null ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 23:08:57 on 14 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: ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.phi -a -n -t20 Cell and symmetry only from ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.ins Phases from ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.phi Native data from ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.hkl Listing output to ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.lst Phases output to ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.phs Poly-Ala trace output to ./1vp4-1.8-parrot-noncs/1vp4-1.8-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 65 Allowed origin shift code: 8 94163 Reflections read from file ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.phi 94163 Reflections read from file ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.hkl 94163 Unique data, highest resolution = 1.820 Angstroms Anisotropic scaling: intensities multiplied by 0.000042h^2 +0.000042k^2 -0.000313l^2 +0.000000kl +0.000000hl +0.000042hk 32 Reflections with d > 2.020 and 0 in range 2.020 > d > 1.820 added Density sharpening factor set to 1.02 Fourier grid = 512 x 512 x 18 0.000 <= z <= 0.167 92 Point spherical net set up with radius 2.42A 32 Extra Fourier layers will be generated <|E^2-1|> = 0.645 ** -f missing ?? ** = 0.264, Contrast = 0.084, Connect. = 0.605 for dens.mod. cycle 1 = 0.269, Contrast = 0.215, Connect. = 0.609 for dens.mod. cycle 2 = 0.279, Contrast = 0.386, Connect. = 0.700 for dens.mod. cycle 3 = 0.292, Contrast = 0.517, Connect. = 0.749 for dens.mod. cycle 4 = 0.300, Contrast = 0.609, Connect. = 0.776 for dens.mod. cycle 5 = 0.300, Contrast = 0.671, Connect. = 0.792 for dens.mod. cycle 6 = 0.300, Contrast = 0.716, Connect. = 0.804 for dens.mod. cycle 7 = 0.300, Contrast = 0.746, Connect. = 0.811 for dens.mod. cycle 8 = 0.300, Contrast = 0.766, Connect. = 0.816 for dens.mod. cycle 9 = 0.300, Contrast = 0.780, Connect. = 0.820 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 5091 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 1050 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 17 30.121 2.215 0.884 0.893 1.000 0.750 CB 1.295 B: 14 39.635 2.281 1.200 0.942 1.000 0.769 CB 1.519 C: 29 39.440 2.038 0.678 0.906 0.929 0.857 CB 1.669 D: 28 48.073 2.084 0.927 0.930 1.000 0.741 CB 1.612 E: 28 48.019 2.101 1.026 0.913 0.963 0.815 CB 1.595 28 residues pruned to eliminate duplicates F: 12 13.772 2.165 0.611 0.418 0.818 0.727 CA 1.586 G: 26 38.049 2.040 0.934 0.922 1.000 0.800 CB 1.356 H: 27 44.023 2.168 0.953 0.911 0.885 0.808 CA 1.634 27 residues pruned to eliminate duplicates I: 17 23.959 2.219 0.829 0.863 0.875 0.750 CB 1.238 17 residues pruned to eliminate duplicates J: 16 39.218 2.241 1.051 0.917 0.933 0.867 CA 1.666 17 residues pruned to eliminate duplicates K: 14 23.205 1.992 0.593 0.884 1.000 0.692 CB 1.465 L: 16 26.687 2.009 0.896 0.897 0.933 0.867 CB 1.387 M: 16 35.191 2.288 0.801 0.917 1.000 0.933 CB 1.556 16 residues pruned to eliminate duplicates N: 23 41.287 2.207 0.941 0.921 1.000 0.864 CB 1.446 23 residues pruned to eliminate duplicates O: 15 37.071 2.313 0.909 0.902 1.000 0.857 CB 1.601 15 residues pruned to eliminate duplicates P: 15 35.003 2.342 0.978 0.915 0.929 0.857 CB 1.536 15 residues pruned to eliminate duplicates Q: 15 41.871 2.370 1.160 0.921 1.000 0.786 CB 1.538 16 residues pruned to eliminate duplicates R: 16 36.544 2.138 1.104 0.909 0.933 0.867 CA 1.595 S: 30 37.473 2.116 0.650 0.902 0.931 0.793 CA 1.527 30 residues pruned to eliminate duplicates T: 26 34.281 2.013 0.778 0.931 1.000 0.840 CB 1.338 26 residues pruned to eliminate duplicates U: 28 39.331 2.044 0.635 0.917 0.963 0.852 CB 1.660 28 residues pruned to eliminate duplicates V: 9 15.004 1.975 0.733 0.605 1.000 0.625 CB 1.403 W: 29 46.296 2.173 0.927 0.924 0.964 0.679 CB 1.522 29 residues pruned to eliminate duplicates X: 30 43.115 2.061 0.672 0.896 0.966 0.759 CA 1.724 29 residues pruned to eliminate duplicates Y: 16 28.119 2.171 1.030 0.915 0.867 0.600 CB 1.343 16 residues pruned to eliminate duplicates Z: 29 46.317 2.156 0.808 0.917 1.000 0.821 CA 1.585 29 residues pruned to eliminate duplicates Z: 15 30.874 2.056 1.014 0.878 0.929 0.857 CA 1.557 Z: 43 30.618 2.113 0.790 0.489 0.857 0.667 CB 1.473 16 residues pruned to eliminate duplicates Z: 10 12.492 2.164 0.543 0.442 0.778 0.667 CB 1.703 10 residues pruned to eliminate duplicates Z: 16 29.249 2.100 0.849 0.915 1.000 0.800 CB 1.375 Z: 18 38.066 2.040 1.078 0.925 1.000 0.706 CA 1.528 14 residues pruned to eliminate duplicates Z: 24 31.341 2.111 0.546 0.924 1.000 0.870 CB 1.407 24 residues pruned to eliminate duplicates Z: 15 32.997 2.076 1.293 0.829 0.929 0.714 CA 1.502 14 residues pruned to eliminate duplicates Z: 23 43.106 2.112 1.179 0.864 1.000 0.773 CB 1.464 Z: 28 37.007 2.128 0.722 0.879 0.926 0.852 CA 1.522 28 residues pruned to eliminate duplicates Z: 18 35.077 1.989 1.313 0.857 0.941 0.765 CA 1.448 18 residues pruned to eliminate duplicates Z: 18 33.207 2.134 0.761 0.900 1.000 0.941 CB 1.531 15 residues pruned to eliminate duplicates Z: 23 38.576 2.195 1.072 0.928 0.955 0.818 CB 1.327 23 residues pruned to eliminate duplicates Z: 24 24.863 1.878 0.674 0.886 0.957 0.826 CB 1.244 Z: 15 28.588 2.142 0.745 0.920 1.000 1.000 CB 1.439 Z: 29 40.565 2.076 0.618 0.891 1.000 0.786 CB 1.640 30 residues pruned to eliminate duplicates Z: 16 24.981 2.053 0.673 0.882 1.000 0.800 CB 1.358 16 residues pruned to eliminate duplicates Z: 14 37.393 2.424 0.897 0.918 1.000 0.923 CB 1.590 18 residues pruned to eliminate duplicates Z: 13 20.028 2.107 0.628 0.861 0.833 0.750 CB 1.486 11 residues pruned to eliminate duplicates Z: 88 67.824 2.144 0.910 0.725 0.943 0.690 CB 1.538 61 residues pruned to eliminate duplicates Z: 16 27.886 2.126 0.725 0.911 0.933 0.667 CB 1.491 16 residues pruned to eliminate duplicates Z: 16 20.650 2.042 0.344 0.913 1.000 0.933 CB 1.375 16 residues pruned to eliminate duplicates Z: 16 32.299 2.160 0.831 0.911 1.000 0.867 CB 1.494 17 residues pruned to eliminate duplicates Z: 24 41.165 2.127 1.119 0.921 1.000 0.565 CB 1.340 26 residues pruned to eliminate duplicates Z: 29 40.138 2.146 0.793 0.909 0.964 0.750 CB 1.452 29 residues pruned to eliminate duplicates Z: 28 18.300 1.923 0.776 0.575 0.815 0.556 CB 1.178 28 residues pruned to eliminate duplicates Z: 17 23.522 1.994 0.715 0.886 0.938 0.812 CB 1.323 17 residues pruned to eliminate duplicates Z: 17 34.070 2.114 1.048 0.933 0.938 0.875 CB 1.465 17 residues pruned to eliminate duplicates Z: 27 23.267 2.101 0.690 0.433 0.923 0.615 CB 1.493 27 residues pruned to eliminate duplicates Z: 17 37.681 2.115 1.222 0.864 0.938 0.750 CB 1.568 17 residues pruned to eliminate duplicates Z: 77 60.605 2.179 0.860 0.702 0.908 0.697 CB 1.571 77 residues pruned to eliminate duplicates Z: 15 39.913 2.284 1.141 0.920 0.929 0.643 CB 1.655 14 residues pruned to eliminate duplicates Z: 25 42.297 2.116 1.047 0.890 1.000 0.625 CB 1.434 24 residues pruned to eliminate duplicates Z: 7 5.520 1.593 0.851 0.219 0.833 0.167 CA 1.275 7 residues pruned to eliminate duplicates Z: 13 21.969 1.937 0.839 0.870 1.000 0.750 CB 1.299 Z: 19 35.856 2.113 1.131 0.889 1.000 0.556 CB 1.351 19 residues pruned to eliminate duplicates Z: 17 27.458 2.157 0.964 0.853 0.938 0.562 CB 1.278 17 residues pruned to eliminate duplicates Z: 8 10.796 2.161 0.555 0.862 0.857 0.714 CB 1.040 8 residues pruned to eliminate duplicates Z: 17 34.590 2.073 1.133 0.889 0.938 0.875 CA 1.502 17 residues pruned to eliminate duplicates Z: 12 18.834 1.948 0.613 0.877 1.000 0.545 CA 1.313 Z: 17 26.662 1.975 0.676 0.890 1.000 0.875 CB 1.449 15 residues pruned to eliminate duplicates Z: 14 19.847 2.052 0.785 0.873 1.000 0.846 CB 1.095 Z: 16 25.426 2.032 0.874 0.904 1.000 0.933 CB 1.228 17 residues pruned to eliminate duplicates Z: 15 32.268 2.113 0.933 0.901 0.929 0.857 CA 1.623 15 residues pruned to eliminate duplicates Z: 12 19.572 1.976 1.061 0.536 0.909 0.545 CB 1.539 Z: 17 35.085 2.102 1.108 0.930 1.000 0.875 CB 1.385 17 residues pruned to eliminate duplicates Z: 30 36.549 2.030 0.571 0.892 0.931 0.828 CB 1.643 30 residues pruned to eliminate duplicates Z: 17 17.831 1.877 0.385 0.884 1.000 0.875 CB 1.239 17 residues pruned to eliminate duplicates Z: 82 61.198 2.159 0.838 0.683 0.951 0.642 CB 1.524 82 residues pruned to eliminate duplicates Z: 27 43.067 2.095 0.731 0.944 0.962 0.923 CB 1.677 27 residues pruned to eliminate duplicates Z: 13 38.375 2.367 1.149 0.922 0.917 0.833 CB 1.671 13 residues pruned to eliminate duplicates Z: 17 31.885 2.110 0.857 0.934 1.000 0.938 CA 1.419 17 residues pruned to eliminate duplicates Z: 14 20.327 2.128 0.784 0.844 0.846 0.692 CA 1.306 14 residues pruned to eliminate duplicates Z: 18 27.019 2.013 0.769 0.887 0.882 0.824 CA 1.504 18 residues pruned to eliminate duplicates Z: 16 33.444 2.146 0.822 0.933 1.000 0.933 CA 1.541 16 residues pruned to eliminate duplicates Z: 14 20.732 2.017 0.869 0.885 1.000 0.923 CB 1.102 14 residues pruned to eliminate duplicates Z: 17 37.387 2.191 1.122 0.871 0.938 0.875 CB 1.564 17 residues pruned to eliminate duplicates Z: 27 44.091 2.058 0.784 0.930 1.000 0.885 CB 1.646 27 residues pruned to eliminate duplicates Z: 18 36.228 2.136 0.870 0.890 1.000 0.765 CA 1.583 18 residues pruned to eliminate duplicates Z: 15 29.602 2.090 0.830 0.902 1.000 0.929 CB 1.475 15 residues pruned to eliminate duplicates Z: 15 38.040 2.117 1.198 0.912 1.000 0.929 CB 1.548 15 residues pruned to eliminate duplicates Z: 15 31.880 2.236 1.202 0.925 0.929 0.571 CB 1.308 15 residues pruned to eliminate duplicates Z: 26 35.528 2.023 0.973 0.897 0.960 0.600 CB 1.328 26 residues pruned to eliminate duplicates Z: 16 33.784 2.166 0.836 0.907 1.000 0.867 CB 1.560 16 residues pruned to eliminate duplicates Z: 16 29.734 1.982 1.112 0.912 1.000 0.467 CB 1.299 14 residues pruned to eliminate duplicates Z: 28 44.430 2.118 0.807 0.910 1.000 0.778 CA 1.584 28 residues pruned to eliminate duplicates Z: 14 25.977 2.144 0.976 0.857 0.923 0.692 CA 1.358 14 residues pruned to eliminate duplicates Z: 31 38.904 2.005 0.590 0.897 0.967 0.833 CB 1.650 31 residues pruned to eliminate duplicates Z: 10 21.966 2.114 0.744 0.907 1.000 0.778 CB 1.411 12 residues pruned to eliminate duplicates Z: 30 44.763 2.099 0.982 0.913 0.931 0.655 CB 1.518 28 residues pruned to eliminate duplicates Z: 48 34.557 2.180 0.944 0.540 0.872 0.617 CB 1.311 27 residues pruned to eliminate duplicates Z: 21 36.503 2.148 0.941 0.868 1.000 0.600 CB 1.431 Z: 18 32.833 2.140 0.756 0.896 1.000 0.706 CA 1.518 18 residues pruned to eliminate duplicates Z: 6 4.447 1.917 0.126 0.805 0.600 0.400 CB 1.176 6 residues pruned to eliminate duplicates Z: 23 34.843 2.177 0.847 0.945 0.955 0.773 CB 1.340 23 residues pruned to eliminate duplicates Z: 23 28.907 2.182 0.584 0.840 0.909 0.636 CB 1.464 21 residues pruned to eliminate duplicates Z: 23 35.253 2.190 0.650 0.946 1.000 1.000 CB 1.438 23 residues pruned to eliminate duplicates Z: 26 37.988 2.142 0.714 0.916 0.920 0.760 CA 1.588 26 residues pruned to eliminate duplicates Z: 14 30.842 2.167 1.081 0.927 1.000 0.846 CB 1.329 14 residues pruned to eliminate duplicates Z: 16 24.725 2.049 0.660 0.883 1.000 0.867 CB 1.358 17 residues pruned to eliminate duplicates Z: 6 12.156 2.201 0.600 0.779 0.800 0.800 CA 1.509 Z: 11 14.475 1.764 0.479 0.767 1.000 0.900 CB 1.384 11 residues pruned to eliminate duplicates Z: 24 40.016 2.138 0.930 0.931 1.000 0.870 CB 1.413 24 residues pruned to eliminate duplicates Z: 36 45.540 2.288 0.811 0.671 1.000 0.543 CB 1.586 29 residues pruned to eliminate duplicates Z: 30 26.598 1.959 0.752 0.718 0.966 0.724 CB 1.223 Z: 11 25.216 2.121 0.994 0.877 1.000 0.600 CB 1.369 10 residues pruned to eliminate duplicates Z: 6 8.669 1.815 0.604 0.781 0.800 0.600 CA 1.300 6 residues pruned to eliminate duplicates Z: 19 12.795 1.824 0.562 0.519 0.889 0.667 CB 1.168 Z: 24 41.324 2.130 1.207 0.910 1.000 0.478 CB 1.299 24 residues pruned to eliminate duplicates Z: 11 20.933 2.175 0.827 0.874 1.000 0.900 CB 1.212 11 residues pruned to eliminate duplicates Z: 23 34.592 2.090 1.008 0.817 0.909 0.591 CA 1.467 23 residues pruned to eliminate duplicates Z: 16 15.886 1.793 0.619 0.582 0.867 0.667 CB 1.506 13 residues pruned to eliminate duplicates Z: 15 32.022 2.123 0.909 0.883 1.000 0.929 CA 1.527 15 residues pruned to eliminate duplicates Z: 26 42.617 2.037 1.259 0.918 1.000 0.680 CB 1.306 26 residues pruned to eliminate duplicates Z: 12 15.190 1.771 0.606 0.882 1.000 0.727 CB 1.165 12 residues pruned to eliminate duplicates Z: 39 33.982 2.177 0.894 0.651 0.868 0.711 CB 1.337 39 residues pruned to eliminate duplicates Z: 14 35.133 2.129 1.009 0.905 1.000 1.000 CB 1.622 15 residues pruned to eliminate duplicates Z: 26 33.192 2.029 0.558 0.920 0.880 0.880 CA 1.680 26 residues pruned to eliminate duplicates Z: 12 25.703 2.055 0.964 0.881 1.000 0.727 CA 1.390 12 residues pruned to eliminate duplicates Z: 23 30.500 2.187 0.657 0.846 0.909 0.591 CB 1.466 23 residues pruned to eliminate duplicates Z: 13 8.604 1.618 0.564 0.744 0.833 0.417 CB 0.947 13 residues pruned to eliminate duplicates Z: 8 11.320 1.585 0.639 0.761 1.000 1.000 CA 1.306 Z: 15 24.647 1.999 1.244 0.838 0.929 0.571 CB 1.182 14 residues pruned to eliminate duplicates Z: 7 10.535 1.969 0.492 0.644 0.833 0.667 CA 1.535 7 residues pruned to eliminate duplicates Z: 29 42.583 2.066 0.583 0.924 1.000 0.929 CA 1.728 31 residues pruned to eliminate duplicates Z: 7 12.088 1.735 0.475 0.875 1.000 1.000 CA 1.403 7 residues pruned to eliminate duplicates Z: 23 31.210 2.156 0.535 0.930 1.000 0.909 CB 1.406 23 residues pruned to eliminate duplicates Z: 17 30.651 2.078 0.931 0.874 1.000 0.750 CB 1.389 17 residues pruned to eliminate duplicates Z: 23 20.920 1.882 0.554 0.890 0.955 0.773 CB 1.150 23 residues pruned to eliminate duplicates Z: 17 30.913 2.165 0.778 0.943 1.000 0.812 CB 1.390 17 residues pruned to eliminate duplicates Z: 30 35.816 2.145 0.552 0.905 0.931 0.828 CB 1.527 30 residues pruned to eliminate duplicates Z: 23 39.052 2.185 0.893 0.888 0.909 0.636 CB 1.595 23 residues pruned to eliminate duplicates Z: 24 15.114 2.099 0.427 0.394 0.826 0.565 CB 1.424 24 residues pruned to eliminate duplicates Z: 21 29.568 2.130 0.786 0.838 0.950 0.600 CB 1.367 21 residues pruned to eliminate duplicates Z: 38 36.803 2.091 1.004 0.602 0.973 0.622 CB 1.347 15 residues pruned to eliminate duplicates Z: 29 48.551 2.098 0.798 0.937 1.000 0.857 CB 1.692 29 residues pruned to eliminate duplicates Z: 76 48.300 2.155 0.750 0.615 0.947 0.693 CB 1.401 66 residues pruned to eliminate duplicates Z: 14 36.823 2.298 1.018 0.920 1.000 0.692 CB 1.551 14 residues pruned to eliminate duplicates Z: 53 50.537 2.145 1.044 0.654 0.923 0.577 CB 1.500 39 residues pruned to eliminate duplicates Z: 71 63.755 2.276 0.965 0.735 0.900 0.629 CB 1.533 73 residues pruned to eliminate duplicates Z: 42 30.923 2.018 0.975 0.532 0.951 0.659 CB 1.234 25 residues pruned to eliminate duplicates Z: 29 43.312 2.090 0.652 0.930 1.000 0.857 CB 1.657 29 residues pruned to eliminate duplicates Z: 16 33.021 2.162 0.886 0.924 1.000 0.667 CB 1.468 16 residues pruned to eliminate duplicates Z: 13 13.019 1.997 0.614 0.760 0.667 0.583 CB 1.389 Z: 6 5.839 1.802 0.301 0.797 0.800 0.600 CB 1.074 6 residues pruned to eliminate duplicates Z: 8 8.236 1.562 0.633 0.758 0.857 0.429 CA 1.132 8 residues pruned to eliminate duplicates Z: 15 32.677 2.103 1.272 0.918 1.000 0.500 CB 1.290 15 residues pruned to eliminate duplicates Z: 17 23.410 1.989 0.639 0.873 1.000 0.750 CB 1.308 17 residues pruned to eliminate duplicates Z: 14 20.254 1.988 0.784 0.867 0.923 0.846 CB 1.256 13 residues pruned to eliminate duplicates Z: 22 22.407 1.857 0.566 0.924 1.000 1.000 CB 1.181 24 residues pruned to eliminate duplicates Z: 28 38.666 2.098 0.689 0.924 0.926 0.815 CA 1.593 28 residues pruned to eliminate duplicates Z: 21 26.407 2.023 0.763 0.849 0.900 0.800 CA 1.363 18 residues pruned to eliminate duplicates Z: 11 19.973 2.069 0.876 0.886 0.900 0.500 CB 1.304 11 residues pruned to eliminate duplicates Z: 19 31.802 2.046 0.831 0.935 1.000 0.944 CB 1.395 19 residues pruned to eliminate duplicates Z: 36 23.579 1.927 0.677 0.640 0.971 0.657 CB 1.114 30 residues pruned to eliminate duplicates Z: 40 22.574 1.973 0.777 0.497 0.923 0.590 CB 1.120 17 residues pruned to eliminate duplicates Z: 17 30.585 2.117 0.785 0.915 0.938 0.812 CB 1.526 17 residues pruned to eliminate duplicates Z: 34 24.425 2.055 0.799 0.543 0.818 0.606 CB 1.348 17 residues pruned to eliminate duplicates Z: 16 15.263 1.704 0.824 0.771 0.933 0.667 CB 1.069 Z: 18 24.546 2.099 0.682 0.866 0.941 0.824 CB 1.312 18 residues pruned to eliminate duplicates Z: 17 22.321 2.006 0.707 0.861 0.938 0.688 CB 1.278 17 residues pruned to eliminate duplicates Z: 23 33.317 2.131 0.857 0.820 0.955 0.864 CA 1.424 23 residues pruned to eliminate duplicates Z: 14 18.952 2.070 0.517 0.893 1.000 0.538 CB 1.202 14 residues pruned to eliminate duplicates Z: 8 11.236 1.994 0.901 0.537 0.857 0.571 CA 1.260 8 residues pruned to eliminate duplicates Z: 14 30.911 2.156 1.228 0.926 0.923 0.769 CB 1.355 14 residues pruned to eliminate duplicates Z: 24 34.860 2.059 0.972 0.812 0.957 0.783 CA 1.427 24 residues pruned to eliminate duplicates Z: 8 10.079 2.042 0.495 0.743 0.714 0.571 CA 1.406 8 residues pruned to eliminate duplicates Z: 29 39.413 2.073 0.905 0.867 0.893 0.679 CB 1.545 29 residues pruned to eliminate duplicates Z: 16 29.483 2.035 1.078 0.881 0.933 0.733 CB 1.397 16 residues pruned to eliminate duplicates Z: 12 11.917 1.855 0.581 0.656 0.909 0.727 CB 1.165 8 residues pruned to eliminate duplicates Z: 20 20.327 1.838 0.736 0.796 0.842 0.632 CB 1.340 20 residues pruned to eliminate duplicates Z: 16 31.236 2.066 1.409 0.878 0.933 0.533 CB 1.260 16 residues pruned to eliminate duplicates Z: 6 9.033 2.136 0.332 0.770 0.800 0.800 CA 1.398 6 residues pruned to eliminate duplicates Z: 30 36.184 2.034 0.468 0.916 0.966 0.931 CB 1.645 30 residues pruned to eliminate duplicates Z: 42 39.427 2.158 0.859 0.671 0.951 0.829 CB 1.379 43 residues pruned to eliminate duplicates Z: 15 29.472 2.237 0.654 0.899 1.000 0.786 CB 1.522 15 residues pruned to eliminate duplicates Z: 15 25.072 2.107 0.781 0.880 0.929 0.643 CB 1.394 15 residues pruned to eliminate duplicates Z: 23 13.095 1.818 0.632 0.548 0.864 0.364 CB 1.039 23 residues pruned to eliminate duplicates Z: 29 38.640 2.059 0.580 0.904 0.964 0.893 CB 1.658 29 residues pruned to eliminate duplicates Z: 40 26.976 1.933 0.839 0.596 0.897 0.564 CB 1.234 27 residues pruned to eliminate duplicates Z: 6 7.664 1.756 0.419 0.833 1.000 0.600 CB 1.032 6 residues pruned to eliminate duplicates Z: 16 19.681 2.006 0.430 0.888 0.933 0.800 CB 1.368 16 residues pruned to eliminate duplicates Z: 40 33.264 2.069 0.911 0.578 0.923 0.462 CB 1.354 42 residues pruned to eliminate duplicates Z: 18 29.299 2.164 0.743 0.926 1.000 0.882 CB 1.322 18 residues pruned to eliminate duplicates Z: 28 36.141 2.075 0.603 0.906 1.000 0.889 CA 1.487 28 residues pruned to eliminate duplicates Z: 38 34.388 2.062 1.012 0.596 0.946 0.622 CB 1.314 38 residues pruned to eliminate duplicates Z: 7 8.650 1.741 0.476 0.793 1.000 0.833 CA 1.063 7 residues pruned to eliminate duplicates Z: 13 27.503 2.131 0.985 0.873 1.000 0.667 CB 1.367 13 residues pruned to eliminate duplicates Z: 26 23.892 2.044 0.620 0.641 0.960 0.760 CB 1.317 25 residues pruned to eliminate duplicates Z: 34 14.778 1.910 0.456 0.456 0.848 0.515 CB 1.140 25 residues pruned to eliminate duplicates Z: 29 45.041 2.075 0.774 0.911 0.964 0.750 CB 1.701 29 residues pruned to eliminate duplicates Z: 29 48.827 2.143 1.002 0.923 1.000 0.571 CB 1.511 30 residues pruned to eliminate duplicates Z: 16 37.129 2.138 1.027 0.927 1.000 0.733 CB 1.551 16 residues pruned to eliminate duplicates Z: 21 33.326 2.169 0.775 0.895 0.950 0.850 CB 1.460 21 residues pruned to eliminate duplicates Z: 24 31.133 2.104 0.554 0.946 1.000 1.000 CB 1.373 24 residues pruned to eliminate duplicates Z: 16 12.757 2.009 0.612 0.381 0.867 0.400 CB 1.332 19 residues pruned to eliminate duplicates Z: 15 25.552 2.055 0.804 0.862 0.929 0.786 CA 1.457 15 residues pruned to eliminate duplicates Z: 19 13.459 1.895 0.567 0.493 0.889 0.556 CB 1.210 19 residues pruned to eliminate duplicates Z: 29 40.390 2.054 0.848 0.918 0.893 0.500 CB 1.589 29 residues pruned to eliminate duplicates Z: 17 24.313 2.003 0.772 0.899 0.938 0.750 CB 1.306 17 residues pruned to eliminate duplicates Z: 25 19.143 1.844 0.700 0.524 0.875 0.625 CB 1.391 23 residues pruned to eliminate duplicates Z: 13 11.315 1.998 0.523 0.447 0.917 0.417 CB 1.236 13 residues pruned to eliminate duplicates Z: 16 18.036 1.887 0.808 0.846 0.933 0.600 CB 1.087 16 residues pruned to eliminate duplicates Z: 28 21.396 2.015 0.710 0.587 0.889 0.630 CB 1.236 28 residues pruned to eliminate duplicates Z: 29 33.524 2.133 0.387 0.912 0.964 0.857 CB 1.573 29 residues pruned to eliminate duplicates Z: 30 38.225 2.004 0.770 0.888 0.931 0.448 CB 1.548 29 residues pruned to eliminate duplicates Z: 88 60.399 2.212 1.021 0.660 0.885 0.609 CB 1.410 88 residues pruned to eliminate duplicates Z: 26 24.348 2.076 0.849 0.558 0.880 0.400 CB 1.362 26 residues pruned to eliminate duplicates Z: 6 4.905 1.796 0.175 0.378 1.000 0.800 CA 1.184 Z: 19 11.049 1.936 0.599 0.404 0.667 0.611 CB 1.395 8 residues pruned to eliminate duplicates Z: 13 14.103 1.832 0.939 0.475 0.917 0.500 CB 1.283 13 residues pruned to eliminate duplicates Z: 17 34.294 2.199 0.929 0.931 1.000 0.875 CB 1.413 17 residues pruned to eliminate duplicates Z: 29 36.768 2.125 0.563 0.909 0.964 0.893 CA 1.539 29 residues pruned to eliminate duplicates Z: 16 33.502 2.113 1.173 0.897 0.933 0.600 CB 1.445 16 residues pruned to eliminate duplicates Z: 34 24.147 2.018 0.716 0.603 0.879 0.606 CB 1.252 27 residues pruned to eliminate duplicates Z: 7 7.288 1.893 -0.004 0.789 0.833 0.500 CB 1.469 7 residues pruned to eliminate duplicates Z: 7 7.596 1.591 0.932 0.659 1.000 0.833 CA 0.870 7 residues pruned to eliminate duplicates Z: 15 21.737 2.038 0.797 0.866 0.857 0.643 CA 1.355 15 residues pruned to eliminate duplicates Z: 55 35.009 1.998 0.953 0.540 0.926 0.537 CB 1.269 51 residues pruned to eliminate duplicates Z: 13 18.209 1.824 0.811 0.847 0.917 0.583 CA 1.288 13 residues pruned to eliminate duplicates Z: 29 36.012 2.152 0.602 0.907 0.929 0.750 CB 1.510 29 residues pruned to eliminate duplicates Z: 12 20.896 2.020 0.711 0.885 1.000 0.636 CB 1.316 12 residues pruned to eliminate duplicates Z: 10 14.183 2.158 0.759 0.452 0.889 0.556 CB 1.472 11 residues pruned to eliminate duplicates Z: 27 47.299 2.099 0.967 0.925 0.962 0.731 CB 1.640 27 residues pruned to eliminate duplicates Z: 28 52.753 2.135 0.972 0.921 1.000 0.778 CB 1.697 29 residues pruned to eliminate duplicates Z: 16 30.527 2.133 1.026 0.886 0.867 0.867 CB 1.519 16 residues pruned to eliminate duplicates Z: 9 7.631 1.834 -0.061 0.854 0.875 0.625 CB 1.323 9 residues pruned to eliminate duplicates Z: 24 43.790 2.142 1.289 0.938 0.957 0.609 CB 1.354 24 residues pruned to eliminate duplicates Z: 27 45.728 2.082 0.935 0.935 0.962 0.654 CB 1.614 27 residues pruned to eliminate duplicates Z: 28 43.905 2.126 0.828 0.912 0.963 0.889 CB 1.600 28 residues pruned to eliminate duplicates Z: 24 23.749 1.826 0.575 0.919 1.000 0.957 CB 1.213 24 residues pruned to eliminate duplicates Z: 12 18.156 1.813 1.082 0.757 0.818 0.636 CB 1.409 12 residues pruned to eliminate duplicates Z: 68 47.406 2.135 0.862 0.602 0.925 0.627 CB 1.429 65 residues pruned to eliminate duplicates Z: 37 33.624 2.066 1.054 0.616 0.917 0.722 CB 1.291 37 residues pruned to eliminate duplicates Z: 23 27.210 1.871 1.042 0.911 0.955 0.636 CB 1.127 23 residues pruned to eliminate duplicates Z: 14 15.841 1.717 0.735 0.823 1.000 0.538 CB 1.115 14 residues pruned to eliminate duplicates Z: 15 22.026 1.971 0.781 0.917 1.000 0.929 CB 1.183 15 residues pruned to eliminate duplicates Z: 6 6.775 1.863 0.153 0.786 0.800 0.600 CB 1.371 6 residues pruned to eliminate duplicates Z: 28 51.458 2.119 0.924 0.927 1.000 0.778 CB 1.702 28 residues pruned to eliminate duplicates Z: 68 43.493 2.050 0.759 0.618 0.970 0.657 CB 1.358 68 residues pruned to eliminate duplicates Z: 17 20.395 1.880 0.715 0.806 0.938 0.562 CA 1.291 17 residues pruned to eliminate duplicates Z: 16 25.932 2.108 0.547 0.911 0.933 0.800 CB 1.559 16 residues pruned to eliminate duplicates Z: 15 24.131 2.036 0.972 0.886 0.929 0.786 CA 1.248 15 residues pruned to eliminate duplicates Z: 6 8.910 1.879 0.212 0.833 1.000 1.000 CA 1.313 8 residues pruned to eliminate duplicates Z: 30 46.185 2.063 0.795 0.913 1.000 0.862 CB 1.639 30 residues pruned to eliminate duplicates Z: 10 10.264 1.843 0.693 0.644 0.778 0.444 CB 1.233 8 residues pruned to eliminate duplicates Z: 23 30.636 2.189 0.527 0.939 0.955 0.909 CB 1.422 23 residues pruned to eliminate duplicates Z: 12 22.775 2.097 0.872 0.869 1.000 0.818 CB 1.278 12 residues pruned to eliminate duplicates Z: 23 28.532 1.891 0.906 0.930 0.955 0.818 CB 1.237 23 residues pruned to eliminate duplicates Z: 15 37.123 2.071 1.333 0.921 0.929 0.714 CB 1.556 15 residues pruned to eliminate duplicates Z: 16 18.282 1.925 0.704 0.929 1.000 0.800 CB 1.007 16 residues pruned to eliminate duplicates Z: 10 12.198 2.166 0.475 0.572 0.889 0.667 CB 1.335 10 residues pruned to eliminate duplicates Z: 21 25.003 2.031 0.443 0.898 1.000 0.850 CA 1.364 21 residues pruned to eliminate duplicates Z: 15 30.817 2.108 0.947 0.931 1.000 0.857 CB 1.403 15 residues pruned to eliminate duplicates Z: 37 38.132 2.059 1.069 0.684 0.944 0.667 CB 1.335 37 residues pruned to eliminate duplicates Z: 15 33.398 2.154 1.003 0.946 1.000 0.857 CB 1.430 15 residues pruned to eliminate duplicates Z: 84 61.310 2.126 0.867 0.677 0.928 0.747 CB 1.553 84 residues pruned to eliminate duplicates Z: 30 32.285 2.169 0.694 0.663 0.931 0.724 CB 1.507 30 residues pruned to eliminate duplicates Z: 49 36.184 2.063 0.938 0.588 0.958 0.583 CB 1.253 49 residues pruned to eliminate duplicates Z: 15 21.983 1.987 0.958 0.896 0.929 0.643 CB 1.165 15 residues pruned to eliminate duplicates Z: 14 14.677 1.975 0.356 0.821 0.923 0.692 CB 1.246 14 residues pruned to eliminate duplicates Z: 15 25.203 2.081 0.863 0.856 0.929 0.786 CA 1.379 15 residues pruned to eliminate duplicates Z: 21 36.198 2.195 0.890 0.852 0.950 0.700 CB 1.518 21 residues pruned to eliminate duplicates Z: 11 20.154 2.016 0.839 0.896 1.000 0.800 CB 1.231 11 residues pruned to eliminate duplicates Z: 73 50.558 2.134 0.913 0.589 0.944 0.625 CB 1.419 71 residues pruned to eliminate duplicates Z: 16 24.074 1.917 0.767 0.858 0.933 0.733 CB 1.448 16 residues pruned to eliminate duplicates Z: 14 30.362 2.351 0.882 0.924 0.923 0.923 CB 1.448 14 residues pruned to eliminate duplicates Z: 12 10.390 1.964 0.615 0.719 0.909 0.818 CB 0.891 12 residues pruned to eliminate duplicates Z: 8 8.836 1.477 0.771 0.800 0.857 0.857 CA 1.146 8 residues pruned to eliminate duplicates Z: 14 12.007 1.747 0.460 0.893 1.000 0.769 CB 0.937 Z: 16 30.776 2.085 0.925 0.916 1.000 0.600 CB 1.398 16 residues pruned to eliminate duplicates Z: 16 33.710 2.139 1.017 0.906 0.933 0.733 CB 1.537 16 residues pruned to eliminate duplicates Z: 13 7.548 1.844 0.665 0.328 0.583 0.417 CB 1.469 13 residues pruned to eliminate duplicates Z: 16 30.294 1.982 1.232 0.884 0.867 0.800 CB 1.474 16 residues pruned to eliminate duplicates Z: 11 20.591 2.026 0.694 0.834 1.000 0.700 CB 1.422 11 residues pruned to eliminate duplicates Z: 15 28.754 2.177 0.686 0.938 1.000 0.857 CA 1.456 15 residues pruned to eliminate duplicates Z: 30 38.595 2.050 0.644 0.865 0.931 0.724 CB 1.674 29 residues pruned to eliminate duplicates Z: 27 29.671 2.032 0.591 0.766 0.962 0.808 CB 1.479 27 residues pruned to eliminate duplicates Z: 26 29.028 1.961 0.857 0.764 1.000 0.720 CB 1.261 27 residues pruned to eliminate duplicates Z: 12 11.350 1.777 0.512 0.889 1.000 0.818 CB 0.917 13 residues pruned to eliminate duplicates Z: 8 6.226 1.850 0.699 0.286 0.714 0.571 CA 1.334 8 residues pruned to eliminate duplicates Z: 16 31.950 2.222 0.723 0.939 1.000 1.000 CA 1.496 16 residues pruned to eliminate duplicates Z: 23 29.158 2.096 0.702 0.809 0.955 0.864 CA 1.395 23 residues pruned to eliminate duplicates Z: 17 27.666 1.977 0.930 0.906 1.000 0.750 CB 1.289 17 residues pruned to eliminate duplicates Z: 24 37.573 2.057 1.034 0.834 0.913 0.783 CB 1.538 24 residues pruned to eliminate duplicates Z: 17 28.572 2.145 0.693 0.872 0.938 0.875 CB 1.528 17 residues pruned to eliminate duplicates Z: 15 16.904 1.936 0.501 0.911 1.000 1.000 CB 1.102 15 residues pruned to eliminate duplicates Z: 18 8.544 1.669 0.664 0.446 0.706 0.353 CB 1.117 19 residues pruned to eliminate duplicates Z: 6 7.059 1.906 0.230 0.508 0.800 0.600 CB 1.669 6 residues pruned to eliminate duplicates Z: 15 13.499 1.687 0.546 0.926 1.000 1.000 CB 0.969 14 residues pruned to eliminate duplicates Z: 28 34.753 2.160 0.648 0.927 0.963 0.889 CB 1.368 28 residues pruned to eliminate duplicates Z: 20 28.482 1.977 1.137 0.881 0.947 0.474 CB 1.182 20 residues pruned to eliminate duplicates Z: 22 26.374 2.001 0.905 0.830 0.857 0.714 CB 1.325 22 residues pruned to eliminate duplicates Z: 19 19.232 2.002 0.706 0.627 0.944 0.444 CB 1.247 23 residues pruned to eliminate duplicates Z: 31 39.449 2.113 0.997 0.707 1.000 0.833 CB 1.414 31 residues pruned to eliminate duplicates Z: 15 17.445 2.008 0.498 0.835 0.929 0.714 CA 1.250 15 residues pruned to eliminate duplicates Z: 38 24.585 1.970 0.814 0.531 0.892 0.622 CB 1.230 38 residues pruned to eliminate duplicates Z: 24 26.869 1.850 0.748 0.884 1.000 0.870 CB 1.251 24 residues pruned to eliminate duplicates Z: 17 13.623 1.817 0.668 0.418 0.938 0.500 CB 1.306 16 residues pruned to eliminate duplicates Z: 15 27.305 1.987 1.089 0.926 1.000 0.929 CB 1.233 15 residues pruned to eliminate duplicates Z: 16 17.139 1.874 0.539 0.916 0.933 0.867 CB 1.161 16 residues pruned to eliminate duplicates Z: 22 19.424 1.949 0.381 0.822 0.857 0.619 CB 1.389 22 residues pruned to eliminate duplicates Z: 6 4.856 1.595 0.488 0.724 0.800 0.600 CB 0.934 6 residues pruned to eliminate duplicates Z: 16 21.800 2.028 0.741 0.843 0.867 0.667 CA 1.370 16 residues pruned to eliminate duplicates Z: 15 29.765 2.194 0.835 0.913 0.929 0.786 CA 1.506 15 residues pruned to eliminate duplicates Z: 10 6.112 1.683 0.233 0.561 0.778 0.556 CB 1.190 Z: 15 30.539 2.186 0.710 0.943 1.000 0.857 CA 1.513 15 residues pruned to eliminate duplicates Z: 29 48.719 2.123 1.091 0.912 0.964 0.750 CB 1.523 29 residues pruned to eliminate duplicates Z: 16 21.510 1.922 0.856 0.936 1.000 0.533 CB 1.084 16 residues pruned to eliminate duplicates Z: 15 35.011 2.272 0.875 0.937 1.000 0.929 CB 1.529 15 residues pruned to eliminate duplicates Z: 15 25.035 1.989 0.951 0.916 1.000 0.571 CB 1.217 15 residues pruned to eliminate duplicates Z: 14 18.764 2.024 0.718 0.858 0.846 0.692 CB 1.303 14 residues pruned to eliminate duplicates Z: 11 17.526 1.934 0.759 0.821 0.900 0.500 CA 1.370 11 residues pruned to eliminate duplicates Z: 15 33.939 2.251 0.909 0.943 1.000 0.929 CB 1.463 15 residues pruned to eliminate duplicates Z: 15 33.406 2.120 1.158 0.913 1.000 0.571 CB 1.381 15 residues pruned to eliminate duplicates Z: 15 29.126 2.098 0.946 0.918 0.929 0.857 CB 1.448 15 residues pruned to eliminate duplicates Z: 11 22.066 1.986 0.968 0.892 0.900 0.700 CA 1.425 11 residues pruned to eliminate duplicates Z: 7 4.484 1.623 0.643 0.352 0.667 0.333 CB 1.209 6 residues pruned to eliminate duplicates Z: 23 33.726 2.165 0.588 0.918 1.000 0.864 CB 1.474 23 residues pruned to eliminate duplicates Z: 68 51.634 2.144 0.733 0.633 0.955 0.731 CB 1.569 68 residues pruned to eliminate duplicates Z: 83 57.118 2.115 0.870 0.653 0.951 0.683 CB 1.454 83 residues pruned to eliminate duplicates Z: 14 23.922 2.155 0.784 0.830 0.923 0.462 CA 1.406 14 residues pruned to eliminate duplicates Z: 24 13.969 1.960 0.685 0.412 0.783 0.435 CB 1.236 22 residues pruned to eliminate duplicates Z: 17 36.834 2.103 0.935 0.932 1.000 0.875 CB 1.580 17 residues pruned to eliminate duplicates Z: 15 29.655 2.052 0.841 0.894 1.000 0.786 CB 1.505 15 residues pruned to eliminate duplicates Z: 23 20.596 1.867 0.400 0.916 0.955 0.955 CB 1.242 23 residues pruned to eliminate duplicates Z: 32 40.015 1.973 0.829 0.887 0.968 0.645 CB 1.484 32 residues pruned to eliminate duplicates Z: 24 14.194 1.861 0.683 0.498 0.870 0.652 CB 1.090 24 residues pruned to eliminate duplicates Z: 16 29.902 2.150 0.953 0.901 0.933 0.600 CB 1.407 16 residues pruned to eliminate duplicates Z: 18 25.670 2.021 0.630 0.863 0.941 0.824 CA 1.474 18 residues pruned to eliminate duplicates Z: 37 31.573 2.033 0.857 0.618 0.917 0.667 CB 1.360 37 residues pruned to eliminate duplicates Z: 16 24.725 1.982 0.531 0.905 1.000 0.933 CB 1.498 16 residues pruned to eliminate duplicates Z: 7 6.694 1.909 0.893 0.295 0.667 0.333 CB 1.427 7 residues pruned to eliminate duplicates Z: 26 25.238 1.983 0.324 0.910 1.000 0.920 CB 1.364 26 residues pruned to eliminate duplicates Z: 19 27.646 1.982 1.082 0.920 0.889 0.444 CB 1.251 19 residues pruned to eliminate duplicates Z: 53 37.730 2.122 0.669 0.626 0.942 0.673 CB 1.393 53 residues pruned to eliminate duplicates Z: 16 16.941 1.873 0.466 0.895 1.000 0.667 CB 1.141 16 residues pruned to eliminate duplicates Z: 13 10.161 1.746 0.150 0.941 1.000 1.000 CB 1.014 13 residues pruned to eliminate duplicates Z: 13 11.987 1.728 0.798 0.495 0.833 0.333 CA 1.343 Z: 7 8.427 1.910 0.567 0.799 0.833 0.833 CA 1.062 7 residues pruned to eliminate duplicates Z: 78 58.350 2.138 0.759 0.707 0.922 0.753 CB 1.588 78 residues pruned to eliminate duplicates Z: 13 13.260 1.732 0.339 0.931 1.000 0.917 CB 1.153 13 residues pruned to eliminate duplicates Z: 12 16.372 1.808 0.681 0.937 1.000 0.909 CB 1.131 14 residues pruned to eliminate duplicates Z: 15 25.059 2.092 0.724 0.896 1.000 0.786 CB 1.330 15 residues pruned to eliminate duplicates Z: 14 8.323 1.781 0.297 0.550 0.923 0.692 CB 1.031 5 residues pruned to eliminate duplicates Z: 16 22.904 1.897 