000 0.682 CB 1.839 23 residues pruned to eliminate duplicates Z: 11 11.175 1.768 0.289 0.913 0.900 0.900 CB 1.219 11 residues pruned to eliminate duplicates Z: 135 98.193 2.529 0.726 0.589 0.933 0.664 CB 1.913 135 residues pruned to eliminate duplicates Z: 24 44.489 2.017 1.021 0.923 1.000 0.652 CB 1.598 24 residues pruned to eliminate duplicates Z: 13 20.163 2.243 0.678 0.684 0.750 0.583 CB 1.742 13 residues pruned to eliminate duplicates Z: 86 67.245 2.489 0.705 0.557 0.929 0.600 CB 1.749 86 residues pruned to eliminate duplicates Z: 7 8.912 1.613 0.882 0.650 0.833 0.667 CB 1.251 6 residues pruned to eliminate duplicates Z: 15 9.570 1.865 0.509 0.456 0.786 0.714 CB 1.210 15 residues pruned to eliminate duplicates Z: 73 72.741 2.548 0.932 0.528 0.931 0.708 CB 1.821 73 residues pruned to eliminate duplicates Z: 23 50.486 2.272 1.119 0.900 0.909 0.864 CB 1.756 23 residues pruned to eliminate duplicates Z: 12 17.015 2.082 0.114 0.861 0.909 0.727 C 1.788 12 residues pruned to eliminate duplicates Z: 43 34.183 2.206 0.725 0.474 0.905 0.548 CB 1.573 43 residues pruned to eliminate duplicates Z: 69 91.414 2.603 0.965 0.667 0.956 0.750 CB 1.942 69 residues pruned to eliminate duplicates Z: 49 73.498 2.548 1.019 0.701 0.917 0.708 CB 1.873 49 residues pruned to eliminate duplicates Z: 144 101.350 2.462 0.862 0.590 0.951 0.657 CB 1.784 144 residues pruned to eliminate duplicates Z: 22 42.077 2.300 0.578 0.929 0.952 0.905 CA 1.859 22 residues pruned to eliminate duplicates Z: 17 42.622 2.275 0.897 0.912 1.000 0.812 CB 1.748 17 residues pruned to eliminate duplicates Z: 37 22.268 2.002 0.583 0.510 0.861 0.667 CB 1.347 37 residues pruned to eliminate duplicates Z: 14 10.767 1.897 0.408 0.581 1.000 0.769 CB 1.034 14 residues pruned to eliminate duplicates Z: 25 24.660 1.929 0.835 0.611 0.917 0.792 CB 1.397 25 residues pruned to eliminate duplicates Z: 6 15.582 2.150 0.491 0.850 1.000 0.600 CB 1.610 6 residues pruned to eliminate duplicates Z: 6 19.726 2.226 0.900 0.705 1.000 1.000 CB 1.732 6 residues pruned to eliminate duplicates Z: 18 15.878 1.594 0.538 0.906 1.000 0.824 CB 1.117 19 residues pruned to eliminate duplicates Z: 9 15.547 1.837 0.742 0.806 1.000 0.875 CB 1.316 9 residues pruned to eliminate duplicates Z: 16 12.684 1.826 0.837 0.501 0.800 0.600 CB 1.220 16 residues pruned to eliminate duplicates Z: 13 12.999 1.872 0.393 0.879 1.000 0.750 CB 1.043 13 residues pruned to eliminate duplicates Z: 93 69.548 2.361 0.850 0.554 0.913 0.641 CB 1.726 93 residues pruned to eliminate duplicates Z: 22 57.272 2.349 1.057 0.912 1.000 0.810 CB 1.832 22 residues pruned to eliminate duplicates Z: 6 2.446 1.501 0.549 0.285 0.600 0.400 CB 0.999 6 residues pruned to eliminate duplicates Z: 11 13.126 1.688 0.406 0.900 1.000 0.900 CB 1.250 11 residues pruned to eliminate duplicates Z: 84 75.174 2.543 0.755 0.553 0.940 0.687 CB 1.869 84 residues pruned to eliminate duplicates Z: 45 30.424 2.101 0.755 0.447 0.909 0.614 CB 1.445 45 residues pruned to eliminate duplicates Z: 32 41.326 2.072 0.887 0.739 1.000 0.839 CB 1.533 32 residues pruned to eliminate duplicates Z: 7 9.247 1.826 0.627 0.503 1.000 0.833 CA 1.267 7 residues pruned to eliminate duplicates Z: 50 57.693 2.297 0.745 0.710 0.959 0.755 CB 1.772 50 residues pruned to eliminate duplicates Z: 6 5.807 1.405 0.638 0.722 1.000 0.600 CA 0.923 6 residues pruned to eliminate duplicates Z: 166 109.557 2.472 0.886 0.607 0.915 0.642 CB 1.806 166 residues pruned to eliminate duplicates Z: 60 47.444 2.218 0.795 0.525 0.898 0.576 CB 1.685 60 residues pruned to eliminate duplicates Z: 18 16.623 1.662 0.496 0.907 1.000 0.824 CB 1.152 17 residues pruned to eliminate duplicates Z: 12 17.514 2.115 0.289 0.873 0.818 0.636 CA 1.725 12 residues pruned to eliminate duplicates Z: 33 46.142 2.118 0.943 0.749 1.000 0.688 CB 1.587 33 residues pruned to eliminate duplicates Z: 65 32.294 2.005 0.542 0.544 0.906 0.656 CB 1.380 63 residues pruned to eliminate duplicates Z: 18 30.965 2.364 0.265 0.925 1.000 0.824 CB 1.762 18 residues pruned to eliminate duplicates Z: 11 10.882 1.654 0.165 0.919 1.000 1.000 CB 1.259 11 residues pruned to eliminate duplicates Z: 9 13.730 1.720 0.455 0.924 1.000 1.000 CB 1.362 9 residues pruned to eliminate duplicates Z: 100 93.241 2.491 0.924 0.605 0.939 0.677 CB 1.884 100 residues pruned to eliminate duplicates Z: 17 9.588 1.687 0.249 0.862 1.000 0.875 CB 0.836 17 residues pruned to eliminate duplicates Z: 21 30.287 2.220 0.921 0.562 0.950 0.650 CB 1.573 21 residues pruned to eliminate duplicates Z: 63 67.516 2.403 0.824 0.636 0.935 0.710 CB 1.839 63 residues pruned to eliminate duplicates Z: 11 12.829 2.147 0.293 0.585 0.800 0.600 CA 1.684 11 residues pruned to eliminate duplicates Z: 19 18.069 2.023 0.803 0.636 0.889 0.667 CB 1.156 19 residues pruned to eliminate duplicates Z: 6 10.749 2.098 0.147 0.857 1.000 0.600 CB 1.472 6 residues pruned to eliminate duplicates Z: 9 15.815 2.378 0.141 0.824 0.875 0.750 CA 1.778 9 residues pruned to eliminate duplicates Z: 11 11.250 1.860 0.630 0.513 0.900 0.600 CB 1.287 11 residues pruned to eliminate duplicates Z: 42 39.330 2.369 0.819 0.552 0.829 0.659 CB 1.634 42 residues pruned to eliminate duplicates Z: 25 49.560 2.112 1.082 0.903 0.958 0.792 C 1.711 25 residues pruned to eliminate duplicates Z: 95 76.416 2.435 0.942 0.583 0.915 0.745 CB 1.682 95 residues pruned to eliminate duplicates Z: 67 69.557 2.577 0.823 0.529 0.924 0.682 CB 1.916 67 residues pruned to eliminate duplicates Z: 36 40.349 2.627 0.559 0.482 0.914 0.514 CB 1.854 36 residues pruned to eliminate duplicates Z: 109 87.371 2.457 0.831 0.586 0.926 0.694 CB 1.858 109 residues pruned to eliminate duplicates Z: 37 27.145 2.039 0.634 0.531 0.917 0.722 CB 1.437 37 residues pruned to eliminate duplicates Z: 54 69.133 2.566 0.773 0.617 0.943 0.679 CB 1.981 54 residues pruned to eliminate duplicates Z: 7 6.713 1.789 0.903 0.476 1.000 0.667 CB 0.824 8 residues pruned to eliminate duplicates Z: 7 17.725 2.053 0.650 0.803 1.000 0.833 CA 1.640 7 residues pruned to eliminate duplicates Z: 9 17.612 1.902 0.924 0.812 1.000 0.875 CB 1.297 9 residues pruned to eliminate duplicates Z: 17 14.728 2.101 0.451 0.481 0.875 0.625 CB 1.407 17 residues pruned to eliminate duplicates Z: 20 19.353 1.839 0.674 0.667 0.947 0.737 CB 1.304 20 residues pruned to eliminate duplicates Z: 19 56.858 2.310 1.142 0.926 1.000 0.667 CB 1.900 19 residues pruned to eliminate duplicates Z: 33 46.534 2.572 0.765 0.544 0.906 0.500 CB 1.914 33 residues pruned to eliminate duplicates Z: 34 33.085 2.080 0.803 0.502 0.970 0.636 CB 1.581 34 residues pruned to eliminate duplicates Z: 22 38.564 2.131 0.711 0.897 1.000 0.810 CB 1.652 22 residues pruned to eliminate duplicates Z: 32 40.839 2.293 0.769 0.656 0.935 0.677 CB 1.671 32 residues pruned to eliminate duplicates Z: 24 26.254 1.935 0.847 0.631 0.957 0.739 CB 1.416 24 residues pruned to eliminate duplicates Z: 10 31.544 2.295 1.390 0.880 1.000 0.889 CB 