0.755 0.901 1.000 0.867 CB 1.268 16 residues pruned to eliminate duplicates Z: 13 14.049 2.102 0.161 0.914 0.917 0.833 CB 1.282 13 residues pruned to eliminate duplicates Z: 12 15.789 2.040 0.384 0.836 1.000 0.909 CB 1.262 12 residues pruned to eliminate duplicates Z: 6 6.734 1.970 0.837 0.739 0.800 0.800 CA 0.839 6 residues pruned to eliminate duplicates Z: 15 18.672 1.928 0.799 0.901 0.929 0.857 CB 1.106 15 residues pruned to eliminate duplicates Z: 11 13.297 2.187 0.549 0.532 1.000 0.600 CB 1.203 11 residues pruned to eliminate duplicates Z: 13 11.764 1.821 0.604 0.471 0.917 0.500 CB 1.306 13 residues pruned to eliminate duplicates Z: 24 23.358 1.865 0.588 0.880 0.957 0.826 CA 1.246 24 residues pruned to eliminate duplicates Z: 9 7.291 1.676 0.551 0.453 0.875 0.500 CB 1.189 10 residues pruned to eliminate duplicates Z: 13 22.770 2.008 0.824 0.871 1.000 0.917 CB 1.309 13 residues pruned to eliminate duplicates Z: 17 26.307 1.991 0.988 0.888 0.938 0.625 CB 1.277 17 residues pruned to eliminate duplicates Z: 10 11.468 1.602 1.203 0.550 1.000 0.444 CB 1.032 Z: 17 23.357 1.986 1.006 0.771 0.812 0.688 CB 1.419 17 residues pruned to eliminate duplicates Z: 13 13.003 1.753 0.937 0.924 0.917 0.917 CB 0.847 12 residues pruned to eliminate duplicates Z: 17 25.555 2.019 0.809 0.802 0.938 0.625 CB 1.433 17 residues pruned to eliminate duplicates Z: 17 24.863 2.001 1.003 0.913 0.938 0.812 CB 1.170 17 residues pruned to eliminate duplicates Z: 24 28.071 2.043 0.529 0.908 1.000 0.870 CB 1.331 24 residues pruned to eliminate duplicates Z: 10 3.420 1.743 0.120 0.599 0.889 0.667 CB 0.598 10 residues pruned to eliminate duplicates Z: 19 16.691 1.911 0.581 0.575 0.944 0.556 CB 1.283 19 residues pruned to eliminate duplicates Z: 28 42.141 2.022 0.653 0.925 1.000 0.889 CB 1.703 28 residues pruned to eliminate duplicates Z: 48 33.445 2.045 0.715 0.592 0.957 0.574 CB 1.330 48 residues pruned to eliminate duplicates Z: 23 25.318 1.834 0.932 0.894 0.955 0.682 CB 1.145 23 residues pruned to eliminate duplicates Z: 42 35.997 2.136 0.807 0.578 0.927 0.683 CB 1.458 42 residues pruned to eliminate duplicates Z: 18 25.700 1.957 0.761 0.797 0.941 0.824 CA 1.481 18 residues pruned to eliminate duplicates Z: 12 20.583 2.151 0.560 0.875 1.000 0.818 CA 1.345 12 residues pruned to eliminate duplicates Z: 16 20.179 2.029 0.482 0.906 1.000 0.933 CB 1.233 16 residues pruned to eliminate duplicates Z: 30 27.052 2.115 0.847 0.543 0.862 0.655 CA 1.430 30 residues pruned to eliminate duplicates Z: 10 16.128 1.700 0.894 0.628 1.000 0.667 CB 1.481 10 residues pruned to eliminate duplicates Z: 25 37.074 2.156 0.990 0.805 0.958 0.542 CB 1.410 25 residues pruned to eliminate duplicates Z: 13 15.705 1.959 0.723 0.849 0.917 0.833 CB 1.086 13 residues pruned to eliminate duplicates Z: 7 9.282 1.676 0.743 0.828 1.000 0.833 CB 0.977 7 residues pruned to eliminate duplicates Z: 10 11.397 1.938 0.332 0.776 1.000 1.000 CB 1.154 10 residues pruned to eliminate duplicates Z: 55 24.182 1.910 0.652 0.566 0.889 0.667 CB 1.100 127 residues pruned to eliminate duplicates Z: 12 24.372 2.107 0.941 0.917 1.000 0.818 CB 1.268 12 residues pruned to eliminate duplicates Z: 17 30.750 2.148 0.887 0.921 1.000 0.625 CB 1.334 17 residues pruned to eliminate duplicates Z: 79 61.437 2.173 0.842 0.695 0.923 0.667 CB 1.576 79 residues pruned to eliminate duplicates Z: 11 21.333 1.942 0.878 0.858 1.000 0.600 CB 1.362 11 residues pruned to eliminate duplicates Z: 8 5.999 1.502 0.875 0.759 0.714 0.429 CB 0.895 8 residues pruned to eliminate duplicates Z: 23 34.289 2.082 1.063 0.809 0.909 0.591 CB 1.431 23 residues pruned to eliminate duplicates Z: 14 18.096 1.955 0.618 0.844 0.923 0.769 CB 1.279 Z: 30 46.227 2.167 0.998 0.898 0.966 0.724 CB 1.469 30 residues pruned to eliminate duplicates Z: 16 40.885 2.266 1.007 0.914 1.000 0.933 CB 1.641 16 residues pruned to eliminate duplicates Z: 23 20.349 1.988 0.669 0.701 0.909 0.636 CB 1.197 23 residues pruned to eliminate duplicates Z: 40 34.066 2.057 0.882 0.576 0.949 0.564 CB 1.381 40 residues pruned to eliminate duplicates Z: 24 17.955 2.127 0.542 0.425 0.826 0.522 CB 1.494 24 residues pruned to eliminate duplicates Z: 11 9.435 1.813 0.760 0.674 0.800 0.400 CB 0.995 11 residues pruned to eliminate duplicates Z: 67 57.964 2.212 1.045 0.673 0.894 0.576 CB 1.504 67 residues pruned to eliminate duplicates Z: 32 18.286 1.853 0.705 0.545 0.903 0.774 CB 1.101 32 residues pruned to eliminate duplicates Z: 48 33.916 2.048 0.900 0.632 0.936 0.596 CB 1.200 48 residues pruned to eliminate duplicates Z: 10 2.817 1.453 0.548 0.257 0.667 0.333 N 0.826 Z: 10 13.093 1.883 0.485 0.746 1.000 0.778 CB 1.253 10 residues pruned to eliminate duplicates Z: 29 36.584 2.103 0.676 0.909 0.964 0.893 CA 1.443 29 residues pruned to eliminate duplicates Z: 7 13.442 1.797 1.092 0.600 1.000 0.833 CA 1.327 Z: 15 23.072 2.052 0.915 0.911 0.929 0.929 CB 1.198 15 residues pruned to eliminate duplicates Z: 21 30.651 1.945 1.050 0.905 0.950 0.600 CB 1.288 Z: 20 6.108 1.685 0.336 0.220 0.789 0.421 CB 1.095 Z: 12 21.631 1.947 0.948 0.843 0.909 0.545 CB 1.409 12 residues pruned to eliminate duplicates Z: 23 28.883 1.908 0.908 0.926 0.955 0.864 CB 1.242 23 residues pruned to eliminate duplicates Z: 55 45.070 2.202 1.036 0.629 0.833 0.630 CB 1.455 55 residues pruned to eliminate duplicates Z: 13 12.574 1.730 0.862 0.443 0.917 0.417 CA 1.303 13 residues pruned to eliminate duplicates Z: 11 23.287 2.075 1.031 0.885 1.000 0.700 CB 1.261 11 residues pruned to eliminate duplicates Z: 73 67.225 2.258 0.972 0.774 0.944 0.736 CB 1.479 73 residues pruned to eliminate duplicates Z: 17 30.494 1.963 1.226 0.908 0.938 0.812 CB 1.322 17 residues pruned to eliminate duplicates Z: 14 10.967 1.824 0.714 0.411 0.769 0.538 CB 1.389 14 residues pruned to eliminate duplicates Z: 6 6.732 1.630 0.057 0.881 1.000 0.800 CB 1.265 6 residues pruned to eliminate duplicates Z: 16 19.410 1.863 0.668 0.886 0.933 0.867 CB 1.246 16 residues pruned to eliminate duplicates Z: 15 16.188 1.715 0.766 0.928 1.000 0.714 CB 1.000 13 residues pruned to eliminate duplicates Z: 38 33.279 2.048 0.850 0.612 0.946 0.541 CB 1.374 38 residues pruned to eliminate duplicates Z: 22 12.383 1.870 0.394 0.441 0.905 0.667 CB 1.217 Z: 17 25.111 1.953 1.037 0.870 0.938 0.438 CB 1.229 17 residues pruned to eliminate duplicates Z: 8 6.171 1.595 0.567 0.441 0.857 0.429 CB 1.157 Z: 30 34.034 2.017 0.514 0.908 0.931 0.759 CB 1.578 30 residues pruned to eliminate duplicates Z: 21 22.266 2.025 0.946 0.652 1.000 0.800 CB 1.097 20 residues pruned to eliminate duplicates Z: 6 10.160 1.653 0.624 0.782 1.000 0.800 CB 1.320 Z: 12 13.190 1.853 0.663 0.651 0.909 0.545 CB 1.233 12 residues pruned to eliminate duplicates Z: 18 11.611 1.878 0.445 0.382 0.941 0.471 CB 1.251 9 residues pruned to eliminate duplicates Z: 9 18.044 2.044 1.016 0.739 0.875 0.625 CB 1.428 9 residues pruned to eliminate duplicates Z: 16 37.277 2.146 1.069 0.927 1.000 0.733 CB 1.519 16 residues pruned to eliminate duplicates Z: 15 38.184 2.245 1.211 0.928 1.000 0.571 CB 1.440 15 residues pruned to eliminate duplicates Z: 13 19.027 2.068 0.532 0.889 0.917 0.833 CB 1.361 13 residues pruned to eliminate duplicates Z: 37 20.378 1.995 0.488 0.496 0.861 0.639 CB 1.334 37 residues pruned to eliminate duplicates Z: 109 70.065 2.144 0.839 0.704 0.926 0.630 CB 1.533 224 residues pruned to eliminate duplicates Z: 34 23.702 1.935 0.631 0.635 0.939 0.667 CB 1.227 34 residues pruned to eliminate duplicates Z: 55 35.521 2.130 0.608 0.589 0.963 0.611 CB 1.347 54 residues pruned to eliminate duplicates Z: 20 24.061 1.952 0.847 0.904 0.947 0.684 CB 1.151 20 residues pruned to eliminate duplicates Z: 83 59.264 2.193 0.984 0.644 0.915 0.634 CB 1.437 83 residues pruned to eliminate duplicates Z: 13 18.506 1.914 0.978 0.845 0.833 0.583 CA 1.259 13 residues pruned to eliminate duplicates Z: 16 19.744 1.956 0.620 0.841 0.933 0.733 CA 1.285 16 residues pruned to eliminate duplicates Z: 9 6.855 1.643 0.396 0.560 0.875 0.500 CB 1.139 Z: 6 13.982 1.859 0.703 0.832 1.000 1.000 CB 1.483 Z: 12 19.320 2.006 0.719 0.894 0.909 0.727 CA 1.333 12 residues pruned to eliminate duplicates Z: 6 5.506 1.634 0.411 0.794 0.800 0.200 CA 1.031 6 residues pruned to eliminate duplicates Z: 85 66.297 2.227 1.034 0.672 0.940 0.667 CB 1.448 85 residues pruned to eliminate duplicates Z: 15 33.953 2.071 1.079 0.925 1.000 0.714 CB 1.479 15 residues pruned to eliminate duplicates Z: 27 22.014 2.012 0.749 0.599 0.885 0.769 CB 1.262 28 residues pruned to eliminate duplicates Z: 6 3.221 1.447 0.740 0.548 0.800 0.600 CB 0.682 6 residues pruned to eliminate duplicates Z: 28 34.769 2.001 0.696 0.890 0.926 0.704 CB 1.532 28 residues pruned to eliminate duplicates Z: 19 17.592 1.811 0.734 0.643 0.944 0.389 CB 1.223 19 residues pruned to eliminate duplicates Z: 15 26.471 2.052 1.028 0.842 0.929 0.643 CA 1.365 15 residues pruned to eliminate duplicates Z: 7 9.933 1.501 1.222 0.687 1.000 0.833 CA 1.024 7 residues pruned to eliminate duplicates Z: 87 67.834 2.248 0.945 0.723 0.942 0.640 CB 1.451 87 residues pruned to eliminate duplicates Z: 37 22.756 1.991 0.827 0.547 0.889 0.611 CB 1.121 37 residues pruned to eliminate duplicates Z: 9 6.135 1.537 0.563 0.795 0.625 0.500 CA 1.116 Z: 35 27.026 2.003 0.746 0.613 0.941 0.588 CB 1.266 33 residues pruned to eliminate duplicates Z: 29 49.684 2.081 0.877 0.944 1.000 0.679 CB 1.666 29 residues pruned to eliminate duplicates Z: 16 8.808 1.624 0.665 0.371 0.800 0.467 CB 1.208 25 residues pruned to eliminate duplicates Z: 13 11.338 1.507 0.500 0.916 1.000 1.000 CB 1.023 12 residues pruned to eliminate duplicates Z: 13 17.373 2.068 0.437 0.875 0.917 0.583 CB 1.340 13 residues pruned to eliminate duplicates Z: 20 18.572 1.848 0.705 0.608 0.895 0.368 CB 1.364 20 residues pruned to eliminate duplicates Z: 8 8.093 1.911 0.446 0.780 0.857 0.429 CB 1.009 8 residues pruned to eliminate duplicates Z: 13 15.031 1.824 0.748 0.684 1.000 0.583 CB 1.149 13 residues pruned to eliminate duplicates Z: 12 9.653 1.967 0.836 0.395 0.909 0.545 CB 0.990 12 residues pruned to eliminate duplicates Z: 9 6.127 1.559 0.119 0.895 1.000 0.875 CB 0.890 Z: 9 12.865 1.996 0.672 0.897 0.875 0.750 CB 1.115 9 residues pruned to eliminate duplicates Z: 29 45.563 2.053 0.862 0.905 1.000 0.464 CB 1.604 29 residues pruned to eliminate duplicates Z: 27 31.506 2.091 0.948 0.646 0.923 0.808 CB 1.435 27 residues pruned to eliminate duplicates Z: 6 10.544 1.718 0.606 0.662 1.000 0.600 CA 1.471 6 residues pruned to eliminate duplicates Z: 14 27.955 1.982 1.086 0.916 1.000 0.692 CB 1.324 14 residues pruned to eliminate duplicates Z: 6 7.210 1.487 0.949 0.817 1.000 0.800 CB 0.845 6 residues pruned to eliminate duplicates Z: 19 14.945 1.944 0.606 0.445 0.889 0.556 CB 1.343 19 residues pruned to eliminate duplicates Z: 14 23.998 2.064 0.833 0.906 0.923 0.615 CB 1.356 14 residues pruned to eliminate duplicates Z: 34 24.181 2.015 0.673 0.584 0.909 0.576 CB 1.267 34 residues pruned to eliminate duplicates Z: 11 14.644 2.013 0.473 0.557 1.000 0.600 CB 1.478 11 residues pruned to eliminate duplicates Z: 14 14.216 1.741 0.511 0.933 1.000 0.923 CB 1.046 14 residues pruned to eliminate duplicates Z: 48 39.243 2.162 0.814 0.541 0.957 0.702 CB 1.464 48 residues pruned to eliminate duplicates Z: 7 12.420 2.098 0.497 0.511 1.000 0.667 CB 1.598 7 residues pruned to eliminate duplicates Z: 6 8.405 1.732 0.771 0.833 1.000 0.800 CB 0.919 Z: 12 6.526 1.502 0.229 0.633 0.909 0.636 CB 1.035 13 residues pruned to eliminate duplicates Z: 7 3.936 1.640 0.041 0.868 1.000 0.667 CB 0.688 7 residues pruned to eliminate duplicates Z: 9 11.871 2.068 0.302 0.876 0.875 0.750 CA 1.294 9 residues pruned to eliminate duplicates Z: 8 5.750 1.668 0.218 0.693 0.857 0.429 CB 1.046 8 residues pruned to eliminate duplicates Z: 20 31.028 2.097 1.013 0.803 0.895 0.737 CB 1.446 20 residues pruned to eliminate duplicates Z: 14 13.241 1.949 0.249 0.856 0.923 0.692 CB 1.204 14 residues pruned to eliminate duplicates Z: 15 16.915 1.934 0.732 0.807 0.857 0.714 CA 1.204 15 residues pruned to eliminate duplicates Z: 23 28.715 1.879 1.044 0.917 0.955 0.727 CB 1.178 23 residues pruned to eliminate duplicates Z: 7 15.364 2.183 0.703 0.811 0.833 0.667 CB 1.544 7 residues pruned to eliminate duplicates Z: 20 27.185 1.914 1.108 0.902 0.947 0.316 CB 1.164 20 residues pruned to eliminate duplicates Z: 13 21.566 2.092 0.752 0.853 0.917 0.750 CB 1.370 13 residues pruned to eliminate duplicates Z: 31 16.079 1.864 0.650 0.543 0.900 0.500 CB 1.017 31 residues pruned to eliminate duplicates Z: 13 9.462 1.666 0.483 0.492 0.917 0.583 CB 1.215 7 residues pruned to eliminate duplicates Z: 29 37.891 2.142 0.554 0.899 1.000 0.893 CA 1.538 29 residues pruned to eliminate duplicates Z: 9 6.197 1.417 0.269 0.834 0.875 0.750 CB 1.044 8 residues pruned to eliminate duplicates Z: 10 9.288 1.693 0.683 0.458 0.778 0.556 CB 1.458 13 residues pruned to eliminate duplicates Z: 8 5.827 1.411 0.183 0.830 1.000 0.571 CB 0.992 8 residues pruned to eliminate duplicates Z: 10 9.024 1.421 0.489 0.855 1.000 0.889 CB 1.049 10 residues pruned to eliminate duplicates Z: 36 41.698 2.267 0.758 0.635 0.971 0.600 CB 1.604 36 residues pruned to eliminate duplicates Z: 10 8.388 1.779 0.552 0.492 0.889 0.444 CB 1.149 10 residues pruned to eliminate duplicates Z: 12 6.453 1.722 0.372 0.431 0.909 0.545 CB 0.973 9 residues pruned to eliminate duplicates Z: 7 12.593 1.700 0.829 0.868 1.000 0.667 CA 1.209 7 residues pruned to eliminate duplicates Z: 10 4.151 1.570 0.355 0.718 0.778 0.444 CB 0.687 10 residues pruned to eliminate duplicates Z: 14 11.742 1.654 0.515 0.917 1.000 0.769 CB 0.917 14 residues pruned to eliminate duplicates Z: 11 21.695 2.001 0.820 0.880 1.000 0.900 CB 1.366 11 residues pruned to eliminate duplicates Z: 13 18.672 1.956 0.644 0.918 0.917 0.583 CB 1.290 13 residues pruned to eliminate duplicates Z: 20 16.918 1.903 0.628 0.562 0.895 0.684 CB 1.318 20 residues pruned to eliminate duplicates Z: 12 15.609 1.923 0.493 0.850 1.000 0.545 CB 1.214 12 residues pruned to eliminate duplicates Z: 34 23.128 2.098 0.586 0.452 0.939 0.455 CB 1.353 34 residues pruned to eliminate duplicates Z: 13 16.682 1.752 0.781 0.916 1.000 0.833 CB 1.090 13 residues pruned to eliminate duplicates Z: 14 27.853 2.239 0.650 0.924 1.000 0.846 CB 1.469 Z: 6 6.961 1.794 0.212 0.718 1.000 1.000 CB 1.175 9 residues pruned to eliminate duplicates Z: 30 39.243 2.018 0.827 0.883 0.931 0.517 CB 1.535 30 residues pruned to eliminate duplicates Z: 30 40.348 2.026 0.771 0.875 0.966 0.724 CB 1.573 30 residues pruned to eliminate duplicates Z: 27 53.664 2.142 1.159 0.929 1.000 0.654 CB 1.593 27 residues pruned to eliminate duplicates Z: 10 6.041 1.339 0.386 0.720 0.889 0.778 CB 1.001 9 residues pruned to eliminate duplicates Z: 7 9.070 1.742 0.501 0.664 1.000 0.500 CB 1.217 7 residues pruned to eliminate duplicates Z: 12 13.562 1.719 0.500 0.727 1.000 0.636 CB 1.292 13 residues pruned to eliminate duplicates Z: 14 20.023 1.957 0.848 0.859 0.923 0.692 CB 1.224 14 residues pruned to eliminate duplicates Z: 6 5.488 1.592 0.479 0.864 1.000 0.800 CB 0.764 6 residues pruned to eliminate duplicates Z: 15 17.539 1.685 0.943 0.932 1.000 0.571 CB 1.000 15 residues pruned to eliminate duplicates Z: 7 3.691 1.436 0.353 0.467 0.833 0.500 N 0.961 Z: 29 37.888 2.116 0.652 0.891 0.964 0.786 CA 1.528 29 residues pruned to eliminate duplicates Z: 39 19.929 1.748 0.743 0.513 0.895 0.658 CB 1.170 46 residues pruned to eliminate duplicates Z: 7 3.602 1.659 0.160 0.885 0.833 0.833 CB 0.662 7 residues pruned to eliminate duplicates Z: 29 41.061 2.167 1.046 0.921 0.857 0.429 CB 1.437 29 residues pruned to eliminate duplicates Z: 16 36.748 2.088 1.141 0.918 0.933 0.933 CB 1.603 16 residues pruned to eliminate duplicates Z: 16 15.807 1.802 0.507 0.886 1.000 0.867 CB 1.084 16 residues pruned to eliminate duplicates Z: 30 49.789 2.054 1.070 0.887 0.966 0.448 CB 1.623 30 residues pruned to eliminate duplicates Z: 61 34.067 1.949 0.931 0.609 0.867 0.617 CB 1.216 66 residues pruned to eliminate duplicates Z: 21 15.934 1.935 0.294 0.610 0.950 0.650 CB 1.349 21 residues pruned to eliminate duplicates Z: 16 20.995 1.831 0.702 0.904 1.000 0.733 CB 1.239 16 residues pruned to eliminate duplicates Z: 9 3.731 1.710 0.092 0.520 1.000 0.500 CB 0.693 Z: 15 34.559 2.106 1.283 0.940 1.000 0.786 CB 1.334 15 residues pruned to eliminate duplicates Z: 47 27.882 2.033 0.738 0.545 0.891 0.630 CB 1.249 6 residues pruned to eliminate duplicates Z: 11 17.024 1.779 0.928 0.926 1.000 0.900 CB 1.101 11 residues pruned to eliminate duplicates Z: 7 6.018 1.743 0.267 0.658 0.833 0.667 CB 1.153 7 residues pruned to eliminate duplicates Z: 9 6.156 1.562 0.119 0.893 1.000 0.875 CB 0.894 9 residues pruned to eliminate duplicates Z: 17 24.630 2.138 0.510 0.861 0.875 0.812 CB 1.603 Z: 17 26.238 2.012 0.999 0.714 0.875 0.625 CB 1.535 17 residues pruned to eliminate duplicates Z: 14 7.895 1.950 0.808 0.530 0.846 0.538 CB 0.712 Z: 24 26.017 2.060 0.369 0.893 1.000 0.913 CB 1.380 24 residues pruned to eliminate duplicates Z: 9 4.780 1.514 0.326 0.811 0.625 0.625 CB 1.027 9 residues pruned to eliminate duplicates Z: 16 14.395 2.083 0.436 0.468 0.933 0.733 CB 1.375 16 residues pruned to eliminate duplicates Z: 6 9.002 1.805 0.822 0.391 1.000 0.800 CA 1.373 6 residues pruned to eliminate duplicates 6 1.952 1.875 0.102 0.285 0.800 0.400 CB 0.672 ? Z: 20 10.397 1.882 0.530 0.364 0.789 0.421 CB 1.215 Z: 14 8.921 1.651 0.465 0.436 0.923 0.462 CB 1.184 14 residues pruned to eliminate duplicates Z: 16 23.624 2.036 0.661 0.879 1.000 0.800 CB 1.308 16 residues pruned to eliminate duplicates Z: 6 11.732 1.868 0.887 0.808 0.800 0.400 CA 1.423 6 residues pruned to eliminate duplicates Z: 6 9.383 1.633 0.678 0.794 1.000 0.600 CB 1.184 6 residues pruned to eliminate duplicates Z: 13 28.586 2.227 0.988 0.918 0.917 0.667 CB 1.434 13 residues pruned to eliminate duplicates Z: 21 18.444 1.901 0.691 0.622 0.850 0.600 CB 1.345 21 residues pruned to eliminate duplicates Z: 51 46.031 2.137 1.142 0.613 0.960 0.500 CB 1.330 47 residues pruned to eliminate duplicates Z: 13 17.460 1.752 0.773 0.919 1.000 0.833 CB 1.143 13 residues pruned to eliminate duplicates Z: 20 24.467 2.112 0.603 0.747 0.895 0.737 CB 1.486 20 residues pruned to eliminate duplicates Z: 14 36.411 2.105 1.473 0.925 1.000 0.538 CB 1.361 14 residues pruned to eliminate duplicates Z: 12 23.187 1.990 0.799 0.915 1.000 0.909 CB 1.380 12 residues pruned to eliminate duplicates Z: 9 4.609 1.627 0.144 0.377 0.875 0.500 CB 1.141 Z: 43 31.165 2.009 0.814 0.572 0.929 0.429 CB 1.326 43 residues pruned to eliminate duplicates Z: 26 20.948 1.954 0.660 0.728 0.960 0.840 CB 1.095 26 residues pruned to eliminate duplicates Z: 26 21.680 2.039 0.731 0.646 0.920 0.720 CB 1.165 26 residues pruned to eliminate duplicates Z: 40 21.684 1.902 0.774 0.527 0.846 0.436 CB 1.184 40 residues pruned to eliminate duplicates Z: 15 21.922 1.952 1.049 0.871 0.857 0.286 CB 1.247 15 residues pruned to eliminate duplicates Z: 7 8.667 1.525 0.619 0.856 1.000 1.000 CB 1.057 7 residues pruned to eliminate duplicates Z: 6 8.134 1.907 0.325 0.797 0.800 0.600 CB 1.388 6 residues pruned to eliminate duplicates Z: 7 2.492 1.401 0.206 0.161 0.833 0.667 CB 1.093 6 residues pruned to eliminate duplicates Z: 17 21.576 1.896 0.754 0.814 0.875 0.875 CB 1.411 17 residues pruned to eliminate duplicates Z: 6 8.186 1.634 0.261 0.808 1.000 0.800 CB 1.359 6 residues pruned to eliminate duplicates Z: 6 2.925 1.462 0.078 0.614 1.000 0.400 CB 0.745 6 residues pruned to eliminate duplicates Z: 12 9.591 1.900 0.357 0.719 0.909 0.727 CB 1.012 12 residues pruned to eliminate duplicates Z: 13 10.642 1.610 0.190 0.921 1.000 0.917 CB 1.128 13 residues pruned to eliminate duplicates Z: 28 25.483 2.013 0.909 0.520 0.963 0.704 CB 1.299 28 residues pruned to eliminate duplicates Z: 37 27.173 1.993 0.692 0.602 0.917 0.556 CB 1.330 37 residues pruned to eliminate duplicates Z: 7 3.236 1.382 0.315 0.438 0.833 0.167 CB 0.930 7 residues pruned to eliminate duplicates Z: 32 24.648 1.922 0.790 0.571 0.903 0.581 CB 1.330 32 residues pruned to eliminate duplicates Z: 16 11.161 1.890 0.623 0.342 0.933 0.600 CB 1.195 12 residues pruned to eliminate duplicates Z: 6 4.090 1.742 0.180 0.434 1.000 0.400 CB 0.952 Z: 6 8.351 1.746 0.654 0.805 1.000 0.800 CA 0.991 6 residues pruned to eliminate duplicates Z: 8 3.619 1.690 0.413 0.210 0.857 0.714 CA 0.941 Z: 14 21.235 1.928 0.645 0.905 1.000 0.923 CB 1.322 14 residues pruned to eliminate duplicates Z: 9 10.047 1.844 0.697 0.386 1.000 0.625 CA 1.281 9 residues pruned to eliminate duplicates Z: 29 41.118 2.145 0.660 0.927 0.964 0.893 CB 1.586 29 residues pruned to eliminate duplicates Z: 21 16.815 1.907 0.499 0.584 1.000 0.750 CB 1.214 21 residues pruned to eliminate duplicates Z: 14 10.426 1.743 0.082 0.938 1.000 1.000 CB 1.067 14 residues pruned to eliminate duplicates Z: 29 37.950 2.137 0.537 0.927 1.000 0.929 CB 1.529 29 residues pruned to eliminate duplicates Z: 6 4.360 1.674 0.935 0.300 0.600 0.400 CB 1.254 6 residues pruned to eliminate duplicates Z: 13 10.561 1.840 0.866 0.536 0.917 0.583 CB 0.935 13 residues pruned to eliminate duplicates Z: 9 5.911 1.447 0.282 0.822 0.750 0.500 CB 1.137 9 residues pruned to eliminate duplicates Z: 8 7.646 1.810 0.291 0.478 1.000 0.571 CB 1.263 8 residues pruned to eliminate duplicates Z: 6 6.386 1.931 0.628 0.409 0.800 0.400 CB 1.250 6 residues pruned to eliminate duplicates Z: 6 2.128 1.572 -0.028 0.460 0.800 0.600 O 0.811 6 residues pruned to eliminate duplicates Z: 6 6.661 1.519 0.455 0.832 1.000 0.600 CB 1.012 6 residues pruned to eliminate duplicates Z: 11 18.682 2.166 0.939 0.585 1.000 0.500 CB 1.297 15 residues pruned to eliminate duplicates Z: 16 20.566 1.979 0.672 0.906 1.000 0.667 CB 1.141 16 residues pruned to eliminate duplicates Z: 15 16.685 2.068 0.730 0.611 0.857 0.714 CB 1.308 16 residues pruned to eliminate duplicates Z: 23 29.860 2.156 0.865 0.664 0.955 0.818 CB 1.425 23 residues pruned to eliminate duplicates Z: 21 16.156 1.768 0.809 0.523 0.950 0.700 CB 1.162 21 residues pruned to eliminate duplicates Z: 22 35.385 2.087 1.070 0.915 1.000 0.476 CB 1.263 22 residues pruned to eliminate duplicates Z: 29 22.344 1.942 0.903 0.555 0.821 0.464 CB 1.318 29 residues pruned to eliminate duplicates Z: 63 58.588 2.231 0.853 0.694 0.952 0.774 CB 1.584 63 residues pruned to eliminate duplicates Z: 6 2.472 1.044 0.462 0.482 1.000 0.800 O 0.738 Z: 13 13.583 1.922 0.733 0.409 1.000 0.833 CB 1.296 13 residues pruned to eliminate duplicates Z: 7 3.922 1.593 0.136 0.321 0.833 0.667 C 1.293 7 residues pruned to eliminate duplicates Z: 13 16.276 1.698 0.628 0.931 1.000 0.917 CB 1.188 13 residues pruned to eliminate duplicates Z: 42 29.465 2.135 0.573 0.527 0.976 0.561 CB 1.367 42 residues pruned to eliminate duplicates Z: 8 6.806 1.655 0.557 0.673 0.857 0.714 CB 0.993 Z: 18 13.942 1.678 0.785 0.805 0.941 0.765 CB 0.919 17 residues pruned to eliminate duplicates Z: 14 12.553 1.753 0.302 0.942 1.000 1.000 CB 1.058 14 residues pruned to eliminate duplicates Z: 6 4.891 1.751 -0.062 0.621 1.000 0.800 O 1.188 6 residues pruned to eliminate duplicates 6 1.348 1.410 0.349 0.143 0.600 0.200 CB 0.821 ? Z: 48 29.461 1.994 0.774 0.551 0.957 0.681 CB 1.208 47 residues pruned to eliminate duplicates Z: 12 7.532 1.555 0.722 0.291 0.818 0.455 CB 1.311 12 residues pruned to eliminate duplicates Z: 12 15.232 1.774 0.574 0.931 1.000 1.000 CB 1.149 12 residues pruned to eliminate duplicates Z: 14 15.990 1.670 1.098 0.944 1.000 0.769 CB 0.876 14 residues pruned to eliminate duplicates Z: 8 11.182 1.656 0.456 0.830 1.000 1.000 N 1.317 8 residues pruned to eliminate duplicates Z: 11 7.894 1.981 0.094 0.611 0.800 0.800 CB 1.296 11 residues pruned to eliminate duplicates Z: 12 13.941 1.933 0.558 0.787 0.909 0.727 CA 1.192 12 residues pruned to eliminate duplicates Z: 36 27.702 1.876 0.805 0.666 0.943 0.686 CB 1.258 33 residues pruned to eliminate duplicates Z: 46 54.832 2.218 0.802 0.831 0.978 0.778 CB 1.571 46 residues pruned to eliminate duplicates Z: 15 23.872 2.349 0.899 0.566 0.857 0.643 CB 1.566 15 residues pruned to eliminate duplicates Z: 25 28.082 2.084 0.983 0.635 0.875 0.667 CB 1.396 25 residues pruned to eliminate duplicates Z: 76 70.709 2.243 1.065 0.750 0.947 0.667 CB 1.489 125 residues pruned to eliminate duplicates Z: 11 14.075 1.928 0.698 0.659 0.900 0.700 CB 1.304 11 residues pruned to eliminate duplicates Z: 6 3.869 1.555 0.139 0.584 0.800 0.600 CB 1.126 6 residues pruned to eliminate duplicates Z: 7 3.761 1.366 0.455 0.738 0.667 0.667 N 0.936 7 residues pruned to eliminate duplicates Z: 8 2.549 1.459 0.599 0.258 0.571 0.286 CB 0.954 Z: 6 4.794 1.632 -0.061 0.469 1.000 0.800 O 1.444 6 residues pruned to eliminate duplicates Z: 12 10.907 1.838 0.473 0.678 0.909 0.727 CB 1.134 12 residues pruned to eliminate duplicates Z: 13 9.261 1.897 0.494 0.344 0.917 0.500 CB 1.219 13 residues pruned to eliminate duplicates Z: 7 4.493 1.503 0.049 0.508 1.000 0.667 C 1.154 7 residues pruned to eliminate duplicates Z: 7 4.110 1.517 0.608 0.448 0.833 0.500 CB 0.871 Z: 17 30.191 2.008 0.858 0.871 1.000 0.875 CB 1.476 17 residues pruned to eliminate duplicates Z: 8 6.478 1.738 0.108 0.665 1.000 0.857 CB 1.091 6 residues pruned to eliminate duplicates Z: 18 14.845 1.813 0.931 0.537 0.824 0.529 CB 1.204 18 residues pruned to eliminate duplicates Z: 10 7.857 1.544 0.642 0.393 1.000 0.667 CA 1.157 10 residues pruned to eliminate duplicates Z: 71 52.510 2.101 0.838 0.642 0.943 0.614 CB 1.509 71 residues pruned to eliminate duplicates Z: 14 7.507 1.840 0.603 0.571 0.769 0.692 CB 0.857 14 residues pruned to eliminate duplicates Z: 6 6.504 1.722 0.307 0.591 1.000 0.400 O 1.185 Z: 7 12.799 1.829 0.509 0.848 1.000 0.333 CA 1.404 7 residues pruned to eliminate duplicates Z: 9 10.143 1.917 0.614 0.761 0.875 0.750 CB 1.051 9 residues pruned to eliminate duplicates Z: 11 10.958 1.806 0.446 0.666 0.900 0.700 CB 1.264 11 residues pruned to eliminate duplicates Z: 6 3.482 1.580 0.047 0.381 1.000 0.600 CA 1.068 6 residues pruned to eliminate duplicates Z: 11 9.727 1.756 0.505 0.725 0.800 0.700 CB 1.188 11 residues pruned to eliminate duplicates Z: 13 17.081 1.939 0.931 0.678 0.917 0.667 CB 1.221 13 residues pruned to eliminate duplicates Z: 21 45.718 2.207 1.309 0.949 0.950 0.750 CB 1.458 21 residues pruned to eliminate duplicates Z: 28 37.376 2.165 0.556 0.913 1.000 0.926 CA 1.511 28 residues pruned to eliminate duplicates Z: 24 34.022 2.137 0.936 0.704 0.957 0.522 CB 1.489 24 residues pruned to eliminate duplicates Z: 19 18.467 1.978 0.676 0.605 0.889 0.722 CB 1.336 14 residues pruned to eliminate duplicates Z: 10 11.550 2.029 0.508 0.483 0.889 0.778 CA 1.441 10 residues pruned to eliminate duplicates Z: 24 22.296 2.112 0.547 0.447 1.000 0.652 CB 1.502 24 residues pruned to eliminate duplicates Z: 7 3.468 1.567 0.096 0.472 0.833 0.500 CB 1.018 Z: 9 12.490 1.861 0.747 0.521 1.000 0.625 CB 1.330 9 residues pruned to eliminate duplicates Z: 8 3.845 1.717 0.580 0.350 0.571 0.143 CB 1.103 Z: 13 16.201 1.755 0.564 0.945 1.000 1.000 CB 1.179 13 residues pruned to eliminate duplicates Z: 16 24.762 2.183 0.846 0.578 0.933 0.667 CB 1.577 Z: 12 16.939 1.911 0.832 0.670 1.000 0.909 CB 1.247 12 residues pruned to eliminate duplicates Z: 14 19.714 2.030 0.867 0.925 0.846 0.462 CB 1.196 14 residues pruned to eliminate duplicates Z: 18 25.326 2.041 1.005 0.733 0.941 0.882 CB 1.294 18 residues pruned to eliminate duplicates Z: 19 23.254 2.002 0.703 0.775 0.944 0.833 CB 1.336 19 residues pruned to eliminate duplicates Z: 40 45.368 2.038 0.699 0.796 1.000 0.769 CB 1.619 40 residues pruned to eliminate duplicates Z: 11 16.102 1.904 0.468 0.806 0.900 0.800 CA 1.549 11 residues pruned to eliminate duplicates Z: 7 9.617 1.771 0.777 0.779 0.833 0.500 CB 1.170 7 residues pruned to eliminate duplicates Z: 14 16.843 1.889 0.807 0.796 0.923 0.538 CB 1.144 14 residues pruned to eliminate duplicates Z: 29 36.458 2.056 1.152 0.711 1.000 0.750 CB 1.286 32 residues pruned to eliminate duplicates Z: 9 9.817 2.142 0.133 0.579 1.000 1.000 CB 1.325 9 residues pruned to eliminate duplicates Z: 14 9.909 1.677 0.692 0.450 0.923 0.615 CB 1.105 14 residues pruned to eliminate duplicates Z: 23 14.480 1.861 0.660 0.343 0.955 0.545 CB 1.242 23 residues pruned to eliminate duplicates Z: 7 8.631 1.860 0.717 0.670 0.833 0.500 CA 1.132 7 residues pruned to eliminate duplicates Z: 11 9.096 1.799 0.508 0.459 0.800 0.500 CB 1.382 14 residues pruned to eliminate duplicates Z: 31 27.482 1.923 0.956 0.641 0.900 0.567 CB 1.298 31 residues pruned to eliminate duplicates Z: 53 33.253 2.117 0.872 0.587 0.885 0.635 CB 1.210 41 residues pruned to eliminate duplicates Z: 15 18.875 2.011 0.699 0.712 1.000 0.714 CB 1.217 15 residues pruned to eliminate duplicates Z: 20 17.988 1.888 0.634 0.597 0.947 0.684 CB 1.286 14 residues pruned to eliminate duplicates Z: 25 31.027 2.116 0.799 0.718 0.958 0.792 CB 1.425 25 residues pruned to eliminate duplicates Z: 27 39.334 2.124 0.789 0.736 0.962 0.731 CB 1.708 27 residues pruned to eliminate duplicates Z: 13 18.135 1.965 0.697 0.842 1.000 0.750 CB 1.170 13 residues pruned to eliminate duplicates Z: 13 13.867 1.764 0.871 0.484 1.000 0.417 CB 1.232 13 residues pruned to eliminate duplicates Z: 16 18.953 1.951 0.781 0.586 1.000 0.867 CA 1.297 16 residues pruned to eliminate duplicates Z: 11 13.229 1.806 0.913 0.655 0.900 0.600 CB 1.165 11 residues pruned to eliminate duplicates Z: 13 18.166 2.016 0.759 0.861 0.917 0.833 CA 1.186 13 residues pruned to eliminate duplicates Z: 18 8.926 1.893 0.705 0.340 0.824 0.294 CB 0.969 18 residues pruned to eliminate duplicates Z: 47 22.042 1.835 0.530 0.543 0.935 0.739 CB 1.187 47 residues pruned to eliminate duplicates Z: 9 7.884 1.748 0.495 0.627 0.875 0.875 CB 1.082 9 residues pruned to eliminate duplicates Z: 10 9.948 1.589 0.350 0.854 0.889 0.667 N 1.284 10 residues pruned to eliminate duplicates Z: 7 3.262 1.163 0.500 0.381 1.000 1.000 CB 0.867 Z: 6 2.921 1.297 0.826 0.484 0.800 0.600 N 0.701 Z: 7 8.442 1.635 0.645 0.533 1.000 0.500 CB 1.240 7 residues pruned to eliminate duplicates Z: 38 24.723 1.963 0.688 0.582 0.946 0.703 CB 1.199 38 residues pruned to eliminate duplicates Z: 14 16.274 1.773 0.660 0.929 1.000 0.846 CB 1.073 14 residues pruned to eliminate duplicates Z: 8 4.708 1.771 0.810 0.196 0.714 0.571 CA 1.117 8 residues pruned to eliminate duplicates Z: 13 13.572 1.688 1.011 0.926 1.000 0.667 CB 0.809 13 residues pruned to eliminate duplicates Z: 18 24.182 1.986 0.898 0.703 0.882 0.706 CB 1.466 18 residues pruned to eliminate duplicates Z: 7 5.589 1.585 0.208 0.792 1.000 0.333 CB 0.922 7 residues pruned to eliminate duplicates Z: 10 12.144 1.859 0.943 0.376 0.889 0.556 CB 1.440 10 residues pruned to eliminate duplicates Z: 23 28.462 1.906 1.032 0.893 0.909 0.545 CB 1.238 21 residues pruned to eliminate duplicates 770 residues left after pruning, divided into chains as follows: A: 24 B: 10 C: 6 D: 11 E: 15 F: 246 G: 15 H: 16 I: 19 J: 33 K: 92 L: 18 M: 84 N: 181 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 40.46 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.540, Connect. = 0.786 for dens.mod. cycle 1 = 0.300, Contrast = 0.624, Connect. = 0.808 for dens.mod. cycle 2 = 0.300, Contrast = 0.766, Connect. = 0.830 for dens.mod. cycle 3 = 0.300, Contrast = 0.784, Connect. = 0.832 for dens.mod. cycle 4 = 0.300, Contrast = 0.803, Connect. = 0.834 for dens.mod. cycle 5 = 0.300, Contrast = 0.810, Connect. = 0.835 for dens.mod. cycle 6 = 0.300, Contrast = 0.818, Connect. = 0.836 for dens.mod. cycle 7 = 0.300, Contrast = 0.821, Connect. = 0.837 for dens.mod. cycle 8 = 0.300, Contrast = 0.823, Connect. = 0.838 for dens.mod. cycle 9 = 0.300, Contrast = 0.824, Connect. = 0.838 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4103 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 984 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 18 52.231 2.361 0.960 0.924 1.000 0.824 CA 1.922 B: 14 30.654 2.281 0.623 0.921 1.000 0.923 CB 1.616 C: 6 9.403 2.220 -0.124 0.885 1.000 0.600 CB 1.561 6 residues pruned to eliminate duplicates D: 16 41.236 2.367 0.961 0.923 0.933 0.800 CB 1.727 E: 24 45.132 2.367 0.780 0.937 0.957 0.783 CB 1.625 F: 29 63.424 2.434 0.865 0.932 1.000 0.786 CB 1.844 G: 29 57.096 2.394 0.896 0.928 0.929 0.821 CB 1.792 29 residues pruned to eliminate duplicates H: 17 49.603 2.396 0.981 0.921 1.000 0.938 CB 1.839 I: 20 29.805 2.069 0.796 0.787 0.947 0.684 CB 1.509 J: 17 46.237 2.338 1.088 0.917 0.938 0.625 CB 1.783 17 residues pruned to eliminate duplicates K: 16 31.103 2.195 0.557 0.920 1.000 0.933 CB 1.655 L: 26 50.699 2.284 1.010 0.908 0.960 0.680 CB 1.634 24 residues pruned to eliminate duplicates M: 25 50.753 2.335 1.033 0.904 0.958 0.458 CB 1.623 25 residues pruned to eliminate duplicates N: 15 46.263 2.494 0.853 0.932 1.000 0.929 CB 1.868 15 residues pruned to eliminate duplicates O: 19 48.016 2.300 1.044 0.897 1.000 0.611 CB 1.724 19 residues pruned to eliminate duplicates P: 24 54.692 2.421 1.062 0.941 0.957 0.913 CB 1.657 26 residues pruned to eliminate duplicates Q: 25 26.134 2.356 0.671 0.371 0.958 0.583 CB 1.623 R: 24 51.318 2.335 0.931 0.842 0.957 0.696 CB 1.849 17 residues pruned to eliminate duplicates S: 16 39.641 2.336 1.122 0.917 0.867 0.600 CB 1.681 16 residues pruned to eliminate duplicates T: 28 62.243 2.411 1.097 0.938 0.889 0.741 CB 1.854 30 residues pruned to eliminate duplicates U: 17 33.079 2.237 0.551 0.930 1.000 0.875 CB 1.666 16 residues pruned to eliminate duplicates V: 15 25.309 2.151 0.777 0.901 0.929 0.714 CB 1.361 15 residues pruned to eliminate duplicates W: 17 29.658 2.186 0.433 0.908 1.000 0.875 CB 1.681 17 residues pruned to eliminate duplicates X: 8 18.268 2.234 0.945 0.795 0.857 0.714 CA 1.432 9 residues pruned to eliminate duplicates Y: 16 29.512 2.314 0.370 0.901 1.000 0.800 CB 1.716 Z: 15 26.277 2.328 0.583 0.893 0.857 0.714 CA 1.596 Z: 21 61.369 2.423 1.250 0.930 1.000 0.700 CB 1.760 21 residues pruned to eliminate duplicates Z: 22 42.765 2.175 1.059 0.849 0.905 0.667 CB 1.707 16 residues pruned to eliminate duplicates Z: 38 30.528 2.055 0.719 0.616 1.000 0.649 CB 1.273 Z: 21 48.866 2.421 0.897 0.885 0.950 0.750 CB 1.808 Z: 14 25.258 2.231 0.438 0.920 1.000 0.923 CB 1.537 14 residues pruned to eliminate duplicates Z: 16 53.280 2.284 1.279 0.916 1.000 0.800 CA 1.867 16 residues pruned to eliminate duplicates Z: 23 47.527 2.293 1.016 0.863 0.955 0.682 CB 1.685 23 residues pruned to eliminate duplicates Z: 32 57.919 2.235 0.947 0.928 1.000 0.806 CB 1.674 32 residues pruned to eliminate duplicates Z: 14 35.865 2.308 0.639 0.909 1.000 0.846 CB 1.866 15 residues pruned to eliminate duplicates Z: 16 36.026 2.355 1.092 0.907 0.867 0.800 CB 1.548 16 residues pruned to eliminate duplicates Z: 14 34.355 2.367 0.925 0.844 1.000 0.615 CB 1.556 Z: 17 37.224 2.309 0.720 0.930 1.000 1.000 CA 1.638 16 residues pruned to eliminate duplicates Z: 23 50.773 2.466 0.986 0.856 0.955 0.818 CB 1.708 21 residues pruned to eliminate duplicates Z: 18 33.062 2.193 0.803 0.882 0.941 0.824 CB 1.560 18 residues pruned to eliminate duplicates Z: 16 26.484 2.144 1.055 0.861 0.867 0.733 CB 1.316 16 residues pruned to eliminate duplicates Z: 24 50.676 2.405 1.009 0.939 0.957 0.739 CB 1.589 24 residues pruned to eliminate duplicates Z: 17 28.910 2.222 0.694 0.901 0.938 0.875 CB 1.462 Z: 10 21.469 2.400 0.609 0.708 1.000 0.667 CB 1.534 Z: 23 50.297 2.463 0.916 0.825 0.955 0.682 CB 1.796 23 residues pruned to eliminate duplicates Z: 89 90.583 2.439 0.967 0.732 0.955 0.750 CB 1.712 56 residues pruned to eliminate duplicates Z: 15 28.719 2.355 0.473 0.835 0.929 0.571 CB 1.784 14 residues pruned to eliminate duplicates Z: 30 43.746 2.171 0.589 0.889 1.000 0.759 CB 1.696 Z: 89 85.758 2.387 0.810 0.723 0.966 0.750 CB 1.791 66 residues pruned to eliminate duplicates Z: 17 33.592 2.304 0.585 0.909 0.938 0.875 CB 1.742 17 residues pruned to eliminate duplicates Z: 29 63.143 2.399 0.887 0.917 1.000 0.714 CB 1.860 28 residues pruned to eliminate duplicates Z: 16 32.863 2.294 0.534 0.922 1.000 1.000 CB 1.696 16 residues pruned to eliminate duplicates Z: 14 39.242 2.290 1.156 0.911 1.000 0.615 CB 1.563 15 residues pruned to eliminate duplicates Z: 137 93.446 2.399 0.845 0.675 0.941 0.743 CB 1.637 106 residues pruned to eliminate duplicates Z: 30 20.194 2.155 0.574 0.384 0.862 0.552 CB 1.451 Z: 22 30.341 2.146 0.707 0.926 0.952 0.905 CB 1.331 Z: 66 67.354 2.439 0.841 0.641 0.938 0.708 CB 1.737 65 residues pruned to eliminate duplicates Z: 13 35.610 2.526 0.733 0.882 0.917 0.667 CB 1.852 13 residues pruned to eliminate duplicates Z: 43 52.983 2.346 0.963 0.654 0.929 0.762 CB 1.658 43 residues pruned to eliminate duplicates Z: 16 44.240 2.225 1.154 0.937 1.000 0.867 CB 1.658 16 residues pruned to eliminate duplicates Z: 25 53.860 2.364 0.951 0.922 1.000 0.875 CB 1.676 25 residues pruned to eliminate duplicates Z: 14 52.693 2.513 1.091 0.944 1.000 0.846 CB 1.926 14 residues pruned to eliminate duplicates Z: 15 34.364 2.370 0.834 0.790 0.929 0.643 CB 1.764 15 residues pruned to eliminate duplicates Z: 38 30.794 2.131 0.762 0.576 0.892 0.622 CB 1.405 14 residues pruned to eliminate duplicates Z: 77 51.999 2.231 0.754 0.581 0.961 0.553 CB 1.468 62 residues pruned to eliminate duplicates Z: 38 34.419 2.233 0.636 0.599 0.946 0.784 CB 1.490 Z: 22 33.549 2.175 0.773 0.928 0.952 0.905 CB 1.396 22 residues pruned to eliminate duplicates Z: 24 43.854 2.389 0.798 0.846 0.913 0.609 CB 1.732 24 residues pruned to eliminate duplicates Z: 17 33.476 2.281 0.605 0.915 1.000 0.812 CA 1.615 17 residues pruned to eliminate duplicates Z: 13 26.699 2.173 0.894 0.857 0.917 0.417 CB 1.505 Z: 29 47.985 2.425 0.718 0.789 0.964 0.786 CB 1.751 29 residues pruned to eliminate duplicates Z: 50 48.687 2.402 0.828 0.511 0.939 0.714 CB 1.668 40 residues pruned to eliminate duplicates Z: 16 23.989 2.225 0.477 0.871 0.933 0.867 CB 1.473 16 residues pruned to eliminate duplicates Z: 49 38.423 2.257 0.720 0.522 0.938 0.604 CB 1.491 30 residues pruned to eliminate duplicates Z: 133 85.190 2.315 0.864 0.661 0.947 0.689 CB 1.564 126 residues pruned to eliminate duplicates Z: 17 31.932 2.262 0.393 0.946 1.000 0.750 CA 1.752 17 residues pruned to eliminate duplicates Z: 14 33.020 2.295 0.614 0.928 1.000 0.615 CB 1.731 14 residues pruned to eliminate duplicates Z: 16 38.360 2.464 0.537 0.936 1.000 0.933 CA 1.821 16 residues pruned to eliminate duplicates Z: 29 66.034 2.400 1.079 0.936 0.964 0.821 CB 1.805 29 residues pruned to eliminate duplicates Z: 16 29.062 2.258 0.932 0.796 0.867 0.733 CB 1.531 16 residues pruned to eliminate duplicates Z: 14 32.993 2.314 0.530 0.933 1.000 1.000 CB 1.803 14 residues pruned to eliminate duplicates Z: 45 43.175 2.374 0.883 0.515 0.864 0.568 CB 1.661 32 residues pruned to eliminate duplicates Z: 17 57.100 2.362 1.288 0.928 1.000 0.750 CB 1.850 17 residues pruned to eliminate duplicates Z: 15 29.118 2.328 0.497 0.853 0.929 0.714 CA 1.777 15 residues pruned to eliminate duplicates Z: 32 50.064 2.148 0.777 0.895 1.000 0.677 CB 1.689 30 residues pruned to eliminate duplicates Z: 30 44.835 2.190 0.594 0.893 1.000 0.862 CB 1.711 30 residues pruned to eliminate duplicates Z: 21 40.927 2.352 0.837 0.845 0.900 0.750 CB 1.750 21 residues pruned to eliminate duplicates Z: 15 28.942 2.397 0.367 0.901 0.929 0.857 CB 1.814 15 residues pruned to eliminate duplicates Z: 15 42.143 2.471 0.680 0.915 1.000 0.857 CA 1.918 15 residues pruned to eliminate duplicates Z: 30 61.499 2.371 0.844 0.925 1.000 0.828 CB 1.834 30 residues pruned to eliminate duplicates Z: 96 58.609 2.234 0.641 0.626 0.947 0.653 CB 1.539 95 residues pruned to eliminate duplicates Z: 15 44.905 2.403 1.044 0.917 0.929 0.714 CB 1.857 15 residues pruned to eliminate duplicates Z: 43 40.779 2.286 0.770 0.569 0.952 0.595 CB 1.527 23 residues pruned to eliminate duplicates Z: 132 89.591 2.328 0.893 0.678 0.939 0.664 CB 1.606 128 residues pruned to eliminate duplicates Z: 17 34.777 2.299 0.779 0.829 0.938 0.688 CB 1.705 17 residues pruned to eliminate duplicates Z: 24 47.209 2.380 0.690 0.948 1.000 1.000 CB 1.690 24 residues pruned to eliminate duplicates Z: 43 29.627 2.215 0.584 0.526 0.905 0.643 CB 1.403 43 residues pruned to eliminate duplicates Z: 23 29.325 2.109 0.584 0.898 0.955 0.955 CB 1.402 23 residues pruned to eliminate duplicates Z: 14 30.851 2.386 0.586 0.887 1.000 0.692 CB 1.630 14 residues pruned to eliminate duplicates Z: 31 62.793 2.327 1.028 0.903 0.967 0.700 CB 1.791 31 residues pruned to eliminate duplicates Z: 20 15.725 1.948 0.400 0.479 0.947 0.579 CB 1.426 20 residues pruned to eliminate duplicates Z: 18 37.673 2.325 0.626 0.912 1.000 0.765 CB 1.712 18 residues pruned to eliminate duplicates Z: 30 41.498 2.153 0.459 0.905 1.000 0.862 CB 1.745 30 residues pruned to eliminate duplicates Z: 22 67.528 2.435 1.378 0.943 1.000 0.810 CB 1.763 25 residues pruned to eliminate duplicates Z: 17 46.241 2.354 0.885 0.902 1.000 0.875 CA 1.859 17 residues pruned to eliminate duplicates Z: 15 29.128 2.370 0.432 0.901 0.929 0.857 CB 1.763 15 residues pruned to eliminate duplicates Z: 30 63.865 2.400 0.928 0.924 0.966 0.862 CB 1.864 30 residues pruned to eliminate duplicates Z: 16 39.674 2.326 0.754 0.929 1.000 0.867 CB 1.757 16 residues pruned to eliminate duplicates Z: 23 47.284 2.414 0.908 0.854 0.909 0.545 CB 1.777 23 residues pruned to eliminate duplicates Z: 16 37.934 2.343 0.816 0.924 1.000 0.867 CB 1.617 16 residues pruned to eliminate duplicates Z: 15 33.797 2.439 0.804 0.877 0.929 0.857 CB 1.606 15 residues pruned to eliminate duplicates Z: 54 49.289 2.355 0.661 0.598 0.962 0.660 CB 1.638 49 residues pruned to eliminate duplicates Z: 14 27.949 2.260 0.785 0.847 1.000 0.615 CB 1.427 14 residues pruned to eliminate duplicates Z: 48 41.756 2.312 0.655 0.604 0.957 0.702 CB 1.507 49 residues pruned to eliminate duplicates Z: 17 45.978 2.368 0.878 0.911 1.000 0.875 CA 1.831 17 residues pruned to eliminate duplicates Z: 42 52.387 2.394 0.884 0.654 0.927 0.707 CB 1.696 42 residues pruned to eliminate duplicates Z: 13 23.193 2.315 0.446 0.877 0.917 0.833 CB 1.585 13 residues pruned to eliminate duplicates Z: 14 25.531 2.420 0.480 0.810 0.846 0.692 CA 1.784 14 residues pruned to eliminate duplicates Z: 8 13.760 2.151 0.429 0.748 0.857 0.857 CB 1.581 8 residues pruned to eliminate duplicates Z: 25 41.855 2.311 0.836 0.910 0.917 0.625 CB 1.558 25 residues pruned to eliminate duplicates Z: 15 43.368 2.286 1.085 0.923 1.000 0.786 CB 1.709 15 residues pruned to eliminate duplicates Z: 56 44.289 2.328 0.727 0.577 0.873 0.545 CB 1.580 56 residues pruned to eliminate duplicates Z: 6 11.798 2.031 0.451 0.806 1.000 0.800 CB 1.371 6 residues pruned to eliminate duplicates Z: 15 35.497 2.269 1.347 0.883 0.857 0.857 CB 1.503 15 residues pruned to eliminate duplicates Z: 16 33.691 2.362 0.918 0.831 0.933 0.600 CB 1.545 16 residues pruned to eliminate duplicates Z: 48 47.279 2.313 0.816 0.626 0.979 0.596 CB 1.490 48 residues pruned to eliminate duplicates Z: 25 48.153 2.362 0.779 0.934 1.000 0.917 CB 1.631 25 residues pruned to eliminate duplicates Z: 29 56.498 2.237 0.872 0.941 1.000 0.821 CB 1.770 32 residues pruned to eliminate duplicates Z: 37 40.797 2.314 0.654 0.627 1.000 0.667 CB 1.576 37 residues pruned to eliminate duplicates Z: 42 32.542 2.255 0.588 0.563 0.951 0.683 CB 1.404 37 residues pruned to eliminate duplicates Z: 17 37.070 2.309 0.897 0.903 1.000 0.500 CB 1.508 17 residues pruned to eliminate duplicates Z: 27 40.732 2.398 0.951 0.604 0.885 0.654 CB 1.748 27 residues pruned to eliminate duplicates Z: 18 39.230 2.354 0.784 0.923 0.941 0.824 CB 1.691 18 residues pruned to eliminate duplicates Z: 15 31.068 2.393 0.449 0.913 0.929 0.857 CB 1.826 15 residues pruned to eliminate duplicates Z: 8 10.677 1.890 0.452 0.829 0.857 0.857 CB 1.292 Z: 27 48.868 2.253 0.674 0.938 1.000 0.885 CB 1.767 27 residues pruned to eliminate duplicates Z: 34 33.827 2.254 0.695 0.565 0.848 0.606 CB 1.706 34 residues pruned to eliminate duplicates Z: 20 30.187 2.205 0.823 0.911 0.895 0.895 CB 1.365 20 residues pruned to eliminate duplicates Z: 12 20.914 2.123 0.465 0.657 1.000 0.727 CA 1.753 12 residues pruned to eliminate duplicates Z: 30 44.185 2.148 0.631 0.912 1.000 0.724 CB 1.659 30 residues pruned to eliminate duplicates Z: 91 84.020 2.351 0.833 0.708 0.956 0.700 CB 1.780 90 residues pruned to eliminate duplicates Z: 7 11.201 1.749 0.792 0.777 1.000 0.833 CB 1.142 7 residues pruned to eliminate duplicates Z: 17 36.697 2.316 0.636 0.913 1.000 0.812 CB 1.713 17 residues pruned to eliminate duplicates Z: 17 37.408 2.280 0.724 0.888 1.000 0.750 CB 1.713 17 residues pruned to eliminate duplicates Z: 22 42.682 2.388 0.785 0.847 0.952 0.857 CB 1.703 22 residues pruned to eliminate duplicates Z: 30 46.117 2.200 0.602 0.899 1.000 0.931 CB 1.736 30 residues pruned to eliminate duplicates Z: 15 45.515 2.475 0.941 0.914 1.000 0.929 CB 1.792 15 residues pruned to eliminate duplicates Z: 153 101.427 2.420 0.926 0.621 0.941 0.592 CB 1.674 141 residues pruned to eliminate duplicates Z: 16 37.386 2.292 0.794 0.939 1.000 0.800 CB 1.631 16 residues pruned to eliminate duplicates Z: 31 51.066 2.361 0.624 0.923 0.933 0.800 CB 1.831 31 residues pruned to eliminate duplicates Z: 27 40.152 2.397 0.922 0.582 0.923 0.577 CA 1.712 27 residues pruned to eliminate duplicates Z: 24 56.911 2.320 1.088 0.869 1.000 0.783 CA 1.790 24 residues pruned to eliminate duplicates Z: 22 42.150 2.339 0.851 0.859 0.905 0.524 CA 1.728 22 residues pruned to eliminate duplicates Z: 24 54.922 2.422 1.128 0.944 0.957 0.783 CB 1.609 24 residues pruned to eliminate duplicates Z: 24 44.712 2.387 0.753 0.940 0.957 0.870 CB 1.617 24 residues pruned to eliminate duplicates Z: 14 27.459 2.313 0.495 0.908 1.000 0.846 CB 1.564 14 residues pruned to eliminate duplicates Z: 31 45.959 2.223 0.725 0.859 0.933 0.833 CA 1.724 31 residues pruned to eliminate duplicates Z: 8 9.948 1.732 0.218 0.799 1.000 0.714 CA 1.373 8 residues pruned to eliminate duplicates Z: 68 60.752 2.391 0.791 0.612 0.910 0.582 CB 1.712 67 residues pruned to eliminate duplicates Z: 22 35.605 2.249 0.696 0.819 0.905 0.714 CA 1.707 22 residues pruned to eliminate duplicates Z: 14 30.049 2.454 0.504 0.878 0.923 0.692 CA 1.776 14 residues pruned to eliminate duplicates Z: 7 13.997 2.357 0.326 0.866 1.000 0.833 CB 1.339 7 residues pruned to eliminate duplicates Z: 16 23.978 2.288 0.181 0.898 1.000 0.867 CB 1.639 16 residues pruned to eliminate duplicates Z: 96 83.975 2.443 0.903 0.689 0.916 0.726 CB 1.702 96 residues pruned to eliminate duplicates Z: 6 14.802 1.908 0.968 0.700 1.000 0.600 CA 1.469 6 residues pruned to eliminate duplicates Z: 49 47.032 2.356 0.874 0.503 0.896 0.688 CB 1.711 49 residues pruned to eliminate duplicates Z: 31 61.089 2.374 0.780 0.924 1.000 0.833 CB 1.853 31 residues pruned to eliminate duplicates Z: 15 37.361 2.360 0.732 0.839 1.000 0.786 CA 1.825 15 residues pruned to eliminate duplicates Z: 38 38.289 2.297 0.750 0.603 0.919 0.784 CB 1.545 38 residues pruned to eliminate duplicates Z: 30 42.050 2.186 0.461 0.907 1.000 0.931 CB 1.738 30 residues pruned to eliminate duplicates Z: 15 36.794 2.262 0.879 0.911 1.000 0.929 CB 1.640 15 residues pruned to eliminate duplicates Z: 105 60.942 2.269 0.677 0.599 0.933 0.654 CB 1.532 105 residues pruned to eliminate duplicates Z: 30 39.916 2.179 0.420 0.872 1.000 0.862 CB 1.746 30 residues pruned to eliminate duplicates Z: 91 81.235 2.354 0.784 0.721 0.956 0.756 CB 1.748 91 residues pruned to eliminate duplicates Z: 24 43.204 2.364 0.612 0.925 1.000 0.957 CB 1.659 24 residues pruned to eliminate duplicates Z: 23 50.888 2.410 1.004 0.822 0.955 0.636 CA 1.780 23 residues pruned to eliminate duplicates Z: 14 29.158 2.362 0.571 0.881 0.846 0.769 CB 1.865 14 residues pruned to eliminate duplicates Z: 6 11.461 2.246 0.527 0.721 0.800 0.600 CA 1.530 6 residues pruned to eliminate duplicates Z: 18 44.725 2.443 0.924 0.834 0.941 0.706 CA 1.838 18 residues pruned to eliminate duplicates Z: 78 68.109 2.414 0.819 0.612 0.922 0.662 CB 1.724 78 residues pruned to eliminate duplicates Z: 13 39.492 2.398 1.153 0.930 0.917 0.917 CB 1.685 13 residues pruned to eliminate duplicates Z: 77 72.888 2.425 0.863 0.636 0.934 0.671 CB 1.744 76 residues pruned to eliminate duplicates Z: 6 10.995 1.940 0.380 0.826 1.000 0.800 CB 1.385 6 residues pruned to eliminate duplicates Z: 6 11.019 2.070 0.745 0.778 0.800 0.800 CB 1.334 6 residues pruned to eliminate duplicates Z: 32 62.459 2.332 0.870 0.927 1.000 0.806 CA 1.803 32 residues pruned to eliminate duplicates Z: 103 78.998 2.390 0.858 0.665 0.873 0.725 CB 1.733 103 residues pruned to eliminate duplicates Z: 27 26.518 2.175 0.705 0.625 0.885 0.654 CB 1.410 27 residues pruned to eliminate duplicates Z: 36 37.195 2.227 0.893 0.621 0.971 0.771 CB 1.369 35 residues pruned to eliminate duplicates Z: 14 29.085 2.401 0.657 0.805 0.923 0.692 CA 1.683 14 residues pruned to eliminate duplicates Z: 24 47.917 2.329 0.766 0.900 1.000 0.826 CB 1.735 24 residues pruned to eliminate duplicates Z: 17 42.164 2.279 1.111 0.869 0.938 0.688 CB 1.707 17 residues pruned to eliminate duplicates Z: 14 24.340 1.992 0.547 0.944 1.000 0.923 CB 1.517 Z: 11 26.902 2.247 1.036 0.694 0.900 0.400 CA 1.730 11 residues pruned to eliminate duplicates Z: 49 34.049 2.224 0.704 0.554 0.917 0.708 CB 1.342 49 residues pruned to eliminate duplicates Z: 13 13.020 1.772 0.635 0.592 0.917 0.250 CB 1.296 13 residues pruned to eliminate duplicates Z: 14 22.161 1.977 0.914 0.877 1.000 0.769 CB 1.179 Z: 32 62.709 2.319 0.940 0.905 1.000 0.742 CB 1.782 32 residues pruned to eliminate duplicates Z: 16 44.439 2.175 1.166 0.933 1.000 0.867 CB 1.699 16 residues pruned to eliminate duplicates Z: 30 43.525 2.152 0.648 0.918 0.966 0.828 CB 1.665 30 residues pruned to eliminate duplicates Z: 11 33.668 2.237 1.059 0.867 1.000 0.700 CA 1.692 12 residues pruned to eliminate duplicates Z: 27 41.809 2.211 0.494 0.920 1.000 0.846 CB 1.748 27 residues pruned to eliminate duplicates Z: 13 24.464 2.044 0.809 0.873 1.000 0.833 CB 1.390 14 residues pruned to eliminate duplicates Z: 17 21.075 2.129 0.393 0.850 1.000 0.875 CB 1.315 17 residues pruned to eliminate duplicates Z: 14 32.858 2.395 1.013 0.889 0.923 0.692 CB 1.474 14 residues pruned to eliminate duplicates Z: 15 16.077 2.084 0.616 0.418 0.929 0.714 CB 1.497 15 residues pruned to eliminate duplicates Z: 22 31.697 2.122 0.782 0.911 0.952 0.857 CB 1.362 22 residues pruned to eliminate duplicates Z: 35 58.958 2.523 0.858 0.672 0.971 0.706 CB 1.896 35 residues pruned to eliminate duplicates Z: 11 26.005 2.298 0.776 0.893 0.900 0.600 CA 1.607 11 residues pruned to eliminate duplicates Z: 23 27.016 2.056 0.591 0.878 0.955 0.864 CB 1.338 23 residues pruned to eliminate duplicates Z: 31 59.284 2.382 0.731 0.922 1.000 0.800 CB 1.846 31 residues pruned to eliminate duplicates Z: 30 67.110 2.395 0.974 0.935 1.000 0.759 CB 1.837 30 residues pruned to eliminate duplicates Z: 15 30.113 2.246 0.950 0.922 1.000 0.929 CB 1.292 15 residues pruned to eliminate duplicates Z: 23 54.738 2.473 0.862 0.853 1.000 0.682 CA 1.873 23 residues pruned to eliminate duplicates Z: 35 45.695 2.322 0.921 0.676 0.941 0.588 CB 1.588 35 residues pruned to eliminate duplicates Z: 14 25.480 2.268 0.293 0.919 1.000 0.846 CB 1.698 14 residues pruned to eliminate duplicates Z: 31 55.020 2.326 0.730 0.898 1.000 0.867 CB 1.786 31 residues pruned to eliminate duplicates Z: 22 44.175 2.411 0.917 0.829 0.857 0.714 CB 1.831 22 residues pruned to eliminate duplicates Z: 23 43.186 2.456 0.971 0.702 0.909 0.455 CB 1.741 23 residues pruned to eliminate duplicates Z: 17 42.568 2.169 1.265 0.901 1.000 0.688 CB 1.546 17 residues pruned to eliminate duplicates Z: 31 37.450 2.090 0.490 0.887 0.967 0.800 CB 1.637 31 residues pruned to eliminate duplicates Z: 12 26.263 2.178 0.746 0.898 1.000 1.000 CB 1.489 13 residues pruned to eliminate duplicates Z: 16 30.817 2.324 0.573 0.923 1.000 0.800 CB 1.530 16 residues pruned to eliminate duplicates Z: 30 57.957 2.383 0.796 0.931 0.966 0.828 CB 1.819 30 residues pruned to eliminate duplicates Z: 17 43.687 2.149 1.248 0.927 1.000 0.812 CB 1.584 17 residues pruned to eliminate duplicates Z: 30 69.323 2.389 1.002 0.934 1.000 0.552 CB 1.877 30 residues pruned to eliminate duplicates Z: 14 26.476 1.963 0.651 0.926 1.000 0.923 CB 1.589 14 residues pruned to eliminate duplicates Z: 21 43.123 2.220 1.263 0.944 0.950 0.700 CB 1.400 22 residues pruned to eliminate duplicates Z: 16 18.521 2.161 0.406 0.920 0.933 0.800 CB 1.187 16 residues pruned to eliminate duplicates Z: 24 49.633 2.407 1.211 0.935 0.870 0.435 CB 1.558 24 residues pruned to eliminate duplicates Z: 13 21.562 2.235 0.433 0.907 0.917 0.833 CB 1.506 13 residues pruned to eliminate duplicates Z: 6 8.931 2.283 0.278 0.621 0.800 0.600 CB 1.526 Z: 24 37.927 2.130 1.009 0.904 0.957 0.739 CB 1.376 23 residues pruned to eliminate duplicates Z: 16 26.508 2.154 0.822 0.917 0.933 0.867 CB 1.318 16 residues pruned to eliminate duplicates Z: 23 51.922 2.340 1.062 0.842 0.955 0.591 CB 1.791 23 residues pruned to eliminate duplicates Z: 32 39.783 2.049 0.632 0.860 1.000 0.774 CB 1.571 32 residues pruned to eliminate duplicates Z: 12 33.739 2.474 0.781 0.894 0.909 0.727 CB 1.822 12 residues pruned to eliminate duplicates Z: 51 51.894 2.388 0.826 0.525 0.940 0.680 CB 1.746 51 residues pruned to eliminate duplicates Z: 16 30.416 2.110 0.915 0.919 1.000 0.867 CB 1.369 16 residues pruned to eliminate duplicates Z: 7 12.234 2.008 0.234 0.874 1.000 1.000 CB 1.466 7 residues pruned to eliminate duplicates Z: 16 37.773 2.230 1.121 0.928 0.933 0.800 CB 1.547 16 residues pruned to eliminate duplicates Z: 11 19.449 2.240 0.717 0.679 0.900 0.600 CB 1.506 11 residues pruned to eliminate duplicates Z: 15 38.828 2.298 1.044 0.914 0.929 0.857 CA 1.683 15 residues pruned to eliminate duplicates Z: 90 82.255 2.354 0.759 0.722 0.978 0.787 CB 1.763 90 residues pruned to eliminate duplicates Z: 46 48.621 2.308 0.801 0.669 0.978 0.733 CB 1.525 48 residues pruned to eliminate duplicates Z: 7 12.376 1.804 0.747 0.856 1.000 1.000 CB 1.182 7 residues pruned to eliminate duplicates Z: 16 26.541 2.199 0.970 0.897 0.933 0.867 CB 1.213 16 residues pruned to eliminate duplicates Z: 31 58.761 2.373 0.693 0.936 1.000 0.900 CB 1.860 31 residues pruned to eliminate duplicates Z: 17 40.475 2.300 0.853 0.923 1.000 0.562 CA 1.669 17 residues pruned to eliminate duplicates Z: 47 44.010 2.313 0.776 0.611 0.913 0.674 CB 1.557 47 residues pruned to eliminate duplicates Z: 15 21.672 2.203 0.359 0.920 1.000 0.929 CB 1.363 15 residues pruned to eliminate duplicates Z: 16 25.455 2.185 0.946 0.924 0.933 0.800 CB 1.163 16 residues pruned to eliminate duplicates Z: 58 45.425 2.300 0.801 0.565 0.930 0.649 CB 1.466 58 residues pruned to eliminate duplicates Z: 13 19.189 2.264 0.344 0.885 0.917 0.833 CB 1.434 13 residues pruned to eliminate duplicates Z: 12 27.543 2.294 0.831 0.885 0.909 0.818 CB 1.570 12 residues pruned to eliminate duplicates Z: 50 36.593 2.235 0.766 0.535 0.918 0.714 CB 1.394 49 residues pruned to eliminate duplicates Z: 13 32.682 2.300 0.592 0.915 1.000 0.917 CB 1.820 13 residues pruned to eliminate duplicates Z: 29 64.397 2.401 1.122 0.937 0.964 0.643 CB 1.723 29 residues pruned to eliminate duplicates Z: 14 29.387 2.233 0.942 0.891 1.000 0.692 CB 1.351 14 residues pruned to eliminate duplicates Z: 16 32.971 2.256 1.022 0.891 0.933 0.600 CB 1.438 16 residues pruned to eliminate duplicates Z: 43 24.065 2.136 0.524 0.504 0.857 0.667 CB 1.326 43 residues pruned to eliminate duplicates Z: 16 38.218 2.338 1.005 0.919 0.933 0.800 CB 1.590 16 residues pruned to eliminate duplicates Z: 31 33.040 2.101 0.294 0.853 0.967 0.700 CB 1.696 31 residues pruned to eliminate duplicates Z: 17 54.727 2.400 1.357 0.921 1.000 0.688 CB 1.702 17 residues pruned to eliminate duplicates Z: 24 58.070 2.396 1.304 0.937 0.957 0.391 CB 1.596 26 residues pruned to eliminate duplicates Z: 18 43.903 2.351 0.796 0.896 1.000 0.824 CA 1.807 18 residues pruned to eliminate duplicates Z: 12 16.864 2.343 0.118 0.799 0.909 0.636 CA 1.645 12 residues pruned to eliminate duplicates Z: 15 35.284 2.258 0.772 0.893 1.000 0.714 CB 1.692 14 residues pruned to eliminate duplicates Z: 16 37.380 2.227 1.154 0.920 1.000 0.867 CB 1.417 17 residues pruned to eliminate duplicates Z: 13 23.739 2.510 0.231 0.855 0.917 0.750 CB 1.787 13 residues pruned to eliminate duplicates Z: 162 111.405 2.418 0.970 0.667 0.932 0.683 CB 1.695 162 residues pruned to eliminate duplicates Z: 15 26.070 2.277 0.268 0.932 1.000 1.000 CB 1.686 15 residues pruned to eliminate duplicates Z: 15 29.446 2.205 1.243 0.906 0.929 0.571 CB 1.219 15 residues pruned to eliminate duplicates Z: 15 15.057 1.948 0.807 0.525 0.857 0.357 CB 1.301 Z: 13 26.536 2.330 0.802 0.522 1.000 0.333 CB 1.785 13 residues pruned to eliminate duplicates Z: 12 21.897 2.221 0.785 0.668 0.909 0.545 CB 1.569 12 residues pruned to eliminate duplicates Z: 8 17.913 2.182 0.919 0.755 0.857 0.571 CB 1.503 8 residues pruned to eliminate duplicates Z: 62 47.698 2.259 0.663 0.637 0.934 0.721 CB 1.531 63 residues pruned to eliminate duplicates Z: 15 38.545 2.429 0.944 0.920 0.929 0.786 CB 1.655 15 residues pruned to eliminate duplicates Z: 17 36.323 2.109 1.014 0.891 0.938 0.750 CB 1.640 17 residues pruned to eliminate duplicates Z: 6 6.776 1.950 0.363 0.529 0.800 0.400 CB 1.385 6 residues pruned to eliminate duplicates Z: 22 38.851 2.151 1.121 0.889 0.952 0.619 CB 1.405 22 residues pruned to eliminate duplicates Z: 16 33.326 2.266 0.746 0.885 1.000 0.533 CB 1.570 16 residues pruned to eliminate duplicates Z: 13 45.294 2.455 1.251 0.930 1.000 0.667 CB 1.654 13 residues pruned to eliminate duplicates Z: 16 33.232 2.242 0.676 0.912 1.000 0.867 CB 1.617 16 residues pruned to eliminate duplicates Z: 17 10.229 1.660 0.711 0.646 0.875 0.688 CB 0.898 Z: 13 17.099 2.252 0.093 0.847 1.000 0.750 CB 1.490 13 residues pruned to eliminate duplicates Z: 29 44.759 2.357 0.731 0.707 1.000 0.821 CB 1.718 29 residues pruned to eliminate duplicates Z: 31 51.441 2.320 0.689 0.913 0.967 0.933 CB 1.755 31 residues pruned to eliminate duplicates Z: 18 43.632 2.347 0.759 0.918 0.941 0.765 CA 1.921 18 residues pruned to eliminate duplicates Z: 23 34.620 2.133 0.889 0.902 0.955 0.727 CB 1.368 23 residues pruned to eliminate duplicates Z: 6 14.489 1.946 0.614 0.830 1.000 0.800 CB 1.552 6 residues pruned to eliminate duplicates Z: 15 22.277 1.915 0.658 0.942 1.000 0.929 CB 1.301 Z: 17 39.980 2.303 0.844 0.909 0.938 0.812 CA 1.782 17 residues pruned to eliminate duplicates Z: 8 8.735 1.755 0.597 0.417 0.857 0.714 CB 1.498 8 residues pruned to eliminate duplicates Z: 7 10.061 2.091 0.461 0.679 0.833 0.833 CB 1.368 7 residues pruned to eliminate duplicates Z: 22 43.164 2.490 0.807 0.814 0.905 0.762 CB 1.761 22 residues pruned to eliminate duplicates Z: 6 14.766 2.058 0.580 0.822 1.000 0.800 CB 1.536 6 residues pruned to eliminate duplicates Z: 13 24.095 2.151 0.507 0.864 0.917 0.667 CB 1.716 13 residues pruned to eliminate duplicates Z: 21 29.033 2.160 0.732 0.930 0.900 0.700 CB 1.348 21 residues pruned to eliminate duplicates Z: 12 9.439 1.996 0.745 0.376 0.909 0.455 CB 1.026 9 residues pruned to eliminate duplicates Z: 17 41.517 2.293 0.911 0.925 1.000 0.750 CA 1.661 17 residues pruned to eliminate duplicates Z: 12 8.275 1.914 0.025 0.693 0.818 0.818 CB 1.303 12 residues pruned to eliminate duplicates Z: 30 52.434 2.210 0.777 0.904 1.000 0.828 CB 1.765 30 residues pruned to eliminate duplicates Z: 43 46.266 2.318 0.917 0.617 0.952 0.667 CB 1.511 46 residues pruned to eliminate duplicates Z: 31 45.852 2.124 0.728 0.893 1.000 0.800 CB 1.637 31 residues pruned to eliminate duplicates Z: 16 37.514 2.314 0.839 0.916 1.000 0.800 CB 1.607 16 residues pruned to eliminate duplicates Z: 23 54.130 2.392 0.929 0.873 1.000 0.773 CA 1.821 23 residues pruned to eliminate duplicates Z: 36 54.351 2.538 0.740 0.638 0.971 0.571 CB 1.882 36 residues pruned to eliminate duplicates Z: 15 26.492 1.930 0.820 0.939 0.929 0.643 CB 1.508 14 residues pruned to eliminate duplicates Z: 13 23.036 2.317 0.372 0.897 0.917 0.833 CB 1.633 13 residues pruned to eliminate duplicates Z: 13 13.211 2.107 0.272 0.831 0.833 0.667 CB 1.282 13 residues pruned to eliminate duplicates Z: 93 80.643 2.324 0.867 0.715 0.924 0.761 CB 1.727 93 residues pruned to eliminate duplicates Z: 12 26.468 2.321 0.573 0.876 1.000 0.636 CB 1.589 12 residues pruned to eliminate duplicates Z: 59 44.894 2.226 0.666 0.618 0.914 0.638 CB 1.556 54 residues pruned to eliminate duplicates Z: 15 31.061 2.322 0.646 0.909 0.929 0.643 CB 1.660 15 residues pruned to eliminate duplicates Z: 30 48.718 2.153 0.793 0.938 1.000 0.586 CB 1.630 30 residues pruned to eliminate duplicates Z: 17 37.262 2.072 1.237 0.902 0.875 0.688 CB 1.639 17 residues pruned to eliminate duplicates Z: 87 91.313 2.466 0.945 0.755 0.942 0.756 CB 1.736 87 residues pruned to eliminate duplicates Z: 16 32.260 2.282 0.620 0.918 1.000 0.933 CB 1.589 16 residues pruned to eliminate duplicates Z: 15 44.115 2.517 0.807 0.926 1.000 0.857 CB 1.818 15 residues pruned to eliminate duplicates Z: 8 11.746 1.815 0.447 0.851 1.000 0.857 CA 1.251 8 residues pruned to eliminate duplicates Z: 17 43.225 2.295 0.995 0.903 1.000 0.688 CB 1.683 17 residues pruned to eliminate duplicates Z: 6 13.663 2.276 0.380 0.865 1.000 0.800 CB 1.425 6 residues pruned to eliminate duplicates Z: 30 50.595 2.174 0.760 0.892 1.000 0.655 CB 1.763 30 residues pruned to eliminate duplicates Z: 6 3.511 1.756 -0.256 0.519 0.800 0.800 CB 1.475 Z: 15 31.974 2.227 1.143 0.927 0.929 0.786 CB 1.351 15 residues pruned to eliminate duplicates Z: 15 21.912 2.044 0.419 0.875 1.000 0.714 CB 1.469 15 residues pruned to eliminate duplicates Z: 97 85.134 2.417 1.001 0.684 0.917 0.646 CB 1.655 97 residues pruned to eliminate duplicates Z: 14 25.610 2.418 0.680 0.559 0.923 0.308 CA 1.787 14 residues pruned to eliminate duplicates Z: 17 34.684 2.170 0.824 0.880 0.938 0.750 CB 1.693 17 residues pruned to eliminate duplicates Z: 13 21.801 2.074 0.781 0.822 0.917 0.583 CB 1.406 11 residues pruned to eliminate duplicates Z: 14 26.926 1.959 0.867 0.943 1.000 0.538 CB 1.415 14 residues pruned to eliminate duplicates Z: 6 13.987 2.268 0.362 0.846 1.000 0.800 CB 1.504 6 residues pruned to eliminate duplicates Z: 76 71.208 2.439 0.793 0.648 0.960 0.707 CB 1.706 76 residues pruned to eliminate duplicates Z: 11 9.634 1.903 0.322 0.658 0.900 0.300 CB 1.161 10 residues pruned to eliminate duplicates Z: 6 14.271 2.149 0.800 0.757 0.800 0.600 CA 1.640 6 residues pruned to eliminate duplicates Z: 12 29.116 2.502 0.823 0.589 0.909 0.636 CB 1.944 12 residues pruned to eliminate duplicates Z: 14 21.273 1.927 0.570 0.924 1.000 0.923 CB 1.369 14 residues pruned to eliminate duplicates Z: 16 19.568 1.887 0.391 0.940 1.000 1.000 CB 1.337 16 residues pruned to eliminate duplicates Z: 16 41.894 2.305 0.941 0.930 1.000 0.600 CA 1.690 16 residues pruned to eliminate duplicates Z: 11 27.466 2.324 0.917 0.862 1.000 0.800 CB 1.431 11 residues pruned to eliminate duplicates Z: 28 24.682 2.033 0.633 0.610 0.926 0.667 CB 1.392 28 residues pruned to eliminate duplicates Z: 92 59.098 2.307 0.747 0.602 0.912 0.714 CB 1.530 92 residues pruned to eliminate duplicates Z: 13 26.973 2.012 0.657 0.934 1.000 0.833 CB 1.630 13 residues pruned to eliminate duplicates Z: 6 20.976 2.303 1.042 0.828 1.000 0.800 CA 1.502 6 residues pruned to eliminate duplicates Z: 43 31.718 2.228 0.703 0.500 0.881 0.690 CB 1.463 43 residues pruned to eliminate duplicates Z: 77 69.911 2.413 0.889 0.627 0.908 0.750 CB 1.720 77 residues pruned to eliminate duplicates Z: 22 31.190 2.169 0.915 0.894 0.857 0.667 CB 1.371 22 residues pruned to eliminate duplicates Z: 15 34.856 2.210 1.078 0.895 1.000 0.500 CB 1.454 15 residues pruned to eliminate duplicates Z: 14 20.515 2.037 0.547 0.851 1.000 0.846 CB 1.336 14 residues pruned to eliminate duplicates Z: 17 22.190 1.935 0.764 0.841 0.938 0.875 CB 1.294 17 residues pruned to eliminate duplicates Z: 32 56.823 2.280 0.932 0.915 1.000 0.871 CB 1.637 32 residues pruned to eliminate duplicates Z: 7 11.114 2.009 0.532 0.845 0.833 0.667 CB 1.315 7 residues pruned to eliminate duplicates Z: 9 5.956 1.755 0.303 0.479 0.750 0.250 CB 1.254 Z: 12 15.705 1.965 0.446 0.710 1.000 0.818 CB 1.378 12 residues pruned to eliminate duplicates Z: 87 76.472 2.347 0.781 0.710 0.919 0.686 CB 1.774 87 residues pruned to eliminate duplicates Z: 6 10.326 2.110 0.800 0.708 0.800 0.600 CA 1.259 6 residues pruned to eliminate duplicates Z: 47 56.912 2.347 0.953 0.675 0.935 0.717 CB 1.667 47 residues pruned to eliminate duplicates Z: 17 33.157 2.278 0.468 0.935 1.000 0.938 CA 1.729 17 residues pruned to eliminate duplicates Z: 18 41.815 2.185 1.114 0.849 1.000 0.706 CA 1.627 18 residues pruned to eliminate duplicates Z: 11 22.965 2.287 0.742 0.698 1.000 0.700 CB 1.522 11 residues pruned to eliminate duplicates Z: 6 4.486 1.644 0.366 0.570 0.600 0.600 CA 1.391 Z: 89 73.408 2.359 0.858 0.660 0.886 0.705 CB 1.736 89 residues pruned to eliminate duplicates Z: 6 9.378 1.871 0.254 0.708 1.000 0.400 CA 1.479 6 residues pruned to eliminate duplicates Z: 15 38.154 2.331 0.807 0.893 1.000 0.786 CB 1.737 15 residues pruned to eliminate duplicates Z: 74 48.278 2.240 0.749 0.571 0.945 0.534 CB 1.425 74 residues pruned to eliminate duplicates Z: 16 40.563 2.365 0.775 0.926 1.000 0.733 CB 1.749 16 residues pruned to eliminate duplicates Z: 23 21.779 2.149 0.625 0.589 0.909 0.727 CB 1.342 23 residues pruned to eliminate duplicates Z: 14 19.937 2.142 0.507 0.593 0.923 0.692 CB 1.698 14 residues pruned to eliminate duplicates Z: 11 9.730 1.936 0.584 0.513 0.900 0.600 CB 1.100 Z: 16 39.892 2.330 0.931 0.934 1.000 0.867 CB 1.595 16 residues pruned to eliminate duplicates Z: 8 10.910 1.713 0.506 0.566 1.000 1.000 CB 1.499 6 residues pruned to eliminate duplicates Z: 29 27.748 2.097 0.730 0.639 1.000 0.821 CB 1.269 29 residues pruned to eliminate duplicates Z: 29 18.105 1.851 0.539 0.563 0.821 0.643 CB 1.375 16 residues pruned to eliminate duplicates Z: 44 37.251 2.244 0.847 0.593 0.930 0.651 CB 1.349 44 residues pruned to eliminate duplicates Z: 13 16.535 2.086 0.757 0.434 0.833 0.417 CB 1.674 6 residues pruned to eliminate duplicates Z: 53 52.256 2.371 0.760 0.580 0.942 0.750 CB 1.706 53 residues pruned to eliminate duplicates Z: 91 89.036 2.351 0.927 0.740 0.967 0.756 CB 1.729 91 residues pruned to eliminate duplicates Z: 79 47.209 2.110 0.687 0.624 0.936 0.667 CB 1.427 68 residues pruned to eliminate duplicates Z: 31 31.461 2.219 0.680 0.647 0.900 0.733 CB 1.493 31 residues pruned to eliminate duplicates Z: 7 6.456 1.644 0.271 0.595 0.833 0.500 CA 1.382 7 residues pruned to eliminate duplicates Z: 6 7.560 2.214 0.195 0.826 0.800 0.800 CB 1.204 6 residues pruned to eliminate duplicates Z: 19 33.733 2.055 0.962 0.876 1.000 0.722 CB 1.433 19 residues pruned to eliminate duplicates Z: 19 25.889 2.268 0.548 0.586 1.000 0.667 CB 1.601 25 residues pruned to eliminate duplicates Z: 46 44.547 2.289 0.765 0.653 0.933 0.711 CB 1.528 46 residues pruned to eliminate duplicates Z: 15 18.602 2.107 0.327 0.909 1.000 1.000 CB 1.262 15 residues pruned to eliminate duplicates Z: 35 42.430 2.338 0.743 0.671 1.000 0.765 CB 1.525 35 residues pruned to eliminate duplicates Z: 25 41.056 2.213 1.038 0.930 0.958 0.750 CB 1.357 25 residues pruned to eliminate duplicates Z: 10 12.995 2.033 0.465 0.713 0.889 0.778 CB 1.349 10 residues pruned to eliminate duplicates Z: 14 28.073 1.954 0.847 0.925 1.000 0.846 CB 1.514 14 residues pruned to eliminate duplicates Z: 38 34.834 2.177 0.730 0.577 0.919 0.568 CB 1.536 38 residues pruned to eliminate duplicates Z: 29 51.263 2.377 0.707 0.877 0.929 0.750 CB 1.867 29 residues pruned to eliminate duplicates Z: 9 6.365 1.847 0.332 0.529 0.875 0.750 CB 1.016 Z: 45 35.404 2.221 0.721 0.551 0.909 0.455 CB 1.460 45 residues pruned to eliminate duplicates Z: 138 86.295 2.318 0.802 0.659 0.956 0.752 CB 1.593 138 residues pruned to eliminate duplicates Z: 15 16.107 1.990 0.269 0.822 1.000 0.786 CB 1.289 15 residues pruned to eliminate duplicates Z: 39 34.099 2.226 0.823 0.515 0.921 0.579 CB 1.459 39 residues pruned to eliminate duplicates Z: 17 48.305 2.519 1.005 0.869 1.000 0.562 CB 1.747 17 residues