1.388 10 residues pruned to eliminate duplicates Z: 51 80.234 2.535 1.061 0.628 0.940 0.600 CB 2.049 51 residues pruned to eliminate duplicates Z: 19 38.591 2.143 0.930 0.886 0.944 0.889 CB 1.681 19 residues pruned to eliminate duplicates Z: 30 27.830 2.102 0.900 0.480 0.897 0.655 CB 1.472 30 residues pruned to eliminate duplicates Z: 99 108.762 2.620 0.999 0.595 0.939 0.684 CB 2.040 99 residues pruned to eliminate duplicates Z: 7 12.283 1.896 1.032 0.654 0.833 0.667 CA 1.354 7 residues pruned to eliminate duplicates Z: 10 26.686 2.418 0.648 0.887 0.889 0.556 CA 1.811 10 residues pruned to eliminate duplicates Z: 58 37.896 2.035 0.637 0.537 0.965 0.561 CB 1.506 58 residues pruned to eliminate duplicates Z: 160 102.828 2.463 0.782 0.599 0.925 0.704 CB 1.828 160 residues pruned to eliminate duplicates Z: 73 55.647 2.422 0.482 0.563 0.931 0.708 CB 1.847 73 residues pruned to eliminate duplicates Z: 60 86.196 2.637 0.852 0.667 0.932 0.695 CB 2.113 60 residues pruned to eliminate duplicates Z: 12 21.615 2.177 0.732 0.760 0.909 0.636 CB 1.509 12 residues pruned to eliminate duplicates Z: 10 24.377 2.296 0.870 0.534 1.000 0.778 CA 1.830 10 residues pruned to eliminate duplicates Z: 9 5.682 1.716 0.278 0.527 1.000 0.875 CB 0.892 9 residues pruned to eliminate duplicates Z: 11 15.054 2.234 0.364 0.615 0.900 0.700 CB 1.558 11 residues pruned to eliminate duplicates Z: 91 72.241 2.539 0.676 0.548 0.944 0.667 CB 1.807 91 residues pruned to eliminate duplicates Z: 90 61.356 2.168 0.864 0.631 0.921 0.685 CB 1.543 90 residues pruned to eliminate duplicates Z: 23 64.133 2.287 1.265 0.911 1.000 0.727 CB 1.870 23 residues pruned to eliminate duplicates Z: 7 3.944 1.510 1.059 0.391 0.833 0.833 CB 0.697 Z: 22 50.318 2.131 1.224 0.915 1.000 0.810 CB 1.637 22 residues pruned to eliminate duplicates Z: 13 21.741 1.922 0.897 0.902 0.917 0.917 CA 1.339 13 residues pruned to eliminate duplicates Z: 7 5.301 1.652 -0.097 0.657 1.000 0.667 CB 1.254 Z: 19 28.329 2.111 0.304 0.922 1.000 0.944 CB 1.706 19 residues pruned to eliminate duplicates Z: 48 34.744 2.201 0.865 0.453 0.872 0.511 CB 1.485 48 residues pruned to eliminate duplicates Z: 42 53.471 2.597 0.689 0.503 0.927 0.707 CB 2.048 42 residues pruned to eliminate duplicates Z: 15 12.843 1.788 0.260 0.937 1.000 0.929 CB 1.060 15 residues pruned to eliminate duplicates Z: 12 17.356 1.924 0.603 0.896 0.818 0.727 CB 1.485 12 residues pruned to eliminate duplicates Z: 22 110.123 2.878 1.396 0.935 1.000 0.952 CB 2.428 22 residues pruned to eliminate duplicates Z: 20 20.019 1.970 0.780 0.487 0.895 0.474 CB 1.484 20 residues pruned to eliminate duplicates Z: 13 22.612 2.126 1.067 0.586 0.917 0.667 CB 1.492 13 residues pruned to eliminate duplicates Z: 21 44.892 2.161 0.879 0.916 1.000 0.900 C 1.746 21 residues pruned to eliminate duplicates Z: 6 7.249 1.799 0.293 0.842 0.800 0.600 CA 1.298 6 residues pruned to eliminate duplicates Z: 14 12.039 1.692 0.277 0.912 1.000 1.000 CB 1.095 14 residues pruned to eliminate duplicates Z: 9 8.023 1.958 0.356 0.546 0.875 0.875 CB 1.166 9 residues pruned to eliminate duplicates Z: 12 21.694 2.060 0.477 0.940 1.000 1.000 CA 1.493 12 residues pruned to eliminate duplicates Z: 99 91.907 2.481 0.954 0.620 0.918 0.735 CB 1.862 99 residues pruned to eliminate duplicates Z: 21 103.902 2.842 1.432 0.929 1.000 0.950 CB 2.352 21 residues pruned to eliminate duplicates Z: 57 32.760 2.001 0.572 0.555 0.964 0.607 CB 1.368 57 residues pruned to eliminate duplicates Z: 96 56.436 2.195 0.781 0.554 0.895 0.632 CB 1.571 58 residues pruned to eliminate duplicates Z: 16 13.752 1.613 0.451 0.910 1.000 0.733 CB 1.076 16 residues pruned to eliminate duplicates Z: 69 84.840 2.586 0.943 0.639 0.926 0.735 CB 1.940 69 residues pruned to eliminate duplicates Z: 39 27.214 1.980 0.638 0.576 0.921 0.684 CB 1.374 39 residues pruned to eliminate duplicates Z: 102 112.298 2.633 0.949 0.637 0.950 0.733 CB 2.015 102 residues pruned to eliminate duplicates Z: 12 26.597 2.079 0.703 0.923 1.000 1.000 CA 1.591 12 residues pruned to eliminate duplicates Z: 19 13.718 1.542 0.435 0.882 1.000 0.889 CB 1.057 19 residues pruned to eliminate duplicates Z: 36 55.668 2.184 0.986 0.751 1.000 0.686 CB 1.734 41 residues pruned to eliminate duplicates Z: 10 7.085 1.819 0.342 0.490 0.889 0.778 CB 1.099 10 residues pruned to eliminate duplicates Z: 34 34.305 2.225 0.883 0.516 0.970 0.727 CB 1.446 34 residues pruned to eliminate duplicates Z: 11 13.915 2.214 0.636 0.424 0.800 0.600 CA 1.643 11 residues pruned to eliminate duplicates Z: 8 17.264 1.981 0.800 0.852 1.000 1.000 CB 1.354 8 residues pruned to eliminate duplicates Z: 111 86.715 2.452 0.936 0.568 0.927 0.609 CB 1.760 118 residues pruned to eliminate duplicates Z: 7 9.303 2.168 0.193 0.629 0.833 0.333 CA 1.561 7 residues pruned to eliminate duplicates Z: 6 12.484 1.946 0.647 0.861 1.000 0.600 CA 1.280 6 residues pruned to eliminate duplicates Z: 36 58.246 2.395 0.892 0.761 0.914 0.829 CB 1.884 36 residues pruned to eliminate duplicates Z: 6 2.909 1.549 0.831 0.325 0.600 0.600 CA 0.927 6 residues pruned to eliminate duplicates Z: 6 4.413 1.531 0.001 0.619 1.000 0.800 O 1.151 Z: 23 49.549 2.332 0.886 0.894 0.955 0.773 CB 1.806 23 residues pruned to eliminate duplicates Z: 18 47.328 2.163 1.083 0.935 1.000 0.529 CB 1.775 18 residues pruned to eliminate duplicates Z: 11 5.373 1.499 0.432 0.533 0.800 0.700 CB 0.958 7 residues pruned to eliminate duplicates Z: 35 37.905 2.248 0.834 0.579 0.912 0.676 CB 1.603 35 residues pruned to eliminate duplicates Z: 26 19.217 2.024 0.718 0.526 0.880 0.760 CB 1.225 26 residues pruned to eliminate duplicates Z: 13 11.545 2.060 0.605 0.551 0.667 0.583 CA 1.438 13 residues pruned to eliminate duplicates Z: 16 15.072 1.928 0.657 0.546 0.933 0.733 CB 1.247 16 residues pruned to eliminate duplicates Z: 17 10.800 1.585 0.168 0.934 0.938 0.875 CB 1.085 17 residues pruned to eliminate duplicates Z: 30 53.007 2.621 0.780 0.604 0.931 0.724 CB 2.052 30 residues pruned to eliminate duplicates Z: 9 11.977 1.934 0.233 0.853 0.875 0.875 CB 1.501 9 residues pruned to eliminate duplicates Z: 13 11.943 1.989 0.394 0.449 0.750 0.500 C 1.747 13 residues pruned to eliminate duplicates Z: 8 16.248 2.220 0.274 0.883 1.000 0.857 CA 1.569 8 residues pruned to eliminate duplicates Z: 8 12.898 1.967 0.445 0.879 1.000 0.571 CB 1.244 8 residues pruned to eliminate duplicates Z: 10 5.714 1.723 0.810 0.307 0.667 0.333 CB 1.135 10 residues pruned to eliminate duplicates Z: 112 104.604 2.586 0.928 0.589 0.937 0.712 CB 1.952 112 residues pruned to eliminate duplicates Z: 143 106.339 2.505 0.860 0.583 0.930 0.704 CB 1.903 143 residues pruned to eliminate duplicates Z: 33 30.274 2.024 0.721 0.589 0.938 0.719 CB 1.505 33 residues pruned to eliminate duplicates Z: 6 5.722 1.727 0.518 0.445 0.800 0.400 C 1.291 6 residues pruned to eliminate duplicates Z: 10 29.257 2.419 0.608 0.884 0.889 0.667 CB 2.038 10 residues pruned to eliminate duplicates Z: 