pruned to eliminate duplicates Z: 13 20.087 2.120 0.920 0.803 0.833 0.500 CB 1.312 13 residues pruned to eliminate duplicates Z: 19 27.521 2.287 0.522 0.619 1.000 0.667 CB 1.664 19 residues pruned to eliminate duplicates Z: 6 11.330 2.188 0.114 0.769 1.000 0.600 CA 1.638 6 residues pruned to eliminate duplicates Z: 6 6.380 1.769 0.315 0.637 0.800 0.600 CA 1.348 6 residues pruned to eliminate duplicates Z: 15 22.961 1.917 0.453 0.930 1.000 0.929 CB 1.541 15 residues pruned to eliminate duplicates Z: 18 43.898 2.356 0.807 0.904 1.000 0.882 CB 1.782 18 residues pruned to eliminate duplicates Z: 24 50.159 2.400 0.836 0.928 0.957 0.913 CB 1.738 24 residues pruned to eliminate duplicates Z: 14 21.804 1.954 0.633 0.935 1.000 0.846 CB 1.321 14 residues pruned to eliminate duplicates Z: 32 44.913 2.413 0.857 0.644 0.935 0.452 CB 1.683 32 residues pruned to eliminate duplicates Z: 35 25.034 2.158 0.598 0.585 0.882 0.765 CB 1.300 35 residues pruned to eliminate duplicates Z: 13 25.997 2.293 0.600 0.884 0.917 0.833 CB 1.612 13 residues pruned to eliminate duplicates Z: 11 19.938 2.059 0.614 0.883 0.900 0.700 CB 1.525 11 residues pruned to eliminate duplicates Z: 14 28.223 1.966 0.959 0.946 1.000 0.769 CB 1.406 14 residues pruned to eliminate duplicates Z: 14 16.424 2.197 0.204 0.853 1.000 0.769 CB 1.273 14 residues pruned to eliminate duplicates Z: 18 19.738 2.233 0.623 0.422 0.941 0.529 CB 1.522 18 residues pruned to eliminate duplicates Z: 27 22.069 2.148 0.794 0.466 0.808 0.500 CB 1.439 27 residues pruned to eliminate duplicates Z: 24 36.110 2.125 0.942 0.914 0.957 0.652 CB 1.349 24 residues pruned to eliminate duplicates Z: 16 12.221 2.034 0.406 0.526 0.733 0.400 CB 1.466 16 residues pruned to eliminate duplicates Z: 28 29.346 2.055 0.751 0.639 0.963 0.593 CB 1.431 28 residues pruned to eliminate duplicates Z: 19 25.806 2.263 0.602 0.626 0.944 0.667 CB 1.578 19 residues pruned to eliminate duplicates Z: 12 14.168 2.079 0.565 0.509 1.000 0.545 CB 1.301 12 residues pruned to eliminate duplicates Z: 47 26.857 2.013 0.578 0.573 0.913 0.543 CB 1.272 47 residues pruned to eliminate duplicates Z: 23 19.226 2.243 0.481 0.378 0.955 0.636 CB 1.472 23 residues pruned to eliminate duplicates Z: 23 54.502 2.372 1.263 0.929 0.955 0.545 CB 1.587 23 residues pruned to eliminate duplicates Z: 16 35.279 2.313 0.759 0.921 1.000 0.800 CA 1.575 16 residues pruned to eliminate duplicates Z: 33 49.355 2.258 0.710 0.881 1.000 0.750 CB 1.636 33 residues pruned to eliminate duplicates Z: 50 52.313 2.411 0.846 0.536 0.918 0.694 CB 1.764 50 residues pruned to eliminate duplicates Z: 101 76.843 2.347 0.765 0.688 0.930 0.730 CB 1.680 101 residues pruned to eliminate duplicates Z: 10 8.655 1.801 0.414 0.752 0.889 0.667 CB 1.018 10 residues pruned to eliminate duplicates Z: 31 52.253 2.126 1.067 0.900 1.000 0.667 CB 1.551 31 residues pruned to eliminate duplicates Z: 15 34.818 2.343 1.032 0.905 0.929 0.714 CB 1.498 15 residues pruned to eliminate duplicates Z: 13 18.803 2.330 0.996 0.575 0.917 0.667 CB 1.184 13 residues pruned to eliminate duplicates Z: 44 46.403 2.275 0.806 0.598 0.930 0.721 CB 1.686 44 residues pruned to eliminate duplicates Z: 26 35.834 2.322 0.686 0.668 1.000 0.800 CB 1.567 26 residues pruned to eliminate duplicates Z: 155 62.675 2.214 0.663 0.528 0.890 0.571 CB 1.499 199 residues pruned to eliminate duplicates Z: 57 37.502 2.151 0.809 0.585 0.946 0.661 CB 1.254 57 residues pruned to eliminate duplicates Z: 7 7.346 2.075 0.226 0.443 0.833 0.333 CB 1.502 7 residues pruned to eliminate duplicates Z: 15 41.509 2.298 0.987 0.943 1.000 0.857 CB 1.683 15 residues pruned to eliminate duplicates Z: 60 47.014 2.302 0.776 0.556 0.949 0.627 CB 1.494 60 residues pruned to eliminate duplicates Z: 16 21.802 1.886 0.551 0.915 1.000 0.733 CB 1.360 Z: 12 12.825 1.853 0.233 0.711 1.000 0.818 CB 1.398 12 residues pruned to eliminate duplicates Z: 7 5.500 1.725 0.341 0.629 0.833 0.667 CB 1.033 7 residues pruned to eliminate duplicates Z: 42 51.186 2.465 0.857 0.616 0.951 0.585 CB 1.646 42 residues pruned to eliminate duplicates Z: 6 7.722 2.000 0.457 0.811 0.800 0.600 CB 1.130 6 residues pruned to eliminate duplicates Z: 11 4.562 2.109 0.231 0.285 0.600 0.300 CB 1.179 Z: 76 70.167 2.435 0.830 0.615 0.947 0.720 CB 1.722 76 residues pruned to eliminate duplicates Z: 6 7.743 1.765 0.320 0.722 0.800 0.600 N 1.520 6 residues pruned to eliminate duplicates Z: 16 26.209 2.229 0.639 0.860 0.933 0.467 CB 1.460 16 residues pruned to eliminate duplicates Z: 30 47.394 2.326 0.613 0.891 0.931 0.690 CB 1.812 30 residues pruned to eliminate duplicates Z: 8 6.140 1.690 0.551 0.539 0.857 0.714 CB 0.995 8 residues pruned to eliminate duplicates Z: 16 34.044 2.291 0.978 0.886 0.933 0.733 CB 1.500 16 residues pruned to eliminate duplicates Z: 29 23.787 2.182 0.466 0.505 0.964 0.643 CB 1.450 29 residues pruned to eliminate duplicates Z: 16 33.566 2.291 0.727 0.911 1.000 0.933 CB 1.552 16 residues pruned to eliminate duplicates Z: 16 18.841 2.129 0.788 0.438 0.867 0.600 CB 1.571 16 residues pruned to eliminate duplicates Z: 6 14.402 2.153 0.434 0.808 1.000 0.400 CA 1.594 6 residues pruned to eliminate duplicates Z: 19 15.536 2.042 0.453 0.605 0.889 0.556 CB 1.257 Z: 8 7.666 1.777 0.579 0.290 0.857 0.429 CB 1.526 8 residues pruned to eliminate duplicates Z: 14 22.861 1.985 0.637 0.953 1.000 0.846 CB 1.343 15 residues pruned to eliminate duplicates Z: 16 38.796 2.267 0.972 0.892 1.000 0.733 CB 1.609 16 residues pruned to eliminate duplicates Z: 14 21.903 2.173 0.570 0.885 0.846 0.692 CB 1.520 14 residues pruned to eliminate duplicates Z: 24 32.735 2.108 1.136 0.899 0.870 0.652 CB 1.246 22 residues pruned to eliminate duplicates Z: 31 46.821 2.112 0.846 0.880 1.000 0.700 CB 1.589 31 residues pruned to eliminate duplicates Z: 25 37.100 2.281 0.550 0.910 0.917 0.833 CB 1.657 25 residues pruned to eliminate duplicates Z: 15 20.910 1.909 0.638 0.947 1.000 0.929 CB 1.236 15 residues pruned to eliminate duplicates Z: 23 36.510 2.153 1.037 0.905 0.955 0.545 CB 1.323 23 residues pruned to eliminate duplicates Z: 30 55.961 2.193 0.987 0.918 1.000 0.655 CB 1.683 30 residues pruned to eliminate duplicates Z: 16 29.143 2.233 0.652 0.852 0.933 0.600 CB 1.617 16 residues pruned to eliminate duplicates Z: 29 31.149 2.135 0.859 0.614 0.893 0.536 CB 1.492 29 residues pruned to eliminate duplicates Z: 15 27.882 1.912 0.841 0.929 1.000 0.786 CB 1.482 15 residues pruned to eliminate duplicates Z: 15 28.431 2.244 0.701 0.921 1.000 1.000 CB 1.402 15 residues pruned to eliminate duplicates Z: 6 2.828 1.688 -0.218 0.399 0.800 0.800 CB 1.333 Z: 10 8.986 2.018 0.660 0.458 0.778 0.667 CB 1.199 10 residues pruned to eliminate duplicates Z: 13 11.591 1.973 0.530 0.444 0.917 0.500 CB 1.280 12 residues pruned to eliminate duplicates Z: 49 40.676 2.255 0.845 0.590 0.896 0.646 CB 1.445 49 residues pruned to eliminate duplicates Z: 14 21.326 1.962 0.531 0.947 1.000 0.923 CB 1.361 14 residues pruned to eliminate duplicates Z: 7 14.339 2.132 0.589 0.757 1.000 0.500 CB 1.375 7 residues pruned to eliminate duplicates Z: 14 4.811 1.778 0.130 0.402 0.846 0.615 CB 0.870 13 residues pruned to eliminate duplicates Z: 6 5.833 2.000 -0.007 0.791 0.800 0.600 CB 1.271 6 residues pruned to eliminate duplicates Z: 32 22.987 2.040 0.734 0.402 0.903 0.516 CB 1.432 32 residues pruned to eliminate duplicates Z: 8 18.947 2.046 0.821 0.825 1.000 0.571 CA 1.450 8 residues pruned to eliminate duplicates Z: 18 21.179 2.112 0.550 0.696 0.941 0.529 CB 1.395 19 residues pruned to eliminate duplicates Z: 14 23.758 1.966 0.748 0.940 1.000 0.769 CB 1.331 15 residues pruned to eliminate duplicates Z: 11 13.268 1.968 0.377 0.695 1.000 0.600 CB 1.296 11 residues pruned to eliminate duplicates Z: 77 66.648 2.411 0.826 0.596 0.908 0.658 CB 1.745 77 residues pruned to eliminate duplicates Z: 15 13.997 1.827 0.181 0.890 0.929 0.857 CB 1.343 15 residues pruned to eliminate duplicates Z: 14 15.916 1.897 0.492 0.908 0.923 0.769 CB 1.200 14 residues pruned to eliminate duplicates Z: 83 66.081 2.269 0.850 0.676 0.951 0.695 CB 1.554 83 residues pruned to eliminate duplicates Z: 12 10.770 2.054 0.685 0.419 0.818 0.636 CB 1.248 12 residues pruned to eliminate duplicates Z: 20 9.947 1.561 0.626 0.559 0.842 0.632 CB 1.008 17 residues pruned to eliminate duplicates Z: 55 61.616 2.447 0.993 0.591 0.944 0.556 CB 1.668 55 residues pruned to eliminate duplicates Z: 16 37.613 2.183 1.009 0.869 1.000 0.667 CB 1.617 16 residues pruned to eliminate duplicates Z: 18 25.921 2.290 0.660 0.652 0.941 0.529 CB 1.525 18 residues pruned to eliminate duplicates Z: 50 33.232 2.215 0.564 0.604 0.918 0.755 CB 1.351 50 residues pruned to eliminate duplicates Z: 21 31.092 2.176 0.720 0.920 0.950 0.850 CB 1.378 21 residues pruned to eliminate duplicates Z: 27 34.269 2.360 0.824 0.593 0.808 0.692 CB 1.768 27 residues pruned to eliminate duplicates Z: 21 36.535 2.203 1.002 0.932 0.950 0.750 CB 1.361 21 residues pruned to eliminate duplicates Z: 56 54.634 2.376 0.811 0.605 0.909 0.673 CB 1.704 56 residues pruned to eliminate duplicates Z: 94 76.236 2.304 0.794 0.690 0.914 0.763 CB 1.759 94 residues pruned to eliminate duplicates Z: 31 47.182 2.173 0.787 0.867 0.967 0.800 CB 1.678 31 residues pruned to eliminate duplicates Z: 14 9.650 1.722 0.580 0.478 0.923 0.462 CB 1.089 14 residues pruned to eliminate duplicates Z: 9 7.414 1.893 0.093 0.468 1.000 0.625 CB 1.309 9 residues pruned to eliminate duplicates Z: 10 7.745 1.609 0.144 0.901 1.000 0.889 CB 1.001 10 residues pruned to eliminate duplicates Z: 7 10.611 1.791 0.574 0.831 1.000 0.500 CA 1.155 7 residues pruned to eliminate duplicates Z: 17 55.453 2.331 1.202 0.944 1.000 0.875 CA 1.871 17 residues pruned to eliminate duplicates Z: 22 38.447 2.240 0.777 0.899 1.000 0.905 CB 1.506 22 residues pruned to eliminate duplicates Z: 6 5.178 1.509 -0.027 0.784 1.000 0.600 CA 1.228 6 residues pruned to eliminate duplicates Z: 15 23.532 1.881 0.853 0.924 0.929 0.571 CB 1.365 15 residues pruned to eliminate duplicates Z: 15 20.527 1.909 0.519 0.935 1.000 0.929 CB 1.319 15 residues pruned to eliminate duplicates Z: 49 33.486 2.244 0.556 0.500 0.917 0.583 CB 1.510 49 residues pruned to eliminate duplicates Z: 19 12.393 2.094 0.285 0.357 0.778 0.444 CB 1.627 19 residues pruned to eliminate duplicates Z: 10 11.611 1.891 0.657 0.423 0.889 0.667 O 1.506 10 residues pruned to eliminate duplicates Z: 37 25.077 2.032 0.493 0.572 0.944 0.528 CB 1.360 37 residues pruned to eliminate duplicates Z: 30 26.842 2.223 0.568 0.491 0.931 0.655 CB 1.550 30 residues pruned to eliminate duplicates Z: 15 25.292 1.870 0.642 0.916 1.000 0.714 CB 1.554 15 residues pruned to eliminate duplicates Z: 87 81.084 2.386 1.035 0.704 0.907 0.721 CB 1.649 87 residues pruned to eliminate duplicates Z: 15 24.451 1.883 0.683 0.944 1.000 0.714 CB 1.428 15 residues pruned to eliminate duplicates Z: 31 29.525 2.225 0.738 0.408 0.933 0.667 CB 1.645 31 residues pruned to eliminate duplicates Z: 12 11.225 1.997 0.563 0.429 1.000 0.636 CB 1.167 12 residues pruned to eliminate duplicates Z: 43 40.646 2.240 0.705 0.575 0.929 0.548 CB 1.646 43 residues pruned to eliminate duplicates Z: 30 18.151 2.109 0.499 0.438 0.966 0.448 CB 1.177 30 residues pruned to eliminate duplicates Z: 49 37.360 2.212 0.722 0.631 0.958 0.625 CB 1.306 49 residues pruned to eliminate duplicates Z: 7 13.003 2.103 0.372 0.696 1.000 0.833 CA 1.539 7 residues pruned to eliminate duplicates Z: 6 10.725 2.027 0.419 0.817 1.000 0.800 CB 1.266 6 residues pruned to eliminate duplicates Z: 24 21.486 1.938 0.490 0.713 0.957 0.739 CB 1.337 24 residues pruned to eliminate duplicates Z: 16 39.829 2.317 0.929 0.916 1.000 0.800 CB 1.625 16 residues pruned to eliminate duplicates Z: 29 50.380 2.370 0.732 0.806 1.000 0.750 CA 1.776 29 residues pruned to eliminate duplicates Z: 17 35.242 2.217 0.990 0.864 0.938 0.750 CB 1.562 17 residues pruned to eliminate duplicates Z: 10 9.090 1.810 0.582 0.429 0.778 0.667 CB 1.465 10 residues pruned to eliminate duplicates Z: 7 4.501 1.829 -0.096 0.635 0.833 0.667 CB 1.175 7 residues pruned to eliminate duplicates Z: 11 32.451 2.381 1.000 0.906 0.900 0.700 CB 1.703 11 residues pruned to eliminate duplicates Z: 27 46.326 2.538 0.874 0.731 0.923 0.808 CB 1.681 27 residues pruned to eliminate duplicates Z: 29 37.956 2.002 0.665 0.912 0.964 0.821 CB 1.581 29 residues pruned to eliminate duplicates Z: 74 48.301 2.245 0.594 0.621 0.973 0.658 CB 1.449 74 residues pruned to eliminate duplicates Z: 7 3.240 1.763 0.263 0.516 0.833 0.667 N 0.701 Z: 15 34.886 2.127 1.274 0.890 1.000 0.500 CB 1.387 15 residues pruned to eliminate duplicates Z: 23 46.339 2.400 0.790 0.854 0.955 0.818 CB 1.780 23 residues pruned to eliminate duplicates Z: 27 22.203 2.186 0.825 0.367 0.885 0.769 CB 1.423 27 residues pruned to eliminate duplicates Z: 133 94.758 2.434 0.861 0.635 0.909 0.720 CB 1.764 133 residues pruned to eliminate duplicates Z: 15 28.880 2.168 1.299 0.919 0.929 0.429 CB 1.175 15 residues pruned to eliminate duplicates Z: 48 38.017 2.216 0.754 0.561 0.915 0.617 CB 1.469 48 residues pruned to eliminate duplicates Z: 8 8.174 1.933 0.637 0.428 0.857 0.429 CB 1.227 8 residues pruned to eliminate duplicates Z: 8 9.853 1.753 0.450 0.759 1.000 0.714 CB 1.164 8 residues pruned to eliminate duplicates Z: 17 27.544 2.090 0.906 0.841 0.875 0.688 CA 1.473 17 residues pruned to eliminate duplicates Z: 15 17.275 1.924 0.201 0.956 1.000 1.000 CB 1.373 14 residues pruned to eliminate duplicates Z: 41 28.088 2.185 0.709 0.476 0.800 0.600 CB 1.522 41 residues pruned to eliminate duplicates Z: 8 4.083 1.685 -0.048 0.731 0.857 0.429 CB 0.912 8 residues pruned to eliminate duplicates Z: 7 3.729 1.728 0.037 0.506 0.833 0.333 CA 1.014 7 residues pruned to eliminate duplicates Z: 19 30.211 2.173 0.636 0.786 0.944 0.833 CA 1.649 19 residues pruned to eliminate duplicates Z: 32 48.914 2.543 1.031 0.660 0.871 0.742 CB 1.683 32 residues pruned to eliminate duplicates Z: 24 35.998 2.230 0.817 0.695 1.000 0.696 CB 1.549 27 residues pruned to eliminate duplicates Z: 14 26.611 1.946 0.949 0.943 1.000 0.462 CB 1.349 14 residues pruned to eliminate duplicates Z: 43 20.796 1.875 0.595 0.533 0.905 0.571 CB 1.147 32 residues pruned to eliminate duplicates Z: 12 7.510 1.621 0.758 0.412 0.818 0.455 CB 1.065 12 residues pruned to eliminate duplicates Z: 8 3.954 1.777 0.141 0.345 0.857 0.429 CB 1.017 8 residues pruned to eliminate duplicates Z: 30 51.431 2.163 0.926 0.891 1.000 0.448 CB 1.648 30 residues pruned to eliminate duplicates Z: 16 44.868 2.165 1.408 0.918 1.000 0.467 CB 1.568 16 residues pruned to eliminate duplicates Z: 29 20.854 2.190 0.458 0.457 0.929 0.607 CB 1.389 29 residues pruned to eliminate duplicates Z: 57 39.441 2.199 0.735 0.559 0.964 0.643 CB 1.353 57 residues pruned to eliminate duplicates Z: 65 46.428 2.219 0.685 0.626 0.938 0.781 CB 1.471 65 residues pruned to eliminate duplicates Z: 48 74.876 2.377 0.901 0.861 1.000 0.830 CB 1.776 48 residues pruned to eliminate duplicates Z: 8 12.752 2.110 0.259 0.808 1.000 0.857 CA 1.387 8 residues pruned to eliminate duplicates Z: 12 35.887 2.332 1.263 0.897 0.909 0.818 CB 1.615 12 residues pruned to eliminate duplicates Z: 14 26.112 2.328 0.450 0.837 0.923 0.538 CB 1.739 14 residues pruned to eliminate duplicates Z: 14 18.831 2.173 0.788 0.415 0.923 0.692 CB 1.591 14 residues pruned to eliminate duplicates Z: 13 20.850 2.081 0.707 0.664 1.000 0.667 CB 1.455 13 residues pruned to eliminate duplicates Z: 61 48.708 2.303 0.829 0.563 0.950 0.617 CB 1.479 61 residues pruned to eliminate duplicates Z: 64 67.270 2.464 0.785 0.641 0.952 0.698 CB 1.773 64 residues pruned to eliminate duplicates Z: 34 25.524 1.883 0.803 0.607 0.909 0.424 CB 1.301 34 residues pruned to eliminate duplicates Z: 74 65.665 2.399 0.855 0.591 0.973 0.699 CB 1.627 74 residues pruned to eliminate duplicates Z: 8 6.351 1.724 0.399 0.803 0.857 0.857 CB 0.891 8 residues pruned to eliminate duplicates Z: 7 7.437 1.823 0.113 0.684 1.000 0.833 CB 1.263 Z: 74 75.752 2.419 0.854 0.659 0.959 0.616 CB 1.778 74 residues pruned to eliminate duplicates Z: 13 20.765 2.121 0.751 0.604 0.917 0.667 CB 1.596 13 residues pruned to eliminate duplicates Z: 12 9.845 1.584 0.367 0.767 0.818 0.273 CB 1.322 12 residues pruned to eliminate duplicates Z: 30 48.704 2.185 0.748 0.899 1.000 0.828 CB 1.694 30 residues pruned to eliminate duplicates Z: 24 46.210 2.530 0.882 0.723 0.957 0.652 CB 1.730 24 residues pruned to eliminate duplicates Z: 78 79.935 2.418 0.912 0.731 0.935 0.805 CB 1.712 78 residues pruned to eliminate duplicates Z: 35 47.920 2.431 0.802 0.657 0.941 0.618 CB 1.723 35 residues pruned to eliminate duplicates Z: 35 27.925 2.053 0.693 0.605 0.882 0.706 CB 1.413 35 residues pruned to eliminate duplicates Z: 53 69.471 2.314 0.919 0.790 0.962 0.692 CB 1.749 53 residues pruned to eliminate duplicates Z: 6 4.816 1.650 0.017 0.628 1.000 0.600 CB 1.138 Z: 30 38.777 2.163 0.607 0.877 0.931 0.828 CB 1.616 30 residues pruned to eliminate duplicates Z: 15 24.438 1.858 0.821 0.921 0.929 0.571 CB 1.463 15 residues pruned to eliminate duplicates Z: 6 3.819 1.608 -0.098 0.616 0.800 0.600 N 1.319 Z: 26 20.363 1.873 0.436 0.678 0.960 0.720 CB 1.339 26 residues pruned to eliminate duplicates Z: 7 11.486 1.887 0.359 0.838 1.000 1.000 CA 1.367 7 residues pruned to eliminate duplicates Z: 32 38.553 2.290 0.791 0.637 0.935 0.581 CB 1.587 34 residues pruned to eliminate duplicates Z: 16 36.664 2.160 1.266 0.892 0.933 0.333 CB 1.489 16 residues pruned to eliminate duplicates Z: 138 98.012 2.393 0.869 0.652 0.942 0.766 CB 1.727 138 residues pruned to eliminate duplicates Z: 10 7.662 1.607 0.266 0.868 0.889 0.556 CB 1.032 10 residues pruned to eliminate duplicates Z: 14 24.259 1.898 0.793 0.931 1.000 0.769 CB 1.381 14 residues pruned to eliminate duplicates Z: 6 5.997 1.741 0.242 0.763 1.000 0.600 CB 0.982 6 residues pruned to eliminate duplicates Z: 16 49.497 2.351 1.213 0.911 0.933 0.667 CA 1.866 16 residues pruned to eliminate duplicates Z: 73 72.761 2.380 0.879 0.643 0.944 0.694 CB 1.777 73 residues pruned to eliminate duplicates Z: 49 29.661 2.222 0.463 0.578 0.938 0.667 CB 1.304 49 residues pruned to eliminate duplicates Z: 18 13.339 2.061 0.356 0.449 0.824 0.647 CB 1.482 18 residues pruned to eliminate duplicates Z: 12 10.517 2.056 0.667 0.319 0.727 0.636 CB 1.553 12 residues pruned to eliminate duplicates Z: 32 45.513 2.176 0.645 0.848 1.000 0.839 CB 1.695 32 residues pruned to eliminate duplicates Z: 16 27.491 2.129 0.862 0.895 0.800 0.667 CB 1.605 16 residues pruned to eliminate duplicates Z: 7 4.177 1.706 -0.041 0.569 0.833 0.667 CA 1.170 7 residues pruned to eliminate duplicates Z: 6 4.300 1.506 0.044 0.606 1.000 0.800 CB 1.105 6 residues pruned to eliminate duplicates Z: 18 45.601 2.409 1.108 0.877 0.941 0.824 CB 1.680 18 residues pruned to eliminate duplicates Z: 38 36.046 2.260 0.671 0.582 0.919 0.622 CB 1.578 38 residues pruned to eliminate duplicates Z: 10 9.054 1.588 0.432 0.826 1.000 0.778 CA 1.001 10 residues pruned to eliminate duplicates Z: 6 3.300 1.592 -0.153 0.748 1.000 0.600 CA 0.877 6 residues pruned to eliminate duplicates Z: 10 12.830 1.719 0.708 0.664 1.000 0.556 CB 1.251 16 residues pruned to eliminate duplicates Z: 17 26.828 2.240 0.705 0.678 1.000 0.750 CB 1.491 18 residues pruned to eliminate duplicates Z: 7 5.740 2.174 0.695 0.127 0.667 0.500 CB 1.522 7 residues pruned to eliminate duplicates 6 1.953 1.506 0.505 0.298 0.800 0.800 CB 0.604 ? Z: 12 8.975 1.559 0.267 0.890 1.000 0.727 CB 0.985 11 residues pruned to eliminate duplicates Z: 136 97.604 2.421 0.976 0.620 0.941 0.600 CB 1.667 136 residues pruned to eliminate duplicates Z: 24 16.314 1.854 0.459 0.683 0.870 0.609 CB 1.223 24 residues pruned to eliminate duplicates Z: 15 13.133 1.940 0.545 0.376 0.929 0.357 CB 1.439 15 residues pruned to eliminate duplicates Z: 35 18.917 1.981 0.359 0.551 0.882 0.500 CB 1.300 25 residues pruned to eliminate duplicates Z: 11 24.411 2.212 0.989 0.660 1.000 0.700 CB 1.512 11 residues pruned to eliminate duplicates Z: 12 15.424 1.936 0.754 0.595 0.909 0.818 CA 1.376 12 residues pruned to eliminate duplicates Z: 16 14.717 2.212 0.615 0.409 0.800 0.667 CB 1.463 16 residues pruned to eliminate duplicates Z: 51 56.270 2.211 0.780 0.749 0.940 0.700 CB 1.722 51 residues pruned to eliminate duplicates Z: 7 4.325 1.282 0.447 0.683 1.000 0.667 CB 0.805 7 residues pruned to eliminate duplicates Z: 13 11.258 1.989 0.520 0.560 0.833 0.667 CB 1.217 13 residues pruned to eliminate duplicates Z: 81 82.650 2.418 0.902 0.747 0.950 0.738 CB 1.696 81 residues pruned to eliminate duplicates Z: 12 21.670 2.138 0.654 0.824 1.000 0.818 CB 1.396 12 residues pruned to eliminate duplicates Z: 7 6.469 1.948 0.276 0.380 1.000 0.500 CA 1.207 7 residues pruned to eliminate duplicates Z: 15 10.224 2.072 0.597 0.448 0.714 0.571 CB 1.219 15 residues pruned to eliminate duplicates Z: 14 20.616 1.930 0.615 0.938 1.000 0.923 CB 1.277 14 residues pruned to eliminate duplicates Z: 27 21.592 1.879 0.715 0.720 0.962 0.654 CB 1.120 27 residues pruned to eliminate duplicates Z: 8 4.319 1.403 0.224 0.498 0.857 0.571 C 1.112 Z: 6 8.200 1.966 0.663 0.435 0.800 0.600 CB 1.500 6 residues pruned to eliminate duplicates Z: 32 37.890 2.234 1.044 0.615 0.871 0.677 CB 1.535 38 residues pruned to eliminate duplicates Z: 7 13.213 2.132 0.471 0.656 1.000 0.833 CA 1.487 7 residues pruned to eliminate duplicates Z: 15 23.554 1.906 0.768 0.938 1.000 0.714 CB 1.299 15 residues pruned to eliminate duplicates Z: 35 56.794 2.266 0.797 0.840 1.000 0.765 CB 1.785 35 residues pruned to eliminate duplicates Z: 15 5.928 2.062 0.118 0.273 0.714 0.357 CB 1.244 15 residues pruned to eliminate duplicates Z: 15 8.407 2.082 0.064 0.513 0.857 0.714 CB 1.168 15 residues pruned to eliminate duplicates Z: 7 13.542 1.892 0.382 0.862 1.000 0.500 CB 1.553 8 residues pruned to eliminate duplicates Z: 6 4.631 1.644 0.226 0.462 0.800 0.600 C 1.336 Z: 11 20.732 2.131 0.413 0.897 1.000 0.900 CB 1.558 11 residues pruned to eliminate duplicates Z: 33 15.840 1.779 0.457 0.602 0.938 0.625 CB 1.045 33 residues pruned to eliminate duplicates Z: 10 17.083 2.219 0.706 0.573 0.889 0.556 CB 1.577 10 residues pruned to eliminate duplicates Z: 11 21.183 2.196 0.650 0.693 1.000 0.500 CB 1.550 11 residues pruned to eliminate duplicates Z: 29 38.028 2.403 0.884 0.543 0.929 0.750 CB 1.639 29 residues pruned to eliminate duplicates Z: 27 43.398 2.168 0.677 0.932 1.000 0.808 CB 1.634 27 residues pruned to eliminate duplicates Z: 6 3.030 1.699 0.194 0.296 0.800 0.600 CB 1.048 Z: 97 74.086 2.293 0.771 0.698 0.938 0.740 CB 1.659 97 residues pruned to eliminate duplicates Z: 14 26.322 1.982 0.925 0.953 1.000 0.923 CB 1.317 14 residues pruned to eliminate duplicates Z: 6 4.434 1.881 0.288 0.223 1.000 0.800 CB 1.132 Z: 17 21.537 2.205 0.526 0.656 0.938 0.750 CB 1.477 17 residues pruned to eliminate duplicates Z: 40 42.004 2.306 0.833 0.590 0.897 0.564 CB 1.627 40 residues pruned to eliminate duplicates Z: 6 6.951 1.638 0.729 0.739 0.800 0.400 CB 1.108 Z: 18 18.683 2.209 0.808 0.437 0.882 0.529 CB 1.372 18 residues pruned to eliminate duplicates Z: 6 4.446 1.585 0.007 0.690 1.000 1.000 N 1.046 Z: 14 22.054 1.976 0.595 0.951 1.000 0.615 CB 1.337 14 residues pruned to eliminate duplicates Z: 17 13.413 1.864 0.821 0.435 0.938 0.500 CB 1.127 17 residues pruned to eliminate duplicates Z: 10 8.074 1.804 0.231 0.501 0.889 0.444 CB 1.362 11 residues pruned to eliminate duplicates Z: 29 32.546 2.141 0.994 0.682 0.929 0.643 CB 1.313 29 residues pruned to eliminate duplicates Z: 39 38.140 2.251 0.783 0.571 0.921 0.684 CB 1.562 39 residues pruned to eliminate duplicates Z: 7 4.907 1.489 0.185 0.887 1.000 0.833 CB 0.819 Z: 18 23.209 2.016 1.023 0.609 0.882 0.706 CB 1.411 18 residues pruned to eliminate duplicates Z: 9 15.647 1.940 0.989 0.679 0.875 0.750 CB 1.390 9 residues pruned to eliminate duplicates Z: 13 24.438 2.193 0.640 0.912 1.000 1.000 CB 1.390 13 residues pruned to eliminate duplicates Z: 21 23.188 2.069 0.792 0.628 0.900 0.600 CB 1.378 56 residues pruned to eliminate duplicates Z: 19 26.096 2.150 1.179 0.631 0.944 0.722 CB 1.229 19 residues pruned to eliminate duplicates Z: 38 26.874 2.009 0.618 0.589 0.946 0.514 CB 1.318 38 residues pruned to eliminate duplicates Z: 11 23.511 2.200 0.821 0.752 1.000 0.800 CB 1.481 11 residues pruned to eliminate duplicates Z: 41 32.732 2.244 0.565 0.519 0.925 0.650 CB 1.562 41 residues pruned to eliminate duplicates Z: 21 42.026 2.434 0.850 0.759 0.950 0.600 CB 1.744 21 residues pruned to eliminate duplicates Z: 7 7.603 1.924 0.046 0.714 1.000 0.833 CA 1.271 7 residues pruned to eliminate duplicates Z: 12 6.432 1.622 0.823 0.224 0.909 0.273 CB 0.996 12 residues pruned to eliminate duplicates Z: 15 21.298 2.143 0.316 0.906 1.000 0.929 CB 1.436 15 residues pruned to eliminate duplicates Z: 24 28.308 2.301 0.803 0.534 0.870 0.652 CB 1.582 24 residues pruned to eliminate duplicates Z: 30 45.063 2.127 0.855 0.870 0.966 0.586 CB 1.603 30 residues pruned to eliminate duplicates Z: 17 34.960 2.325 0.869 0.880 0.875 0.688 CB 1.666 17 residues pruned to eliminate duplicates Z: 60 78.913 2.463 1.094 0.705 0.949 0.780 CB 1.742 60 residues pruned to eliminate duplicates Z: 6 5.944 1.493 0.861 0.367 1.000 0.400 O 1.104 Z: 6 7.656 1.534 0.531 0.680 1.000 0.800 CB 1.236 6 residues pruned to eliminate duplicates Z: 7 5.212 1.428 0.331 0.875 1.000 1.000 CB 0.815 7 residues pruned to eliminate duplicates Z: 15 19.838 1.901 0.746 0.901 0.929 0.786 CB 1.228 15 residues pruned to eliminate duplicates Z: 15 26.420 1.907 0.673 0.941 1.000 0.786 CB 1.535 15 residues pruned to eliminate duplicates Z: 21 26.550 2.168 0.636 0.698 0.900 0.700 CB 1.552 21 residues pruned to eliminate duplicates Z: 23 13.920 1.762 0.327 0.727 1.000 0.727 CB 1.034 23 residues pruned to eliminate duplicates Z: 6 15.491 2.059 0.437 0.827 1.000 0.600 CB 1.764 6 residues pruned to eliminate duplicates Z: 7 4.734 1.486 0.158 0.866 1.000 1.000 CB 0.822 7 residues pruned to eliminate duplicates Z: 23 42.448 2.162 1.263 0.923 0.955 0.636 CB 1.362 29 residues pruned to eliminate duplicates Z: 67 88.691 2.445 1.159 0.736 0.970 0.727 CB 1.726 67 residues pruned to eliminate duplicates Z: 15 30.955 2.192 1.036 0.859 1.000 0.571 CB 1.364 15 residues pruned to eliminate duplicates Z: 6 2.406 1.659 0.124 0.178 0.800 0.600 N 1.063 Z: 42 36.314 2.187 0.729 0.512 0.902 0.561 CB 1.642 42 residues pruned to eliminate duplicates Z: 6 7.147 1.883 0.397 0.804 1.000 0.800 CB 0.932 6 residues pruned to eliminate duplicates Z: 6 6.562 2.036 0.385 0.362 0.800 0.600 CB 1.507 6 residues pruned to eliminate duplicates Z: 12 13.025 1.853 0.858 0.436 0.909 0.636 CB 1.340 18 residues pruned to eliminate duplicates Z: 25 25.285 2.134 0.578 0.644 0.958 0.542 CB 1.398 Z: 31 18.435 1.849 0.503 0.604 0.967 0.600 CB 1.135 31 residues pruned to eliminate duplicates Z: 15 35.055 2.179 0.829 0.903 1.000 0.286 CB 1.675 15 residues pruned to eliminate duplicates Z: 52 32.827 2.121 0.613 0.536 0.961 0.627 CB 1.351 52 residues pruned to eliminate duplicates Z: 11 4.117 1.636 0.352 0.185 0.800 0.400 N 1.074 Z: 18 34.897 2.373 0.864 0.613 1.000 0.706 CA 1.719 18 residues pruned to eliminate duplicates Z: 14 25.172 1.895 0.937 0.921 1.000 0.615 CB 1.339 14 residues pruned to eliminate duplicates Z: 12 7.853 1.520 0.260 0.873 1.000 0.727 CB 0.900 12 residues pruned to eliminate duplicates Z: 14 28.047 2.151 0.954 0.892 0.923 0.385 CB 1.441 14 residues pruned to eliminate duplicates Z: 13 24.426 2.260 0.644 0.862 0.917 0.667 CB 1.520 13 residues pruned to eliminate duplicates Z: 9 7.172 1.874 0.273 0.621 0.875 0.375 CB 1.083 9 residues pruned to eliminate duplicates Z: 40 76.829 2.383 1.111 0.868 1.000 0.872 CB 1.787 40 residues pruned to eliminate duplicates Z: 7 6.860 1.886 -0.004 0.508 1.000 0.667 N 1.478 7 residues pruned to eliminate duplicates Z: 54 54.904 2.382 0.786 0.613 0.962 0.679 CB 1.655 54 residues pruned to eliminate duplicates Z: 10 6.518 1.706 0.504 0.482 0.889 0.889 CB 0.970 8 residues pruned to eliminate duplicates Z: 9 17.186 2.392 0.673 0.501 1.000 0.875 CB 1.517 9 residues pruned to eliminate duplicates Z: 52 61.285 2.415 0.907 0.618 0.961 0.667 CB 1.735 52 residues pruned to eliminate duplicates Z: 42 36.131 2.230 0.785 0.578 0.854 0.610 CB 1.540 42 residues pruned to eliminate duplicates Z: 9 2.484 1.600 -0.100 0.434 0.750 0.375 CB 0.872 7 residues pruned to eliminate duplicates Z: 17 31.815 2.166 0.784 0.899 0.938 0.500 CB 1.569 17 residues pruned to eliminate duplicates Z: 17 23.474 1.904 0.685 0.863 0.938 0.812 CB 1.432 17 residues pruned to eliminate duplicates Z: 40 56.240 2.424 0.774 0.677 0.974 0.769 CB 1.826 40 residues pruned to eliminate duplicates Z: 9 4.808 1.467 0.195 0.779 1.000 0.750 CB 0.758 Z: 36 32.305 2.250 0.558 0.672 0.943 0.771 CB 1.410 36 residues pruned to eliminate duplicates Z: 6 3.841 2.074 -0.208 0.337 0.800 0.400 CB 1.562 6 residues pruned to eliminate duplicates Z: 48 62.828 2.286 0.743 0.830 0.979 0.745 CB 1.766 48 residues pruned to eliminate duplicates Z: 12 16.415 2.238 0.269 0.816 0.909 0.455 CB 1.457 12 residues pruned to eliminate duplicates Z: 65 44.307 2.273 0.782 0.518 0.922 0.547 CB 1.457 65 residues pruned to eliminate duplicates Z: 6 2.307 1.567 -0.039 0.164 0.800 0.400 CB 1.288 Using tripeptides from previous cycle as seeds Z: 16 27.359 2.138 0.970 0.839 0.933 0.600 CB 1.341 16 residues pruned to eliminate duplicates Z: 17 24.034 2.015 0.726 0.862 0.875 0.688 CB 1.450 17 residues pruned to eliminate duplicates Z: 14 36.192 2.286 1.156 0.897 1.000 0.538 CB 1.458 25 residues pruned to eliminate duplicates Z: 14 46.672 2.447 1.255 0.917 1.000 0.846 CB 1.656 14 residues pruned to eliminate duplicates Z: 13 43.730 2.449 1.258 0.920 1.000 0.667 CB 1.607 13 residues pruned to eliminate duplicates Z: 23 39.662 2.321 1.002 0.684 0.955 0.409 CB 1.611 14 residues pruned to eliminate duplicates Z: 13 34.746 2.400 0.879 0.890 1.000 0.417 CB 1.600 13 residues pruned to eliminate duplicates Z: 15 36.354 2.325 1.258 0.779 0.929 0.571 CB 1.558 15 residues pruned to eliminate duplicates Z: 25 35.842 2.237 0.976 0.644 1.000 0.625 CB 1.447 24 residues pruned to eliminate duplicates Z: 15 32.871 2.247 1.229 0.903 1.000 0.357 CB 1.250 15 residues pruned to eliminate duplicates Z: 25 32.954 2.146 1.002 0.634 1.000 0.500 CB 1.381 25 residues pruned to eliminate duplicates Z: 24 36.796 2.228 1.038 0.691 0.957 0.565 CB 1.484 24 residues pruned to eliminate duplicates Z: 25 27.464 2.154 0.715 0.599 1.000 0.750 CB 1.381 25 residues pruned to eliminate duplicates Z: 25 34.112 2.223 0.946 0.638 1.000 0.625 CB 1.414 25 residues pruned to eliminate duplicates Z: 25 31.307 2.190 0.735 0.666 0.958 0.625 CB 1.504 25 residues pruned to eliminate duplicates Z: 26 25.225 2.141 0.590 0.661 0.880 0.640 CB 1.450 25 residues pruned to eliminate duplicates Z: 6 8.727 1.945 0.654 0.369 1.000 0.400 CA 1.396 6 residues pruned to eliminate duplicates Z: 24 29.678 2.220 0.556 0.712 0.957 0.652 CB 1.546 24 residues pruned to eliminate duplicates Z: 25 36.030 2.153 0.943 0.653 1.000 0.667 CB 1.525 25 residues pruned to eliminate duplicates Z: 16 11.786 1.723 0.497 0.716 0.933 0.600 CB 1.040 17 residues pruned to eliminate duplicates Z: 10 7.915 1.609 0.278 0.596 1.000 0.667 CB 1.171 10 residues pruned to eliminate duplicates Z: 18 11.972 1.639 0.548 0.687 0.941 0.765 CB 1.024 18 residues pruned to eliminate duplicates Z: 6 8.333 1.899 0.502 0.797 1.000 0.800 CB 1.007 6 residues pruned to eliminate duplicates Z: 11 10.501 1.862 0.474 0.550 1.000 0.600 CB 1.152 11 residues pruned to eliminate duplicates Z: 16 13.181 1.739 0.786 0.688 0.933 0.600 CB 0.988 16 residues pruned to eliminate duplicates Z: 7 7.966 1.846 0.616 0.675 1.000 0.500 CB 0.928 7 residues pruned to eliminate duplicates Z: 38 24.185 2.004 0.628 0.561 0.892 0.541 CB 1.288 38 residues pruned to eliminate duplicates Z: 31 20.068 1.880 0.501 0.659 0.967 0.700 CB 1.159 31 residues pruned to eliminate duplicates Z: 24 15.685 1.778 0.433 0.636 1.000 0.696 CB 1.130 24 residues pruned to eliminate duplicates Z: 39 24.983 1.963 0.538 0.589 0.974 0.474 CB 1.266 39 residues pruned to eliminate duplicates Z: 10 6.937 1.577 0.095 0.843 1.000 0.667 CB 0.997 10 residues pruned to eliminate duplicates Z: 105 60.055 2.287 0.698 0.593 0.913 0.577 CB 1.518 105 residues pruned to eliminate duplicates Z: 23 15.688 1.793 0.361 0.668 1.000 0.773 CB 1.174 23 residues pruned to eliminate duplicates Z: 33 23.730 1.961 0.553 0.657 0.938 0.625 CB 1.271 33 residues pruned to eliminate duplicates Z: 33 19.096 1.932 0.528 0.488 0.938 0.656 CB 1.234 33 residues pruned to eliminate duplicates Z: 34 23.576 1.919 0.536 0.618 0.939 0.667 CB 1.326 34 residues pruned to eliminate duplicates Z: 76 52.343 2.256 0.797 0.593 0.920 0.520 CB 1.483 77 residues pruned to eliminate duplicates Z: 11 8.345 1.595 0.287 0.825 1.000 0.800 CB 0.970 11 residues pruned to eliminate duplicates Z: 10 7.731 1.551 0.227 0.871 1.000 0.556 CB 0.988 10 residues pruned to eliminate duplicates Z: 10 6.534 2.194 0.433 0.301 0.667 0.556 CB 1.298 10 residues pruned to eliminate duplicates Z: 8 7.616 2.054 0.523 0.403 0.714 0.571 CB 1.427 10 residues pruned to eliminate duplicates Z: 6 5.655 1.912 0.261 0.429 0.800 0.400 CB 1.411 5 residues pruned to eliminate duplicates Z: 6 3.549 1.918 0.669 0.252 0.600 0.600 CA 1.100 6 residues pruned to eliminate duplicates Z: 38 36.809 2.230 0.697 0.608 0.973 0.703 CB 1.483 38 residues pruned to eliminate duplicates Z: 51 34.223 2.217 0.607 0.578 0.960 0.700 CB 1.312 51 residues pruned to eliminate duplicates Z: 150 76.735 2.308 0.648 0.631 0.919 0.718 CB 1.589 150 residues pruned to eliminate duplicates Z: 135 82.300 2.337 0.755 0.671 0.910 0.784 CB 1.627 135 residues pruned to eliminate duplicates Z: 30 36.590 2.278 0.896 0.740 0.931 0.724 CB 1.363 30 residues pruned to eliminate duplicates Z: 49 33.346 2.250 0.593 0.592 0.938 0.688 CB 1.311 49 residues pruned to eliminate duplicates Z: 38 37.412 2.238 0.835 0.594 0.973 0.676 CB 1.407 38 residues pruned to eliminate duplicates Z: 54 36.767 2.242 0.754 0.540 0.925 0.642 CB 1.335 54 residues pruned to eliminate