19 31.785 2.275 0.228 0.918 1.000 0.944 CB 1.891 19 residues pruned to eliminate duplicates Z: 8 11.103 1.707 0.597 0.849 1.000 0.714 CA 1.142 8 residues pruned to eliminate duplicates Z: 16 27.986 2.315 0.842 0.634 0.933 0.800 CB 1.601 16 residues pruned to eliminate duplicates Z: 9 12.103 2.043 0.540 0.822 0.875 0.750 CB 1.176 9 residues pruned to eliminate duplicates Z: 35 31.913 2.242 0.497 0.553 0.882 0.706 CB 1.754 35 residues pruned to eliminate duplicates Z: 13 23.773 1.971 0.659 0.943 1.000 1.000 CA 1.454 13 residues pruned to eliminate duplicates Z: 17 16.013 1.640 0.482 0.926 1.000 0.625 CB 1.155 17 residues pruned to eliminate duplicates 6 1.888 1.649 0.300 0.257 0.800 0.800 CB 0.651 ? Z: 50 57.316 2.443 0.899 0.542 0.918 0.633 CB 1.845 50 residues pruned to eliminate duplicates Z: 28 35.040 2.297 0.847 0.575 0.889 0.704 CB 1.663 28 residues pruned to eliminate duplicates Z: 67 91.798 2.636 1.028 0.669 0.939 0.712 CB 1.925 67 residues pruned to eliminate duplicates Z: 9 41.731 2.599 1.031 0.918 1.000 1.000 C 1.971 9 residues pruned to eliminate duplicates Z: 23 34.558 2.078 0.551 0.927 1.000 0.955 CB 1.602 23 residues pruned to eliminate duplicates Z: 11 19.781 2.162 0.306 0.914 1.000 0.900 CB 1.567 11 residues pruned to eliminate duplicates Z: 34 44.787 2.509 0.613 0.574 0.970 0.848 CB 1.850 34 residues pruned to eliminate duplicates Z: 136 97.234 2.519 0.682 0.591 0.941 0.696 CB 1.924 136 residues pruned to eliminate duplicates Z: 12 13.963 1.787 0.613 0.918 0.909 0.727 CB 1.133 12 residues pruned to eliminate duplicates Z: 64 56.890 2.232 0.912 0.665 0.905 0.651 CB 1.593 63 residues pruned to eliminate duplicates Z: 6 5.087 1.674 0.430 0.671 0.800 0.800 CA 1.015 6 residues pruned to eliminate duplicates 7 1.590 1.376 -0.425 0.511 1.000 0.667 C 0.811 ? Z: 16 19.273 2.117 0.791 0.654 0.933 0.867 CB 1.218 16 residues pruned to eliminate duplicates Z: 18 10.998 1.540 0.068 0.876 1.000 0.882 CB 1.178 18 residues pruned to eliminate duplicates Z: 13 12.911 1.795 0.230 0.929 1.000 1.000 CB 1.182 13 residues pruned to eliminate duplicates Z: 14 9.200 1.705 0.316 0.448 0.923 0.462 CB 1.300 14 residues pruned to eliminate duplicates Z: 27 18.239 1.719 0.657 0.719 1.000 0.692 CB 1.030 31 residues pruned to eliminate duplicates Z: 16 13.330 1.709 0.561 0.934 1.000 0.933 CB 0.900 16 residues pruned to eliminate duplicates Z: 7 35.102 2.446 1.064 0.886 1.000 0.833 CA 2.048 7 residues pruned to eliminate duplicates Z: 8 23.305 2.257 0.655 0.820 1.000 0.857 CA 1.786 8 residues pruned to eliminate duplicates Z: 15 19.293 2.332 0.554 0.428 0.929 0.571 CB 1.651 15 residues pruned to eliminate duplicates Z: 7 6.071 1.758 0.576 0.474 0.667 0.333 CB 1.379 Z: 10 29.361 2.121 1.089 0.736 1.000 0.889 CB 1.787 Z: 17 12.218 1.604 0.174 0.902 1.000 0.875 CB 1.158 17 residues pruned to eliminate duplicates Z: 10 14.289 1.931 0.842 0.556 0.889 0.889 CA 1.427 5 residues pruned to eliminate duplicates Z: 7 9.558 1.681 0.830 0.834 0.833 0.833 CB 1.141 7 residues pruned to eliminate duplicates Z: 16 19.061 2.303 0.478 0.485 0.867 0.533 CB 1.694 16 residues pruned to eliminate duplicates Z: 11 24.287 2.023 0.834 0.839 1.000 0.900 CB 1.546 11 residues pruned to eliminate duplicates Z: 11 11.544 1.640 0.301 0.903 1.000 0.900 CB 1.219 11 residues pruned to eliminate duplicates Z: 11 17.877 1.806 0.699 0.917 1.000 0.900 CB 1.300 11 residues pruned to eliminate duplicates Z: 14 15.851 1.986 0.788 0.535 0.769 0.769 CB 1.555 14 residues pruned to eliminate duplicates Z: 9 18.337 1.979 0.456 0.883 1.000 1.000 C 1.627 9 residues pruned to eliminate duplicates Z: 16 10.923 1.716 0.086 0.924 1.000 1.000 CB 1.062 16 residues pruned to eliminate duplicates Z: 48 63.362 2.387 0.820 0.680 0.957 0.660 CA 1.883 48 residues pruned to eliminate duplicates Z: 8 6.236 1.675 0.621 0.616 1.000 0.857 CB 0.778 8 residues pruned to eliminate duplicates Z: 59 63.660 2.600 0.727 0.522 0.897 0.638 CB 2.032 59 residues pruned to eliminate duplicates Z: 33 83.069 2.604 1.249 0.730 0.969 0.812 CB 2.103 33 residues pruned to eliminate duplicates Z: 10 20.115 2.011 1.407 0.838 0.889 0.667 CA 1.164 10 residues pruned to eliminate duplicates Z: 44 31.569 2.178 0.378 0.543 0.953 0.628 CB 1.613 44 residues pruned to eliminate duplicates Z: 34 34.005 2.234 0.817 0.549 0.879 0.606 CB 1.583 34 residues pruned to eliminate duplicates Z: 53 47.362 2.466 0.609 0.504 0.962 0.635 CB 1.714 53 residues pruned to eliminate duplicates Z: 17 43.890 2.618 0.770 0.623 1.000 0.812 CB 2.109 17 residues pruned to eliminate duplicates Z: 19 39.564 2.340 0.798 0.876 1.000 0.444 CB 1.611 19 residues pruned to eliminate duplicates Z: 13 27.143 2.205 0.522 0.853 1.000 0.833 CA 1.725 13 residues pruned to eliminate duplicates Z: 39 33.321 1.978 0.946 0.606 0.895 0.684 CB 1.420 49 residues pruned to eliminate duplicates Z: 12 18.752 1.632 0.786 0.940 1.000 1.000 CB 1.347 12 residues pruned to eliminate duplicates Z: 24 22.496 1.968 0.697 0.612 0.870 0.652 CB 1.453 24 residues pruned to eliminate duplicates Z: 53 44.468 2.333 0.423 0.543 0.962 0.712 CB 1.852 53 residues pruned to eliminate duplicates Z: 41 79.440 2.487 1.186 0.685 1.000 0.750 CB 1.949 41 residues pruned to eliminate duplicates Z: 40 38.071 2.178 1.043 0.541 0.872 0.641 CB 1.510 12 residues pruned to eliminate duplicates Z: 10 13.629 1.841 0.431 0.849 0.889 0.667 CB 1.437 10 residues pruned to eliminate duplicates Z: 21 36.103 2.176 0.883 0.702 0.950 0.600 CA 1.724 21 residues pruned to eliminate duplicates Z: 54 42.124 2.353 0.740 0.459 0.830 0.679 CB 1.774 54 residues pruned to eliminate duplicates Z: 24 47.591 2.233 0.979 0.866 0.957 0.826 CB 1.720 24 residues pruned to eliminate duplicates Z: 38 29.453 1.981 0.816 0.557 0.892 0.676 CB 1.428 38 residues pruned to eliminate duplicates Z: 13 12.178 1.723 0.276 0.917 1.000 0.917 CB 1.128 13 residues pruned to eliminate duplicates Z: 69 94.674 2.644 0.919 0.654 0.941 0.691 CB 2.084 69 residues pruned to eliminate duplicates Z: 64 92.024 2.647 0.961 0.675 0.921 0.698 CB 2.065 64 residues pruned to eliminate duplicates Z: 10 23.783 2.075 0.826 0.878 1.000 0.889 CA 1.518 10 residues pruned to eliminate duplicates Z: 55 40.658 2.340 0.762 0.441 0.833 0.593 CB 1.711 55 residues pruned to eliminate duplicates Z: 17 19.806 2.250 0.902 0.632 0.750 0.688 CB 1.363 17 residues pruned to eliminate duplicates Z: 82 79.887 2.454 0.825 0.594 0.951 0.667 CB 1.907 82 residues pruned to eliminate duplicates Z: 10 25.762 2.357 0.496 0.887 0.889 0.667 CA 1.975 10 residues pruned to eliminate duplicates Z: 68 86.335 2.612 0.876 0.648 0.955 0.731 CB 1.963 68 residues pruned to eliminate duplicates Z: 61 55.960 2.204 0.865 0.639 0.900 0.700 CB 1.714 62 residues pruned to eliminate duplicates Z: 14 16.054 2.091 0.713 0.457 0.923 0.615 CB 1.407 14 residues pruned to eliminate duplicates Z: 162 101.072 2.472 0.740 0.572 0.932 0.696 CB 1.853 162 residues pruned to eliminate duplicates Z: 