duplicates Z: 37 35.599 2.272 0.726 0.597 0.944 0.778 CB 1.460 37 residues pruned to eliminate duplicates Z: 39 38.985 2.230 0.887 0.602 0.974 0.711 CB 1.400 39 residues pruned to eliminate duplicates Z: 141 83.508 2.305 0.778 0.657 0.950 0.714 CB 1.567 141 residues pruned to eliminate duplicates Z: 32 39.600 2.231 0.881 0.643 1.000 0.677 CB 1.482 32 residues pruned to eliminate duplicates Z: 51 35.917 2.220 0.671 0.587 0.940 0.740 CB 1.341 51 residues pruned to eliminate duplicates Z: 156 77.403 2.285 0.692 0.603 0.935 0.677 CB 1.557 156 residues pruned to eliminate duplicates Z: 47 40.926 2.275 0.848 0.611 0.935 0.674 CB 1.382 47 residues pruned to eliminate duplicates Z: 49 33.230 2.187 0.860 0.540 0.917 0.667 CB 1.236 51 residues pruned to eliminate duplicates Z: 18 30.120 2.125 1.130 0.794 0.941 0.647 CB 1.325 18 residues pruned to eliminate duplicates Z: 37 39.847 2.284 0.882 0.623 0.972 0.667 CB 1.416 37 residues pruned to eliminate duplicates Z: 54 35.467 2.236 0.741 0.549 0.906 0.623 CB 1.318 54 residues pruned to eliminate duplicates Z: 93 54.392 2.292 0.708 0.570 0.913 0.685 CB 1.483 93 residues pruned to eliminate duplicates Z: 36 35.893 2.212 0.895 0.573 0.914 0.571 CB 1.475 36 residues pruned to eliminate duplicates Z: 49 32.657 2.196 0.703 0.548 0.896 0.625 CB 1.342 49 residues pruned to eliminate duplicates Z: 92 54.871 2.306 0.688 0.564 0.901 0.692 CB 1.542 92 residues pruned to eliminate duplicates Z: 37 40.440 2.279 0.990 0.617 0.972 0.722 CB 1.368 37 residues pruned to eliminate duplicates Z: 38 42.648 2.288 0.931 0.609 1.000 0.703 CB 1.431 38 residues pruned to eliminate duplicates Z: 50 38.304 2.257 0.765 0.602 0.939 0.694 CB 1.328 50 residues pruned to eliminate duplicates Z: 55 36.131 2.248 0.766 0.533 0.889 0.648 CB 1.349 55 residues pruned to eliminate duplicates Z: 48 37.412 2.237 0.828 0.576 0.894 0.681 CB 1.387 48 residues pruned to eliminate duplicates Z: 36 40.395 2.283 0.906 0.641 0.971 0.714 CB 1.415 36 residues pruned to eliminate duplicates Z: 37 38.654 2.265 0.818 0.621 1.000 0.778 CB 1.396 37 residues pruned to eliminate duplicates Z: 22 13.703 2.118 0.323 0.369 0.905 0.429 CB 1.358 22 residues pruned to eliminate duplicates Z: 55 32.299 2.168 0.786 0.471 0.926 0.463 CB 1.262 55 residues pruned to eliminate duplicates Z: 56 36.607 2.237 0.802 0.539 0.873 0.655 CB 1.351 56 residues pruned to eliminate duplicates Z: 59 36.160 2.158 0.750 0.497 0.897 0.655 CB 1.406 59 residues pruned to eliminate duplicates Z: 11 14.960 2.213 0.337 0.673 1.000 0.700 CB 1.363 18 residues pruned to eliminate duplicates Z: 21 13.337 2.195 0.366 0.417 0.900 0.650 CB 1.205 21 residues pruned to eliminate duplicates Z: 47 27.567 2.168 0.742 0.519 0.848 0.674 CB 1.245 47 residues pruned to eliminate duplicates Z: 49 35.445 2.246 0.730 0.560 0.938 0.625 CB 1.325 49 residues pruned to eliminate duplicates Z: 49 37.589 2.243 0.733 0.598 0.958 0.667 CB 1.327 49 residues pruned to eliminate duplicates Z: 55 37.510 2.224 0.757 0.542 0.944 0.704 CB 1.327 55 residues pruned to eliminate duplicates Z: 51 32.748 2.227 0.669 0.558 0.920 0.680 CB 1.280 51 residues pruned to eliminate duplicates Z: 50 35.823 2.233 0.706 0.583 0.918 0.714 CB 1.350 50 residues pruned to eliminate duplicates Z: 50 36.286 2.211 0.848 0.552 0.898 0.592 CB 1.343 50 residues pruned to eliminate duplicates Z: 13 10.249 2.171 0.413 0.556 0.833 0.583 CB 1.096 13 residues pruned to eliminate duplicates Z: 109 77.743 2.355 0.794 0.653 0.917 0.676 CB 1.676 109 residues pruned to eliminate duplicates Z: 8 5.895 1.766 0.547 0.416 0.857 0.571 CB 1.038 8 residues pruned to eliminate duplicates Z: 91 83.575 2.361 0.842 0.718 0.944 0.767 CB 1.762 91 residues pruned to eliminate duplicates Z: 91 83.368 2.351 0.860 0.714 0.933 0.722 CB 1.774 91 residues pruned to eliminate duplicates Z: 53 46.826 2.359 0.712 0.638 0.865 0.731 CB 1.632 53 residues pruned to eliminate duplicates Z: 89 83.542 2.375 0.848 0.730 0.943 0.761 CB 1.748 89 residues pruned to eliminate duplicates Z: 143 79.883 2.293 0.772 0.627 0.915 0.690 CB 1.600 143 residues pruned to eliminate duplicates Z: 91 80.835 2.358 0.771 0.713 0.956 0.733 CB 1.761 91 residues pruned to eliminate duplicates Z: 90 85.254 2.370 0.838 0.729 0.944 0.719 CB 1.788 90 residues pruned to eliminate duplicates Z: 92 77.074 2.337 0.710 0.710 0.945 0.769 CB 1.769 92 residues pruned to eliminate duplicates Z: 46 49.344 2.333 0.820 0.598 0.933 0.778 CB 1.691 46 residues pruned to eliminate duplicates Z: 24 18.883 2.131 0.570 0.473 0.913 0.739 CB 1.325 24 residues pruned to eliminate duplicates Z: 90 82.884 2.362 0.840 0.715 0.944 0.787 CB 1.764 90 residues pruned to eliminate duplicates Z: 91 79.659 2.338 0.787 0.719 0.944 0.700 CB 1.746 91 residues pruned to eliminate duplicates Z: 44 48.909 2.319 0.770 0.609 0.930 0.674 CB 1.762 44 residues pruned to eliminate duplicates Z: 44 47.535 2.340 0.908 0.631 0.860 0.721 CB 1.669 44 residues pruned to eliminate duplicates Z: 75 83.104 2.396 0.932 0.763 0.946 0.757 CB 1.747 75 residues pruned to eliminate duplicates Z: 6 15.200 2.161 1.052 0.487 0.800 0.600 N 1.941 6 residues pruned to eliminate duplicates Z: 90 82.384 2.376 0.800 0.710 0.955 0.708 CB 1.768 90 residues pruned to eliminate duplicates Z: 90 82.494 2.343 0.835 0.716 0.966 0.753 CB 1.731 90 residues pruned to eliminate duplicates Z: 88 89.961 2.406 0.871 0.742 0.966 0.713 CB 1.787 88 residues pruned to eliminate duplicates Z: 48 44.456 2.288 0.828 0.575 0.851 0.596 CB 1.695 48 residues pruned to eliminate duplicates Z: 42 51.562 2.369 0.892 0.630 0.927 0.683 CB 1.715 42 residues pruned to eliminate duplicates Z: 89 84.602 2.382 0.859 0.730 0.943 0.727 CB 1.756 89 residues pruned to eliminate duplicates Z: 99 82.198 2.379 0.814 0.722 0.939 0.724 CB 1.677 99 residues pruned to eliminate duplicates Z: 133 90.170 2.317 0.888 0.678 0.947 0.682 CB 1.608 133 residues pruned to eliminate duplicates Z: 76 77.182 2.384 0.847 0.746 0.933 0.693 CB 1.742 76 residues pruned to eliminate duplicates Z: 90 86.576 2.367 0.886 0.731 0.955 0.753 CB 1.749 90 residues pruned to eliminate duplicates Z: 89 84.732 2.389 0.832 0.711 0.966 0.682 CB 1.764 89 residues pruned to eliminate duplicates Z: 90 81.801 2.355 0.908 0.708 0.933 0.652 CB 1.714 90 residues pruned to eliminate duplicates Z: 76 78.833 2.384 0.898 0.752 0.933 0.733 CB 1.723 76 residues pruned to eliminate duplicates Z: 89 87.571 2.394 0.892 0.735 0.955 0.727 CB 1.748 90 residues pruned to eliminate duplicates Z: 17 50.583 2.313 1.327 0.929 1.000 0.750 CB 1.644 17 residues pruned to eliminate duplicates Z: 88 83.509 2.392 0.843 0.717 0.954 0.621 CB 1.749 88 residues pruned to eliminate duplicates Z: 89 84.996 2.381 0.847 0.722 0.966 0.682 CB 1.745 89 residues pruned to eliminate duplicates Z: 89 84.881 2.383 0.828 0.731 0.977 0.682 CB 1.727 89 residues pruned to eliminate duplicates Z: 91 80.100 2.345 0.853 0.704 0.944 0.644 CB 1.709 91 residues pruned to eliminate duplicates Z: 90 79.528 2.349 0.842 0.711 0.944 0.640 CB 1.704 90 residues pruned to eliminate duplicates Z: 91 79.288 2.367 0.800 0.703 0.944 0.678 CB 1.726 91 residues pruned to eliminate duplicates Z: 88 86.350 2.397 0.880 0.737 0.943 0.667 CB 1.762 88 residues pruned to eliminate duplicates Z: 18 34.172 2.348 1.178 0.747 0.824 0.353 CB 1.578 18 residues pruned to eliminate duplicates Z: 50 63.160 2.314 0.800 0.778 0.959 0.796 CB 1.768 50 residues pruned to eliminate duplicates Z: 88 78.583 2.379 0.837 0.690 0.931 0.667 CB 1.740 88 residues pruned to eliminate duplicates Z: 90 85.662 2.368 0.874 0.725 0.955 0.685 CB 1.749 90 residues pruned to eliminate duplicates Z: 100 79.375 2.330 0.795 0.680 0.949 0.717 CB 1.703 100 residues pruned to eliminate duplicates Z: 90 83.442 2.371 0.841 0.718 0.955 0.787 CB 1.743 90 residues pruned to eliminate duplicates Z: 89 82.220 2.380 0.822 0.721 0.943 0.705 CB 1.754 89 residues pruned to eliminate duplicates Z: 152 77.043 2.303 0.706 0.582 0.921 0.656 CB 1.602 257 residues pruned to eliminate duplicates Z: 15 33.138 2.442 0.422 0.906 1.000 0.929 CB 1.813 15 residues pruned to eliminate duplicates Z: 91 80.793 2.347 0.853 0.711 0.933 0.644 CB 1.733 91 residues pruned to eliminate duplicates Z: 90 80.640 2.347 0.828 0.717 0.955 0.697 CB 1.714 90 residues pruned to eliminate duplicates Z: 90 83.119 2.363 0.804 0.720 0.966 0.742 CB 1.753 90 residues pruned to eliminate duplicates Z: 90 81.169 2.341 0.857 0.727 0.944 0.652 CB 1.709 90 residues pruned to eliminate duplicates Z: 43 61.727 2.285 0.796 0.848 1.000 0.738 CB 1.722 43 residues pruned to eliminate duplicates Z: 90 81.138 2.369 0.815 0.700 0.955 0.730 CB 1.745 90 residues pruned to eliminate duplicates Z: 50 63.169 2.321 0.792 0.768 0.959 0.694 CB 1.784 50 residues pruned to eliminate duplicates Z: 42 62.582 2.325 0.752 0.840 1.000 0.780 CB 1.790 42 residues pruned to eliminate duplicates Z: 89 79.065 2.376 0.808 0.706 0.932 0.739 CB 1.746 89 residues pruned to eliminate duplicates Z: 42 64.237 2.327 0.816 0.843 1.000 0.805 CB 1.767 42 residues pruned to eliminate duplicates Z: 88 81.880 2.392 0.788 0.722 0.954 0.747 CB 1.762 88 residues pruned to eliminate duplicates Z: 92 82.619 2.334 0.839 0.707 0.967 0.692 CB 1.729 92 residues pruned to eliminate duplicates Z: 91 82.018 2.368 0.782 0.707 0.956 0.722 CB 1.776 91 residues pruned to eliminate duplicates Z: 135 85.486 2.319 0.808 0.663 0.955 0.701 CB 1.586 135 residues pruned to eliminate duplicates Z: 91 81.653 2.361 0.762 0.713 0.967 0.756 CB 1.765 91 residues pruned to eliminate duplicates Z: 89 81.635 2.374 0.840 0.714 0.932 0.705 CB 1.761 89 residues pruned to eliminate duplicates Z: 75 79.337 2.388 0.819 0.756 0.959 0.824 CB 1.762 75 residues pruned to eliminate duplicates Z: 54 55.160 2.281 0.756 0.698 0.906 0.604 CB 1.744 54 residues pruned to eliminate duplicates Z: 48 63.267 2.347 0.724 0.792 0.979 0.766 CB 1.802 48 residues pruned to eliminate duplicates Z: 91 79.517 2.359 0.767 0.716 0.944 0.722 CB 1.751 91 residues pruned to eliminate duplicates Z: 48 62.479 2.359 0.710 0.792 0.957 0.787 CB 1.827 48 residues pruned to eliminate duplicates Z: 42 62.338 2.336 0.707 0.848 1.000 0.854 CB 1.811 42 residues pruned to eliminate duplicates Z: 98 74.894 2.318 0.776 0.676 0.948 0.691 CB 1.656 98 residues pruned to eliminate duplicates Z: 90 78.692 2.356 0.787 0.704 0.955 0.742 CB 1.723 90 residues pruned to eliminate duplicates Z: 89 84.718 2.388 0.854 0.711 0.955 0.682 CB 1.765 89 residues pruned to eliminate duplicates Z: 37 55.312 2.474 0.642 0.755 0.972 0.806 CB 1.859 37 residues pruned to eliminate duplicates Z: 115 86.021 2.386 0.812 0.668 0.921 0.667 CB 1.733 115 residues pruned to eliminate duplicates Z: 82 74.667 2.335 0.767 0.711 0.938 0.704 CB 1.770 82 residues pruned to eliminate duplicates Z: 130 85.274 2.354 0.746 0.653 0.930 0.620 CB 1.703 130 residues pruned to eliminate duplicates Z: 152 101.850 2.398 0.804 0.668 0.954 0.742 CB 1.720 152 residues pruned to eliminate duplicates Z: 31 63.655 2.406 0.927 0.886 1.000 0.867 CB 1.808 31 residues pruned to eliminate duplicates Z: 87 91.079 2.466 1.100 0.699 0.930 0.640 CB 1.701 87 residues pruned to eliminate duplicates Z: 130 92.669 2.427 0.905 0.633 0.938 0.667 CB 1.660 130 residues pruned to eliminate duplicates Z: 73 93.923 2.495 1.088 0.777 0.972 0.722 CB 1.712 73 residues pruned to eliminate duplicates Z: 74 90.792 2.465 1.063 0.750 0.959 0.753 CB 1.742 74 residues pruned to eliminate duplicates Z: 141 98.361 2.413 0.980 0.607 0.929 0.686 CB 1.692 141 residues pruned to eliminate duplicates Z: 74 94.399 2.494 1.076 0.785 0.959 0.795 CB 1.732 74 residues pruned to eliminate duplicates Z: 108 80.097 2.395 0.918 0.627 0.916 0.598 CB 1.633 108 residues pruned to eliminate duplicates Z: 163 105.657 2.450 0.888 0.639 0.914 0.667 CB 1.725 163 residues pruned to eliminate duplicates Z: 112 88.103 2.443 0.937 0.633 0.919 0.640 CB 1.697 112 residues pruned to eliminate duplicates Z: 87 91.086 2.441 1.037 0.696 0.953 0.709 CB 1.732 87 residues pruned to eliminate duplicates Z: 22 61.335 2.434 1.169 0.933 0.952 0.810 CB 1.859 22 residues pruned to eliminate duplicates Z: 90 89.836 2.461 0.946 0.724 0.944 0.697 CB 1.720 90 residues pruned to eliminate duplicates Z: 72 68.153 2.387 0.884 0.639 0.901 0.676 CB 1.752 72 residues pruned to eliminate duplicates Z: 148 92.399 2.385 0.864 0.625 0.946 0.633 CB 1.611 148 residues pruned to eliminate duplicates Z: 147 90.030 2.371 0.932 0.632 0.918 0.616 CB 1.566 147 residues pruned to eliminate duplicates Z: 89 86.516 2.419 1.105 0.680 0.920 0.602 CB 1.668 89 residues pruned to eliminate duplicates Z: 130 96.503 2.437 0.932 0.654 0.938 0.605 CB 1.667 130 residues pruned to eliminate duplicates Z: 86 97.968 2.484 1.105 0.734 0.965 0.647 CB 1.706 86 residues pruned to eliminate duplicates Z: 99 84.481 2.421 0.932 0.700 0.939 0.633 CB 1.621 99 residues pruned to eliminate duplicates Z: 73 98.880 2.497 1.203 0.781 0.972 0.653 CB 1.701 73 residues pruned to eliminate duplicates Z: 63 96.788 2.503 1.231 0.798 0.952 0.613 CB 1.782 63 residues pruned to eliminate duplicates Z: 91 89.196 2.405 1.123 0.704 0.956 0.522 CB 1.601 91 residues pruned to eliminate duplicates Z: 95 88.342 2.396 1.061 0.684 0.957 0.532 CB 1.628 95 residues pruned to eliminate duplicates Z: 94 89.953 2.426 1.041 0.685 0.925 0.602 CB 1.719 94 residues pruned to eliminate duplicates Z: 101 83.167 2.413 0.988 0.652 0.900 0.480 CB 1.673 101 residues pruned to eliminate duplicates Z: 90 82.882 2.429 1.095 0.645 0.910 0.562 CB 1.656 90 residues pruned to eliminate duplicates Z: 110 81.378 2.412 0.854 0.598 0.927 0.560 CB 1.712 110 residues pruned to eliminate duplicates Z: 12 6.638 1.803 0.356 0.312 0.818 0.364 CB 1.232 12 residues pruned to eliminate duplicates Z: 114 90.437 2.434 1.023 0.629 0.912 0.619 CB 1.679 114 residues pruned to eliminate duplicates Z: 92 92.527 2.434 1.013 0.718 0.956 0.637 CB 1.700 92 residues pruned to eliminate duplicates Z: 87 81.651 2.427 1.076 0.658 0.907 0.512 CB 1.664 87 residues pruned to eliminate duplicates Z: 138 95.471 2.442 0.959 0.618 0.905 0.642 CB 1.685 138 residues pruned to eliminate duplicates Z: 180 109.664 2.426 0.914 0.625 0.922 0.654 CB 1.702 178 residues pruned to eliminate duplicates Z: 6 3.703 1.897 0.218 0.100 0.800 0.400 CB 1.493 6 residues pruned to eliminate duplicates Z: 87 86.646 2.441 1.053 0.708 0.930 0.616 CB 1.659 87 residues pruned to eliminate duplicates Z: 14 9.507 2.080 0.488 0.298 0.692 0.462 CA 1.542 14 residues pruned to eliminate duplicates Z: 62 37.905 2.227 0.575 0.525 0.902 0.639 CB 1.497 62 residues pruned to eliminate duplicates Z: 104 85.699 2.419 0.990 0.655 0.922 0.631 CB 1.647 104 residues pruned to eliminate duplicates Z: 91 84.901 2.423 1.152 0.642 0.911 0.578 CB 1.649 91 residues pruned to eliminate duplicates Z: 85 66.029 2.413 0.814 0.565 0.917 0.679 CB 1.687 86 residues pruned to eliminate duplicates Z: 6 5.541 1.737 0.962 0.384 0.800 0.600 CA 1.028 6 residues pruned to eliminate duplicates Z: 27 38.923 2.356 0.894 0.594 0.923 0.615 CB 1.694 27 residues pruned to eliminate duplicates Z: 28 44.980 2.428 1.017 0.607 0.926 0.556 CB 1.724 28 residues pruned to eliminate duplicates Z: 77 67.579 2.427 0.796 0.590 0.934 0.711 CB 1.747 77 residues pruned to eliminate duplicates Z: 53 49.047 2.363 0.826 0.488 0.942 0.596 CB 1.694 53 residues pruned to eliminate duplicates Z: 28 44.369 2.431 0.950 0.626 0.926 0.593 CB 1.727 28 residues pruned to eliminate duplicates Z: 27 45.097 2.398 1.078 0.627 0.923 0.538 CB 1.706 27 residues pruned to eliminate duplicates Z: 77 70.926 2.409 0.887 0.604 0.934 0.684 CB 1.735 77 residues pruned to eliminate duplicates Z: 76 76.372 2.452 0.898 0.633 0.960 0.680 CB 1.742 76 residues pruned to eliminate duplicates Z: 52 47.191 2.375 0.774 0.497 0.922 0.549 CB 1.708 52 residues pruned to eliminate duplicates Z: 50 52.841 2.444 0.839 0.527 0.939 0.714 CB 1.743 50 residues pruned to eliminate duplicates Z: 28 39.898 2.423 0.868 0.593 0.926 0.667 CB 1.676 28 residues pruned to eliminate duplicates Z: 26 44.045 2.403 1.077 0.636 0.960 0.640 CB 1.618 26 residues pruned to eliminate duplicates Z: 50 51.353 2.430 0.863 0.512 0.939 0.673 CB 1.706 50 residues pruned to eliminate duplicates Z: 68 66.044 2.441 0.755 0.630 0.955 0.687 CB 1.745 68 residues pruned to eliminate duplicates Z: 79 63.667 2.397 0.814 0.573 0.936 0.667 CB 1.651 79 residues pruned to eliminate duplicates Z: 28 42.318 2.389 0.981 0.585 0.926 0.630 CB 1.714 28 residues pruned to eliminate duplicates Z: 52 45.819 2.419 0.723 0.518 0.902 0.588 CB 1.678 52 residues pruned to eliminate duplicates Z: 44 42.010 2.381 0.793 0.524 0.837 0.581 CB 1.751 44 residues pruned to eliminate duplicates Z: 42 45.674 2.403 0.797 0.506 0.976 0.659 CB 1.684 42 residues pruned to eliminate duplicates Z: 42 44.288 2.411 0.778 0.472 0.976 0.634 CB 1.702 42 residues pruned to eliminate duplicates Z: 66 47.382 2.367 0.740 0.473 0.877 0.646 CB 1.673 66 residues pruned to eliminate duplicates Z: 77 70.787 2.414 0.850 0.600 0.961 0.697 CB 1.722 77 residues pruned to eliminate duplicates Z: 52 49.494 2.399 0.769 0.500 0.941 0.725 CB 1.735 52 residues pruned to eliminate duplicates Z: 76 67.445 2.438 0.788 0.598 0.960 0.653 CB 1.695 76 residues pruned to eliminate duplicates Z: 53 47.500 2.356 0.823 0.524 0.923 0.577 CB 1.623 53 residues pruned to eliminate duplicates Z: 80 61.757 2.377 0.754 0.586 0.911 0.709 CB 1.684 80 residues pruned to eliminate duplicates Z: 24 28.183 2.413 0.730 0.390 0.913 0.696 CB 1.732 24 residues pruned to eliminate duplicates Z: 53 55.087 2.381 0.734 0.605 0.981 0.769 CB 1.707 53 residues pruned to eliminate duplicates Z: 77 71.028 2.422 0.858 0.607 0.934 0.684 CB 1.751 77 residues pruned to eliminate duplicates Z: 53 46.567 2.377 0.824 0.510 0.904 0.673 CB 1.632 53 residues pruned to eliminate duplicates Z: 75 65.600 2.374 0.869 0.598 0.932 0.649 CB 1.680 75 residues pruned to eliminate duplicates Z: 75 70.782 2.391 0.833 0.621 0.959 0.689 CB 1.745 75 residues pruned to eliminate duplicates Z: 53 57.340 2.406 0.840 0.590 0.962 0.788 CB 1.714 53 residues pruned to eliminate duplicates Z: 78 69.842 2.395 0.863 0.605 0.935 0.714 CB 1.726 78 residues pruned to eliminate duplicates Z: 50 45.933 2.423 0.772 0.506 0.918 0.612 CB 1.654 50 residues pruned to eliminate duplicates Z: 72 51.424 2.299 0.811 0.520 0.887 0.620 CB 1.620 72 residues pruned to eliminate duplicates Z: 26 26.604 2.378 0.716 0.340 0.880 0.680 CB 1.764 26 residues pruned to eliminate duplicates Z: 29 28.629 2.335 0.670 0.359 0.964 0.679 CB 1.675 29 residues pruned to eliminate duplicates Z: 51 59.447 2.416 0.873 0.608 0.960 0.680 CB 1.746 50 residues pruned to eliminate duplicates Z: 7 8.909 2.131 0.863 0.418 0.667 0.667 CB 1.497 7 residues pruned to eliminate duplicates Z: 48 49.435 2.437 0.779 0.517 0.957 0.702 CB 1.707 48 residues pruned to eliminate duplicates Z: 76 61.197 2.345 0.814 0.586 0.920 0.640 CB 1.663 76 residues pruned to eliminate duplicates Z: 76 69.394 2.425 0.837 0.607 0.960 0.707 CB 1.693 76 residues pruned to eliminate duplicates Z: 51 56.144 2.405 0.775 0.606 0.980 0.720 CB 1.716 51 residues pruned to eliminate duplicates Z: 31 48.793 2.365 0.935 0.731 0.933 0.733 CB 1.694 31 residues pruned to eliminate duplicates Z: 27 36.217 2.219 0.661 0.853 0.885 0.808 CB 1.610 27 residues pruned to eliminate duplicates Z: 29 56.566 2.427 0.930 0.783 1.000 0.786 CB 1.780 29 residues pruned to eliminate duplicates Z: 51 57.410 2.407 0.760 0.621 0.980 0.680 CB 1.745 51 residues pruned to eliminate duplicates Z: 31 50.312 2.396 0.749 0.752 1.000 0.700 CB 1.750 31 residues pruned to eliminate duplicates Z: 26 39.612 2.280 0.534 0.887 0.960 0.880 CB 1.702 26 residues pruned to eliminate duplicates Z: 39 41.565 2.220 0.871 0.659 0.947 0.684 CB 1.478 39 residues pruned to eliminate duplicates Z: 53 52.045 2.355 0.703 0.603 0.962 0.712 CB 1.696 53 residues pruned to eliminate duplicates Z: 31 46.408 2.375 0.788 0.736 0.967 0.800 CB 1.670 31 residues pruned to eliminate duplicates Z: 51 58.560 2.407 0.886 0.621 0.940 0.700 CB 1.732 51 residues pruned to eliminate duplicates Z: 30 48.030 2.364 0.867 0.760 0.966 0.552 CB 1.661 30 residues pruned to eliminate duplicates Z: 50 57.775 2.427 0.832 0.619 0.959 0.673 CB 1.729 50 residues pruned to eliminate duplicates Z: 54 54.901 2.351 0.885 0.602 0.943 0.547 CB 1.637 54 residues pruned to eliminate duplicates Z: 31 50.369 2.393 0.914 0.761 0.967 0.367 CB 1.646 31 residues pruned to eliminate duplicates Z: 96 71.989 2.365 0.852 0.558 0.947 0.547 CB 1.683 96 residues pruned to eliminate duplicates Z: 24 57.328 2.404 1.258 0.925 0.957 0.478 CB 1.615 24 residues pruned to eliminate duplicates Z: 76 71.056 2.425 0.896 0.632 0.960 0.560 CB 1.643 76 residues pruned to eliminate duplicates Z: 25 48.859 2.304 1.128 0.918 0.917 0.583 CB 1.566 25 residues pruned to eliminate duplicates Z: 77 76.092 2.421 0.935 0.632 0.947 0.605 CB 1.738 77 residues pruned to eliminate duplicates Z: 68 71.377 2.417 0.981 0.636 0.955 0.627 CB 1.678 68 residues pruned to eliminate duplicates Z: 54 56.359 2.340 0.897 0.593 0.962 0.528 CB 1.658 54 residues pruned to eliminate duplicates Z: 69 70.522 2.389 0.956 0.626 0.956 0.544 CB 1.701 69 residues pruned to eliminate duplicates Z: 29 60.768 2.442 1.128 0.776 1.000 0.643 CB 1.733 29 residues pruned to eliminate duplicates Z: 31 31.429 2.089 0.832 0.603 0.900 0.233 CB 1.511 31 residues pruned to eliminate duplicates Z: 29 64.327 2.441 1.204 0.806 1.000 0.607 CB 1.730 29 residues pruned to eliminate duplicates Z: 6 5.201 1.727 0.518 0.428 0.800 0.600 CB 1.194 6 residues pruned to eliminate duplicates Z: 12 7.639 1.821 0.680 0.346 0.909 0.455 CB 0.979 12 residues pruned to eliminate duplicates Z: 12 6.721 1.944 0.406 0.364 0.909 0.455 CB 0.944 12 residues pruned to eliminate duplicates Z: 12 7.515 1.897 0.653 0.354 0.909 0.364 CB 0.931 12 residues pruned to eliminate duplicates Z: 14 8.207 1.874 0.471 0.333 0.846 0.462 CB 1.171 14 residues pruned to eliminate duplicates Z: 17 8.534 2.010 0.563 0.296 0.750 0.562 CB 1.137 17 residues pruned to eliminate duplicates Z: 66 34.667 2.171 0.548 0.498 0.938 0.662 CB 1.366 66 residues pruned to eliminate duplicates Z: 18 12.229 2.013 0.654 0.293 0.824 0.471 CB 1.365 18 residues pruned to eliminate duplicates Z: 56 32.170 2.131 0.714 0.497 0.909 0.618 CB 1.311 56 residues pruned to eliminate duplicates Z: 7 6.518 2.006 0.305 0.228 1.000 0.667 CB 1.396 7 residues pruned to eliminate duplicates Z: 9 5.374 1.765 0.858 0.192 0.625 0.375 N 1.340 9 residues pruned to eliminate duplicates Z: 7 5.564 2.119 0.500 0.240 0.667 0.500 CB 1.448 7 residues pruned to eliminate duplicates Z: 29 21.993 1.928 0.605 0.643 0.893 0.714 CB 1.315 29 residues pruned to eliminate duplicates Z: 16 16.114 1.816 0.497 0.843 0.933 0.800 CB 1.221 16 residues pruned to eliminate duplicates Z: 96 45.111 2.113 0.648 0.567 0.926 0.589 CB 1.345 96 residues pruned to eliminate duplicates Z: 25 19.501 1.815 0.794 0.653 0.917 0.583 CB 1.157 25 residues pruned to eliminate duplicates Z: 38 19.623 1.859 0.708 0.586 0.892 0.595 CB 1.049 38 residues pruned to eliminate duplicates Z: 16 22.402 1.900 0.816 0.856 0.933 0.733 CB 1.325 16 residues pruned to eliminate duplicates Z: 31 20.261 1.915 0.772 0.595 0.867 0.533 CB 1.148 31 residues pruned to eliminate duplicates Z: 27 19.028 1.839 0.647 0.696 0.923 0.462 CB 1.116 27 residues pruned to eliminate duplicates Z: 31 17.919 1.815 0.588 0.605 0.933 0.467 CB 1.101 31 residues pruned to eliminate duplicates Z: 44 23.913 1.940 0.761 0.526 0.907 0.535 CB 1.147 44 residues pruned to eliminate duplicates Z: 35 18.481 1.832 0.665 0.607 0.941 0.647 CB 0.997 35 residues pruned to eliminate duplicates Z: 20 21.110 1.759 0.942 0.729 1.000 0.632 CB 1.153 20 residues pruned to eliminate duplicates Z: 20 19.642 1.711 0.789 0.781 1.000 0.526 CB 1.149 20 residues pruned to eliminate duplicates Z: 27 23.357 1.877 0.834 0.716 0.962 0.577 CB 1.138 27 residues pruned to eliminate duplicates Z: 19 24.567 2.234 0.707 0.668 0.889 0.556 CB 1.462 19 residues pruned to eliminate duplicates Z: 15 24.624 2.247 0.785 0.727 1.000 0.571 CB 1.338 15 residues pruned to eliminate duplicates Z: 19 24.782 2.312 0.648 0.616 0.889 0.389 CB 1.545 19 residues pruned to eliminate duplicates Z: 14 25.285 2.101 0.880 0.786 0.923 0.462 CB 1.496 14 residues pruned to eliminate duplicates Z: 19 29.029 2.267 0.784 0.634 0.944 0.556 CB 1.580 19 residues pruned to eliminate duplicates Z: 12 20.505 2.169 0.615 0.817 0.909 0.273 CB 1.474 12 residues pruned to eliminate duplicates Z: 19 27.607 2.316 0.629 0.627 0.944 0.611 CB 1.620 19 residues pruned to eliminate duplicates Z: 19 25.125 2.315 0.603 0.592 0.944 0.500 CB 1.547 19 residues pruned to eliminate duplicates Z: 17 19.737 2.178 0.736 0.555 0.812 0.625 CA 1.522 17 residues pruned to eliminate duplicates Z: 19 25.389 2.312 0.539 0.603 0.944 0.667 CB 1.615 19 residues pruned to eliminate duplicates Z: 18 24.972 2.346 0.530 0.616 0.941 0.588 CB 1.606 18 residues pruned to eliminate duplicates Z: 19 27.393 2.299 0.736 0.597 0.944 0.611 CB 1.562 19 residues pruned to eliminate duplicates Z: 12 26.151 2.389 0.718 0.779 0.909 0.636 CB 1.652 12 residues pruned to eliminate duplicates Z: 19 26.744 2.292 0.605 0.593 0.944 0.667 CB 1.660 19 residues pruned to eliminate duplicates Z: 18 30.045 2.334 0.687 0.633 1.000 0.706 CB 1.633 18 residues pruned to eliminate duplicates Z: 18 29.480 2.350 0.641 0.661 1.000 0.765 CB 1.597 18 residues pruned to eliminate duplicates Z: 18 28.736 2.321 0.536 0.676 1.000 0.706 CB 1.662 18 residues pruned to eliminate duplicates Z: 16 24.961 2.001 0.589 0.855 1.000 0.933 CB 1.496 16 residues pruned to eliminate duplicates Z: 17 22.068 1.941 0.532 0.824 0.938 0.875 CB 1.495 17 residues pruned to eliminate duplicates Z: 17 26.701 1.955 0.692 0.864 1.000 0.812 CB 1.479 17 residues pruned to eliminate duplicates Z: 17 22.508 1.946 0.570 0.815 0.938 0.875 CB 1.493 17 residues pruned to eliminate duplicates Z: 16 28.861 2.036 0.763 0.872 1.000 0.867 CB 1.513 16 residues pruned to eliminate duplicates Z: 18 20.505 1.839 0.606 0.722 0.941 0.765 CB 1.464 18 residues pruned to eliminate duplicates Z: 25 22.977 1.934 0.740 0.738 0.833 0.750 CB 1.351 25 residues pruned to eliminate duplicates Z: 17 23.000 1.926 0.629 0.811 0.938 0.812 CB 1.491 17 residues pruned to eliminate duplicates Z: 17 22.232 1.926 0.598 0.797 0.938 0.688 CB 1.485 17 residues pruned to eliminate duplicates Z: 18 21.087 1.867 0.734 0.709 0.882 0.765 CB 1.481 18 residues pruned to eliminate duplicates Z: 25 25.873 1.954 0.807 0.724 0.917 0.583 CB 1.334 25 residues pruned to eliminate duplicates Z: 33 23.985 1.904 0.743 0.530 0.875 0.469 CB 1.417 33 residues pruned to eliminate duplicates Z: 18 22.344 1.860 0.915 0.773 0.882 0.529 CB 1.354 18 residues pruned to eliminate duplicates Z: 35 23.980 1.894 0.807 0.515 0.824 0.529 CB 1.437 31 residues pruned to eliminate duplicates Z: 20 25.259 1.873 0.750 0.782 0.895 0.632 CB 1.541 20 residues pruned to eliminate duplicates Z: 29 31.266 1.951 0.853 0.584 0.964 0.679 CB 1.563 36 residues pruned to eliminate duplicates Z: 19 26.460 1.922 0.751 0.760 0.944 0.833 CB 1.557 19 residues pruned to eliminate duplicates Z: 15 14.513 1.919 0.761 0.388 0.929 0.571 CA 1.391 15 residues pruned to eliminate duplicates Z: 13 13.849 2.078 0.601 0.391 0.833 0.333 CB 1.618 13 residues pruned to eliminate duplicates Z: 16 11.372 1.971 0.543 0.325 0.733 0.467 CB 1.596 16 residues pruned to eliminate duplicates Z: 15 12.589 1.958 0.628 0.351 0.857 0.429 CB 1.447 13 residues pruned to eliminate duplicates Z: 7 8.921 1.681 0.953 0.359 1.000 0.833 CB 1.291 7 residues pruned to eliminate duplicates Z: 12 12.343 2.083 0.668 0.423 0.727 0.455 CB 1.595 12 residues pruned to eliminate duplicates Z: 17 14.835 2.058 0.663 0.344 0.812 0.438 CB 1.580 15 residues pruned to eliminate duplicates Z: 18 32.556 2.280 0.728 0.771 0.941 0.765 CB 1.676 18 residues pruned to eliminate duplicates Z: 48 45.899 2.307 0.789 0.619 0.936 0.745 CB 1.548 48 residues pruned to eliminate duplicates Z: 37 44.844 2.348 0.807 0.614 1.000 0.722 CB 1.581 37 residues pruned to eliminate duplicates Z: 46 50.589 2.323 0.838 0.641 0.978 0.733 CB 1.583 46 residues pruned to eliminate duplicates Z: 61 48.098 2.321 0.779 0.531 0.967 0.633 CB 1.508 61 residues pruned to eliminate duplicates Z: 72 48.108 2.287 0.719 0.522 0.930 0.592 CB 1.530 72 residues pruned to eliminate duplicates Z: 90 57.687 2.322 0.746 0.594 0.933 0.663 CB 1.478 90 residues pruned to eliminate duplicates Z: 61 47.249 2.306 0.775 0.548 0.967 0.667 CB 1.472 61 residues pruned to eliminate duplicates Z: 54 43.516 2.284 0.765 0.557 0.925 0.585 CB 1.519 54 residues pruned to eliminate duplicates Z: 40 43.111 2.279 0.851 0.609 0.949 0.667 CB 1.555 35 residues pruned to eliminate duplicates Z: 16 38.536 2.295 1.201 0.921 1.000 0.733 CB 1.386 16 residues pruned to eliminate duplicates Z: 37 49.610 2.369 0.959 0.624 0.972 0.750 CB 1.631 40 residues pruned to eliminate duplicates Z: 16 35.170 2.338 0.798 0.927 0.933 0.867 CB 1.621 16 residues pruned to eliminate duplicates Z: 136 96.420 2.416 0.857 0.681 0.941 0.726 CB 1.665 136 residues pruned to eliminate duplicates Z: 46 48.894 2.322 0.851 0.629 0.956 0.644 CB 1.573 48 residues pruned to eliminate duplicates Z: 18 34.903 2.268 0.720 0.789 1.000 0.765 CB 1.683 18 residues pruned to eliminate duplicates Z: 79 49.666 2.193 0.815 0.556 0.885 0.551 CB 1.513 77 residues pruned to eliminate duplicates Z: 8 7.294 1.963 0.339 0.351 1.000 0.429 CB 1.233 8 residues pruned to eliminate duplicates Z: 50 42.775 2.263 0.845 0.564 0.959 0.592 CB 1.435 50 residues pruned to eliminate duplicates Z: 37 42.159 2.348 0.786 0.586 1.000 0.639 CB 1.544 37 residues pruned to eliminate duplicates Z: 38 43.042 2.329 0.759 0.617 0.973 0.703 CB 1.589 38 residues pruned to eliminate duplicates Z: 38 39.058 2.307 0.641 0.633 1.000 0.703 CB 1.497 38 residues pruned to eliminate duplicates Z: 37 47.170 2.334 0.963 0.616 1.000 0.722 CB 1.537 37 residues pruned to eliminate duplicates Z: 39 40.159 2.290 0.860 0.606 0.921 0.684 CB 1.501 39 residues pruned to eliminate duplicates Z: 50 43.682 2.293 0.768 0.602 0.939 0.714 CB 1.487 50 residues pruned to eliminate duplicates Z: 50 41.086 2.297 0.727 0.607 0.918 0.673 CB 1.455 50 residues pruned to eliminate duplicates Z: 58 38.229 2.212 0.737 0.551 0.895 0.649 CB 1.402 58 residues pruned to eliminate duplicates Z: 31 22.037 2.135 0.572 0.489 0.900 0.633 CB 1.347 31 residues pruned to eliminate duplicates Z: 48 48.350 2.327 0.830 0.627 0.979 0.702 CB 1.502 48 residues pruned to eliminate duplicates Z: 48 47.658 2.316 0.883 0.602 0.979 0.660 CB 1.478 48 residues pruned to eliminate duplicates Z: 49 41.784 2.290 0.665 0.592 0.979 0.750 CB 1.479 49 residues pruned to eliminate duplicates Z: 13 10.957 2.069 0.482 0.535 0.833 0.583 CB 1.197 13 residues pruned to eliminate duplicates Z: 10 17.924 2.233 0.478 0.657 1.000 0.778 CB 1.565 10 residues pruned to eliminate duplicates Z: 49 39.312 2.289 0.687 0.578 0.938 0.688 CB 1.454 49 residues pruned to eliminate duplicates Z: 16 9.969 2.235 0.319 0.384 0.867 0.533 CB 1.139 16 residues pruned to eliminate duplicates Z: 25 18.359 2.187 0.629 0.424 0.833 0.458 CB 1.367 25 residues pruned to eliminate duplicates Z: 154 94.331 2.431 0.854 0.594 0.922 0.680 CB 1.679 154 residues pruned to eliminate duplicates Z: 26 21.305 2.168 0.721 0.484 0.840 0.640 CB 1.382 26 residues pruned to eliminate duplicates Z: 17 18.048 2.191 0.663 0.417 0.938 0.562 CB 1.440 17 residues pruned to eliminate duplicates Z: 152 92.954 2.373 0.884 0.637 0.907 0.603 CB 1.641 152 residues pruned to eliminate duplicates Z: 130 90.885 2.395 0.965 0.648 0.907 0.659 CB 1.634 130 residues pruned to eliminate duplicates Z: 15 19.734 2.260 0.812 0.537 0.929 0.571 CB 1.338 15 residues pruned to eliminate duplicates Z: 43 55.086 2.454 0.955 0.664 0.929 0.738 CB 1.639 43 residues pruned to eliminate duplicates Z: 43 43.871 2.432 0.706 0.616 0.905 0.690 CB 1.616 43 residues pruned to eliminate duplicates Z: 10 29.173 2.505 0.997 0.587 1.000 0.778 CB 1.789 10 residues pruned to eliminate duplicates Z: 103 85.303 2.428 0.933 0.670 0.912 0.667 CB 1.686 103 residues pruned to eliminate duplicates Z: 13 20.092 2.401 0.672 0.585 0.917 0.833 CB 1.453 13 residues pruned to eliminate duplicates Z: 109 86.610 2.416 0.902 0.659 0.926 0.694 CB 1.690 109 residues pruned to eliminate duplicates Z: 155 90.626 2.399 0.792 0.605 0.922 0.649 CB 1.667 155 residues pruned to eliminate duplicates Z: 132 97.263 2.391 0.864 0.681 0.969 0.740 CB 1.665 132 residues pruned to eliminate duplicates Z: 104 82.724 2.421 0.889 0.651 0.913 0.660 CB 1.697 104 residues pruned to eliminate duplicates Z: 95 85.170 2.436 0.863 0.702 0.936 0.660 CB 1.720 95 residues pruned to eliminate duplicates Z: 93 89.773 2.451 0.942 0.703 0.935 0.728 CB 1.748 93 residues pruned to eliminate duplicates Z: 39 58.551 2.536 0.992 0.668 0.947 0.763 CB 1.699 39 residues pruned to eliminate duplicates Z: 41 50.764 2.497 0.789 0.639 0.950 0.650 CB 1.661 41 residues pruned to eliminate duplicates Z: 27 47.163 2.537 0.844 0.725 0.962 0.731 CB 1.678 27 residues pruned to eliminate duplicates Z: 130 91.907 2.431 0.892 0.643 0.930 0.682 CB 1.655 130 residues pruned to eliminate duplicates Z: 47 52.305 2.490 0.855 0.622 0.891 0.674 CB 1.669 47 residues pruned to eliminate duplicates Z: 116 85.872 2.423 0.880 0.629 0.922 0.643 CB 1.689 116 residues pruned to eliminate duplicates Z: 74 94.865 2.501 1.027 0.782 0.973 0.753 CB 1.757 74 residues pruned to eliminate duplicates Z: 27 52.118 2.537 1.023 0.727 0.962 0.769 CB 1.689 27 residues pruned to eliminate duplicates Z: 104 86.787 2.427 0.952 0.678 0.942 0.660 CB 1.627 104 residues pruned to eliminate duplicates Z: 74 95.091 2.489 1.064 0.785 0.959 0.795 CB 1.758 74 residues pruned to eliminate duplicates Z: 90 85.309 2.445 0.908 0.690 0.955 0.730 CB 1.706 90 residues pruned to eliminate duplicates Z: 87 86.945 2.464 0.934 0.707 0.953 0.709 CB 1.709 87 residues pruned to eliminate duplicates Z: 77 87.314 