61 61.543 2.251 0.922 0.655 0.917 0.700 CB 1.735 61 residues pruned to eliminate duplicates Z: 62 62.619 2.506 0.819 0.551 0.918 0.623 CB 1.824 62 residues pruned to eliminate duplicates Z: 22 20.263 2.308 0.640 0.339 0.762 0.429 CA 1.829 22 residues pruned to eliminate duplicates Z: 13 36.247 2.197 1.045 0.921 0.917 0.750 CA 1.788 13 residues pruned to eliminate duplicates Z: 30 28.206 2.208 0.358 0.655 0.931 0.897 CB 1.624 30 residues pruned to eliminate duplicates Z: 12 23.333 2.262 0.905 0.545 0.909 0.727 CB 1.718 12 residues pruned to eliminate duplicates Z: 19 35.041 2.309 0.388 0.921 1.000 0.833 CB 1.814 19 residues pruned to eliminate duplicates Z: 19 16.047 1.596 0.557 0.843 1.000 0.500 CB 1.133 19 residues pruned to eliminate duplicates Z: 18 20.996 1.655 0.875 0.922 1.000 0.706 CB 1.154 18 residues pruned to eliminate duplicates Z: 63 76.264 2.529 0.936 0.587 0.935 0.661 CB 1.944 63 residues pruned to eliminate duplicates Z: 16 10.394 1.610 0.009 0.931 1.000 0.867 CB 1.154 16 residues pruned to eliminate duplicates Z: 13 11.245 1.798 0.239 0.869 1.000 0.833 CB 1.064 13 residues pruned to eliminate duplicates Z: 89 48.356 2.242 0.578 0.484 0.898 0.648 CB 1.649 89 residues pruned to eliminate duplicates Z: 17 18.428 1.644 0.755 0.911 1.000 0.562 CB 1.132 17 residues pruned to eliminate duplicates Z: 13 21.669 2.245 0.784 0.549 0.833 0.750 CB 1.788 Z: 10 24.433 2.056 0.711 0.852 1.000 0.778 CA 1.713 10 residues pruned to eliminate duplicates Z: 9 18.314 2.312 0.179 0.887 1.000 1.000 CB 1.711 9 residues pruned to eliminate duplicates Z: 50 40.392 2.293 0.493 0.530 0.918 0.612 CB 1.782 50 residues pruned to eliminate duplicates Z: 43 45.178 2.171 0.803 0.657 0.905 0.643 CB 1.701 43 residues pruned to eliminate duplicates Z: 17 19.594 2.046 0.787 0.478 0.938 0.688 CB 1.461 17 residues pruned to eliminate duplicates Z: 18 11.914 1.565 0.221 0.868 1.000 0.824 CB 1.105 18 residues pruned to eliminate duplicates Z: 74 73.353 2.456 0.842 0.610 0.945 0.685 CB 1.809 74 residues pruned to eliminate duplicates Z: 54 57.233 2.177 0.985 0.675 0.962 0.642 CB 1.610 54 residues pruned to eliminate duplicates Z: 11 17.835 1.728 0.730 0.926 1.000 1.000 CB 1.324 11 residues pruned to eliminate duplicates Z: 9 11.798 1.978 0.453 0.607 0.875 0.625 CA 1.499 9 residues pruned to eliminate duplicates Z: 71 59.732 2.383 0.810 0.514 0.943 0.529 CB 1.731 71 residues pruned to eliminate duplicates Z: 11 19.336 2.081 0.722 0.811 0.900 0.800 CB 1.446 11 residues pruned to eliminate duplicates Z: 82 82.853 2.538 0.944 0.568 0.914 0.605 CB 1.912 82 residues pruned to eliminate duplicates Z: 39 31.662 2.009 0.715 0.610 0.974 0.632 CB 1.380 39 residues pruned to eliminate duplicates Z: 57 55.397 2.450 0.705 0.518 0.946 0.714 CB 1.839 57 residues pruned to eliminate duplicates Z: 19 13.952 1.985 0.432 0.473 0.778 0.444 CB 1.529 19 residues pruned to eliminate duplicates Z: 21 32.672 2.382 0.775 0.594 1.000 0.650 CB 1.580 21 residues pruned to eliminate duplicates Z: 10 25.415 2.032 1.046 0.858 1.000 0.778 CB 1.501 10 residues pruned to eliminate duplicates Z: 36 50.320 2.333 0.692 0.750 0.943 0.686 CA 1.828 36 residues pruned to eliminate duplicates Z: 16 18.813 1.924 0.796 0.526 0.867 0.667 CB 1.582 16 residues pruned to eliminate duplicates Z: 11 32.191 2.214 0.944 0.805 1.000 0.500 C 1.813 11 residues pruned to eliminate duplicates Z: 11 19.142 2.194 0.712 0.604 0.900 0.500 CA 1.623 11 residues pruned to eliminate duplicates Z: 63 62.764 2.507 0.801 0.537 0.935 0.661 CB 1.819 63 residues pruned to eliminate duplicates Z: 37 28.638 2.103 0.641 0.489 0.917 0.611 CB 1.525 37 residues pruned to eliminate duplicates Z: 51 78.184 2.471 1.091 0.700 0.980 0.820 CB 1.819 51 residues pruned to eliminate duplicates Z: 6 2.625 1.265 0.434 0.851 0.800 0.800 C 0.599 6 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 17 13.013 1.840 0.638 0.517 0.875 0.625 CB 1.213 17 residues pruned to eliminate duplicates Z: 18 11.827 1.781 0.825 0.486 0.765 0.647 CB 1.171 18 residues pruned to eliminate duplicates Z: 17 13.762 1.836 0.807 0.542 0.812 0.625 CB 1.225 17 residues pruned to eliminate duplicates Z: 6 6.060 1.405 1.026 0.474 1.000 0.800 CA 0.977 6 residues pruned to eliminate duplicates Z: 16 16.870 1.953 0.755 0.585 0.933 0.600 CB 1.255 16 residues pruned to eliminate duplicates Z: 7 8.442 1.730 0.937 0.332 1.000 0.667 CB 1.236 7 residues pruned to eliminate duplicates Z: 65 85.373 2.668 0.873 0.652 0.906 0.719 CB 2.046 65 residues pruned to eliminate duplicates Z: 135 95.558 2.532 0.695 0.583 0.925 0.679 CB 1.919 135 residues pruned to eliminate duplicates Z: 103 99.628 2.606 0.797 0.628 0.931 0.696 CB 2.004 103 residues pruned to eliminate duplicates Z: 66 92.843 2.648 0.924 0.669 0.969 0.754 CB 1.995 66 residues pruned to eliminate duplicates Z: 76 85.334 2.621 0.859 0.623 0.947 0.747 CB 1.901 76 residues pruned to eliminate duplicates Z: 50 73.118 2.531 0.914 0.685 0.959 0.735 CB 1.897 50 residues pruned to eliminate duplicates Z: 81 85.343 2.622 0.836 0.578 0.950 0.613 CB 1.936 81 residues pruned to eliminate duplicates Z: 135 91.800 2.516 0.729 0.568 0.896 0.672 CB 1.907 135 residues pruned to eliminate duplicates Z: 34 70.497 2.585 0.934 0.763 0.970 0.758 CB 2.004 34 residues pruned to eliminate duplicates Z: 67 94.279 2.623 0.983 0.654 0.985 0.773 CB 1.962 67 residues pruned to eliminate duplicates Z: 113 101.270 2.596 0.840 0.606 0.920 0.705 CB 1.970 113 residues pruned to eliminate duplicates Z: 67 91.210 2.649 0.875 0.669 0.970 0.712 CB 1.994 67 residues pruned to eliminate duplicates Z: 128 107.406 2.588 0.786 0.607 0.929 0.709 CB 2.005 128 residues pruned to eliminate duplicates Z: 68 91.592 2.642 0.918 0.664 0.955 0.701 CB 1.985 68 residues pruned to eliminate duplicates Z: 86 85.925 2.588 0.883 0.598 0.906 0.718 CB 1.923 86 residues pruned to eliminate duplicates Z: 66 99.579 2.663 1.043 0.669 0.969 0.785 CB 2.004 66 residues pruned to eliminate duplicates Z: 48 77.658 2.548 1.042 0.720 0.957 0.723 CB 1.864 48 residues pruned to eliminate duplicates Z: 157 102.658 2.468 0.736 0.589 0.929 0.712 CB 1.895 157 residues pruned to eliminate duplicates Z: 71 92.913 2.618 0.985 0.653 0.957 0.657 CB 1.936 71 residues pruned to eliminate duplicates Z: 70 90.741 2.625 0.929 0.650 0.942 0.696 CB 1.991 70 residues pruned to eliminate duplicates Z: 48 78.466 2.556 1.049 0.720 0.957 0.745 CB 1.872 48 residues pruned to eliminate duplicates Z: 68 98.807 2.643 1.021 0.682 0.955 0.776 CB 2.000 68 residues pruned to eliminate duplicates Z: 65 88.309 2.620 0.968 0.641 0.938 0.703 CB 2.000 65 residues pruned to eliminate duplicates Z: 56 82.431 2.679 0.836 0.633 0.964 0.691 CB 2.069 56 residues pruned to eliminate duplicates Z: 144 101.994 2.513 0.794 0.584 0.916 0.671 CB 1.905 144 residues pruned to eliminate duplicates Z: 69 87.577 2.577 0.980 0.638 0.926 0.750 CB 1.974 69 residues pruned to eliminate duplicates Z: 139 94.157 2.508 0.723 0.569 0.913 0.681 CB 1.901 139 residues pruned to eliminate duplicates Z: 65 80.134 2.603 0.897 0.617 0.922 0.703 CB 1.970 65 residues pruned to eliminate duplicates Z: 43 82.652 2.579 1.022 0.726 0.976 0.714 CB 2.044 43 residues pruned to eliminate duplicates Z: 70 87.377 2.588 0.969 0.643 0.913 0.725 CB 1.977 70 residues pruned to eliminate duplicates Z: 148 98.900 2.468 0.780 0.573 0.918 0.639 CB 1.885 148 residues pruned to eliminate duplicates Z: 68 90.007 2.615 0.955 0.661 0.940 0.791 CB 1.971 68 residues pruned to eliminate duplicates Z: 36 43.854 2.479 0.707 0.514 0.857 0.600 CB 2.016 36 residues pruned to eliminate duplicates Z: 85 83.212 2.599 0.839 0.591 0.917 0.690 CB 1.899 85 residues pruned to eliminate duplicates Z: 70 92.037 2.622 1.009 0.644 0.928 0.710 CB 1.982 70 residues pruned to eliminate duplicates Z: 32 46.225 2.624 0.743 0.511 0.871 0.677 CB 2.063 32 residues pruned to eliminate duplicates Z: 76 85.595 2.582 0.910 0.609 0.920 0.693 CB 1.965 76 residues pruned to eliminate duplicates Z: 135 104.438 2.541 0.727 0.590 0.970 0.672 CB 1.944 135 residues pruned to eliminate duplicates Z: 65 95.232 2.661 0.974 0.642 0.953 0.703 CB 2.082 65 residues pruned to eliminate duplicates Z: 65 95.885 2.643 0.942 0.648 0.969 0.719 CB 2.100 65 residues pruned to eliminate duplicates Z: 86 85.020 2.605 0.817 0.584 0.929 0.682 CB 1.933 86 residues pruned to eliminate duplicates Z: 135 102.480 2.548 0.738 0.604 0.925 0.716 CB 1.958 135 residues pruned to eliminate duplicates Z: 70 89.195 2.616 0.893 0.630 0.957 0.710 CB 2.006 70 residues pruned to eliminate duplicates Z: 130 101.719 2.566 0.738 0.592 0.930 0.682 CB 1.976 130 residues pruned to eliminate duplicates Z: 135 103.025 2.539 0.734 0.595 0.955 0.746 CB 1.934 135 residues pruned to eliminate duplicates Z: 62 99.818 2.662 1.035 0.654 0.967 0.672 CB 2.113 68 residues pruned to eliminate duplicates Z: 12 34.412 2.655 0.661 0.704 0.909 0.636 CA 2.149 12 residues pruned to eliminate duplicates Z: 76 85.475 2.600 0.832 0.619 0.947 0.707 CB 1.956 76 residues pruned to eliminate duplicates Z: 70 95.503 2.637 0.945 0.662 0.957 0.710 CB 2.017 70 residues pruned to eliminate duplicates Z: 76 57.702 2.435 0.507 0.560 0.907 0.627 CB 1.889 76 residues pruned to eliminate duplicates Z: 85 90.801 2.607 0.921 0.601 0.940 0.679 CB 1.911 85 residues pruned to eliminate duplicates Z: 71 88.745 2.581 0.913 0.630 0.943 0.700 CB 2.016 71 residues pruned to eliminate duplicates Z: 69 91.118 2.628 0.977 0.641 0.941 0.735 CB 1.981 63 residues pruned to eliminate duplicates Z: 6 3.082 1.848 -0.208 0.433 0.800 0.600 CB 1.261 6 residues pruned to eliminate duplicates Z: 159 105.961 2.471 0.743 0.599 0.956 0.690 CB 1.864 159 residues pruned to eliminate duplicates Z: 21 20.095 2.353 0.447 0.414 0.900 0.500 CB 1.604 21 residues pruned to eliminate duplicates Z: 135 102.446 2.535 0.722 0.601 0.955 0.716 CB 1.927 135 residues pruned to eliminate duplicates Z: 83 91.116 2.628 0.831 0.604 0.963 0.683 CB 1.966 83 residues pruned to eliminate duplicates Z: 93 58.659 2.320 0.537 0.546 0.913 0.685 CB 1.797 93 residues pruned to eliminate duplicates Z: 23 20.739 2.415 0.417 0.386 0.864 0.682 CB 1.689 23 residues pruned to eliminate duplicates Z: 68 56.939 2.419 0.553 0.540 0.925 0.612 CB 1.924 68 residues pruned to eliminate duplicates Z: 76 53.113 2.353 0.570 0.531 0.907 0.627 CB 1.776 76 residues pruned to eliminate duplicates Z: 139 95.231 2.497 0.759 0.563 0.913 0.652 CB 1.900 139 residues pruned to eliminate duplicates Z: 76 54.243 2.407 0.520 0.525 0.933 0.613 CB 1.790 76 residues pruned to eliminate duplicates Z: 73 57.735 2.402 0.549 0.546 0.917 0.639 CB 1.907 73 residues pruned to eliminate duplicates Z: 83 52.783 2.347 0.497 0.488 0.915 0.659 CB 1.837 83 residues pruned to eliminate duplicates Z: 129 103.724 2.565 0.729 0.608 0.922 0.703 CB 2.024 129 residues pruned to eliminate duplicates Z: 96 67.771 2.458 0.546 0.529 0.926 0.600 CB 1.919 96 residues pruned to eliminate duplicates Z: 135 106.343 2.532 0.798 0.579 0.970 0.687 CB 1.927 135 residues pruned to eliminate duplicates Z: 66 57.419 2.438 0.567 0.548 0.938 0.677 CB 1.895 66 residues pruned to eliminate duplicates Z: 70 60.738 2.441 0.610 0.558 0.913 0.725 CB 1.925 70 residues pruned to eliminate duplicates Z: 133 104.621 2.560 0.747 0.603 0.947 0.682 CB 1.950 133 residues pruned to eliminate duplicates Z: 43 41.389 2.389 0.402 0.569 0.976 0.786 CB 1.828 43 residues pruned to eliminate duplicates Z: 129 106.389 2.563 0.762 0.608 0.953 0.711 CB 1.972 129 residues pruned to eliminate duplicates Z: 118 72.520 2.411 0.590 0.535 0.923 0.701 CB 1.830 118 residues pruned to eliminate duplicates Z: 110 93.888 2.585 0.749 0.577 0.936 0.697 CB 1.973 110 residues pruned to eliminate duplicates Z: 44 35.031 2.350 0.314 0.540 0.953 0.698 CB 1.746 44 residues pruned to eliminate duplicates Z: 136 104.723 2.533 0.779 0.606 0.941 0.704 CB 1.922 136 residues pruned to eliminate duplicates Z: 7 7.677 1.772 0.402 0.298 1.000 0.667 O 1.580 7 residues pruned to eliminate duplicates Z: 38 26.858 2.112 0.430 0.474 0.919 0.595 CB 1.633 38 residues pruned to eliminate duplicates Z: 37 36.410 2.270 0.635 0.539 0.917 0.667 CB 1.716 37 residues pruned to eliminate duplicates Z: 69 62.681 2.417 0.653 0.556 0.941 0.691 CB 1.914 69 residues pruned to eliminate duplicates Z: 66 60.370 2.410 0.717 0.553 0.923 0.708 CB 1.861 66 residues pruned to eliminate duplicates Z: 36 36.953 2.292 0.487 0.596 0.971 0.743 CB 1.722 36 residues pruned to eliminate duplicates Z: 32 35.295 2.295 0.524 0.610 0.935 0.742 CB 1.746 32 residues pruned to eliminate duplicates Z: 31 39.160 2.365 0.542 0.621 0.967 0.733 CB 1.810 31 residues pruned to eliminate duplicates Z: 134 107.560 2.540 0.817 0.603 0.955 0.722 CB 1.918 134 residues pruned to eliminate duplicates Z: 34 32.317 2.267 0.370 0.589 0.909 0.697 CB 1.830 34 residues pruned to eliminate duplicates Z: 34 34.478 2.261 0.534 0.574 0.909 0.727 CB 1.773 34 residues pruned to eliminate duplicates Z: 44 41.491 2.348 0.531 0.550 0.930 0.721 CB 1.802 44 residues pruned to eliminate duplicates Z: 134 109.729 2.554 0.811 0.616 0.947 0.722 CB 1.946 134 residues pruned to eliminate duplicates Z: 33 41.458 2.297 0.630 0.610 1.000 0.719 CB 1.764 33 residues pruned to eliminate duplicates Z: 33 35.263 2.295 0.465 0.603 0.969 0.688 CB 1.735 33 residues pruned to eliminate duplicates Z: 21 32.752 2.322 0.484 0.738 0.950 0.850 CB 1.808 21 residues pruned to eliminate duplicates Z: 120 112.805 2.605 0.862 0.616 0.941 0.689 CB 2.031 125 residues pruned to eliminate duplicates Z: 18 35.186 2.213 0.483 0.901 1.000 0.882 CB 1.856 18 residues pruned to eliminate duplicates Z: 33 38.939 2.287 0.591 0.586 1.000 0.688 CB 1.742 33 residues pruned to eliminate duplicates Z: 32 35.317 2.322 0.504 0.610 0.903 0.774 CB 1.812 32 residues pruned to eliminate duplicates Z: 23 34.505 2.205 0.688 0.709 0.955 0.773 CB 1.712 23 residues