2.472 0.964 0.759 0.934 0.763 CB 1.754 77 residues pruned to eliminate duplicates Z: 95 86.428 2.433 0.850 0.708 0.957 0.734 CB 1.713 95 residues pruned to eliminate duplicates Z: 103 85.524 2.436 0.931 0.662 0.902 0.686 CB 1.717 103 residues pruned to eliminate duplicates Z: 114 81.768 2.398 0.811 0.630 0.938 0.681 CB 1.671 114 residues pruned to eliminate duplicates Z: 105 77.061 2.398 0.862 0.641 0.904 0.644 CB 1.640 105 residues pruned to eliminate duplicates Z: 94 92.991 2.438 1.028 0.717 0.946 0.677 CB 1.693 94 residues pruned to eliminate duplicates Z: 99 86.454 2.459 0.913 0.684 0.908 0.673 CB 1.726 99 residues pruned to eliminate duplicates Z: 154 95.207 2.410 0.872 0.592 0.928 0.627 CB 1.683 154 residues pruned to eliminate duplicates Z: 26 59.001 2.568 1.277 0.739 1.000 0.760 CB 1.630 26 residues pruned to eliminate duplicates Z: 79 92.489 2.440 1.015 0.753 0.987 0.718 CB 1.723 79 residues pruned to eliminate duplicates Z: 139 92.555 2.415 0.885 0.622 0.928 0.667 CB 1.662 139 residues pruned to eliminate duplicates Z: 73 95.043 2.494 1.114 0.794 0.958 0.778 CB 1.713 73 residues pruned to eliminate duplicates Z: 119 92.432 2.412 0.958 0.656 0.932 0.661 CB 1.673 119 residues pruned to eliminate duplicates Z: 87 96.588 2.481 1.048 0.730 0.965 0.651 CB 1.727 87 residues pruned to eliminate duplicates Z: 107 88.466 2.424 0.996 0.650 0.934 0.632 CB 1.654 107 residues pruned to eliminate duplicates Z: 147 96.822 2.383 0.955 0.638 0.925 0.664 CB 1.634 147 residues pruned to eliminate duplicates Z: 129 95.513 2.423 0.950 0.651 0.922 0.680 CB 1.683 129 residues pruned to eliminate duplicates Z: 17 28.915 2.212 0.794 0.750 1.000 0.625 CB 1.458 18 residues pruned to eliminate duplicates Z: 12 29.536 2.251 0.815 0.889 1.000 0.636 CB 1.570 12 residues pruned to eliminate duplicates Z: 11 28.928 2.313 0.997 0.896 1.000 0.700 CB 1.419 11 residues pruned to eliminate duplicates Z: 18 19.315 2.168 0.479 0.646 0.882 0.706 CB 1.445 18 residues pruned to eliminate duplicates Z: 19 19.829 2.147 0.608 0.576 1.000 0.722 CB 1.258 19 residues pruned to eliminate duplicates Z: 18 24.128 2.158 0.607 0.626 1.000 0.706 CB 1.498 18 residues pruned to eliminate duplicates Z: 18 21.619 2.184 0.510 0.596 1.000 0.647 CB 1.451 18 residues pruned to eliminate duplicates Z: 19 19.219 2.157 0.440 0.573 0.889 0.611 CB 1.528 19 residues pruned to eliminate duplicates Z: 25 24.035 2.107 0.594 0.573 1.000 0.625 CB 1.362 25 residues pruned to eliminate duplicates Z: 18 25.484 2.191 0.722 0.635 1.000 0.765 CB 1.443 18 residues pruned to eliminate duplicates Z: 22 18.753 2.012 0.539 0.542 0.857 0.571 CB 1.481 22 residues pruned to eliminate duplicates Z: 25 22.301 2.098 0.539 0.578 0.958 0.792 CB 1.364 25 residues pruned to eliminate duplicates Z: 56 29.012 1.989 0.586 0.557 0.909 0.636 CB 1.291 56 residues pruned to eliminate duplicates Z: 24 22.056 2.101 0.521 0.572 1.000 0.652 CB 1.342 24 residues pruned to eliminate duplicates Z: 39 15.763 1.803 0.428 0.517 0.868 0.684 CB 1.124 39 residues pruned to eliminate duplicates Z: 24 24.018 2.079 0.580 0.674 0.957 0.696 CB 1.357 24 residues pruned to eliminate duplicates Z: 38 28.014 1.987 0.574 0.607 0.973 0.703 CB 1.367 38 residues pruned to eliminate duplicates Z: 71 45.415 2.137 0.677 0.625 0.957 0.643 CB 1.406 71 residues pruned to eliminate duplicates Z: 11 18.966 2.265 0.578 0.653 1.000 0.400 CB 1.455 11 residues pruned to eliminate duplicates Z: 38 29.669 2.017 0.710 0.612 0.946 0.595 CB 1.344 38 residues pruned to eliminate duplicates Z: 68 46.887 2.233 0.732 0.611 0.925 0.567 CB 1.441 69 residues pruned to eliminate duplicates Z: 14 18.384 1.982 0.839 0.595 0.846 0.462 CB 1.511 14 residues pruned to eliminate duplicates Z: 76 51.514 2.248 0.714 0.568 0.960 0.627 CB 1.506 76 residues pruned to eliminate duplicates Z: 38 25.820 2.015 0.554 0.611 0.946 0.730 CB 1.290 38 residues pruned to eliminate duplicates Z: 15 12.306 2.197 0.355 0.363 0.786 0.357 CB 1.630 15 residues pruned to eliminate duplicates Z: 34 23.242 1.935 0.554 0.641 1.000 0.727 CB 1.179 33 residues pruned to eliminate duplicates Z: 13 19.792 2.270 0.654 0.571 0.917 0.583 CB 1.551 13 residues pruned to eliminate duplicates Z: 106 60.278 2.265 0.720 0.565 0.943 0.600 CB 1.504 106 residues pruned to eliminate duplicates Z: 38 26.183 2.009 0.501 0.614 0.973 0.730 CB 1.318 38 residues pruned to eliminate duplicates Z: 6 3.302 1.539 0.587 0.208 0.800 0.400 CB 1.066 6 residues pruned to eliminate duplicates Z: 77 51.972 2.241 0.832 0.600 0.921 0.579 CB 1.433 77 residues pruned to eliminate duplicates Z: 35 61.985 2.540 0.963 0.677 0.971 0.588 CB 1.867 35 residues pruned to eliminate duplicates Z: 36 56.138 2.512 0.986 0.654 0.914 0.343 CB 1.803 36 residues pruned to eliminate duplicates Z: 36 53.912 2.530 0.946 0.632 0.886 0.486 CB 1.847 36 residues pruned to eliminate duplicates Z: 64 43.005 2.215 0.698 0.616 0.952 0.619 CB 1.354 64 residues pruned to eliminate duplicates Z: 23 51.619 2.559 1.013 0.732 0.955 0.591 CB 1.816 23 residues pruned to eliminate duplicates Z: 34 62.864 2.562 0.962 0.672 0.970 0.727 CB 1.916 34 residues pruned to eliminate duplicates Z: 37 48.894 2.405 0.914 0.605 0.917 0.611 CB 1.748 37 residues pruned to eliminate duplicates Z: 44 44.926 2.473 0.773 0.568 0.907 0.558 CB 1.614 44 residues pruned to eliminate duplicates Z: 75 49.771 2.277 0.648 0.612 0.932 0.662 CB 1.487 75 residues pruned to eliminate duplicates Z: 76 53.137 2.250 0.736 0.602 0.973 0.600 CB 1.466 76 residues pruned to eliminate duplicates Z: 23 47.163 2.441 0.758 0.853 0.955 0.682 CA 1.815 23 residues pruned to eliminate duplicates Z: 76 51.697 2.270 0.674 0.613 0.947 0.613 CB 1.490 76 residues pruned to eliminate duplicates Z: 32 35.645 2.388 0.744 0.579 0.968 0.774 CB 1.473 32 residues pruned to eliminate duplicates Z: 75 54.211 2.273 0.752 0.598 0.959 0.649 CB 1.502 75 residues pruned to eliminate duplicates Z: 36 58.443 2.534 0.920 0.634 0.943 0.600 CB 1.899 36 residues pruned to eliminate duplicates Z: 77 52.428 2.246 0.716 0.600 0.961 0.697 CB 1.477 77 residues pruned to eliminate duplicates Z: 107 62.311 2.296 0.638 0.597 0.953 0.632 CB 1.539 107 residues pruned to eliminate duplicates Z: 76 49.891 2.218 0.629 0.613 0.973 0.693 CB 1.471 74 residues pruned to eliminate duplicates Z: 26 46.599 2.326 0.860 0.811 0.960 0.680 CA 1.711 26 residues pruned to eliminate duplicates Z: 106 61.622 2.293 0.738 0.592 0.914 0.657 CB 1.511 106 residues pruned to eliminate duplicates Z: 37 52.302 2.509 0.916 0.614 0.917 0.583 CB 1.776 37 residues pruned to eliminate duplicates Z: 43 48.614 2.497 0.736 0.580 0.952 0.619 CB 1.683 43 residues pruned to eliminate duplicates Z: 35 55.055 2.556 0.816 0.637 0.971 0.559 CB 1.844 35 residues pruned to eliminate duplicates Z: 37 52.178 2.505 0.825 0.619 0.944 0.639 CB 1.800 37 residues pruned to eliminate duplicates Z: 13 37.749 2.565 1.084 0.526 1.000 0.333 CB 1.985 13 residues pruned to eliminate duplicates Z: 66 49.921 2.314 0.778 0.541 0.892 0.523 CB 1.619 66 residues pruned to eliminate duplicates Z: 81 54.618 2.268 0.703 0.577 0.963 0.625 CB 1.526 83 residues pruned to eliminate duplicates Z: 6 2.314 1.626 0.212 0.176 0.800 0.600 CA 0.972 Z: 18 40.542 2.258 0.891 0.853 1.000 0.647 CB 1.702 24 residues pruned to eliminate duplicates Z: 45 41.835 2.368 0.887 0.525 0.886 0.500 CB 1.553 45 residues pruned to eliminate duplicates Z: 45 48.874 2.346 0.901 0.546 0.932 0.477 CB 1.695 45 residues pruned to eliminate duplicates Z: 63 49.845 2.349 0.890 0.535 0.887 0.597 CB 1.553 63 residues pruned to eliminate duplicates Z: 108 54.734 2.250 0.588 0.579 0.925 0.589 CB 1.483 108 residues pruned to eliminate duplicates Z: 31 35.951 2.280 0.709 0.642 0.900 0.667 CB 1.639 31 residues pruned to eliminate duplicates Z: 33 31.737 2.220 0.702 0.563 0.938 0.688 CB 1.490 33 residues pruned to eliminate duplicates Z: 39 35.786 2.275 0.939 0.523 0.816 0.605 CB 1.577 39 residues pruned to eliminate duplicates Z: 32 36.789 2.347 0.916 0.578 0.839 0.613 CB 1.625 32 residues pruned to eliminate duplicates Z: 34 33.094 2.275 0.726 0.553 0.909 0.636 CB 1.532 34 residues pruned to eliminate duplicates Z: 18 36.816 2.261 0.811 0.815 1.000 0.824 CB 1.658 18 residues pruned to eliminate duplicates Z: 107 62.206 2.249 0.716 0.590 0.962 0.642 CB 1.493 106 residues pruned to eliminate duplicates Z: 18 37.273 2.194 0.894 0.876 0.941 0.588 CA 1.681 18 residues pruned to eliminate duplicates Z: 32 31.451 2.284 0.627 0.597 0.903 0.613 CB 1.534 32 residues pruned to eliminate duplicates Z: 34 31.280 2.259 0.698 0.591 0.879 0.515 CB 1.480 34 residues pruned to eliminate duplicates Z: 33 33.956 2.265 0.781 0.604 0.906 0.469 CB 1.487 33 residues pruned to eliminate duplicates Z: 41 32.167 2.315 0.631 0.539 0.825 0.575 CB 1.570 41 residues pruned to eliminate duplicates Z: 44 41.963 2.306 0.807 0.524 0.907 0.558 CB 1.653 44 residues pruned to eliminate duplicates Z: 34 32.491 2.226 0.770 0.604 0.848 0.697 CB 1.534 34 residues pruned to eliminate duplicates Z: 16 12.085 2.262 0.794 0.289 0.667 0.533 CB 1.461 16 residues pruned to eliminate duplicates Z: 34 35.894 2.265 0.793 0.605 0.909 0.515 CB 1.532 34 residues pruned to eliminate duplicates Z: 34 32.590 2.218 0.787 0.586 0.879 0.515 CB 1.500 34 residues pruned to eliminate duplicates Z: 41 40.690 2.326 0.819 0.516 0.900 0.500 CB 1.662 41 residues pruned to eliminate duplicates Z: 32 35.804 2.301 0.797 0.600 0.871 0.516 CB 1.623 32 residues pruned to eliminate duplicates Z: 105 63.527 2.274 0.706 0.612 0.952 0.625 CB 1.517 105 residues pruned to eliminate duplicates Z: 34 38.821 2.296 1.070 0.596 0.848 0.545 CB 1.529 34 residues pruned to eliminate duplicates Z: 7 16.480 2.266 0.711 0.607 1.000 0.667 CA 1.567 7 residues pruned to eliminate duplicates Z: 32 41.117 2.337 0.926 0.630 0.935 0.581 CB 1.552 32 residues pruned to eliminate duplicates Z: 11 9.273 2.006 0.209 0.663 0.800 0.500 CB 1.299 Z: 13 9.577 1.805 0.275 0.663 0.917 0.750 CB 1.127 11 residues pruned to eliminate duplicates Z: 12 11.032 1.871 0.361 0.653 0.909 0.545 CB 1.246 13 residues pruned to eliminate duplicates Z: 13 13.579 1.828 0.355 0.656 1.000 0.583 CB 1.369 12 residues pruned to eliminate duplicates Z: 12 10.772 1.941 0.150 0.679 0.909 0.727 CB 1.358 12 residues pruned to eliminate duplicates Z: 31 20.400 1.930 0.486 0.559 0.967 0.633 CB 1.268 28 residues pruned to eliminate duplicates Z: 7 7.396 1.944 0.219 0.608 1.000 0.833 CB 1.150 7 residues pruned to eliminate duplicates Z: 17 18.068 2.137 0.426 0.530 0.938 0.625 CB 1.535 17 residues pruned to eliminate duplicates Z: 17 19.164 2.160 0.395 0.488 1.000 0.500 CB 1.609 17 residues pruned to eliminate duplicates Z: 13 12.064 1.941 0.258 0.606 0.917 0.750 CB 1.408 13 residues pruned to eliminate duplicates Z: 40 17.346 1.769 0.340 0.557 0.949 0.667 CB 1.169 40 residues pruned to eliminate duplicates Z: 43 43.600 2.315 0.764 0.582 0.976 0.548 CB 1.559 18 residues pruned to eliminate duplicates Z: 6 4.966 1.598 0.215 0.399 1.000 0.400 N 1.273 6 residues pruned to eliminate duplicates Z: 17 17.344 2.164 0.339 0.531 0.938 0.688 CB 1.548 17 residues pruned to eliminate duplicates Z: 61 36.073 2.101 0.649 0.577 0.933 0.583 CB 1.336 61 residues pruned to eliminate duplicates Z: 6 4.942 1.994 0.279 0.402 1.000 0.600 CB 0.962 6 residues pruned to eliminate duplicates Z: 25 43.123 2.453 0.936 0.663 0.958 0.417 CB 1.663 25 residues pruned to eliminate duplicates Z: 26 44.123 2.358 0.923 0.635 0.920 0.440 CB 1.864 26 residues pruned to eliminate duplicates Z: 31 40.119 2.361 1.017 0.594 0.867 0.400 CB 1.622 23 residues pruned to eliminate duplicates Z: 8 12.038 2.282 0.683 0.530 0.857 0.571 CA 1.342 8 residues pruned to eliminate duplicates Z: 43 36.146 2.224 0.771 0.561 0.929 0.476 CB 1.438 43 residues pruned to eliminate duplicates Z: 24 39.396 2.452 1.022 0.587 0.826 0.739 CA 1.844 24 residues pruned to eliminate duplicates Z: 23 52.815 2.494 1.171 0.700 0.955 0.545 CB 1.816 23 residues pruned to eliminate duplicates Z: 79 60.491 2.365 0.847 0.607 0.872 0.603 CB 1.625 33 residues pruned to eliminate duplicates Z: 22 50.521 2.448 1.139 0.769 0.952 0.619 CB 1.742 22 residues pruned to eliminate duplicates Z: 45 41.418 2.248 0.790 0.579 0.977 0.568 CB 1.472 45 residues pruned to eliminate duplicates Z: 43 41.933 2.305 0.795 0.589 0.952 0.571 CB 1.509 43 residues pruned to eliminate duplicates Z: 25 47.199 2.459 1.161 0.642 1.000 0.625 CB 1.588 25 residues pruned to eliminate duplicates Z: 43 36.649 2.281 0.708 0.568 0.929 0.548 CB 1.464 43 residues pruned to eliminate duplicates Z: 31 43.856 2.406 0.933 0.605 1.000 0.633 CB 1.557 31 residues pruned to eliminate duplicates Z: 35 69.557 2.540 1.192 0.659 0.971 0.647 CB 1.904 35 residues pruned to eliminate duplicates Z: 35 67.192 2.554 1.056 0.659 0.971 0.794 CB 1.951 35 residues pruned to eliminate duplicates Z: 73 57.886 2.314 0.694 0.612 0.958 0.653 CB 1.633 73 residues pruned to eliminate duplicates Z: 26 47.610 2.361 1.078 0.646 0.960 0.680 CB 1.764 26 residues pruned to eliminate duplicates Z: 43 35.830 2.280 0.634 0.573 0.905 0.500 CB 1.528 43 residues pruned to eliminate duplicates Z: 25 43.602 2.475 1.016 0.640 0.958 0.583 CB 1.633 25 residues pruned to eliminate duplicates Z: 37 59.220 2.520 0.981 0.639 0.972 0.667 CB 1.786 37 residues pruned to eliminate duplicates Z: 35 63.406 2.541 0.991 0.663 0.971 0.647 CB 1.905 35 residues pruned to eliminate duplicates Z: 29 38.554 2.269 1.051 0.561 0.893 0.643 CB 1.653 29 residues pruned to eliminate duplicates Z: 36 61.074 2.493 1.135 0.629 0.914 0.629 CB 1.879 36 residues pruned to eliminate duplicates Z: 55 50.289 2.375 0.841 0.534 0.907 0.574 CB 1.668 55 residues pruned to eliminate duplicates Z: 82 50.966 2.295 0.627 0.518 0.914 0.679 CB 1.630 82 residues pruned to eliminate duplicates Z: 37 57.015 2.499 0.849 0.639 1.000 0.750 CB 1.805 37 residues pruned to eliminate duplicates Z: 87 57.521 2.306 0.635 0.592 0.930 0.686 CB 1.619 103 residues pruned to eliminate duplicates Z: 25 52.289 2.301 0.976 0.827 1.000 0.750 CA 1.769 25 residues pruned to eliminate duplicates Z: 12 42.786 2.609 1.369 0.525 1.000 0.545 CB 2.036 12 residues pruned to eliminate duplicates Z: 35 62.325 2.521 0.895 0.672 1.000 0.706 CB 1.910 35 residues pruned to eliminate duplicates Z: 127 67.014 2.300 0.681 0.585 0.929 0.611 CB 1.533 127 residues pruned to eliminate duplicates Z: 35 64.022 2.522 0.960 0.663 1.000 0.647 CB 1.910 35 residues pruned to eliminate duplicates Z: 11 18.189 2.311 1.122 0.447 0.800 0.400 CB 1.548 11 residues pruned to eliminate duplicates Z: 42 38.603 2.290 0.821 0.515 0.902 0.537 CB 1.579 42 residues pruned to eliminate duplicates Z: 116 64.113 2.288 0.697 0.567 0.922 0.591 CB 1.566 127 residues pruned to eliminate duplicates Z: 14 14.196 2.018 0.351 0.657 0.846 0.615 CB 1.476 14 residues pruned to eliminate duplicates Z: 71 44.302 2.187 0.721 0.555 0.900 0.614 CB 1.482 71 residues pruned to eliminate duplicates Z: 91 65.144 2.310 0.790 0.603 0.933 0.678 CB 1.613 91 residues pruned to eliminate duplicates Z: 32 33.425 2.217 0.563 0.608 0.968 0.677 CB 1.616 32 residues pruned to eliminate duplicates Z: 22 19.732 2.126 0.319 0.652 0.905 0.619 CB 1.473 22 residues pruned to eliminate duplicates Z: 54 49.266 2.300 0.666 0.622 0.925 0.679 CB 1.702 54 residues pruned to eliminate duplicates Z: 31 27.230 2.230 0.433 0.567 0.900 0.700 CB 1.621 31 residues pruned to eliminate duplicates Z: 32 31.211 2.266 0.532 0.589 0.935 0.581 CB 1.585 32 residues pruned to eliminate duplicates Z: 67 60.209 2.373 0.775 0.596 0.939 0.667 CB 1.709 67 residues pruned to eliminate duplicates Z: 17 31.107 2.281 0.660 0.807 0.938 0.812 CB 1.676 17 residues pruned to eliminate duplicates Z: 21 25.804 2.212 0.527 0.658 0.900 0.800 CB 1.639 21 residues pruned to eliminate duplicates Z: 105 54.660 2.238 0.637 0.559 0.904 0.587 CB 1.528 105 residues pruned to eliminate duplicates Z: 32 29.626 2.229 0.619 0.578 0.903 0.677 CB 1.515 32 residues pruned to eliminate duplicates Z: 69 54.181 2.355 0.828 0.584 0.882 0.588 CB 1.597 69 residues pruned to eliminate duplicates Z: 91 61.699 2.316 0.755 0.586 0.911 0.644 CB 1.618 91 residues pruned to eliminate duplicates Z: 57 61.025 2.357 0.829 0.641 0.964 0.625 CB 1.720 57 residues pruned to eliminate duplicates Z: 56 57.907 2.359 0.811 0.621 0.945 0.600 CB 1.725 56 residues pruned to eliminate duplicates Z: 137 70.087 2.277 0.676 0.576 0.934 0.618 CB 1.567 137 residues pruned to eliminate duplicates Z: 41 43.171 2.293 0.815 0.584 0.900 0.575 CB 1.682 41 residues pruned to eliminate duplicates Z: 67 58.662 2.344 0.853 0.572 0.924 0.667 CB 1.679 67 residues pruned to eliminate duplicates Z: 35 34.051 2.144 1.003 0.528 0.824 0.618 CB 1.606 35 residues pruned to eliminate duplicates Z: 62 60.041 2.382 0.746 0.613 0.967 0.623 CB 1.717 62 residues pruned to eliminate duplicates Z: 28 25.144 2.246 0.610 0.526 0.889 0.593 CB 1.467 28 residues pruned to eliminate duplicates Z: 65 42.788 2.264 0.792 0.495 0.875 0.516 CB 1.515 65 residues pruned to eliminate duplicates Z: 29 25.193 2.172 0.665 0.485 0.857 0.500 CB 1.560 29 residues pruned to eliminate duplicates Z: 12 22.666 2.190 1.112 0.514 0.909 0.545 CB 1.603 12 residues pruned to eliminate duplicates Z: 59 41.481 2.179 0.790 0.599 0.914 0.586 CB 1.391 59 residues pruned to eliminate duplicates Z: 39 30.778 2.127 0.895 0.517 0.921 0.474 CB 1.323 39 residues pruned to eliminate duplicates Z: 19 12.126 1.935 0.651 0.390 0.722 0.500 CB 1.391 19 residues pruned to eliminate duplicates Z: 31 38.230 2.304 0.846 0.636 0.900 0.533 CB 1.605 31 residues pruned to eliminate duplicates Z: 41 33.171 2.218 0.725 0.521 0.925 0.650 CB 1.451 41 residues pruned to eliminate duplicates Z: 68 49.824 2.267 0.777 0.578 0.910 0.597 CB 1.540 68 residues pruned to eliminate duplicates Z: 116 58.750 2.238 0.631 0.573 0.939 0.530 CB 1.489 116 residues pruned to eliminate duplicates Z: 40 33.831 2.223 0.777 0.530 0.872 0.564 CB 1.527 40 residues pruned to eliminate duplicates Z: 36 34.205 2.270 0.827 0.554 0.857 0.629 CB 1.543 36 residues pruned to eliminate duplicates Z: 18 21.779 2.050 0.642 0.623 0.882 0.647 CB 1.583 18 residues pruned to eliminate duplicates Z: 36 35.018 2.263 0.765 0.556 0.914 0.571 CB 1.535 36 residues pruned to eliminate duplicates Z: 42 33.601 2.161 0.761 0.537 0.927 0.634 CB 1.434 42 residues pruned to eliminate duplicates Z: 25 26.887 2.232 0.659 0.613 0.917 0.667 CB 1.452 25 residues pruned to eliminate duplicates Z: 87 62.872 2.284 0.792 0.638 0.907 0.663 CB 1.604 87 residues pruned to eliminate duplicates Z: 52 37.560 2.203 0.724 0.533 0.902 0.647 CB 1.486 52 residues pruned to eliminate duplicates Z: 57 45.228 2.220 0.709 0.630 0.946 0.625 CB 1.490 57 residues pruned to eliminate duplicates Z: 40 37.775 2.206 0.708 0.606 0.923 0.667 CB 1.572 40 residues pruned to eliminate duplicates Z: 70 44.590 2.169 0.702 0.532 0.913 0.464 CB 1.542 70 residues pruned to eliminate duplicates Z: 89 45.810 2.209 0.660 0.490 0.920 0.602 CB 1.460 89 residues pruned to eliminate duplicates Z: 44 33.633 2.197 0.795 0.571 0.837 0.581 CB 1.450 44 residues pruned to eliminate duplicates Z: 20 13.169 1.865 0.635 0.410 0.895 0.526 CB 1.217 20 residues pruned to eliminate duplicates Z: 17 14.004 1.825 0.775 0.481 0.875 0.562 CB 1.259 Z: 6 2.492 1.623 0.496 0.177 0.800 0.600 CA 0.846 6 residues pruned to eliminate duplicates Z: 86 45.644 2.191 0.673 0.585 0.882 0.671 CB 1.410 86 residues pruned to eliminate duplicates Z: 50 35.476 2.237 0.664 0.517 0.898 0.592 CB 1.491 50 residues pruned to eliminate duplicates Z: 50 36.678 2.231 0.730 0.519 0.898 0.612 CB 1.484 50 residues pruned to eliminate duplicates Z: 50 34.191 2.224 0.673 0.513 0.878 0.653 CB 1.476 50 residues pruned to eliminate duplicates Z: 49 34.023 2.238 0.644 0.527 0.875 0.729 CB 1.485 49 residues pruned to eliminate duplicates Z: 42 28.783 2.222 0.581 0.500 0.902 0.634 CB 1.419 42 residues pruned to eliminate duplicates Z: 69 43.191 2.159 0.764 0.567 0.926 0.647 CB 1.392 69 residues pruned to eliminate duplicates Z: 60 32.288 2.212 0.580 0.448 0.898 0.644 CB 1.412 60 residues pruned to eliminate duplicates Z: 41 31.394 2.280 0.525 0.489 0.925 0.675 CB 1.561 41 residues pruned to eliminate duplicates Z: 49 37.493 2.241 0.653 0.551 0.938 0.771 CB 1.482 49 residues pruned to eliminate duplicates Z: 51 37.401 2.234 0.721 0.538 0.940 0.560 CB 1.410 51 residues pruned to eliminate duplicates Z: 42 31.297 2.243 0.618 0.475 0.927 0.683 CB 1.489 42 residues pruned to eliminate duplicates Z: 36 31.218 2.248 0.703 0.579 0.886 0.600 CB 1.442 36 residues pruned to eliminate duplicates Z: 51 34.024 2.240 0.627 0.503 0.900 0.680 CB 1.462 51 residues pruned to eliminate duplicates Z: 37 31.841 2.244 0.694 0.567 0.917 0.611 CB 1.427 37 residues pruned to eliminate duplicates Z: 28 27.595 2.180 0.726 0.600 0.926 0.593 CB 1.385 28 residues pruned to eliminate duplicates Z: 27 25.164 2.210 0.725 0.644 0.846 0.769 CB 1.337 27 residues pruned to eliminate duplicates Z: 69 49.594 2.218 0.840 0.598 0.941 0.662 CB 1.426 69 residues pruned to eliminate duplicates Z: 70 49.129 2.245 0.717 0.622 0.942 0.725 CB 1.452 70 residues pruned to eliminate duplicates Z: 42 32.095 2.224 0.644 0.507 0.902 0.756 CB 1.509 42 residues pruned to eliminate duplicates Z: 72 46.674 2.235 0.656 0.610 0.930 0.761 CB 1.452 72 residues pruned to eliminate duplicates Z: 75 49.750 2.195 0.793 0.639 0.919 0.716 CB 1.404 75 residues pruned to eliminate duplicates Z: 50 33.646 2.159 0.724 0.510 0.898 0.633 CB 1.425 50 residues pruned to eliminate duplicates Z: 71 50.570 2.211 0.768 0.642 0.957 0.800 CB 1.414 71 residues pruned to eliminate duplicates Z: 27 30.462 2.313 0.558 0.608 0.962 0.692 CB 1.556 27 residues pruned to eliminate duplicates Z: 51 34.096 2.221 0.687 0.517 0.900 0.660 CB 1.407 51 residues pruned to eliminate duplicates Z: 13 14.531 2.168 0.602 0.516 0.917 0.667 CB 1.296 13 residues pruned to eliminate duplicates Z: 43 34.564 2.165 0.699 0.616 0.905 0.738 CB 1.436 43 residues pruned to eliminate duplicates Z: 37 29.519 2.206 0.648 0.597 0.944 0.611 CB 1.306 37 residues pruned to eliminate duplicates Z: 43 28.916 2.183 0.515 0.532 0.952 0.786 CB 1.374 43 residues pruned to eliminate duplicates Z: 29 23.684 2.134 0.702 0.390 0.964 0.643 CB 1.435 29 residues pruned to eliminate duplicates Z: 50 34.205 2.246 0.657 0.521 0.898 0.653 CB 1.432 50 residues pruned to eliminate duplicates Z: 82 43.536 2.174 0.741 0.557 0.852 0.667 CB 1.419 82 residues pruned to eliminate duplicates Z: 15 19.826 2.044 0.897 0.401 0.929 0.714 CB 1.633 15 residues pruned to eliminate duplicates Z: 49 37.545 2.217 0.781 0.541 0.917 0.667 CB 1.437 49 residues pruned to eliminate duplicates Z: 72 47.538 2.209 0.758 0.655 0.915 0.746 CB 1.374 72 residues pruned to eliminate duplicates Z: 52 33.360 2.191 0.646 0.524 0.902 0.686 CB 1.402 52 residues pruned to eliminate duplicates Z: 49 39.593 2.243 0.798 0.571 0.875 0.708 CB 1.512 49 residues pruned to eliminate duplicates Z: 50 35.668 2.227 0.735 0.546 0.878 0.755 CB 1.437 50 residues pruned to eliminate duplicates Z: 53 29.723 2.135 0.764 0.505 0.827 0.654 CB 1.317 53 residues pruned to eliminate duplicates Z: 50 37.603 2.214 0.687 0.579 0.898 0.776 CB 1.485 50 residues pruned to eliminate duplicates Z: 51 34.796 2.202 0.768 0.526 0.900 0.740 CB 1.369 51 residues pruned to eliminate duplicates Z: 76 45.003 2.168 0.686 0.636 0.920 0.747 CB 1.360 76 residues pruned to eliminate duplicates Z: 27 27.634 2.089 0.679 0.809 0.923 0.731 CB 1.278 27 residues pruned to eliminate duplicates Z: 70 44.918 2.187 0.693 0.609 0.913 0.681 CB 1.442 70 residues pruned to eliminate duplicates Z: 73 52.317 2.234 0.743 0.664 0.944 0.778 CB 1.440 74 residues pruned to eliminate duplicates Z: 24 32.429 2.088 0.678 0.882 1.000 0.913 CB 1.397 24 residues pruned to eliminate duplicates Z: 24 28.243 2.154 0.564 0.796 0.913 0.783 CB 1.477 24 residues pruned to eliminate duplicates Z: 80 46.192 2.180 0.691 0.585 0.911 0.722 CB 1.426 80 residues pruned to eliminate duplicates Z: 26 33.090 2.139 0.670 0.813 1.000 0.720 CB 1.411 26 residues pruned to eliminate duplicates Z: 75 48.874 2.197 0.735 0.629 0.932 0.662 CB 1.416 75 residues pruned to eliminate duplicates Z: 26 39.266 2.159 0.978 0.804 1.000 0.640 CB 1.411 27 residues pruned to eliminate duplicates Z: 21 29.221 2.152 0.747 0.890 0.900 0.800 CB 1.389 21 residues pruned to eliminate duplicates Z: 26 38.174 2.145 0.897 0.855 1.000 0.680 CB 1.385 23 residues pruned to eliminate duplicates Z: 21 35.184 2.194 0.974 0.907 0.900 0.750 CB 1.434 21 residues pruned to eliminate duplicates Z: 27 40.934 2.135 1.053 0.796 1.000 0.423 CB 1.413 29 residues pruned to eliminate duplicates Z: 23 38.062 2.145 1.264 0.915 0.909 0.364 CB 1.299 23 residues pruned to eliminate duplicates Z: 26 37.387 2.161 1.038 0.812 0.960 0.480 CB 1.348 27 residues pruned to eliminate duplicates Z: 22 35.024 2.162 1.091 0.907 0.857 0.571 CB 1.402 22 residues pruned to eliminate duplicates Z: 23 37.231 2.239 0.873 0.837 0.955 0.636 CB 1.483 23 residues pruned to eliminate duplicates Z: 62 45.787 2.226 0.774 0.624 0.934 0.623 CB 1.414 62 residues pruned to eliminate duplicates Z: 24 39.890 2.168 1.089 0.874 0.957 0.478 CB 1.396 24 residues pruned to eliminate duplicates Z: 29 32.358 2.090 0.912 0.743 0.893 0.393 CB 1.378 29 residues pruned to eliminate duplicates Z: 75 51.971 2.205 0.759 0.640 0.959 0.595 CB 1.425 75 residues pruned to eliminate duplicates Z: 25 40.180 2.168 1.005 0.895 1.000 0.542 CB 1.352 25 residues pruned to eliminate duplicates Z: 68 49.485 2.195 0.858 0.617 0.925 0.746 CB 1.434 68 residues pruned to eliminate duplicates Z: 75 49.569 2.167 0.885 0.612 0.946 0.608 CB 1.341 71 residues pruned to eliminate duplicates 791 residues left after pruning, divided into chains as follows: A: 21 B: 284 C: 195 D: 11 E: 280 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 44.28 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.546, Connect. = 0.793 for dens.mod. cycle 1 = 0.300, Contrast = 0.620, Connect. = 0.813 for dens.mod. cycle 2 = 0.300, Contrast = 0.763, Connect. = 0.833 for dens.mod. cycle 3 = 0.300, Contrast = 0.780, Connect. = 0.835 for dens.mod. cycle 4 = 0.300, Contrast = 0.798, Connect. = 0.836 for dens.mod. cycle 5 = 0.300, Contrast = 0.805, Connect. = 0.837 for dens.mod. cycle 6 = 0.300, Contrast = 0.813, Connect. = 0.838 for dens.mod. cycle 7 = 0.300, Contrast = 0.815, Connect. = 0.838 for dens.mod. cycle 8 = 0.300, Contrast = 0.818, Connect. = 0.839 for dens.mod. cycle 9 = 0.300, Contrast = 0.819, Connect. = 0.839 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4092 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 986 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 17 37.080 2.253 1.055 0.852 0.938 0.625 CB 1.580 B: 27 47.260 2.251 1.022 0.870 0.923 0.731 CB 1.611 C: 12 22.036 2.268 0.436 0.911 1.000 0.909 CB 1.445 D: 15 25.004 2.151 0.516 0.881 1.000 0.929 CB 1.484 12 residues pruned to eliminate duplicates E: 25 55.183 2.368 1.058 0.921 1.000 0.542 CB 1.627 27 residues pruned to eliminate duplicates F: 25 52.353 2.370 1.005 0.913 0.958 0.583 CB 1.660 25 residues pruned to eliminate duplicates G: 15 35.407 2.294 0.643 0.868 1.000 0.929 CB 1.835 H: 16 40.928 2.340 0.873 0.918 1.000 0.800 CA 1.700 17 residues pruned to eliminate duplicates I: 17 47.658 2.383 0.954 0.933 1.000 0.875 CB 1.786 J: 26 47.461 2.304 0.999 0.893 0.920 0.720 CB 1.609 26 residues pruned to eliminate duplicates K: 32 60.697 2.326 1.006 0.908 0.968 0.645 CB 1.715 L: 17 49.742 2.353 1.136 0.914 0.938 0.688 CB 1.867 M: 15 35.301 2.346 0.639 0.916 1.000 0.929 CB 1.734 N: 16 54.711 2.506 1.271 0.873 1.000 0.800 CB 1.807 O: 29 62.125 2.383 0.991 0.939 1.000 0.857 CB 1.719 30 residues pruned to eliminate duplicates P: 11 19.299 2.293 0.226 0.892 1.000 0.800 CB 1.559 11 residues pruned to eliminate duplicates Q: 75 54.374 2.267 0.739 0.565 0.973 0.568 CB 1.547 R: 26 46.614 2.271 1.014 0.888 0.920 0.640 CB 1.596 26 residues pruned to eliminate duplicates S: 17 52.828 2.512 1.097 0.891 1.000 0.750 CB 1.803 17 residues pruned to eliminate duplicates T: 26 26.827 2.335 0.716 0.364 0.920 0.680 CB 1.685 U: 21 38.938 2.436 0.613 0.840 0.900 0.700 CB 1.838 21 residues pruned to eliminate duplicates V: 23 41.396 2.267 0.854 0.816 0.909 0.773 CA 1.755 17 residues pruned to eliminate duplicates W: 31 45.507 2.281 0.413 0.908 1.000 0.900 CB 1.830 X: 32 49.025 2.277 0.702 0.872 0.968 0.806 CB 1.712 31 residues pruned to eliminate duplicates Y: 16 31.370 2.267 0.513 0.903 1.000 0.733 CB 1.684 16 residues pruned to eliminate duplicates Z: 16 43.048 2.334 1.141 0.922 0.933 0.533 CB 1.676 16 residues pruned to eliminate duplicates Z: 17 45.430 2.332 0.893 0.923 1.000 0.938 CB 1.808 17 residues pruned to eliminate duplicates Z: 16 29.013 2.249 0.567 0.895 0.933 0.800 CB 1.632 16 residues pruned to eliminate duplicates Z: 25 49.454 2.369 0.885 0.916 0.958 0.667 CB 1.666 25 residues pruned to eliminate duplicates Z: 16 44.264 2.396 1.024 0.905 1.000 0.733 CB 1.677 16 residues pruned to eliminate duplicates Z: 21 43.846 2.437 0.888 0.824 0.900 0.750 CB 1.788 23 residues pruned to eliminate duplicates Z: 14 26.456 2.273 0.538 0.907 1.000 0.846 CB 1.492 16 residues pruned to eliminate duplicates Z: 30 47.242 2.149 1.029 0.860 0.931 0.586 CB 1.588 30 residues pruned to eliminate duplicates Z: 22 41.254 2.430 0.750 0.838 0.905 0.810 CB 1.748 22 residues pruned to eliminate duplicates Z: 25 38.233 2.335 0.722 0.772 0.917 0.667 CB 1.665 25 residues pruned to eliminate duplicates Z: 17 34.791 2.284 0.982 0.868 0.938 0.812 CB 1.498 17 residues pruned to eliminate duplicates Z: 23 48.653 2.367 1.011 0.807 0.909 0.727 CB 1.834 21 residues pruned to eliminate duplicates Z: 89 91.241 2.424 0.892 0.735 0.966 0.739 CB 1.777 63 residues pruned to eliminate duplicates Z: 18 46.160 2.230 1.208 0.876 1.000 0.882 CB 1.653 18 residues pruned to eliminate duplicates Z: 32 47.262 2.270 0.529 0.896 1.000 0.806 CB 1.752 32 residues pruned to eliminate duplicates Z: 12 36.460 2.411 0.977 0.902 1.000 0.727 CB 1.646 Z: 18 45.922 2.314 0.895 0.930 1.000 0.765 CB 1.776 18 residues pruned to eliminate duplicates Z: 16 43.897 2.406 0.862 0.894 1.000 0.867 CA 1.815 16 residues pruned to eliminate duplicates Z: 31 58.095 2.376 0.741 0.922 1.000 0.767 CB 1.803 31 residues pruned to eliminate duplicates Z: 29 58.401 2.395 0.864 0.911 0.964 0.750 CB 1.818 29 residues pruned to eliminate duplicates Z: 14 24.710 2.315 0.579 0.868 0.846 0.692 CB 1.620 Z: 29 64.256 2.369 1.063 0.935 1.000 0.857 CB 1.732 29 residues pruned to eliminate duplicates Z: 62 44.786 2.234 0.721 0.609 0.934 0.607 CB 1.439 62 residues pruned to eliminate duplicates Z: 15 22.569 2.237 0.532 0.815 0.857 0.714 CB 1.561 15 residues pruned to eliminate duplicates Z: 25 45.752 2.334 0.710 0.908 1.000 0.792 CB 1.662 25 residues pruned to eliminate duplicates Z: 18 42.369 2.319 0.763 0.913 0.941 0.824 CB 1.890 18 residues pruned to eliminate duplicates Z: 16 46.602 2.235 1.156 0.934 1.000 0.867 CA 1.741 16 residues pruned to eliminate duplicates Z: 16 41.578 2.356 1.020 0.900 0.933 0.867 CB 1.726 16 residues pruned to eliminate duplicates Z: 15 28.061 2.296 0.830 0.866 0.857 0.714 CB 1.524 14 residues pruned to eliminate duplicates Z: 92 90.173 2.372 0.950 0.724 0.956 0.747 CB 1.746 92 residues pruned to eliminate duplicates Z: 24 35.429 2.126 0.822 0.902 0.957 0.783 CB 1.423 Z: 15 51.311 2.496 0.986 0.922 1.000 0.857 CB 1.946 15 residues pruned to eliminate duplicates Z: 32 42.825 2.348 0.730 0.733 0.935 0.774 CB 1.642 32 residues pruned to eliminate duplicates Z: 175 95.171 2.391 0.841 0.621 0.908 0.632 CB 1.609 78 residues pruned to eliminate duplicates Z: 50 36.625 2.266 0.646 0.547 0.918 0.714 CB 1.459 Z: 19 33.790 2.210 0.980 0.871 0.833 0.556 CB 1.593 19 residues pruned to eliminate duplicates Z: 16 32.715 2.334 0.456 0.923 1.000 0.867 CA 1.747 Z: 15 48.728 2.511 0.929 0.935 1.000 0.929 CB 1.874 15 residues pruned to eliminate duplicates Z: 16 33.604 2.314 0.671 0.925 1.000 0.867 CB 1.574 16 residues pruned to eliminate duplicates Z: 15 28.580 2.323 0.568 0.864 0.929 0.643 CB 1.655 15 residues pruned to eliminate duplicates Z: 20 42.485 2.284 1.004 0.866 0.842 0.579 CB 1.851 20 residues pruned to eliminate duplicates Z: 14 46.833 2.470 1.096 0.922 1.000 0.923 CB 1.765 14 residues pruned to eliminate duplicates Z: 12 18.372 2.279 0.631 0.383 1.000 0.636 CB 1.687 12 residues pruned to eliminate duplicates Z: 13 20.995 2.191 0.729 0.624 0.917 0.833 CB 1.552 13 residues pruned to eliminate duplicates Z: 6 12.079 1.891 0.442 0.861 1.000 0.800 O 1.456 6 residues pruned to eliminate duplicates Z: 14 25.927 2.320 0.527 0.899 1.000 0.769 CB 1.451 15 residues pruned to eliminate duplicates Z: 22 45.275 2.321 0.864 0.817 1.000 0.810 CA 1.734 22 residues pruned to eliminate duplicates Z: 15 40.599 2.356 0.861 0.929 1.000 0.929 CA 1.732 15 residues pruned to eliminate duplicates Z: 14 21.361 2.265 0.428 0.887 0.923 0.769 CB 1.431 14 residues pruned to eliminate duplicates Z: 23 48.006 2.454 0.990 0.811 0.864 0.591 CB 1.851 23 residues pruned to eliminate duplicates Z: 31 47.491 2.279 0.507 0.878 1.000 0.867 CB 1.833 29 residues pruned to eliminate duplicates Z: 19 29.676 2.127 0.447 0.855 1.000 0.722 CB 1.678 19 residues pruned to eliminate duplicates Z: 19 12.689 2.126 0.340 0.493 0.778 0.500 CB 1.360 Z: 91 64.518 2.369 0.876 0.593 0.911 0.667 CB 1.537 87 residues pruned to eliminate duplicates Z: 15 32.025 2.271 0.662 0.907 1.000 0.786 CB 1.612 14 residues pruned to eliminate duplicates Z: 23 30.597 2.118 0.496 0.939 1.000 0.909 CB 1.430 23 residues pruned to eliminate duplicates Z: 14 28.221 2.347 0.533 0.857 0.923 0.692 CB 1.737 14 residues pruned to eliminate duplicates Z: 42 34.442 2.262 0.690 0.574 0.951 0.659 CB 1.377 Z: 13 30.938 2.440 0.568 0.867 1.000 0.667 CB 1.707 13 residues pruned to eliminate duplicates Z: 14 32.528 2.311 0.508 0.920 1.000 0.846 CB 1.823 14 residues pruned to eliminate duplicates Z: 17 30.019 2.163 0.620 0.889 1.000 0.812 CB 1.542 17 residues pruned to eliminate duplicates Z: 12 