pruned to eliminate duplicates Z: 44 51.632 2.363 0.742 0.572 0.977 0.698 CB 1.826 44 residues pruned to eliminate duplicates Z: 32 39.892 2.304 0.717 0.605 0.935 0.677 CB 1.752 32 residues pruned to eliminate duplicates Z: 97 87.185 2.547 0.804 0.563 0.927 0.677 CB 1.963 97 residues pruned to eliminate duplicates Z: 30 42.354 2.362 0.757 0.645 0.931 0.655 CB 1.778 30 residues pruned to eliminate duplicates Z: 31 45.408 2.346 0.815 0.627 0.967 0.633 CB 1.787 31 residues pruned to eliminate duplicates Z: 33 43.151 2.270 0.816 0.604 0.969 0.656 CB 1.730 33 residues pruned to eliminate duplicates Z: 34 40.742 2.220 0.855 0.606 0.970 0.545 CB 1.605 34 residues pruned to eliminate duplicates Z: 54 47.446 2.229 0.739 0.555 0.981 0.623 CB 1.624 54 residues pruned to eliminate duplicates Z: 66 70.183 2.450 0.811 0.568 0.954 0.708 CB 1.926 66 residues pruned to eliminate duplicates Z: 22 36.978 2.270 0.866 0.706 0.905 0.810 CB 1.746 22 residues pruned to eliminate duplicates Z: 66 65.553 2.445 0.775 0.565 0.938 0.677 CB 1.875 66 residues pruned to eliminate duplicates Z: 32 35.160 2.142 0.790 0.580 0.903 0.613 CB 1.688 32 residues pruned to eliminate duplicates Z: 20 24.510 2.084 0.628 0.605 0.947 0.684 CA 1.583 20 residues pruned to eliminate duplicates Z: 11 14.361 2.112 0.507 0.430 1.000 0.700 CA 1.534 11 residues pruned to eliminate duplicates Z: 20 25.454 2.131 0.547 0.647 0.947 0.737 CA 1.630 20 residues pruned to eliminate duplicates Z: 54 50.320 2.316 0.901 0.523 0.906 0.604 CB 1.694 54 residues pruned to eliminate duplicates Z: 10 17.030 2.111 1.048 0.431 0.889 0.778 CA 1.587 10 residues pruned to eliminate duplicates Z: 26 29.865 2.228 0.917 0.557 0.840 0.640 CB 1.575 26 residues pruned to eliminate duplicates Z: 24 26.987 2.130 0.674 0.604 0.913 0.696 CB 1.565 24 residues pruned to eliminate duplicates Z: 20 30.352 2.253 0.824 0.629 0.895 0.579 CB 1.677 20 residues pruned to eliminate duplicates Z: 21 27.991 2.156 0.631 0.644 0.950 0.800 CA 1.638 21 residues pruned to eliminate duplicates Z: 22 36.231 2.175 0.860 0.711 1.000 0.667 CB 1.614 22 residues pruned to eliminate duplicates Z: 54 46.462 2.215 0.684 0.610 0.925 0.547 CB 1.667 54 residues pruned to eliminate duplicates Z: 25 24.510 2.140 0.766 0.540 0.875 0.667 CB 1.455 25 residues pruned to eliminate duplicates Z: 25 22.915 1.945 0.670 0.544 0.875 0.667 CA 1.578 25 residues pruned to eliminate duplicates Z: 29 30.489 2.246 0.907 0.529 0.821 0.571 CB 1.592 29 residues pruned to eliminate duplicates Z: 86 74.271 2.387 0.837 0.583 0.953 0.659 CB 1.780 86 residues pruned to eliminate duplicates Z: 20 32.441 2.211 0.872 0.670 0.895 0.737 CB 1.717 20 residues pruned to eliminate duplicates Z: 27 32.564 2.223 0.949 0.580 0.885 0.654 CB 1.543 27 residues pruned to eliminate duplicates Z: 95 71.046 2.364 0.737 0.568 0.957 0.638 CB 1.745 95 residues pruned to eliminate duplicates Z: 19 20.847 2.136 0.833 0.609 0.833 0.722 CB 1.358 19 residues pruned to eliminate duplicates Z: 26 35.463 2.239 0.991 0.592 0.920 0.840 CB 1.584 26 residues pruned to eliminate duplicates Z: 7 4.437 2.170 0.691 0.295 0.667 0.667 CB 0.932 7 residues pruned to eliminate duplicates Z: 26 28.295 2.235 0.788 0.566 0.880 0.760 CB 1.511 26 residues pruned to eliminate duplicates Z: 20 21.907 2.332 0.840 0.455 0.842 0.632 CB 1.457 20 residues pruned to eliminate duplicates Z: 61 52.711 2.323 0.819 0.578 0.900 0.717 CB 1.661 61 residues pruned to eliminate duplicates Z: 30 30.075 2.236 0.858 0.507 0.828 0.621 CB 1.614 30 residues pruned to eliminate duplicates Z: 38 38.913 2.297 0.755 0.572 0.946 0.676 CB 1.565 38 residues pruned to eliminate duplicates Z: 14 21.819 2.325 0.889 0.515 0.846 0.769 CB 1.605 14 residues pruned to eliminate duplicates Z: 19 25.215 2.354 0.827 0.513 0.889 0.667 CB 1.535 19 residues pruned to eliminate duplicates Z: 20 24.151 2.217 1.122 0.505 0.789 0.632 CB 1.485 20 residues pruned to eliminate duplicates Z: 15 20.263 2.253 0.752 0.610 0.857 0.643 CB 1.442 15 residues pruned to eliminate duplicates Z: 21 18.416 2.273 0.772 0.474 0.750 0.650 CB 1.399 21 residues pruned to eliminate duplicates Z: 14 23.747 2.364 0.821 0.612 0.846 0.692 CB 1.626 14 residues pruned to eliminate duplicates Z: 82 61.622 2.342 0.855 0.560 0.877 0.630 CB 1.697 83 residues pruned to eliminate duplicates Z: 6 3.595 1.550 0.635 0.409 0.600 0.400 CB 1.163 6 residues pruned to eliminate duplicates Z: 6 5.945 1.839 0.722 0.355 0.800 0.800 CA 1.227 6 residues pruned to eliminate duplicates Z: 83 53.174 2.173 0.746 0.599 0.939 0.622 CB 1.500 83 residues pruned to eliminate duplicates Z: 65 54.380 2.232 0.852 0.645 0.891 0.609 CB 1.613 65 residues pruned to eliminate duplicates Z: 38 40.570 2.090 0.846 0.773 0.919 0.730 CB 1.479 38 residues pruned to eliminate duplicates Z: 70 51.967 2.171 0.880 0.616 0.913 0.667 CB 1.505 70 residues pruned to eliminate duplicates Z: 45 42.481 2.138 0.748 0.693 0.909 0.705 CB 1.580 45 residues pruned to eliminate duplicates Z: 32 46.955 2.205 0.932 0.767 0.935 0.806 CB 1.671 32 residues pruned to eliminate duplicates Z: 44 61.296 2.390 0.755 0.727 0.953 0.721 CB 1.904 44 residues pruned to eliminate duplicates Z: 44 63.601 2.395 0.762 0.723 1.000 0.814 CB 1.879 44 residues pruned to eliminate duplicates Z: 51 55.618 2.274 0.714 0.703 0.960 0.720 CB 1.748 51 residues pruned to eliminate duplicates Z: 46 50.212 2.351 0.629 0.690 0.911 0.756 CB 1.802 46 residues pruned to eliminate duplicates Z: 45 56.600 2.332 0.785 0.686 0.955 0.727 CB 1.811 45 residues pruned to eliminate duplicates Z: 32 54.547 2.414 0.906 0.790 0.871 0.774 CA 1.894 32 residues pruned to eliminate duplicates Z: 30 63.471 2.495 0.970 0.807 0.931 0.724 CA 1.970 30 residues pruned to eliminate duplicates Z: 34 61.451 2.419 0.898 0.793 0.939 0.758 CA 1.918 34 residues pruned to eliminate duplicates Z: 45 56.526 2.362 0.818 0.704 0.909 0.705 CB 1.813 45 residues pruned to eliminate duplicates Z: 33 62.044 2.419 0.862 0.785 1.000 0.719 CA 1.895 33 residues pruned to eliminate duplicates Z: 32 62.418 2.412 0.892 0.786 1.000 0.742 CA 1.910 32 residues pruned to eliminate duplicates Z: 46 57.475 2.346 0.748 0.686 0.956 0.667 CA 1.843 46 residues pruned to eliminate duplicates Z: 131 87.656 2.496 0.721 0.571 0.908 0.692 CB 1.841 131 residues pruned to eliminate duplicates Z: 33 58.140 2.352 0.906 0.792 0.969 0.812 CA 1.832 33 residues pruned to eliminate duplicates Z: 36 65.287 2.399 0.961 0.793 1.000 0.800 CB 1.815 43 residues pruned to eliminate duplicates Z: 32 59.011 2.376 0.921 0.794 0.968 0.806 CA 1.855 32 residues pruned to eliminate duplicates Z: 93 85.267 2.512 0.840 0.592 0.957 0.707 CB 1.842 93 residues pruned to eliminate duplicates Z: 37 53.790 2.317 0.847 0.724 0.944 0.750 CA 1.813 37 residues pruned to eliminate duplicates Z: 38 51.949 2.301 0.886 0.751 0.919 0.784 CB 1.712 38 residues pruned to eliminate duplicates Z: 31 70.402 2.477 0.993 0.824 1.000 0.800 CA 1.967 31 residues pruned to eliminate duplicates Z: 37 63.847 2.369 0.991 0.771 0.972 0.833 CB 1.826 37 residues pruned to eliminate duplicates Z: 45 57.285 2.354 0.824 0.714 0.909 0.773 CB 1.822 45 residues pruned to eliminate duplicates Z: 32 60.690 2.382 0.946 0.795 0.968 0.742 CB 1.875 32 residues pruned to eliminate duplicates Z: 50 56.337 2.266 0.812 0.712 0.980 0.673 CB 1.652 50 residues pruned to eliminate duplicates Z: 74 79.466 2.557 0.893 0.620 0.932 0.616 CB 1.842 74 residues pruned to eliminate duplicates Z: 63 80.038 2.541 0.987 0.667 0.919 0.742 CB 1.877 63 residues pruned to eliminate duplicates Z: 32 67.353 2.430 1.027 0.801 0.968 0.774 CA 1.950 32 residues pruned to eliminate duplicates Z: 36 60.635 2.394 0.877 0.774 0.943 0.714 CB 1.899 36 residues pruned to eliminate duplicates Z: 50 53.626 2.235 0.773 0.708 0.959 0.714 CB 1.668 50 residues pruned to eliminate duplicates Z: 34 62.745 2.363 0.917 0.778 1.000 0.667 CA 1.888 34 residues pruned to eliminate duplicates Z: 36 54.088 2.322 1.001 0.684 0.943 0.629 CB 1.763 36 residues pruned to eliminate duplicates Z: 43 63.312 2.421 0.816 0.714 0.952 0.714 CB 1.922 43 residues pruned to eliminate duplicates Z: 150 89.371 2.441 0.701 0.579 0.940 0.658 CB 1.739 150 residues pruned to eliminate duplicates Z: 83 82.277 2.523 0.890 0.601 0.939 0.646 CB 1.843 83 residues pruned to eliminate duplicates Z: 140 90.901 2.489 0.756 0.554 0.921 0.633 CB 1.817 140 residues pruned to eliminate duplicates Z: 36 47.598 2.514 0.832 0.549 0.914 0.571 CB 1.821 36 residues pruned to eliminate duplicates Z: 40 56.839 2.381 0.894 0.621 0.949 0.667 CA 1.897 40 residues pruned to eliminate duplicates Z: 10 22.234 2.416 0.688 0.643 1.000 0.444 CA 1.590 10 residues pruned to eliminate duplicates Z: 73 60.967 2.468 0.807 0.494 0.889 0.514 CB 1.822 73 residues pruned to eliminate duplicates Z: 57 57.811 2.274 0.860 0.614 0.964 0.571 CB 1.700 57 residues pruned to eliminate duplicates Z: 92 81.409 2.498 0.874 0.580 0.923 0.692 CB 1.828 92 residues pruned to eliminate duplicates Z: 75 62.951 2.529 0.829 0.475 0.905 0.595 CB 1.793 75 residues pruned to eliminate duplicates Z: 77 65.883 2.532 0.804 0.513 0.908 0.618 CB 1.800 77 residues pruned to eliminate duplicates Z: 51 52.098 2.540 0.850 0.460 0.900 0.580 CB 1.815 51 residues pruned to eliminate duplicates Z: 85 71.214 2.555 0.739 0.511 0.929 0.679 CB 1.862 85 residues pruned to eliminate duplicates Z: 102 67.824 2.498 0.675 0.523 0.881 0.653 CB 1.789 102 residues pruned to eliminate duplicates Z: 101 77.995 2.491 0.788 0.539 0.930 0.630 CB 1.813 101 residues pruned to eliminate duplicates Z: 142 90.917 2.479 0.669 0.584 0.943 0.660 CB 1.810 142 residues pruned to eliminate duplicates Z: 99 77.354 2.561 0.680 0.542 0.939 0.643 CB 1.857 99 residues pruned to eliminate duplicates Z: 130 95.163 2.517 0.748 0.584 0.953 0.674 CB 1.842 130 residues pruned to eliminate duplicates Z: 46 47.452 2.557 0.850 0.480 0.822 0.578 CB 1.855 46 residues pruned to eliminate duplicates Z: 39 49.249 2.625 0.787 0.513 0.895 0.553 CB 1.879 39 residues pruned to eliminate duplicates Z: 98 74.423 2.521 0.720 0.536 0.918 0.598 CB 1.833 98 residues pruned to eliminate duplicates Z: 99 71.926 2.552 0.616 0.525 0.939 0.653 CB 1.831 99 residues pruned to eliminate duplicates Z: 66 82.705 2.500 0.994 0.653 0.908 0.600 CB 1.967 66 residues pruned to eliminate duplicates Z: 121 96.213 2.489 0.873 0.576 0.950 0.683 CB 1.844 121 residues pruned to eliminate duplicates Z: 76 63.831 2.550 0.784 0.487 0.920 0.587 CB 1.783 76 residues pruned to eliminate duplicates Z: 95 71.340 2.521 0.711 0.535 0.936 0.649 CB 1.761 95 residues pruned to eliminate duplicates Z: 39 52.127 2.599 0.880 0.508 0.868 0.658 CB 1.978 39 residues pruned to eliminate duplicates Z: 125 88.721 2.510 0.811 0.553 0.919 0.677 CB 1.810 125 residues pruned to eliminate duplicates Z: 94 79.962 2.453 0.882 0.563 0.925 0.602 CB 1.827 94 residues pruned to eliminate duplicates Z: 80 79.383 2.513 0.916 0.596 0.937 0.658 CB 1.808 80 residues pruned to eliminate duplicates Z: 50 48.984 2.477 0.747 0.494 0.918 0.612 CB 1.772 50 residues pruned to eliminate duplicates Z: 100 73.760 2.501 0.749 0.536 0.919 0.667 CB 1.780 100 residues pruned to eliminate duplicates Z: 99 77.452 2.544 0.714 0.549 0.939 0.694 CB 1.822 99 residues pruned to eliminate duplicates Z: 68 69.305 2.556 0.831 0.530 0.940 0.642 CB 1.869 68 residues pruned to eliminate duplicates Z: 117 90.427 2.524 0.807 0.578 0.931 0.681 CB 1.834 117 residues pruned to eliminate duplicates Z: 126 90.886 2.463 0.731 0.580 0.944 0.640 CB 1.870 126 residues pruned to eliminate duplicates Z: 88 72.930 2.563 0.693 0.527 0.954 0.690 CB 1.838 88 residues pruned to eliminate duplicates Z: 18 19.576 2.268 0.685 0.320 0.882 0.529 CB 1.717 18 residues pruned to eliminate duplicates Z: 16 20.382 2.445 0.783 0.286 0.933 0.533 CB 1.646 16 residues pruned to eliminate duplicates Z: 72 50.021 2.419 0.607 0.511 0.873 0.676 CB 1.729 72 residues pruned to eliminate duplicates Z: 68 67.668 2.547 0.847 0.526 0.910 0.612 CB 1.881 68 residues pruned to eliminate duplicates Z: 85 80.009 2.472 0.871 0.577 0.952 0.655 CB 1.840 85 residues pruned to eliminate duplicates Z: 98 78.854 2.554 0.710 0.548 0.938 0.649 CB 1.864 98 residues pruned to eliminate duplicates Z: 49 55.437 2.578 0.927 0.510 0.854 0.667 CB 1.867 49 residues pruned to eliminate duplicates Z: 84 86.598 2.501 1.018 0.616 0.928 0.663 CB 1.819 84 residues pruned to eliminate duplicates Z: 100 80.218 2.540 0.756 0.541 0.939 0.717 CB 1.848 100 residues pruned to eliminate duplicates Z: 59 52.511 2.403 0.811 0.504 0.897 0.672 CB 1.760 59 residues pruned to eliminate duplicates Z: 97 73.512 2.551 0.666 0.539 0.917 0.677 CB 1.854 97 residues pruned to eliminate duplicates Z: 55 45.951 2.424 0.476 0.564 0.926 0.722 CB 1.774 55 residues pruned to eliminate duplicates Z: 30 31.652 2.295 0.760 0.418 0.931 0.586 CB 1.703 30 residues pruned to eliminate duplicates Z: 68 64.863 2.503 0.814 0.504 0.925 0.582 CB 1.878 68 residues pruned to eliminate duplicates Z: 41 41.014 2.391 0.648 0.509 0.925 0.650 CB 1.763 41 residues pruned to eliminate duplicates Z: 33 34.583 2.397 0.569 0.469 0.938 0.594 CB 1.789 33 residues pruned to eliminate duplicates Z: 59 65.113 2.547 0.856 0.534 0.931 0.621 CB 1.878 59 residues pruned to eliminate duplicates Z: 131 89.550 2.453 0.735 0.599 0.946 0.669 CB 1.775 131 residues pruned to eliminate duplicates Z: 47 44.555 2.377 0.783 0.498 0.891 0.630 CB 1.743 47 residues pruned to eliminate duplicates Z: 130 91.801 2.484 0.790 0.586 0.922 0.690 CB 1.814 130 residues pruned to eliminate duplicates Z: 37 38.732 2.391 0.718 0.485 0.889 0.694 CB 1.795 37 residues pruned to eliminate duplicates Z: 48 49.552 2.459 0.741 0.493 0.936 0.723 CB 1.816 48 residues pruned to eliminate duplicates Z: 146 98.109 2.468 0.779 0.591 0.931 0.697 CB 1.826 146 residues pruned to eliminate duplicates Z: 97 66.735 2.413 0.735 