24.962 2.171 0.564 0.914 1.000 0.545 CB 1.567 Z: 17 31.103 2.290 0.395 0.896 1.000 0.875 CA 1.744 17 residues pruned to eliminate duplicates Z: 15 59.113 2.556 1.375 0.953 1.000 0.857 CB 1.791 15 residues pruned to eliminate duplicates Z: 116 88.251 2.446 0.982 0.644 0.887 0.565 CB 1.674 116 residues pruned to eliminate duplicates Z: 16 44.556 2.379 0.870 0.942 1.000 0.933 CB 1.793 16 residues pruned to eliminate duplicates Z: 15 40.812 2.325 1.382 0.882 1.000 0.714 CB 1.424 12 residues pruned to eliminate duplicates Z: 33 46.843 2.210 0.611 0.871 0.969 0.719 CB 1.752 33 residues pruned to eliminate duplicates Z: 15 40.386 2.365 0.829 0.911 0.929 0.857 CB 1.903 15 residues pruned to eliminate duplicates Z: 17 39.838 2.216 1.187 0.881 0.938 0.750 CB 1.586 17 residues pruned to eliminate duplicates Z: 23 55.013 2.426 0.963 0.855 1.000 0.773 CA 1.818 23 residues pruned to eliminate duplicates Z: 15 55.321 2.468 1.177 0.932 1.000 0.929 CB 1.922 15 residues pruned to eliminate duplicates Z: 19 14.862 2.072 0.332 0.479 0.889 0.667 CB 1.459 20 residues pruned to eliminate duplicates Z: 13 31.528 2.229 0.789 0.911 1.000 0.750 CB 1.617 13 residues pruned to eliminate duplicates Z: 31 51.017 2.291 0.702 0.885 1.000 0.767 CB 1.724 31 residues pruned to eliminate duplicates Z: 17 19.038 2.147 0.938 0.387 0.812 0.688 CB 1.587 Z: 176 91.805 2.287 0.822 0.633 0.949 0.646 CB 1.549 133 residues pruned to eliminate duplicates Z: 31 58.288 2.313 1.178 0.897 0.933 0.567 CB 1.620 31 residues pruned to eliminate duplicates Z: 32 56.601 2.287 0.789 0.886 1.000 0.742 CB 1.793 32 residues pruned to eliminate duplicates Z: 16 45.136 2.378 0.906 0.926 1.000 0.867 CB 1.803 16 residues pruned to eliminate duplicates Z: 30 58.528 2.378 0.917 0.920 0.966 0.793 CB 1.739 30 residues pruned to eliminate duplicates Z: 53 51.701 2.408 0.641 0.585 0.962 0.712 CB 1.740 55 residues pruned to eliminate duplicates Z: 16 44.869 2.354 1.152 0.919 0.933 0.867 CB 1.727 16 residues pruned to eliminate duplicates Z: 16 31.954 2.231 0.685 0.890 0.933 0.667 CB 1.692 16 residues pruned to eliminate duplicates Z: 18 36.165 2.346 0.863 0.842 0.882 0.706 CB 1.695 18 residues pruned to eliminate duplicates Z: 70 49.675 2.284 0.680 0.632 0.913 0.681 CB 1.508 70 residues pruned to eliminate duplicates Z: 31 46.570 2.288 0.526 0.866 1.000 0.867 CB 1.784 31 residues pruned to eliminate duplicates Z: 32 44.900 2.227 0.597 0.880 0.935 0.806 CB 1.755 32 residues pruned to eliminate duplicates Z: 28 56.918 2.265 0.841 0.943 1.000 0.815 CB 1.820 28 residues pruned to eliminate duplicates Z: 14 42.963 2.481 0.938 0.942 1.000 0.692 CB 1.718 14 residues pruned to eliminate duplicates Z: 65 45.087 2.296 0.693 0.550 0.906 0.672 CB 1.523 66 residues pruned to eliminate duplicates Z: 29 30.297 2.135 0.773 0.578 0.857 0.679 CB 1.637 16 residues pruned to eliminate duplicates Z: 14 26.937 2.361 0.443 0.896 0.923 0.769 CB 1.702 14 residues pruned to eliminate duplicates Z: 16 44.573 2.378 0.912 0.913 1.000 0.933 CB 1.792 16 residues pruned to eliminate duplicates Z: 30 57.970 2.345 0.922 0.901 1.000 0.862 CB 1.705 30 residues pruned to eliminate duplicates Z: 16 33.332 2.290 0.715 0.914 1.000 0.800 CB 1.549 16 residues pruned to eliminate duplicates Z: 19 37.156 2.214 0.765 0.893 0.944 0.611 CB 1.703 19 residues pruned to eliminate duplicates Z: 30 51.437 2.312 0.749 0.907 0.966 0.828 CB 1.738 30 residues pruned to eliminate duplicates Z: 30 49.439 2.345 0.506 0.896 1.000 0.828 CB 1.862 30 residues pruned to eliminate duplicates Z: 39 42.595 2.304 0.944 0.595 0.974 0.684 CB 1.448 39 residues pruned to eliminate duplicates Z: 65 45.305 2.237 0.705 0.592 0.938 0.734 CB 1.450 65 residues pruned to eliminate duplicates Z: 15 33.576 2.346 0.851 0.916 0.857 0.857 CB 1.702 15 residues pruned to eliminate duplicates Z: 17 30.168 2.171 0.647 0.881 1.000 0.875 CB 1.528 17 residues pruned to eliminate duplicates Z: 13 20.067 2.286 0.338 0.861 0.917 0.583 CB 1.518 13 residues pruned to eliminate duplicates Z: 25 48.681 2.340 0.830 0.914 1.000 0.917 CB 1.642 25 residues pruned to eliminate duplicates Z: 19 48.032 2.184 1.211 0.924 1.000 0.833 CB 1.647 19 residues pruned to eliminate duplicates Z: 16 26.661 2.244 0.539 0.870 0.933 0.867 CB 1.560 16 residues pruned to eliminate duplicates Z: 18 30.634 2.120 0.733 0.869 0.941 0.706 CB 1.570 18 residues pruned to eliminate duplicates Z: 13 34.070 2.452 0.930 0.579 1.000 0.583 CB 1.926 8 residues pruned to eliminate duplicates Z: 31 51.955 2.293 0.637 0.892 1.000 0.767 CB 1.814 31 residues pruned to eliminate duplicates Z: 26 44.093 2.273 0.704 0.893 1.000 0.960 CB 1.634 26 residues pruned to eliminate duplicates Z: 19 43.039 2.175 0.974 0.879 1.000 0.778 CB 1.713 19 residues pruned to eliminate duplicates Z: 14 35.866 2.492 0.688 0.918 0.923 0.923 CB 1.807 14 residues pruned to eliminate duplicates Z: 51 61.210 2.425 0.883 0.707 0.920 0.680 CB 1.707 44 residues pruned to eliminate duplicates Z: 15 44.626 2.483 1.110 0.919 0.929 0.786 CB 1.729 15 residues pruned to eliminate duplicates Z: 24 50.326 2.402 0.898 0.945 0.957 0.826 CB 1.665 26 residues pruned to eliminate duplicates Z: 44 44.176 2.350 0.884 0.562 0.860 0.535 CB 1.665 44 residues pruned to eliminate duplicates Z: 7 7.155 1.971 0.048 0.807 0.833 0.833 CA 1.299 7 residues pruned to eliminate duplicates Z: 14 28.738 2.397 0.511 0.861 0.923 0.769 CB 1.752 14 residues pruned to eliminate duplicates Z: 23 35.632 2.170 0.979 0.940 0.909 0.682 CB 1.351 23 residues pruned to eliminate duplicates Z: 62 46.337 2.232 0.769 0.608 0.967 0.607 CB 1.403 62 residues pruned to eliminate duplicates Z: 19 38.914 2.468 0.669 0.837 0.944 0.833 CB 1.763 19 residues pruned to eliminate duplicates Z: 17 37.612 2.302 0.691 0.899 1.000 0.938 CA 1.727 17 residues pruned to eliminate duplicates Z: 31 54.948 2.266 0.858 0.880 1.000 0.733 CB 1.727 31 residues pruned to eliminate duplicates Z: 20 46.324 2.149 1.245 0.862 1.000 0.789 CB 1.617 20 residues pruned to eliminate duplicates Z: 14 14.156 2.116 0.503 0.721 0.769 0.692 CB 1.314 14 residues pruned to eliminate duplicates Z: 31 59.081 2.354 0.924 0.934 0.967 0.767 CB 1.718 31 residues pruned to eliminate duplicates Z: 32 60.642 2.334 0.834 0.922 1.000 0.839 CB 1.789 32 residues pruned to eliminate duplicates Z: 14 38.843 2.449 0.772 0.912 1.000 0.692 CB 1.758 14 residues pruned to eliminate duplicates Z: 8 14.462 2.236 -0.083 0.895 1.000 0.857 CB 1.910 8 residues pruned to eliminate duplicates Z: 24 45.027 2.315 0.889 0.850 0.913 0.870 CB 1.742 24 residues pruned to eliminate duplicates Z: 17 36.439 2.281 0.659 0.922 1.000 0.875 CB 1.692 17 residues pruned to eliminate duplicates Z: 65 62.529 2.388 0.764 0.635 0.938 0.656 CB 1.743 64 residues pruned to eliminate duplicates Z: 30 60.614 2.339 1.049 0.911 0.966 0.517 CB 1.724 30 residues pruned to eliminate duplicates Z: 16 37.228 2.517 0.596 0.910 1.000 0.733 CB 1.697 16 residues pruned to eliminate duplicates Z: 33 54.776 2.274 0.749 0.909 1.000 0.781 CB 1.728 33 residues pruned to eliminate duplicates Z: 26 46.028 2.532 0.882 0.754 0.960 0.800 CB 1.604 26 residues pruned to eliminate duplicates Z: 22 33.747 2.384 0.623 0.804 0.810 0.571 CA 1.803 22 residues pruned to eliminate duplicates Z: 30 50.951 2.321 0.690 0.913 1.000 0.897 CB 1.707 30 residues pruned to eliminate duplicates Z: 23 51.355 2.394 0.859 0.854 1.000 0.773 CB 1.817 23 residues pruned to eliminate duplicates Z: 17 30.401 2.251 0.623 0.845 0.938 0.688 CB 1.650 17 residues pruned to eliminate duplicates Z: 15 23.263 2.120 0.523 0.631 1.000 0.643 CB 1.702 15 residues pruned to eliminate duplicates Z: 31 37.806 2.185 0.982 0.671 0.933 0.767 CB 1.459 31 residues pruned to eliminate duplicates Z: 15 50.869 2.436 1.159 0.935 1.000 0.929 CB 1.802 15 residues pruned to eliminate duplicates Z: 16 43.316 2.400 0.776 0.910 1.000 0.800 CA 1.860 16 residues pruned to eliminate duplicates Z: 32 34.202 2.168 0.625 0.664 0.935 0.742 CB 1.601 32 residues pruned to eliminate duplicates Z: 6 11.955 2.073 0.530 0.794 1.000 0.600 CA 1.303 6 residues pruned to eliminate duplicates Z: 15 34.091 2.259 0.680 0.897 1.000 0.786 CB 1.718 15 residues pruned to eliminate duplicates Z: 31 49.684 2.294 0.543 0.890 1.000 0.800 CB 1.844 31 residues pruned to eliminate duplicates Z: 13 21.421 2.090 0.765 0.888 0.917 0.667 CB 1.318 Z: 21 32.573 2.108 0.831 0.890 0.950 0.850 CB 1.429 21 residues pruned to eliminate duplicates Z: 90 69.648 2.388 0.870 0.625 0.944 0.708 CB 1.558 91 residues pruned to eliminate duplicates Z: 26 25.790 2.322 0.626 0.386 0.920 0.600 CB 1.677 26 residues pruned to eliminate duplicates Z: 50 46.070 2.414 0.715 0.524 0.918 0.592 CB 1.691 50 residues pruned to eliminate duplicates Z: 26 43.066 2.277 0.622 0.894 1.000 0.960 CB 1.674 26 residues pruned to eliminate duplicates Z: 7 4.761 1.937 0.319 0.677 0.500 0.500 CB 1.293 7 residues pruned to eliminate duplicates Z: 23 48.975 2.301 1.099 0.836 0.955 0.591 CB 1.696 23 residues pruned to eliminate duplicates Z: 32 53.696 2.243 0.751 0.885 1.000 0.871 CB 1.773 32 residues pruned to eliminate duplicates Z: 16 24.485 2.237 0.648 0.918 0.933 0.867 CB 1.296 16 residues pruned to eliminate duplicates Z: 17 34.983 2.144 0.978 0.889 1.000 0.812 CB 1.485 17 residues pruned to eliminate duplicates Z: 32 50.271 2.258 0.659 0.899 0.968 0.774 CB 1.781 32 residues pruned to eliminate duplicates Z: 32 65.158 2.358 0.987 0.933 0.968 0.806 CB 1.802 32 residues pruned to eliminate duplicates Z: 92 82.820 2.440 1.037 0.668 0.890 0.637 CB 1.681 92 residues pruned to eliminate duplicates Z: 7 6.947 1.697 0.477 0.739 0.833 0.333 CA 1.096 7 residues pruned to eliminate duplicates Z: 11 8.692 1.972 0.223 0.408 0.900 0.200 CB 1.395 11 residues pruned to eliminate duplicates Z: 16 34.116 2.239 0.518 0.920 1.000 0.800 CA 1.824 16 residues pruned to eliminate duplicates Z: 16 41.477 2.364 0.965 0.915 0.933 0.800 CB 1.745 16 residues pruned to eliminate duplicates Z: 12 23.106 2.279 0.719 0.654 0.909 0.545 CB 1.695 12 residues pruned to eliminate duplicates Z: 15 29.780 2.304 0.371 0.926 1.000 1.000 CB 1.768 15 residues pruned to eliminate duplicates Z: 17 49.419 2.343 1.005 0.954 1.000 0.875 CA 1.809 17 residues pruned to eliminate duplicates Z: 27 42.929 2.199 0.690 0.857 0.962 0.769 CB 1.736 27 residues pruned to eliminate duplicates Z: 13 15.777 2.254 0.206 0.852 0.833 0.833 CB 1.488 13 residues pruned to eliminate duplicates Z: 29 25.368 2.120 0.662 0.621 0.893 0.679 CB 1.359 29 residues pruned to eliminate duplicates Z: 16 15.608 1.974 0.600 0.397 0.933 0.400 CA 1.524 16 residues pruned to eliminate duplicates Z: 29 47.967 2.288 0.767 0.906 0.964 0.857 CB 1.653 29 residues pruned to eliminate duplicates Z: 63 41.569 2.217 0.698 0.578 0.935 0.710 CB 1.391 63 residues pruned to eliminate duplicates Z: 27 39.034 2.444 0.853 0.646 0.885 0.615 CB 1.667 27 residues pruned to eliminate duplicates Z: 6 13.528 1.990 0.470 0.713 1.000 0.600 CB 1.706 6 residues pruned to eliminate duplicates Z: 31 48.758 2.292 0.607 0.923 1.000 0.800 CB 1.698 31 residues pruned to eliminate duplicates Z: 10 10.400 1.935 -0.043 0.814 0.889 0.667 CB 1.603 10 residues pruned to eliminate duplicates Z: 12 33.428 2.452 0.856 0.876 1.000 0.727 CB 1.610 12 residues pruned to eliminate duplicates Z: 29 40.053 2.428 0.782 0.578 0.929 0.500 CB 1.748 29 residues pruned to eliminate duplicates Z: 16 36.753 2.252 0.872 0.905 1.000 0.733 CB 1.603 16 residues pruned to eliminate duplicates Z: 6 11.054 2.015 0.477 0.691 0.800 0.400 CB 1.744 6 residues pruned to eliminate duplicates Z: 24 35.425 2.111 0.796 0.884 0.957 0.870 CB 1.473 24 residues pruned to eliminate duplicates Z: 14 19.923 2.169 0.366 0.853 0.923 0.692 CB 1.493 14 residues pruned to eliminate duplicates Z: 44 49.309 2.343 0.928 0.632 0.907 0.721 CB 1.622 44 residues pruned to eliminate duplicates Z: 14 24.249 1.990 0.560 0.917 1.000 1.000 CB 1.530 Z: 86 80.970 2.448 0.921 0.714 0.906 0.729 CB 1.698 86 residues pruned to eliminate duplicates Z: 57 33.210 2.196 0.666 0.526 0.875 0.679 CB 1.352 57 residues pruned to eliminate duplicates Z: 114 95.716 2.422 1.048 0.680 0.912 0.637 CB 1.688 114 residues pruned to eliminate duplicates Z: 16 51.495 2.453 1.308 0.948 1.000 0.667 CB 1.622 16 residues pruned to eliminate duplicates Z: 38 47.126 2.341 0.958 0.618 0.973 0.703 CB 1.555 38 residues pruned to eliminate duplicates Z: 15 28.178 2.245 0.647 0.917 0.929 0.786 CB 1.549 15 residues pruned to eliminate duplicates Z: 25 53.235 2.307 1.266 0.937 0.958 0.542 CB 1.510 24 residues pruned to eliminate duplicates Z: 6 10.166 2.292 0.463 0.610 0.800 0.600 CB 1.526 Z: 41 25.959 2.133 0.531 0.533 0.975 0.700 CB 1.248 41 residues pruned to eliminate duplicates Z: 14 18.392 2.214 0.155 0.925 1.000 0.923 CB 1.399 14 residues pruned to eliminate duplicates Z: 31 55.481 2.318 0.750 0.897 1.000 0.833 CB 1.788 31 residues pruned to eliminate duplicates Z: 91 91.119 2.468 0.928 0.730 0.956 0.733 CB 1.716 91 residues pruned to eliminate duplicates Z: 12 18.682 2.262 0.535 0.593 0.909 0.636 CB 1.632 12 residues pruned to eliminate duplicates Z: 16 45.935 2.446 1.160 0.912 1.000 0.800 CB 1.590 16 residues pruned to eliminate duplicates Z: 23 27.284 2.227 0.251 0.875 0.955 0.818 CB 1.592 23 residues pruned to eliminate duplicates Z: 15 40.502 2.433 0.779 0.927 1.000 0.786 CB 1.752 15 residues pruned to eliminate duplicates Z: 12 26.332 2.264 0.492 0.898 1.000 0.818 CB 1.681 13 residues pruned to eliminate duplicates Z: 23 42.073 2.442 0.703 0.852 0.955 0.545 CB 1.671 23 residues pruned to eliminate duplicates Z: 17 38.931 2.298 0.779 0.934 1.000 0.750 CA 1.661 17 residues pruned to eliminate duplicates Z: 76 60.542 2.333 0.860 0.572 0.947 0.653 CB 1.587 76 residues pruned to eliminate duplicates Z: 23 49.723 2.459 0.886 0.941 0.955 0.955 CB 1.662 23 residues pruned to eliminate duplicates Z: 14 28.042 2.271 0.698 0.922 1.000 0.923 CB 1.419 14 residues pruned to eliminate duplicates Z: 36 39.044 2.209 0.669 0.676 0.971 0.800 CB 1.567 36 residues pruned to eliminate duplicates Z: 6 8.432 2.169 0.036 0.839 1.000 0.800 CB 1.253 6 residues pruned to eliminate duplicates Z: 31 54.208 2.275 0.905 0.894 0.933 0.700 CB 1.755 31 residues pruned to eliminate duplicates Z: 15 35.353 2.299 0.994 0.938 1.000 0.929 CB 1.433 15 residues pruned to eliminate duplicates Z: 13 25.246 2.038 0.928 0.818 1.000 0.750 CB 1.408 12 residues pruned to eliminate duplicates Z: 7 16.556 2.161 0.577 0.851 1.000 1.000 CA 1.468 7 residues pruned to eliminate duplicates Z: 30 63.414 2.369 1.084 0.934 1.000 0.517 CB 1.663 30 residues pruned to eliminate duplicates Z: 14 29.548 2.151 0.815 0.877 0.923 0.692 CB 1.652 13 residues pruned to eliminate duplicates Z: 25 57.375 2.371 1.226 0.914 0.958 0.625 CB 1.637 25 residues pruned to eliminate duplicates Z: 71 56.402 2.332 0.760 0.567 0.914 0.600 CB 1.683 74 residues pruned to eliminate duplicates Z: 16 36.396 2.286 0.821 0.913 0.933 0.533 CB 1.712 16 residues pruned to eliminate duplicates Z: 27 46.771 2.363 0.585 0.934 0.962 0.923 CB 1.776 27 residues pruned to eliminate duplicates Z: 6 9.467 2.179 0.104 0.815 0.800 0.800 CB 1.673 6 residues pruned to eliminate duplicates Z: 12 17.289 2.042 0.579 0.656 0.909 0.727 CB 1.539 12 residues pruned to eliminate duplicates Z: 14 15.860 2.057 0.631 0.493 1.000 0.385 CB 1.320 4 residues pruned to eliminate duplicates Z: 13 33.215 2.463 0.585 0.866 1.000 0.833 CB 1.797 13 residues pruned to eliminate duplicates Z: 22 57.574 2.386 1.228 0.936 1.000 0.619 CB 1.647 22 residues pruned to eliminate duplicates Z: 22 43.630 2.175 1.146 0.936 1.000 0.571 CB 1.420 22 residues pruned to eliminate duplicates Z: 14 21.814 2.022 0.732 0.809 1.000 0.692 CB 1.319 12 residues pruned to eliminate duplicates Z: 50 29.026 2.107 0.528 0.585 0.939 0.714 CB 1.264 50 residues pruned to eliminate duplicates Z: 16 22.564 2.109 0.624 0.906 1.000 0.867 CB 1.210 16 residues pruned to eliminate duplicates Z: 16 31.264 2.298 0.487 0.891 1.000 0.733 CB 1.698 16 residues pruned to eliminate duplicates Z: 13 29.872 2.413 0.558 0.934 1.000 0.750 CB 1.600 13 residues pruned to eliminate duplicates Z: 31 48.998 2.306 0.526 0.894 1.000 0.900 CB 1.824 31 residues pruned to eliminate duplicates Z: 89 57.391 2.297 0.610 0.577 0.955 0.614 CB 1.609 85 residues pruned to eliminate duplicates Z: 32 52.964 2.298 0.723 0.919 0.968 0.839 CB 1.749 32 residues pruned to eliminate duplicates Z: 29 52.580 2.241 0.664 0.944 1.000 0.964 CB 1.846 29 residues pruned to eliminate duplicates Z: 16 38.030 2.318 1.134 0.931 0.933 0.733 CB 1.486 16 residues pruned to eliminate duplicates Z: 14 21.728 2.028 0.826 0.809 1.000 0.538 CB 1.244 13 residues pruned to eliminate duplicates Z: 23 36.130 2.174 0.881 0.918 0.955 0.636 CB 1.392 23 residues pruned to eliminate duplicates Z: 41 32.058 2.228 0.621 0.524 0.925 0.650 CB 1.481 41 residues pruned to eliminate duplicates Z: 34 24.692 2.094 0.526 0.542 0.939 0.667 CB 1.374 34 residues pruned to eliminate duplicates Z: 17 30.531 2.215 0.657 0.880 1.000 0.750 CB 1.506 17 residues pruned to eliminate duplicates Z: 22 36.886 2.171 0.927 0.929 0.952 0.714 CB 1.414 22 residues pruned to eliminate duplicates Z: 6 15.061 2.267 0.411 0.810 1.000 0.600 CB 1.607 6 residues pruned to eliminate duplicates Z: 15 40.102 2.298 1.183 0.908 1.000 0.786 CB 1.517 14 residues pruned to eliminate duplicates Z: 24 51.016 2.332 0.913 0.910 1.000 0.870 CB 1.692 24 residues pruned to eliminate duplicates Z: 13 21.977 2.069 0.676 0.833 1.000 0.917 CB 1.373 13 residues pruned to eliminate duplicates Z: 91 89.537 2.410 0.913 0.715 0.944 0.722 CB 1.783 91 residues pruned to eliminate duplicates Z: 16 31.802 2.148 0.911 0.925 1.000 0.933 CB 1.404 16 residues pruned to eliminate duplicates Z: 13 20.763 2.246 0.242 0.877 1.000 0.917 CB 1.561 13 residues pruned to eliminate duplicates Z: 16 31.594 2.236 1.023 0.932 1.000 0.867 CB 1.259 16 residues pruned to eliminate duplicates Z: 14 29.710 2.282 0.920 0.918 1.000 0.923 CB 1.326 14 residues pruned to eliminate duplicates Z: 15 20.361 1.943 0.386 0.930 1.000 0.857 CB 1.412 15 residues pruned to eliminate duplicates Z: 72 51.749 2.284 0.729 0.598 0.930 0.620 CB 1.523 72 residues pruned to eliminate duplicates Z: 16 35.420 2.325 0.778 0.897 0.933 0.600 CB 1.698 16 residues pruned to eliminate duplicates Z: 6 13.507 2.102 0.394 0.845 1.000 0.800 CA 1.533 6 residues pruned to eliminate duplicates Z: 32 55.618 2.311 0.839 0.901 0.968 0.742 CB 1.734 32 residues pruned to eliminate duplicates Z: 31 56.173 2.302 0.793 0.915 1.000 0.833 CB 1.756 31 residues pruned to eliminate duplicates Z: 45 33.863 2.239 0.595 0.534 0.955 0.682 CB 1.449 45 residues pruned to eliminate duplicates Z: 17 40.360 2.300 0.900 0.894 1.000 0.750 CA 1.655 17 residues pruned to eliminate duplicates Z: 45 45.795 2.421 0.664 0.597 0.955 0.636 CB 1.637 45 residues pruned to eliminate duplicates Z: 22 64.473 2.437 1.367 0.940 1.000 0.762 CB 1.693 22 residues pruned to eliminate duplicates Z: 14 26.022 2.006 0.584 0.930 1.000 0.846 CB 1.588 14 residues pruned to eliminate duplicates Z: 27 57.035 2.499 1.076 0.721 1.000 0.769 CB 1.766 27 residues pruned to eliminate duplicates Z: 67 69.200 2.462 0.837 0.625 0.924 0.712 CB 1.812 67 residues pruned to eliminate duplicates Z: 6 16.331 2.272 0.581 0.826 1.000 0.800 CA 1.533 6 residues pruned to eliminate duplicates Z: 8 16.512 2.211 1.008 0.762 0.714 0.571 CA 1.560 8 residues pruned to eliminate duplicates Z: 10 12.815 2.252 0.678 0.438 0.778 0.667 CB 1.549 8 residues pruned to eliminate duplicates Z: 16 10.623 1.920 0.559 0.371 0.867 0.400 CB 1.215 16 residues pruned to eliminate duplicates Z: 37 52.683 2.408 0.986 0.618 0.972 0.500 CB 1.689 37 residues pruned to eliminate duplicates Z: 13 18.437 2.173 0.197 0.879 1.000 0.667 CB 1.484 13 residues pruned to eliminate duplicates Z: 41 68.364 2.435 0.729 0.870 1.000 0.800 CB 1.873 41 residues pruned to eliminate duplicates Z: 18 26.887 2.127 0.710 0.857 0.941 0.412 CB 1.404 18 residues pruned to eliminate duplicates Z: 20 36.451 2.477 0.609 0.865 0.842 0.789 CB 1.827 20 residues pruned to eliminate duplicates Z: 15 37.494 2.278 1.240 0.936 1.000 0.714 CB 1.368 15 residues pruned to eliminate duplicates Z: 22 35.187 2.175 0.837 0.916 0.952 0.762 CB 1.424 22 residues pruned to eliminate duplicates Z: 14 20.025 1.963 0.503 0.931 1.000 0.769 CB 1.315 14 residues pruned to eliminate duplicates Z: 39 49.543 2.450 0.784 0.572 0.921 0.579 CB 1.862 39 residues pruned to eliminate duplicates Z: 14 23.743 1.953 0.577 0.916 1.000 0.846 CB 1.511 14 residues pruned to eliminate duplicates Z: 6 11.486 1.951 0.779 0.786 1.000 0.600 CB 1.151 6 residues pruned to eliminate duplicates Z: 17 45.606 2.441 0.910 0.904 1.000 0.938 CB 1.741 17 residues pruned to eliminate duplicates Z: 17 40.940 2.276 1.043 0.924 1.000 0.625 CA 1.546 17 residues pruned to eliminate duplicates Z: 7 6.180 1.706 0.027 0.552 1.000 0.333 CB 1.369 5 residues pruned to eliminate duplicates Z: 30 38.860 2.269 0.333 0.880 0.966 0.793 CB 1.790 30 residues pruned to eliminate duplicates Z: 12 5.787 1.685 0.520 0.312 0.727 0.273 CB 1.153 12 residues pruned to eliminate duplicates Z: 88 60.158 2.416 0.638 0.561 0.920 0.644 CB 1.671 88 residues pruned to eliminate duplicates Z: 32 52.640 2.223 0.811 0.884 1.000 0.645 CB 1.697 32 residues pruned to eliminate duplicates Z: 8 12.023 2.278 0.305 0.667 0.857 0.429 CA 1.528 8 residues pruned to eliminate duplicates Z: 17 38.529 2.227 0.777 0.930 1.000 0.750 CB 1.702 17 residues pruned to eliminate duplicates Z: 11 32.185 2.477 0.976 0.548 1.000 0.300 CB 1.984 11 residues pruned to eliminate duplicates Z: 9 13.277 1.908 0.450 0.855 1.000 0.875 CB 1.253 9 residues pruned to eliminate duplicates Z: 8 8.550 1.861 0.239 0.809 0.857 0.571 CB 1.248 9 residues pruned to eliminate duplicates Z: 6 10.914 1.704 0.770 0.826 1.000 0.800 CB 1.220 6 residues pruned to eliminate duplicates Z: 24 40.361 2.382 0.564 0.934 0.957 0.957 CB 1.647 24 residues pruned to eliminate duplicates Z: 32 56.614 2.327 0.748 0.902 1.000 0.871 CB 1.782 32 residues pruned to eliminate duplicates Z: 6 6.569 2.094 0.298 0.576 0.800 0.600 CB 1.256 6 residues pruned to eliminate duplicates Z: 16 40.853 2.259 1.084 0.931 1.000 0.400 CB 1.566 16 residues pruned to eliminate duplicates Z: 24 30.871 2.314 0.785 0.471 0.913 0.696 CB 1.758 24 residues pruned to eliminate duplicates Z: 13 21.208 2.069 0.758 0.903 0.917 0.667 CB 1.309 13 residues pruned to eliminate duplicates Z: 38 26.359 2.039 0.564 0.566 0.865 0.649 CB 1.473 14 residues pruned to eliminate duplicates Z: 11 25.293 2.274 0.637 0.903 1.000 0.700 CB 1.532 12 residues pruned to eliminate duplicates Z: 70 43.509 2.209 0.696 0.577 0.899 0.696 CB 1.444 70 residues pruned to eliminate duplicates Z: 28 23.164 2.228 0.676 0.367 0.852 0.630 CB 1.616 28 residues pruned to eliminate duplicates Z: 12 13.915 2.072 0.636 0.395 0.909 0.636 CB 1.522 12 residues pruned to eliminate duplicates Z: 36 23.306 2.025 0.475 0.585 0.943 0.657 CB 1.289 36 residues pruned to eliminate duplicates Z: 32 39.448 2.212 0.364 0.855 1.000 0.839 CB 1.734 32 residues pruned to eliminate duplicates Z: 103 83.831 2.424 0.907 0.668 0.912 0.725 CB 1.686 103 residues pruned to eliminate duplicates Z: 29 38.357 2.349 0.857 0.627 0.893 0.679 CB 1.652 29 residues pruned to eliminate duplicates Z: 51 42.426 2.267 0.840 0.555 0.900 0.660 CB 1.514 51 residues pruned to eliminate duplicates Z: 25 25.230 2.296 0.380 0.578 0.958 0.667 CB 1.574 27 residues pruned to eliminate duplicates Z: 11 25.901 2.273 0.991 0.880 0.900 0.700 CB 1.457 12 residues pruned to eliminate duplicates Z: 50 29.671 2.200 0.518 0.496 0.878 0.633 CB 1.453 50 residues pruned to eliminate duplicates Z: 44 38.778 2.334 0.582 0.519 0.953 0.605 CB 1.649 44 residues pruned to eliminate duplicates Z: 17 32.984 2.232 0.934 0.811 0.938 0.625 CB 1.555 14 residues pruned to eliminate duplicates Z: 24 24.797 2.118 0.585 0.837 0.870 0.478 CB 1.325 24 residues pruned to eliminate duplicates Z: 56 37.937 2.200 0.770 0.509 0.945 0.727 CB 1.377 56 residues pruned to eliminate duplicates Z: 11 23.734 2.327 0.644 0.558 1.000 0.800 CB 1.854 11 residues pruned to eliminate duplicates Z: 32 39.254 2.233 1.048 0.647 0.903 0.645 CB 1.488 32 residues pruned to eliminate duplicates Z: 14 19.758 1.932 0.354 0.914 1.000 1.000 CB 1.480 14 residues pruned to eliminate duplicates Z: 19 18.776 2.176 0.351 0.615 0.889 0.556 CB 1.519 19 residues pruned to eliminate duplicates Z: 16 32.266 2.227 1.149 0.911 0.933 0.733 CB 1.321 16 residues pruned to eliminate duplicates Z: 16 18.711 2.187 0.252 0.910 1.000 0.867 CB 1.252 16 residues pruned to eliminate duplicates Z: 17 44.599 2.295 0.966 0.921 1.000 0.375 CA 1.740 17 residues pruned to eliminate duplicates Z: 28 53.532 2.313 1.000 0.902 0.963 0.519 CB 1.650 28 residues pruned to eliminate duplicates Z: 16 41.810 2.223 1.139 0.939 1.000 0.600 CB 1.578 16 residues pruned to eliminate duplicates Z: 16 35.135 2.333 0.829 0.925 0.933 0.867 CB 1.599 16 residues pruned to eliminate duplicates Z: 31 26.219 2.068 0.670 0.624 1.000 0.533 CB 1.234 14 residues pruned to eliminate duplicates Z: 13 29.357 2.287 0.677 0.865 1.000 0.917 CB 1.619 13 residues pruned to eliminate duplicates Z: 15 11.551 2.114 0.493 0.428 0.786 0.643 CB 1.341 15 residues pruned to eliminate duplicates Z: 13 21.821 2.022 0.434 0.880 1.000 0.750 CA 1.573 13 residues pruned to eliminate duplicates Z: 16 32.434 2.245 1.024 0.890 0.933 0.733 CB 1.421 16 residues pruned to eliminate duplicates Z: 41 41.415 2.405 0.799 0.512 0.900 0.725 CB 1.662 41 residues pruned to eliminate duplicates Z: 68 42.053 2.260 0.652 0.488 0.881 0.597 CB 1.582 68 residues pruned to eliminate duplicates Z: 9 16.649 2.430 0.618 0.485 0.875 0.750 CA 1.737 9 residues pruned to eliminate duplicates Z: 30 24.373 1.793 0.719 0.627 0.966 0.586 CB 1.350 30 residues pruned to eliminate duplicates Z: 49 31.651 2.186 0.631 0.529 0.938 0.708 CB 1.328 49 residues pruned to eliminate duplicates Z: 14 23.928 1.963 0.664 0.908 1.000 0.615 CB 1.443 14 residues pruned to eliminate duplicates Z: 8 7.424 1.728 0.145 0.443 1.000 0.429 N 1.504 Z: 13 15.795 1.933 0.418 0.712 1.000 0.750 CB 1.373 13 residues pruned to eliminate duplicates Z: 15 24.774 1.917 0.839 0.939 0.929 0.643 CB 1.406 15 residues pruned to eliminate duplicates Z: 29 56.281 2.332 0.965 0.940 0.964 0.893 CB 1.671 29 residues pruned to eliminate duplicates Z: 115 100.079 2.471 1.066 0.689 0.921 0.684 CB 1.677 115 residues pruned to eliminate duplicates Z: 15 23.268 1.913 0.756 0.939 0.929 0.429 CB 1.386 15 residues pruned to eliminate duplicates Z: 17 40.519 2.270 0.882 0.908 1.000 0.750 CA 1.684 17 residues pruned to eliminate duplicates Z: 18 43.188 2.240 0.954 0.880 1.000 0.765 CA 1.734 18 residues pruned to eliminate duplicates Z: 26 50.180 2.266 0.999 0.893 1.000 0.720 CB 1.591 26 residues pruned to eliminate duplicates Z: 14 18.538 1.964 0.244 0.929 1.000 1.000 CB 1.473 14 residues pruned to eliminate duplicates Z: 23 32.827 2.080 0.884 0.901 0.955 0.682 CB 1.335 23 residues pruned to eliminate duplicates Z: 9 12.768 1.802 0.333 0.858 1.000 0.625 CA 1.384 9 residues pruned to eliminate duplicates Z: 23 45.794 2.458 0.671 0.864 0.955 0.682 CB 1.826 23 residues pruned to eliminate duplicates Z: 14 23.539 1.961 0.478 0.930 1.000 1.000 CB 1.574 14 residues pruned to eliminate duplicates Z: 16 36.688 2.318 0.946 0.924 0.933 0.800 CB 1.580 16 residues pruned to eliminate duplicates Z: 13 15.728 1.908 0.459 0.732 1.000 0.583 CB 1.324 13 residues pruned to eliminate duplicates Z: 25 28.730 2.237 0.615 0.660 0.958 0.750 CB 1.459 25 residues pruned to eliminate duplicates Z: 16 46.752 2.327 1.409 0.923 1.000 0.533 CB 1.514 16 residues pruned to eliminate duplicates Z: 14 20.761 2.124 0.548 0.897 0.923 0.769 CB 1.359 14 residues pruned to eliminate duplicates Z: 25 42.129 2.297 0.606 0.888 1.000 0.917 CB 1.679 25 residues pruned to eliminate duplicates Z: 97 84.926 2.418 0.859 0.692 0.938 0.708 CB 1.725 97 residues pruned to eliminate duplicates Z: 14 24.119 1.987 0.542 0.933 1.000 0.769 CB 1.524 14 residues pruned to eliminate duplicates Z: 15 29.067 2.283 0.623 0.931 0.929 0.786 CB 1.578 15 residues pruned to eliminate duplicates Z: 11 19.888 2.277 0.523 0.859 0.900 0.500 CB 1.482 11 residues pruned to eliminate duplicates Z: 7 12.931 2.085 0.605 0.482 1.000 0.667 CA 1.607 7 residues pruned to eliminate duplicates Z: 31 49.211 2.296 0.602 0.889 0.967 0.767 CB 1.820 31 residues pruned to eliminate duplicates Z: 15 29.192 2.314 0.563 0.896 0.929 0.857 CB 1.665 15 residues pruned to eliminate duplicates Z: 134 91.730 2.358 0.932 0.677 0.925 0.632 CB 1.604 136 residues pruned to eliminate duplicates Z: 23 41.780 2.179 1.067 0.917 0.955 0.773 CB 1.463 24 residues pruned to eliminate duplicates Z: 27 36.735 2.178 0.889 0.785 0.885 0.654 CB 1.540 27 residues pruned to eliminate duplicates Z: 48 41.079 2.249 0.830 0.623 0.979 0.766 CB 1.324 48 residues pruned to eliminate duplicates Z: 7 6.474 1.755 -0.009 0.790 1.000 0.833 CA 1.178 7 residues pruned to eliminate duplicates Z: 16 35.975 2.302 0.549 0.929 1.000 0.933 CB 1.823 16 residues pruned to eliminate duplicates Z: 6 18.945 2.188 0.860 0.826 1.000 0.800 CA 1.570 6 residues pruned to eliminate duplicates Z: 17 35.443 2.187 1.153 0.866 0.938 0.688 CB 1.470 17 residues pruned to eliminate duplicates Z: 41 45.969 2.381 0.879 0.557 0.975 0.675 CB 1.577 41 residues pruned to eliminate duplicates Z: 57 27.228 2.109 0.554 0.390 0.893 0.536 CB 1.398 57 residues pruned to eliminate duplicates Z: 23 38.396 2.143 1.058 0.907 0.955 0.636 CB 1.381 23 residues pruned to eliminate duplicates Z: 41 47.703 2.333 0.620 0.674 0.975 0.750 CB 1.744 41 residues pruned to eliminate duplicates Z: 38 39.492 2.280 0.830 0.616 0.973 0.703 CB 1.433 40 residues pruned to eliminate duplicates Z: 7 4.873 1.755 0.087 0.585 0.833 0.667 CB 1.154 7 residues pruned to eliminate duplicates Z: 77 69.241 2.417 0.775 0.625 0.961 0.658 CB 1.714 76 residues pruned to eliminate duplicates Z: 12 20.817 2.193 0.503 0.895 0.909 0.636 CB 1.501 12 residues pruned to eliminate duplicates Z: 19 23.327 2.275 0.418 0.639 0.944 0.833 CB 1.585 19 residues pruned to eliminate duplicates Z: 33 64.990 2.287 1.148 0.937 0.938 0.594 CB 1.737 33 residues pruned to eliminate duplicates Z: 16 44.027 2.281 1.191 0.885 0.933 0.800 CB 1.760 16 residues pruned to eliminate duplicates Z: 32 52.587 2.240 0.805 0.880 1.000 0.516 CB 1.692 32 residues pruned to eliminate duplicates Z: 123 94.233 2.410 0.796 0.701 0.943 0.697 CB 1.741 123 residues pruned to eliminate duplicates Z: 21 36.878 2.256 0.805 0.729 1.000 0.700 CB 1.648 21 residues pruned to eliminate duplicates Z: 15 34.245 2.357 0.973 0.848 0.857 0.643 CA 1.703 15 residues pruned to eliminate duplicates Z: 14 21.764 2.138 0.427 0.891 1.000 0.615 CB 1.423 14 residues pruned to eliminate duplicates Z: 47 49.951 2.419 0.846 0.606 0.891 0.652 CB 1.672 47 residues pruned to eliminate duplicates Z: 15 29.641 2.250 0.680 0.625 1.000 0.786 CB 1.864 15 residues pruned to eliminate duplicates Z: 29 62.337 2.353 1.159 0.910 0.964 0.536 CB 1.705 29 residues pruned to eliminate duplicates Z: 24 19.996 2.265 0.471 0.372 0.913 0.609 CB 1.572 24 residues pruned to eliminate duplicates Z: 37 38.872 2.291 0.879 0.580 0.917 0.444 CB 1.520 37 residues pruned to eliminate duplicates Z: 15 7.225 1.848 0.344 0.368 0.714 0.429 CB 1.253 15 residues pruned to eliminate duplicates Z: 11 24.760 2.192 0.930 0.834 0.900 0.700 CA 1.542 11 residues pruned to eliminate duplicates Z: 6 3.289 1.682 0.239 0.458 0.600 0.400 CB 1.227 Z: 12 13.213 2.002 0.277 0.655 1.000 0.545 CB 1.350 12 residues pruned to eliminate duplicates Z: 31 33.493 2.287 0.535 0.747 1.000 0.800 CB 1.397 31 residues pruned to eliminate duplicates Z: 15 29.615 2.300 0.625 0.933 0.929 0.786 CB 1.591 15 residues pruned to eliminate duplicates Z: 49 33.923 2.223 0.718 0.570 0.938 0.646 CB 1.278 49 residues pruned to eliminate duplicates Z: 8 11.424 1.962 0.276 0.848 1.000 0.857 CA 1.279 8 residues pruned to eliminate duplicates Z: 24 39.685 2.121 1.045 0.914 0.957 0.609 CB 1.411 23 residues pruned to eliminate duplicates Z: 31 48.226 2.295 0.594 0.915 0.967 0.900 CB 1.760 31 residues pruned to eliminate duplicates Z: 157 97.988 2.422 0.817 0.610 0.942 0.635 CB 1.705 163 residues pruned to eliminate duplicates Z: 86 82.668 2.415 0.820 0.707 0.929 0.694 CB 1.818 86 residues pruned to eliminate duplicates Z: 31 41.530 2.234 0.542 0.860 0.967 0.700 CB 1.675 31 residues pruned to eliminate duplicates Z: 12 19.360 2.126 0.545 0.697 0.909 0.727 CB 1.634 12 residues pruned to eliminate duplicates Z: 75 47.876 2.228 0.648 0.612 0.919 0.676 CB 1.484 75 residues pruned to eliminate duplicates Z: 30 30.265 2.148 0.859 0.579 1.000 0.414 CB 1.305 32 residues pruned to eliminate duplicates Z: 14 21.289 1.965 0.510 0.924 1.000 0.769 CB 1.398 14 residues pruned to eliminate duplicates Z: 46 48.409 2.389 0.827 0.624 0.889 0.756 CB 1.655 46 residues pruned to eliminate duplicates Z: 17 36.683 2.296 0.702 0.914 1.000 0.875 CA 1.659 17 residues pruned to eliminate duplicates Z: 14 25.664 1.958 0.748 0.913 1.000 0.692 CB 1.471 14 residues pruned to eliminate duplicates Z: 14 26.244 1.981 0.756 0.938 1.000 0.846 CB 1.456 14 residues pruned to eliminate duplicates Z: 16 8.952 1.493 0.498 0.730 0.933 0.867 CB 0.900 Z: 51 35.154 2.232 0.649 0.511 0.900 0.620 CB 1.485 51 residues pruned to eliminate duplicates Z: 14 26.505 1.989 0.647 0.936 1.000 1.000 CB 1.563 14 residues pruned to eliminate duplicates Z: 6 6.734 2.086 0.094 0.789 0.800 0.600 CB 1.280 6 residues pruned to eliminate duplicates Z: 10 18.582 2.407 0.593 0.589 1.000 0.889 CB 1.483 10 residues pruned to eliminate duplicates Z: 90 66.150 2.375 0.784 0.628 0.933 0.652 CB 1.573 90 residues pruned to eliminate duplicates Z: 7 10.600 1.895 0.334 0.794 1.000 0.500 CA 1.323 7 residues pruned to eliminate duplicates Z: 15 35.025 2.439 0.592 0.905 1.000 0.929 CB 1.716 15 residues pruned to eliminate duplicates Z: 50 27.791 2.207 0.473 0.571 0.878 0.633 CB 1.299 50 residues pruned to eliminate duplicates Z: 