0.548 0.906 0.698 CB 1.712 97 residues pruned to eliminate duplicates Z: 94 76.443 2.564 0.679 0.555 0.925 0.699 CB 1.888 94 residues pruned to eliminate duplicates Z: 60 66.125 2.540 0.934 0.522 0.932 0.661 CB 1.840 60 residues pruned to eliminate duplicates Z: 97 72.948 2.559 0.671 0.531 0.927 0.677 CB 1.822 97 residues pruned to eliminate duplicates Z: 72 62.390 2.479 0.674 0.544 0.944 0.718 CB 1.811 72 residues pruned to eliminate duplicates Z: 102 90.019 2.491 0.871 0.580 0.941 0.634 CB 1.892 102 residues pruned to eliminate duplicates Z: 55 45.724 2.401 0.574 0.532 0.926 0.685 CB 1.723 55 residues pruned to eliminate duplicates Z: 67 55.407 2.454 0.612 0.556 0.909 0.667 CB 1.795 67 residues pruned to eliminate duplicates Z: 50 44.390 2.436 0.769 0.481 0.857 0.673 CB 1.750 50 residues pruned to eliminate duplicates Z: 53 55.156 2.484 0.685 0.606 0.923 0.769 CB 1.790 53 residues pruned to eliminate duplicates Z: 37 39.176 2.489 0.559 0.541 0.889 0.778 CB 1.819 37 residues pruned to eliminate duplicates Z: 125 94.247 2.468 0.886 0.577 0.935 0.661 CB 1.803 125 residues pruned to eliminate duplicates Z: 37 35.948 2.450 0.458 0.563 0.944 0.722 CB 1.670 37 residues pruned to eliminate duplicates Z: 58 48.611 2.394 0.792 0.466 0.895 0.614 CB 1.737 58 residues pruned to eliminate duplicates Z: 33 40.761 2.467 0.674 0.605 0.906 0.750 CB 1.742 33 residues pruned to eliminate duplicates Z: 126 84.519 2.450 0.818 0.562 0.904 0.736 CB 1.767 126 residues pruned to eliminate duplicates Z: 97 84.080 2.546 0.835 0.556 0.938 0.656 CB 1.856 97 residues pruned to eliminate duplicates Z: 128 102.839 2.530 0.841 0.609 0.945 0.677 CB 1.870 128 residues pruned to eliminate duplicates Z: 88 76.973 2.562 0.740 0.537 0.954 0.736 CB 1.872 88 residues pruned to eliminate duplicates Z: 36 37.506 2.488 0.533 0.595 0.914 0.714 CB 1.660 36 residues pruned to eliminate duplicates Z: 23 32.600 2.505 0.423 0.674 0.909 0.773 CB 1.826 23 residues pruned to eliminate duplicates Z: 98 81.611 2.557 0.776 0.545 0.938 0.660 CB 1.861 98 residues pruned to eliminate duplicates Z: 37 42.624 2.469 0.690 0.549 0.917 0.694 CB 1.770 37 residues pruned to eliminate duplicates Z: 98 78.743 2.506 0.813 0.539 0.928 0.598 CB 1.825 98 residues pruned to eliminate duplicates Z: 72 59.985 2.458 0.801 0.513 0.887 0.662 CB 1.789 72 residues pruned to eliminate duplicates Z: 97 84.933 2.560 0.869 0.561 0.938 0.698 CB 1.821 97 residues pruned to eliminate duplicates Z: 140 103.151 2.493 0.902 0.571 0.928 0.647 CB 1.858 140 residues pruned to eliminate duplicates Z: 43 60.582 2.483 0.935 0.600 0.976 0.643 CB 1.812 43 residues pruned to eliminate duplicates Z: 55 61.088 2.406 0.858 0.601 0.944 0.630 CB 1.788 55 residues pruned to eliminate duplicates Z: 38 43.451 2.447 0.666 0.576 0.919 0.676 CB 1.772 38 residues pruned to eliminate duplicates Z: 38 39.025 2.396 0.826 0.549 0.892 0.568 CB 1.568 38 residues pruned to eliminate duplicates Z: 70 66.179 2.501 0.853 0.552 0.899 0.710 CB 1.819 70 residues pruned to eliminate duplicates Z: 23 43.190 2.471 0.717 0.681 0.955 0.545 CB 1.925 23 residues pruned to eliminate duplicates Z: 99 85.227 2.529 0.873 0.552 0.939 0.602 CB 1.839 99 residues pruned to eliminate duplicates Z: 35 44.134 2.445 0.800 0.564 0.912 0.559 CB 1.773 35 residues pruned to eliminate duplicates Z: 134 91.860 2.454 0.835 0.555 0.947 0.677 CB 1.769 134 residues pruned to eliminate duplicates Z: 142 106.149 2.505 0.873 0.599 0.943 0.652 CB 1.839 142 residues pruned to eliminate duplicates Z: 112 73.931 2.383 0.892 0.514 0.928 0.586 CB 1.653 112 residues pruned to eliminate duplicates Z: 65 68.946 2.445 0.919 0.587 0.953 0.703 CB 1.773 65 residues pruned to eliminate duplicates Z: 97 81.962 2.472 0.994 0.550 0.906 0.646 CB 1.784 102 residues pruned to eliminate duplicates Z: 8 4.681 1.636 0.617 0.384 0.857 0.429 CB 0.883 8 residues pruned to eliminate duplicates Z: 27 41.195 2.502 0.910 0.556 0.885 0.500 CB 1.809 28 residues pruned to eliminate duplicates Z: 6 5.166 1.426 0.795 0.761 0.800 0.600 CB 0.895 6 residues pruned to eliminate duplicates Z: 120 94.394 2.525 0.902 0.575 0.933 0.664 CB 1.798 120 residues pruned to eliminate duplicates Z: 27 32.223 2.416 0.669 0.544 0.885 0.577 CB 1.697 27 residues pruned to eliminate duplicates Z: 42 47.313 2.391 0.926 0.573 0.902 0.634 CB 1.657 26 residues pruned to eliminate duplicates Z: 12 36.131 2.382 0.910 0.894 0.909 0.364 CA 1.889 12 residues pruned to eliminate duplicates Z: 128 95.930 2.501 0.923 0.545 0.937 0.630 CB 1.808 128 residues pruned to eliminate duplicates Z: 45 56.261 2.402 0.871 0.634 0.909 0.523 CB 1.831 45 residues pruned to eliminate duplicates Z: 125 88.442 2.508 0.853 0.548 0.927 0.637 CB 1.758 125 residues pruned to eliminate duplicates Z: 124 92.281 2.496 0.934 0.542 0.919 0.634 CB 1.801 124 residues pruned to eliminate duplicates Z: 27 35.418 2.449 0.792 0.565 0.885 0.615 CB 1.681 27 residues pruned to eliminate duplicates Z: 52 57.475 2.419 0.909 0.585 0.922 0.706 CB 1.743 52 residues pruned to eliminate duplicates Z: 50 53.312 2.457 0.777 0.619 0.898 0.612 CB 1.736 50 residues pruned to eliminate duplicates Z: 127 93.438 2.521 0.902 0.560 0.913 0.651 CB 1.795 127 residues pruned to eliminate duplicates Z: 29 35.150 2.333 0.898 0.578 0.893 0.643 CB 1.558 29 residues pruned to eliminate duplicates Z: 14 7.846 1.848 0.883 0.227 0.692 0.385 CB 1.242 Z: 6 5.715 1.837 1.015 0.322 0.600 0.400 C 1.399 6 residues pruned to eliminate duplicates Z: 74 59.272 2.435 0.859 0.536 0.890 0.616 CB 1.661 87 residues pruned to eliminate duplicates Z: 6 4.479 1.892 0.302 0.317 0.800 0.600 CB 1.243 Z: 6 3.732 1.681 0.375 0.271 0.800 0.600 CA 1.171 6 residues pruned to eliminate duplicates Z: 17 20.058 2.261 0.707 0.569 0.812 0.688 CB 1.496 23 residues pruned to eliminate duplicates Z: 16 25.393 2.313 0.870 0.573 0.867 0.667 CB 1.630 16 residues pruned to eliminate duplicates Z: 17 25.424 2.232 0.973 0.586 0.938 0.750 CB 1.417 19 residues pruned to eliminate duplicates 646 residues left after pruning, divided into chains as follows: A: 70 B: 61 C: 12 D: 16 E: 168 F: 319 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 39.00 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 1 used as input for final density modification = 0.300, Contrast = 0.516, Connect. = 0.752 for dens.mod. cycle 1 = 0.302, Contrast = 0.589, Connect. = 0.779 for dens.mod. cycle 2 = 0.302, Contrast = 0.720, Connect. = 0.813 for dens.mod. cycle 3 = 0.302, Contrast = 0.731, Connect. = 0.815 for dens.mod. cycle 4 = 0.302, Contrast = 0.748, Connect. = 0.818 for dens.mod. cycle 5 = 0.302, Contrast = 0.756, Connect. = 0.819 for dens.mod. cycle 6 = 0.302, Contrast = 0.765, Connect. = 0.821 for dens.mod. cycle 7 = 0.302, Contrast = 0.770, Connect. = 0.822 for dens.mod. cycle 8 = 0.302, Contrast = 0.775, Connect. = 0.823 for dens.mod. cycle 9 = 0.302, Contrast = 0.779, Connect. = 0.823 for dens.mod. cycle 10 TimeTaking 328.18