44 44.134 2.317 0.904 0.592 0.930 0.605 CB 1.502 44 residues pruned to eliminate duplicates Z: 42 28.814 2.008 0.592 0.555 0.902 0.610 CB 1.479 40 residues pruned to eliminate duplicates Z: 15 27.035 1.924 0.651 0.927 1.000 0.786 CB 1.594 15 residues pruned to eliminate duplicates Z: 14 12.899 1.900 0.580 0.467 0.923 0.462 CB 1.336 14 residues pruned to eliminate duplicates Z: 7 10.971 1.844 0.309 0.838 1.000 1.000 CB 1.387 Z: 13 26.990 2.161 0.693 0.903 1.000 0.667 CB 1.518 13 residues pruned to eliminate duplicates Z: 19 20.154 2.115 0.661 0.594 0.889 0.389 CB 1.390 19 residues pruned to eliminate duplicates Z: 15 16.826 1.876 0.153 0.936 1.000 0.929 CB 1.447 15 residues pruned to eliminate duplicates Z: 21 21.800 1.870 0.650 0.822 0.850 0.600 CB 1.406 21 residues pruned to eliminate duplicates Z: 163 93.584 2.417 0.769 0.601 0.932 0.660 CB 1.675 163 residues pruned to eliminate duplicates Z: 15 20.597 1.921 0.410 0.940 1.000 0.929 CB 1.411 15 residues pruned to eliminate duplicates Z: 23 42.273 2.144 1.275 0.910 0.955 0.545 CB 1.372 23 residues pruned to eliminate duplicates Z: 39 25.664 1.972 0.696 0.590 0.921 0.579 CB 1.240 39 residues pruned to eliminate duplicates Z: 7 4.350 1.781 -0.149 0.637 1.000 0.333 CB 1.031 Z: 12 21.343 2.260 0.384 0.854 0.909 0.727 CB 1.672 12 residues pruned to eliminate duplicates Z: 102 80.427 2.385 0.851 0.693 0.911 0.634 CB 1.669 102 residues pruned to eliminate duplicates Z: 14 26.780 1.983 0.661 0.942 1.000 1.000 CB 1.564 14 residues pruned to eliminate duplicates Z: 23 21.281 2.114 0.571 0.612 0.864 0.727 CB 1.422 20 residues pruned to eliminate duplicates Z: 6 6.483 1.994 0.067 0.829 1.000 0.800 CB 1.026 6 residues pruned to eliminate duplicates Z: 8 4.428 1.826 0.172 0.474 0.857 0.571 CB 0.937 Z: 29 53.042 2.404 0.873 0.831 0.964 0.750 CB 1.735 29 residues pruned to eliminate duplicates Z: 38 33.485 2.268 0.590 0.623 1.000 0.703 CB 1.360 38 residues pruned to eliminate duplicates Z: 51 34.680 2.231 0.848 0.528 0.900 0.560 CB 1.286 51 residues pruned to eliminate duplicates Z: 14 31.522 2.000 1.022 0.954 1.000 0.846 CB 1.487 14 residues pruned to eliminate duplicates Z: 7 4.432 1.760 0.092 0.664 0.833 0.667 CB 0.971 Z: 17 12.695 2.123 0.880 0.289 0.750 0.438 CB 1.344 16 residues pruned to eliminate duplicates Z: 8 11.929 1.825 0.518 0.807 1.000 0.857 CA 1.245 8 residues pruned to eliminate duplicates Z: 33 25.108 2.269 0.590 0.409 0.844 0.531 CB 1.605 33 residues pruned to eliminate duplicates Z: 42 51.973 2.392 0.740 0.658 0.951 0.732 CB 1.772 42 residues pruned to eliminate duplicates Z: 7 17.227 2.126 0.607 0.837 1.000 0.667 CA 1.539 7 residues pruned to eliminate duplicates Z: 48 41.468 2.269 0.774 0.597 0.872 0.574 CB 1.570 49 residues pruned to eliminate duplicates Z: 17 49.699 2.318 1.096 0.910 1.000 0.875 CB 1.814 17 residues pruned to eliminate duplicates Z: 19 13.216 1.977 0.405 0.502 0.833 0.667 CB 1.343 19 residues pruned to eliminate duplicates Z: 22 37.172 2.164 0.983 0.839 0.905 0.619 CB 1.561 22 residues pruned to eliminate duplicates Z: 15 22.792 1.926 0.567 0.920 1.000 0.714 CB 1.421 15 residues pruned to eliminate duplicates Z: 25 37.442 2.205 0.770 0.870 0.958 0.792 CB 1.492 25 residues pruned to eliminate duplicates Z: 16 18.395 2.288 0.455 0.503 0.933 0.733 CB 1.524 16 residues pruned to eliminate duplicates Z: 44 37.173 2.141 0.647 0.618 0.953 0.628 CB 1.508 49 residues pruned to eliminate duplicates Z: 70 86.363 2.444 0.901 0.790 0.957 0.812 CB 1.813 70 residues pruned to eliminate duplicates Z: 34 21.460 1.903 0.637 0.578 0.879 0.667 CB 1.266 34 residues pruned to eliminate duplicates Z: 6 6.890 1.787 0.376 0.848 1.000 1.000 CB 0.929 6 residues pruned to eliminate duplicates Z: 12 20.092 2.139 0.654 0.743 0.909 0.545 CB 1.515 12 residues pruned to eliminate duplicates Z: 16 19.793 2.197 0.388 0.900 0.933 0.800 CB 1.283 16 residues pruned to eliminate duplicates 6 1.640 1.350 0.927 0.412 0.600 0.400 N 0.515 ? Z: 12 15.985 1.958 0.574 0.732 0.909 0.727 CB 1.397 12 residues pruned to eliminate duplicates Z: 17 16.975 2.125 0.455 0.436 1.000 0.625 CB 1.466 17 residues pruned to eliminate duplicates Z: 6 5.980 1.708 0.206 0.705 1.000 0.600 CB 1.077 6 residues pruned to eliminate duplicates Z: 13 21.994 2.232 0.464 0.891 0.917 0.833 CB 1.524 13 residues pruned to eliminate duplicates Z: 34 24.757 1.936 0.610 0.613 0.970 0.697 CB 1.281 34 residues pruned to eliminate duplicates Z: 16 34.229 2.197 1.118 0.925 0.933 0.600 CB 1.428 16 residues pruned to eliminate duplicates Z: 17 32.464 2.293 0.641 0.934 0.938 0.750 CA 1.603 17 residues pruned to eliminate duplicates Z: 9 7.301 1.507 0.490 0.720 0.875 0.500 N 1.077 9 residues pruned to eliminate duplicates Z: 12 13.438 2.191 0.473 0.577 0.818 0.727 CB 1.424 12 residues pruned to eliminate duplicates Z: 48 41.466 2.234 0.726 0.626 0.915 0.766 CB 1.522 48 residues pruned to eliminate duplicates Z: 13 16.532 2.084 0.784 0.423 0.833 0.417 CB 1.669 13 residues pruned to eliminate duplicates Z: 33 42.693 2.306 0.947 0.606 0.906 0.719 CB 1.678 33 residues pruned to eliminate duplicates Z: 43 55.076 2.521 1.018 0.628 0.881 0.643 CB 1.681 43 residues pruned to eliminate duplicates Z: 15 20.632 1.920 0.542 0.923 1.000 0.571 CB 1.308 15 residues pruned to eliminate duplicates Z: 9 10.178 2.003 0.749 0.363 0.875 0.750 CB 1.361 9 residues pruned to eliminate duplicates Z: 54 36.542 2.215 0.713 0.587 0.925 0.604 CB 1.317 54 residues pruned to eliminate duplicates Z: 42 24.656 1.948 0.448 0.558 0.927 0.683 CB 1.393 42 residues pruned to eliminate duplicates Z: 41 26.974 1.971 0.582 0.543 0.900 0.675 CB 1.458 41 residues pruned to eliminate duplicates Z: 30 57.354 2.248 0.905 0.916 1.000 0.414 CB 1.756 30 residues pruned to eliminate duplicates Z: 6 3.179 1.477 0.191 0.579 0.800 0.600 O 0.937 6 residues pruned to eliminate duplicates Z: 19 14.774 2.018 0.722 0.530 0.778 0.500 CB 1.250 19 residues pruned to eliminate duplicates Z: 16 23.130 2.189 0.330 0.933 1.000 1.000 CB 1.432 16 residues pruned to eliminate duplicates Z: 16 16.218 2.103 0.344 0.886 0.867 0.733 CB 1.233 16 residues pruned to eliminate duplicates Z: 49 40.074 2.240 0.784 0.591 0.958 0.646 CB 1.385 49 residues pruned to eliminate duplicates Z: 31 59.739 2.329 0.825 0.885 1.000 0.767 CB 1.853 31 residues pruned to eliminate duplicates Z: 72 48.727 2.239 0.646 0.647 0.930 0.761 CB 1.473 72 residues pruned to eliminate duplicates Z: 35 25.007 2.000 0.752 0.556 0.882 0.647 CB 1.313 35 residues pruned to eliminate duplicates Z: 19 27.870 2.206 0.702 0.649 1.000 0.778 CB 1.523 19 residues pruned to eliminate duplicates Z: 41 33.849 2.189 0.753 0.531 0.825 0.525 CB 1.640 41 residues pruned to eliminate duplicates Z: 6 9.291 2.018 0.320 0.837 1.000 0.600 CB 1.166 6 residues pruned to eliminate duplicates Z: 32 48.512 2.241 0.720 0.890 0.968 0.806 CB 1.680 32 residues pruned to eliminate duplicates Z: 26 29.545 2.364 0.731 0.533 0.880 0.680 CB 1.588 26 residues pruned to eliminate duplicates Z: 54 40.120 2.258 0.775 0.494 0.981 0.660 CB 1.410 54 residues pruned to eliminate duplicates Z: 14 27.868 1.937 0.983 0.923 1.000 0.692 CB 1.414 14 residues pruned to eliminate duplicates Z: 14 20.506 1.951 0.416 0.950 1.000 0.846 CB 1.420 14 residues pruned to eliminate duplicates Z: 7 5.391 1.414 0.467 0.675 1.000 0.333 O 0.903 7 residues pruned to eliminate duplicates Z: 16 15.761 1.898 0.607 0.534 0.867 0.600 CB 1.488 16 residues pruned to eliminate duplicates Z: 15 40.106 2.227 1.208 0.913 1.000 0.429 CB 1.542 15 residues pruned to eliminate duplicates Z: 42 39.650 2.325 0.770 0.531 0.854 0.512 CB 1.709 42 residues pruned to eliminate duplicates Z: 36 19.233 2.030 0.521 0.389 0.829 0.571 CB 1.430 36 residues pruned to eliminate duplicates Z: 8 8.727 1.726 0.667 0.514 0.857 0.429 C 1.318 8 residues pruned to eliminate duplicates Z: 9 10.390 1.632 0.553 0.715 1.000 0.625 CB 1.192 9 residues pruned to eliminate duplicates Z: 23 40.278 2.175 1.101 0.944 0.955 0.727 CB 1.363 23 residues pruned to eliminate duplicates Z: 29 47.408 2.191 0.705 0.901 0.964 0.786 CB 1.775 29 residues pruned to eliminate duplicates Z: 18 46.836 2.238 1.071 0.909 1.000 1.000 CB 1.739 18 residues pruned to eliminate duplicates Z: 34 23.407 1.940 0.596 0.604 0.939 0.545 CB 1.268 34 residues pruned to eliminate duplicates Z: 10 11.127 1.980 0.383 0.515 0.889 0.556 CB 1.502 10 residues pruned to eliminate duplicates Z: 100 85.131 2.416 0.992 0.679 0.919 0.636 CB 1.640 100 residues pruned to eliminate duplicates Z: 10 22.176 2.206 0.713 0.705 1.000 0.667 CA 1.623 10 residues pruned to eliminate duplicates Z: 6 13.068 1.955 0.664 0.825 1.000 0.800 CB 1.356 6 residues pruned to eliminate duplicates Z: 6 4.497 1.793 -0.034 0.601 1.000 0.600 CB 1.055 Z: 23 22.498 2.263 0.600 0.467 0.909 0.818 CB 1.506 23 residues pruned to eliminate duplicates Z: 13 12.932 1.872 0.811 0.474 0.917 0.417 CB 1.233 13 residues pruned to eliminate duplicates Z: 49 37.031 2.162 0.672 0.560 0.958 0.500 CB 1.456 49 residues pruned to eliminate duplicates Z: 18 31.348 2.095 0.838 0.878 0.941 0.706 CB 1.523 18 residues pruned to eliminate duplicates Z: 8 16.437 2.227 0.594 0.673 0.857 0.571 CA 1.740 8 residues pruned to eliminate duplicates Z: 50 35.267 2.208 0.726 0.549 0.898 0.612 CB 1.403 50 residues pruned to eliminate duplicates Z: 50 36.398 2.221 0.770 0.545 0.878 0.714 CB 1.443 50 residues pruned to eliminate duplicates Z: 33 49.856 2.172 0.892 0.881 0.969 0.500 CB 1.602 33 residues pruned to eliminate duplicates Z: 19 15.684 2.163 0.411 0.489 0.833 0.556 CB 1.471 19 residues pruned to eliminate duplicates Z: 8 8.328 1.770 0.607 0.425 1.000 0.571 CB 1.196 8 residues pruned to eliminate duplicates Z: 6 2.603 1.335 0.304 0.580 1.000 0.400 CA 0.620 Z: 32 45.213 2.232 0.960 0.904 0.839 0.387 CB 1.576 32 residues pruned to eliminate duplicates Z: 86 88.586 2.387 0.987 0.723 0.941 0.718 CB 1.760 86 residues pruned to eliminate duplicates Z: 19 22.239 2.139 0.622 0.655 0.889 0.667 CB 1.472 19 residues pruned to eliminate duplicates Z: 16 25.560 1.897 0.745 0.943 1.000 0.600 CB 1.381 16 residues pruned to eliminate duplicates Z: 101 85.218 2.443 1.010 0.651 0.900 0.570 CB 1.675 101 residues pruned to eliminate duplicates Z: 15 31.547 2.202 0.854 0.888 1.000 0.857 CB 1.487 15 residues pruned to eliminate duplicates Z: 17 9.267 1.725 0.448 0.378 0.875 0.562 CB 1.208 17 residues pruned to eliminate duplicates Z: 14 33.835 2.166 1.033 0.886 1.000 0.538 CA 1.538 14 residues pruned to eliminate duplicates Z: 9 13.203 2.040 0.514 0.854 1.000 0.500 CB 1.117 9 residues pruned to eliminate duplicates Z: 56 66.061 2.424 0.769 0.677 0.964 0.618 CB 1.832 56 residues pruned to eliminate duplicates Z: 79 64.932 2.382 0.761 0.602 0.923 0.718 CB 1.723 79 residues pruned to eliminate duplicates Z: 29 31.866 2.148 0.719 0.665 0.929 0.714 CB 1.508 29 residues pruned to eliminate duplicates Z: 24 27.966 2.138 0.712 0.722 0.913 0.652 CB 1.428 24 residues pruned to eliminate duplicates Z: 71 47.368 2.158 0.841 0.595 0.914 0.586 CB 1.424 69 residues pruned to eliminate duplicates 8 1.920 1.665 0.079 0.159 0.714 0.286 CB 0.858 ? Z: 18 23.846 2.194 0.611 0.616 0.941 0.706 CB 1.558 18 residues pruned to eliminate duplicates Z: 47 51.996 2.467 0.976 0.591 0.891 0.630 CB 1.618 47 residues pruned to eliminate duplicates Z: 7 7.996 2.065 0.361 0.508 0.833 0.500 CB 1.383 7 residues pruned to eliminate duplicates Z: 12 19.114 2.263 0.849 0.555 0.818 0.727 CB 1.597 13 residues pruned to eliminate duplicates Z: 8 6.453 1.926 0.708 0.210 0.714 0.571 N 1.462 8 residues pruned to eliminate duplicates Z: 16 45.972 2.389 0.906 0.892 1.000 0.800 CA 1.872 16 residues pruned to eliminate duplicates Z: 33 49.749 2.185 0.784 0.899 1.000 0.406 CB 1.613 33 residues pruned to eliminate duplicates Z: 15 33.523 2.290 1.053 0.872 0.929 0.714 CB 1.495 15 residues pruned to eliminate duplicates Z: 13 25.242 2.172 0.587 0.892 1.000 0.917 CB 1.519 13 residues pruned to eliminate duplicates Z: 13 11.019 1.939 0.270 0.687 0.833 0.583 CB 1.306 13 residues pruned to eliminate duplicates Z: 12 10.873 2.036 0.371 0.700 0.909 0.727 CB 1.076 19 residues pruned to eliminate duplicates Z: 34 21.628 2.004 0.511 0.509 0.909 0.606 CB 1.356 34 residues pruned to eliminate duplicates Z: 55 35.384 2.200 0.719 0.561 0.926 0.611 CB 1.296 55 residues pruned to eliminate duplicates Z: 73 65.776 2.383 0.797 0.641 0.917 0.722 CB 1.731 73 residues pruned to eliminate duplicates 7 1.554 1.341 -0.288 0.235 1.000 0.500 CB 0.903 ? Z: 16 32.902 2.438 0.694 0.650 1.000 0.667 CA 1.788 16 residues pruned to eliminate duplicates Z: 8 15.069 2.166 0.789 0.481 0.857 0.714 CB 1.748 8 residues pruned to eliminate duplicates Z: 13 9.357 2.078 0.262 0.584 0.917 0.667 CB 1.036 13 residues pruned to eliminate duplicates Z: 20 24.890 2.230 0.504 0.654 0.947 0.684 CB 1.557 20 residues pruned to eliminate duplicates Z: 7 3.785 1.746 -0.273 0.665 1.000 0.833 CB 1.045 6 residues pruned to eliminate duplicates Z: 26 34.624 2.264 0.928 0.626 0.880 0.520 CB 1.600 26 residues pruned to eliminate duplicates Z: 14 19.005 1.987 0.288 0.950 1.000 1.000 CB 1.421 14 residues pruned to eliminate duplicates Z: 17 14.585 2.131 0.591 0.302 0.938 0.438 CB 1.429 17 residues pruned to eliminate duplicates Z: 14 23.918 1.985 0.660 0.953 1.000 1.000 CB 1.385 14 residues pruned to eliminate duplicates Z: 21 38.594 2.206 1.029 0.936 0.950 0.550 CB 1.413 23 residues pruned to eliminate duplicates Z: 14 22.487 1.975 0.903 0.881 0.923 0.769 CB 1.302 14 residues pruned to eliminate duplicates Z: 6 8.171 2.132 0.225 0.496 1.000 0.400 CB 1.406 6 residues pruned to eliminate duplicates Z: 132 95.019 2.406 0.987 0.657 0.916 0.595 CB 1.638 132 residues pruned to eliminate duplicates Z: 28 37.374 2.314 0.799 0.681 1.000 0.815 CB 1.463 28 residues pruned to eliminate duplicates Z: 14 23.967 1.964 0.668 0.940 0.923 0.846 CB 1.527 14 residues pruned to eliminate duplicates Z: 47 30.136 2.255 0.433 0.578 0.913 0.696 CB 1.398 47 residues pruned to eliminate duplicates Z: 35 27.078 2.193 0.612 0.528 0.794 0.588 CB 1.610 35 residues pruned to eliminate duplicates Z: 55 34.261 2.211 0.542 0.551 0.944 0.630 CB 1.378 55 residues pruned to eliminate duplicates Z: 15 15.350 2.225 0.963 0.413 0.786 0.500 CB 1.308 15 residues pruned to eliminate duplicates Z: 10 24.158 2.414 0.463 0.906 1.000 0.889 CB 1.622 10 residues pruned to eliminate duplicates Z: 6 3.564 1.627 0.165 0.411 0.800 0.400 CB 1.155 Z: 49 39.971 2.240 0.586 0.624 0.938 0.667 CB 1.542 49 residues pruned to eliminate duplicates 6 1.678 1.622 -0.009 0.341 0.800 0.400 N 0.694 ? Z: 17 12.807 1.869 0.755 0.385 0.875 0.562 CB 1.260 17 residues pruned to eliminate duplicates Z: 6 5.573 1.555 0.161 0.844 1.000 0.600 C 1.027 6 residues pruned to eliminate duplicates Z: 34 35.494 2.286 0.737 0.581 0.909 0.667 CB 1.584 34 residues pruned to eliminate duplicates Z: 39 45.420 2.286 0.856 0.656 1.000 0.789 CB 1.502 39 residues pruned to eliminate duplicates Z: 17 38.332 2.337 0.619 0.914 1.000 0.812 CB 1.791 17 residues pruned to eliminate duplicates Z: 6 3.891 1.771 -0.199 0.547 0.800 0.600 C 1.464 4 residues pruned to eliminate duplicates Z: 15 31.795 2.278 0.770 0.926 0.929 0.571 CB 1.591 15 residues pruned to eliminate duplicates Z: 63 72.288 2.408 0.907 0.713 0.952 0.726 CB 1.731 63 residues pruned to eliminate duplicates Z: 6 8.164 1.933 0.406 0.736 0.800 0.600 CB 1.359 6 residues pruned to eliminate duplicates Z: 31 40.522 2.234 0.773 0.659 0.967 0.667 CB 1.667 31 residues pruned to eliminate duplicates Z: 16 33.408 2.199 0.912 0.899 0.933 0.667 CB 1.572 16 residues pruned to eliminate duplicates Z: 13 15.588 1.984 0.801 0.791 0.917 0.333 CB 1.064 13 residues pruned to eliminate duplicates Z: 27 21.448 2.089 0.611 0.544 0.885 0.731 CB 1.354 27 residues pruned to eliminate duplicates Z: 24 45.119 2.577 0.669 0.717 1.000 0.609 CB 1.796 24 residues pruned to eliminate duplicates Z: 44 33.153 2.168 0.757 0.506 0.884 0.581 CB 1.492 44 residues pruned to eliminate duplicates Z: 37 25.294 1.997 0.683 0.543 0.889 0.500 CB 1.353 37 residues pruned to eliminate duplicates Z: 17 44.250 2.392 1.222 0.882 0.938 0.625 CB 1.607 17 residues pruned to eliminate duplicates Z: 13 10.743 1.921 0.161 0.655 0.917 0.583 CB 1.314 13 residues pruned to eliminate duplicates Z: 31 53.836 2.334 0.940 0.914 0.933 0.700 CB 1.644 31 residues pruned to eliminate duplicates Z: 7 5.621 1.640 0.849 0.682 0.833 0.833 CB 0.768 Z: 14 14.973 1.914 0.658 0.460 1.000 0.615 CB 1.363 14 residues pruned to eliminate duplicates Z: 30 23.308 2.175 0.592 0.500 0.897 0.552 CB 1.394 30 residues pruned to eliminate duplicates Z: 77 66.456 2.429 0.755 0.613 0.934 0.605 CB 1.720 77 residues pruned to eliminate duplicates Z: 11 13.272 2.067 0.349 0.668 0.900 0.500 CB 1.432 11 residues pruned to eliminate duplicates Z: 72 51.785 2.260 0.716 0.643 0.915 0.690 CB 1.514 72 residues pruned to eliminate duplicates Z: 169 88.178 2.397 0.769 0.580 0.905 0.649 CB 1.642 169 residues pruned to eliminate duplicates Z: 30 26.501 2.149 0.733 0.508 0.897 0.586 CB 1.462 30 residues pruned to eliminate duplicates Z: 6 3.372 1.313 0.239 0.484 1.000 0.400 CB 0.941 Z: 25 44.810 2.295 1.010 0.802 0.917 0.417 CB 1.661 25 residues pruned to eliminate duplicates Z: 42 47.341 2.431 0.789 0.662 0.927 0.732 CB 1.579 42 residues pruned to eliminate duplicates Z: 6 8.197 2.010 0.250 0.854 0.800 0.400 CB 1.347 6 residues pruned to eliminate duplicates Z: 11 28.966 2.201 1.076 0.616 1.000 0.600 N 1.797 11 residues pruned to eliminate duplicates Z: 16 37.180 2.301 0.920 0.923 1.000 0.733 CB 1.527 16 residues pruned to eliminate duplicates Z: 7 2.470 1.583 0.777 0.339 0.500 0.500 CA 0.854 Z: 15 38.345 2.388 0.683 0.916 1.000 0.929 CA 1.801 15 residues pruned to eliminate duplicates Z: 91 85.470 2.456 0.922 0.687 0.933 0.744 CB 1.723 91 residues pruned to eliminate duplicates Z: 35 64.001 2.362 0.872 0.830 1.000 0.706 CB 1.866 35 residues pruned to eliminate duplicates Z: 49 35.250 2.204 0.558 0.603 0.958 0.750 CB 1.403 49 residues pruned to eliminate duplicates Z: 44 54.059 2.379 0.839 0.714 0.907 0.791 CB 1.711 44 residues pruned to eliminate duplicates Z: 22 17.197 2.068 0.740 0.361 0.810 0.714 CB 1.496 22 residues pruned to eliminate duplicates Z: 22 35.832 2.416 0.813 0.670 0.905 0.810 CB 1.686 22 residues pruned to eliminate duplicates Z: 30 18.505 1.906 0.511 0.495 0.897 0.759 CB 1.338 30 residues pruned to eliminate duplicates Z: 19 17.180 2.087 0.697 0.369 0.833 0.500 CB 1.579 19 residues pruned to eliminate duplicates Z: 50 30.694 2.307 0.516 0.453 0.837 0.531 CB 1.571 50 residues pruned to eliminate duplicates Z: 11 8.886 1.718 0.403 0.727 1.000 0.800 CB 0.950 11 residues pruned to eliminate duplicates Z: 8 11.748 1.923 0.609 0.517 1.000 0.714 CA 1.412 Z: 23 45.093 2.428 0.739 0.811 1.000 0.818 CA 1.737 23 residues pruned to eliminate duplicates Z: 12 15.807 2.279 0.774 0.483 0.727 0.636 CB 1.650 12 residues pruned to eliminate duplicates Z: 14 8.223 1.809 0.188 0.684 0.923 0.846 CB 0.971 14 residues pruned to eliminate duplicates Z: 14 19.309 2.041 0.427 0.882 1.000 0.846 CB 1.331 14 residues pruned to eliminate duplicates Z: 14 26.686 1.938 0.947 0.931 1.000 0.846 CB 1.370 14 residues pruned to eliminate duplicates Z: 30 29.161 2.275 0.660 0.499 0.966 0.793 CB 1.487 30 residues pruned to eliminate duplicates Z: 28 17.510 1.907 0.458 0.574 0.963 0.778 CB 1.172 28 residues pruned to eliminate duplicates Z: 32 62.659 2.282 0.959 0.924 1.000 0.742 CB 1.768 29 residues pruned to eliminate duplicates Z: 31 59.040 2.270 0.883 0.918 1.000 0.733 CB 1.779 31 residues pruned to eliminate duplicates Z: 8 4.060 1.429 0.297 0.406 0.857 0.571 CB 1.066 Z: 11 11.491 2.083 0.761 0.442 0.900 0.500 CB 1.167 11 residues pruned to eliminate duplicates Z: 10 20.295 2.158 0.856 0.609 1.000 0.667 CB 1.523 10 residues pruned to eliminate duplicates Z: 27 26.378 2.253 0.630 0.466 0.885 0.500 CB 1.648 27 residues pruned to eliminate duplicates Z: 19 26.724 2.163 0.885 0.619 0.889 0.500 CB 1.553 19 residues pruned to eliminate duplicates Z: 43 51.204 2.456 0.868 0.582 0.952 0.452 CB 1.672 43 residues pruned to eliminate duplicates Z: 59 58.467 2.431 0.794 0.589 0.948 0.534 CB 1.705 59 residues pruned to eliminate duplicates Z: 31 41.270 2.331 0.753 0.625 0.967 0.500 CA 1.696 31 residues pruned to eliminate duplicates Z: 18 8.853 1.633 0.555 0.446 0.824 0.529 CB 1.086 18 residues pruned to eliminate duplicates Z: 28 25.880 1.961 0.710 0.653 0.926 0.667 CB 1.391 28 residues pruned to eliminate duplicates 7 1.990 1.627 0.006 0.312 0.667 0.167 CB 0.917 ? Z: 61 49.966 2.304 0.780 0.598 0.933 0.717 CB 1.534 61 residues pruned to eliminate duplicates Z: 8 5.544 1.371 0.324 0.875 1.000 0.857 CB 0.840 7 residues pruned to eliminate duplicates Z: 6 5.186 1.380 0.119 0.862 1.000 0.600 C 1.103 6 residues pruned to eliminate duplicates Z: 17 42.896 2.293 0.806 0.913 1.000 0.938 CA 1.833 17 residues pruned to eliminate duplicates Z: 18 42.917 2.374 0.970 0.824 0.941 0.941 CB 1.786 18 residues pruned to eliminate duplicates Z: 6 7.092 1.900 0.478 0.658 1.000 0.800 CB 0.976 6 residues pruned to eliminate duplicates Z: 24 16.141 1.877 0.571 0.500 0.913 0.652 CB 1.251 24 residues pruned to eliminate duplicates Z: 103 65.703 2.286 0.764 0.590 0.961 0.608 CB 1.541 103 residues pruned to eliminate duplicates Z: 9 14.196 1.918 0.682 0.610 1.000 0.875 CA 1.402 9 residues pruned to eliminate duplicates Z: 71 48.398 2.319 0.720 0.553 0.886 0.471 CB 1.555 71 residues pruned to eliminate duplicates Z: 30 53.962 2.306 0.962 0.911 0.966 0.655 CB 1.625 30 residues pruned to eliminate duplicates Z: 15 9.960 2.018 0.388 0.383 0.857 0.571 CB 1.255 15 residues pruned to eliminate duplicates Z: 15 32.735 2.134 1.259 0.921 0.929 0.571 CB 1.376 15 residues pruned to eliminate duplicates Z: 7 3.395 1.338 0.497 0.825 0.833 0.500 CB 0.627 7 residues pruned to eliminate duplicates Z: 25 36.616 2.065 1.034 0.880 0.958 0.708 CB 1.345 25 residues pruned to eliminate duplicates Z: 14 27.874 2.285 0.653 0.915 1.000 0.923 CB 1.447 14 residues pruned to eliminate duplicates Z: 6 10.993 2.060 0.770 0.717 0.800 0.600 CA 1.385 6 residues pruned to eliminate duplicates Z: 15 23.252 1.844 0.870 0.917 0.929 0.714 CB 1.370 15 residues pruned to eliminate duplicates Z: 15 32.369 2.274 0.836 0.923 1.000 1.000 CB 1.456 15 residues pruned to eliminate duplicates Z: 7 10.266 2.009 0.345 0.570 1.000 0.833 CB 1.450 7 residues pruned to eliminate duplicates Z: 12 23.114 1.986 0.817 0.885 1.000 0.727 CB 1.394 12 residues pruned to eliminate duplicates Z: 83 48.600 2.153 0.729 0.577 0.939 0.573 CB 1.426 83 residues pruned to eliminate duplicates Z: 10 23.896 2.307 0.904 0.853 0.889 0.889 CB 1.508 10 residues pruned to eliminate duplicates Z: 6 3.211 1.568 0.071 0.542 0.800 0.800 CB 1.025 7 1.097 1.302 0.550 0.451 0.833 0.500 CB 0.280 ? Z: 13 23.234 2.196 0.514 0.826 1.000 0.750 CB 1.522 13 residues pruned to eliminate duplicates Z: 6 6.189 1.199 0.860 0.749 1.000 0.800 CA 0.994 Z: 31 43.910 2.391 0.974 0.564 0.967 0.700 CB 1.651 31 residues pruned to eliminate duplicates Z: 7 10.140 1.907 0.445 0.679 1.000 0.667 CB 1.275 7 residues pruned to eliminate duplicates Z: 8 9.078 1.863 0.450 0.760 0.857 0.857 N 1.175 8 residues pruned to eliminate duplicates Z: 13 18.943 2.185 0.500 0.670 1.000 0.583 CB 1.426 13 residues pruned to eliminate duplicates Z: 6 5.029 1.678 0.340 0.677 1.000 0.800 CB 0.850 Z: 27 36.095 2.336 0.608 0.664 0.962 0.731 CB 1.683 27 residues pruned to eliminate duplicates Z: 15 20.062 2.286 0.617 0.500 0.929 0.571 CB 1.563 15 residues pruned to eliminate duplicates Z: 107 79.962 2.368 0.833 0.640 0.943 0.651 CB 1.663 107 residues pruned to eliminate duplicates Z: 11 20.304 2.230 0.668 0.654 1.000 0.600 CB 1.496 11 residues pruned to eliminate duplicates Z: 34 25.761 2.057 0.558 0.511 0.970 0.606 CB 1.427 34 residues pruned to eliminate duplicates Z: 50 35.210 2.216 0.668 0.578 0.939 0.612 CB 1.345 50 residues pruned to eliminate duplicates Z: 43 37.105 2.239 0.804 0.569 0.952 0.762 CB 1.392 43 residues pruned to eliminate duplicates Z: 6 2.052 1.347 0.451 0.100 0.800 0.600 O 0.978 Z: 32 47.883 2.296 1.090 0.699 0.935 0.645 CB 1.598 32 residues pruned to eliminate duplicates Z: 31 22.069 1.961 0.514 0.596 0.967 0.667 CB 1.281 31 residues pruned to eliminate duplicates Z: 27 17.197 1.983 0.592 0.436 0.885 0.462 CB 1.291 27 residues pruned to eliminate duplicates Z: 15 16.191 2.271 0.822 0.342 0.857 0.357 CB 1.450 15 residues pruned to eliminate duplicates Z: 45 38.422 2.231 0.576 0.670 0.864 0.636 CB 1.630 34 residues pruned to eliminate duplicates Z: 17 25.111 2.191 0.802 0.641 1.000 0.875 CB 1.394 17 residues pruned to eliminate duplicates Z: 12 14.703 1.961 0.357 0.696 1.000 0.818 CB 1.394 12 residues pruned to eliminate duplicates Z: 12 19.161 2.179 0.623 0.853 0.818 0.727 CB 1.475 12 residues pruned to eliminate duplicates Z: 6 4.417 1.555 0.054 0.880 1.000 0.800 CB 0.873 6 residues pruned to eliminate duplicates Z: 106 83.197 2.430 0.909 0.642 0.924 0.657 CB 1.658 106 residues pruned to eliminate duplicates Z: 64 51.005 2.305 0.705 0.641 0.889 0.603 CB 1.612 64 residues pruned to eliminate duplicates Z: 89 83.913 2.358 0.900 0.724 0.932 0.750 CB 1.749 101 residues pruned to eliminate duplicates Z: 6 3.844 1.634 0.042 0.868 1.000 1.000 CB 0.738 6 residues pruned to eliminate duplicates Z: 8 4.498 1.478 0.364 0.798 0.857 0.286 CB 0.758 8 residues pruned to eliminate duplicates Z: 8 4.824 1.600 0.303 0.412 0.857 0.286 CB 1.119 8 residues pruned to eliminate duplicates Z: 15 25.496 1.924 0.929 0.940 1.000 0.357 CB 1.274 15 residues pruned to eliminate duplicates Z: 58 79.466 2.463 0.811 0.786 0.965 0.772 CB 1.901 60 residues pruned to eliminate duplicates Z: 11 23.817 2.208 1.072 0.888 0.900 0.600 CB 1.317 11 residues pruned to eliminate duplicates Z: 17 17.993 2.154 0.586 0.501 0.938 0.625 CB 1.404 17 residues pruned to eliminate duplicates Z: 54 62.327 2.405 0.864 0.625 0.981 0.736 CB 1.730 54 residues pruned to eliminate duplicates Z: 67 61.807 2.353 0.857 0.666 0.909 0.682 CB 1.644 67 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 14 34.066 2.207 1.249 0.887 1.000 0.769 CB 1.373 14 residues pruned to eliminate duplicates Z: 27 31.347 2.153 0.921 0.626 0.962 0.577 CB 1.373 27 residues pruned to eliminate duplicates Z: 24 35.041 2.181 1.058 0.680 1.000 0.652 CB 1.380 24 residues pruned to eliminate duplicates Z: 26 27.333 2.128 0.981 0.619 0.880 0.600 CB 1.317 26 residues pruned to eliminate duplicates Z: 35 28.530 2.161 0.773 0.549 0.882 0.588 CB 1.379 35 residues pruned to eliminate duplicates Z: 25 29.311 2.193 0.962 0.626 0.917 0.542 CB 1.347 25 residues pruned to eliminate duplicates Z: 15 26.517 2.249 1.202 0.727 0.929 0.643 CB 1.257 15 residues pruned to eliminate duplicates Z: 24 33.845 2.246 0.976 0.644 0.957 0.652 CB 1.453 24 residues pruned to eliminate duplicates Z: 63 52.745 2.312 0.899 0.587 0.871 0.581 CB 1.611 67 residues pruned to eliminate duplicates Z: 15 34.756 2.292 1.131 0.893 1.000 0.500 CB 1.365 15 residues pruned to eliminate duplicates Z: 24 32.821 2.268 0.781 0.637 1.000 0.565 CB 1.490 24 residues pruned to eliminate duplicates Z: 24 31.834 2.185 0.774 0.671 0.957 0.652 CB 1.529 24 residues pruned to eliminate duplicates Z: 23 27.274 2.265 0.473 0.689 1.000 0.682 CB 1.466 23 residues pruned to eliminate duplicates Z: 31 30.395 2.090 0.726 0.634 0.933 0.533 CB 1.454 39 residues pruned to eliminate duplicates Z: 26 28.990 2.160 0.637 0.622 0.960 0.560 CB 1.522 26 residues pruned to eliminate duplicates Z: 25 22.472 2.091 0.726 0.522 0.833 0.333 CB 1.491 25 residues pruned to eliminate duplicates Z: 24 31.246 2.145 0.977 0.598 0.957 0.391 CB 1.463 24 residues pruned to eliminate duplicates Z: 25 31.397 2.105 0.947 0.620 0.958 0.542 CB 1.457 25 residues pruned to eliminate duplicates Z: 25 28.395 2.185 0.708 0.631 0.958 0.542 CB 1.433 25 residues pruned to eliminate duplicates Z: 19 24.309 2.294 0.553 0.582 0.944 0.611 CB 1.573 19 residues pruned to eliminate duplicates Z: 18 28.609 2.322 0.749 0.647 0.941 0.588 CB 1.582 18 residues pruned to eliminate duplicates Z: 19 24.233 2.306 0.531 0.569 0.944 0.556 CB 1.602 19 residues pruned to eliminate duplicates Z: 20 23.805 2.117 0.666 0.578 0.895 0.789 CA 1.605 20 residues pruned to eliminate duplicates Z: 18 24.773 2.300 0.483 0.643 0.941 0.706 CB 1.638 18 residues pruned to eliminate duplicates Z: 19 29.227 2.303 0.709 0.648 0.944 0.611 CB 1.614 19 residues pruned to eliminate duplicates Z: 19 25.472 2.322 0.467 0.636 0.944 0.611 CB 1.642 19 residues pruned to eliminate duplicates Z: 18 28.519 2.328 0.617 0.637 1.000 0.765 CB 1.616 18 residues pruned to eliminate duplicates Z: 18 26.912 2.329 0.469 0.648 1.000 0.706 CB 1.662 18 residues pruned to eliminate duplicates Z: 20 22.444 2.229 0.361 0.581 1.000 0.632 CB 1.570 20 residues pruned to eliminate duplicates Z: 19 21.213 2.206 0.347 0.592 0.944 0.722 CA 1.631 19 residues pruned to eliminate duplicates Z: 20 19.429 2.194 0.463 0.544 0.895 0.579 CB 1.487 20 residues pruned to eliminate duplicates Z: 19 25.112 2.311 0.470 0.644 0.944 0.556 CB 1.613 19 residues pruned to eliminate duplicates Z: 20 20.109 2.192 0.366 0.593 0.947 0.579 CA 1.488 20 residues pruned to eliminate duplicates Z: 18 25.844 2.336 0.447 0.641 1.000 0.588 CB 1.626 18 residues pruned to eliminate duplicates Z: 58 36.043 2.110 0.529 0.542 0.930 0.667 CB 1.528 58 residues pruned to eliminate duplicates Z: 56 34.255 2.135 0.369 0.573 0.964 0.618 CB 1.529 56 residues pruned to eliminate duplicates Z: 56 34.678 2.137 0.453 0.538 0.927 0.564 CB 1.564 56 residues pruned to eliminate duplicates Z: 25 21.839 2.041 0.459 0.624 0.958 0.542 CB 1.391 25 residues pruned to eliminate duplicates Z: 51 31.299 2.074 0.576 0.600 0.900 0.620 CB 1.368 51 residues pruned to eliminate duplicates Z: 8 5.639 1.677 0.263 0.473 0.714 0.286 CB 1.447 8 residues pruned to eliminate duplicates Z: 39 27.845 2.049 0.595 0.557 0.895 0.579 CB 1.462 39 residues pruned to eliminate duplicates Z: 39 26.768 1.992 0.424 0.605 0.974 0.658 CB 1.423 39 residues pruned to eliminate duplicates Z: 45 28.854 1.978 0.635 0.531 0.886 0.591 CB 1.472 45 residues pruned to eliminate duplicates Z: 39 28.774 2.051 0.586 0.581 0.921 0.579 CB 1.442 39 residues pruned to eliminate duplicates Z: 19 17.855 1.881 0.378 0.776 0.944 0.722 CB 1.348 19 residues pruned to eliminate duplicates Z: 32 27.829 2.009 0.627 0.576 0.903 0.742 CB 1.572 32 residues pruned to eliminate duplicates Z: 32 26.138 2.012 0.545 0.570 0.935 0.677 CB 1.509 32 residues pruned to eliminate duplicates Z: 39 27.509 2.043 0.604 0.551 0.895 0.579 CB 1.449 39 residues pruned to eliminate duplicates Z: 39 26.110 2.061 0.468 0.590 0.895 0.553 CB 1.436 39 residues pruned to eliminate duplicates Z: 42 29.211 2.005 0.660 0.566 0.902 0.585 CB 1.424 42 residues pruned to eliminate duplicates Z: 56 38.241 2.115 0.685 0.577 0.909 0.655 CB 1.477 56 residues pruned to eliminate duplicates Z: 14 31.366 1.983 0.952 0.953 1.000 0.923 CB 1.547 14 residues pruned to eliminate duplicates Z: 30 30.420 1.985 0.731 0.656 1.000 0.724 CB 1.421 30 residues pruned to eliminate duplicates Z: 197 98.293 2.318 0.857 0.627 0.918 0.643 CB 1.576 197 residues pruned to eliminate duplicates Z: 43 29.065 1.988 0.659 0.523 0.929 0.500 CB 1.431 43 residues pruned to eliminate duplicates Z: 33 28.594 1.971 0.737 0.577 0.906 0.531 CB 1.513 33 residues pruned to eliminate duplicates Z: 28 30.641 2.046 0.741 0.594 0.926 0.630 CB 1.633 28 residues pruned to eliminate duplicates Z: 29 29.076 2.010 0.771 0.559 0.893 0.643 CB 1.633 29 residues pruned to eliminate duplicates Z: 28 27.689 1.966 0.818 0.617 0.889 0.519 CB 1.501 28 residues pruned to eliminate duplicates Z: 14 15.896 2.095 0.588 0.385 0.846 0.462 CB 1.770 14 residues pruned to eliminate duplicates Z: 13 15.983 2.148 0.658 0.389 0.833 0.500 CB 1.748 13 residues pruned to eliminate duplicates Z: 24 24.212 1.965 0.822 0.671 0.870 0.565 CB 1.385 24 residues pruned to eliminate duplicates Z: 35 27.319 1.978 0.715 0.607 0.912 0.559 CB 1.368 35 residues pruned to eliminate duplicates Z: 15 15.897 2.029 0.732 0.350 0.857 0.429 CA 1.658 15 residues pruned to eliminate duplicates Z: 13 16.262 2.128 0.523 0.417 0.917 0.417 CB 1.723 13 residues pruned to eliminate duplicates Z: 15 14.559 2.022 0.595 0.386 0.857 0.500 CB 1.588 15 residues pruned to eliminate duplicates Z: 14 12.251 1.975 0.427 0.414 0.846 0.538 CB 1.558 14 residues pruned to eliminate duplicates Z: 32 27.125 1.973 0.556 0.585 1.000 0.419 CB 1.462 32 residues pruned to eliminate duplicates Z: 42 27.657 2.030 0.717 0.532 0.902 0.537 CB 1.331 42 residues pruned to eliminate duplicates Z: 17 14.331 2.122 0.465 0.329 0.938 0.375 CB 1.482 17 residues pruned to eliminate duplicates Z: 16 13.933 2.092 0.765 0.287 0.800 0.667 CB 1.547 16 residues pruned to eliminate duplicates Z: 34 36.049 2.304 0.805 0.593 0.909 0.667 CB 1.519 34 residues pruned to eliminate duplicates Z: 7 4.085 1.944 0.288 0.263 0.667 0.167 N 1.310 7 residues pruned to eliminate duplicates Z: 57 39.550 2.262 0.708 0.527 0.875 0.661 CB 1.523 57 residues pruned to eliminate duplicates Z: 54 41.463 2.276 0.799 0.498 0.868 0.585 CB 1.607 54 residues pruned to eliminate duplicates Z: 90 46.334 2.193 0.616 0.536 0.910 0.640 CB 1.469 90 residues pruned to eliminate duplicates Z: 43 40.298 2.284 0.807 0.562 0.929 0.643 CB 1.527 43 residues pruned to eliminate duplicates Z: 82 44.064 2.229 0.622 0.494 0.901 0.667 CB 1.511 82 residues pruned to eliminate duplicates Z: 50 45.799 2.316 0.792 0.581 0.939 0.592 CB 1.553 50 residues pruned to eliminate duplicates Z: 40 38.080 2.261 0.872 0.583 0.923 0.641 CB 1.442 40 residues pruned to eliminate duplicates Z: 38 48.062 2.336 0.970 0.615 0.973 0.676 CB 1.583 38 residues pruned to eliminate duplicates Z: 155 90.719 2.392 0.839 0.625 0.922 0.643 CB 1.601 155 residues pruned to eliminate duplicates Z: 35 41.036 2.311 0.896 0.618 0.971 0.647 CB 1.480 35 residues pruned to eliminate duplicates Z: 90 59.291 2.361 0.737 0.579 0.944 0.652 CB 1.505 90 residues pruned to eliminate duplicates Z: 36 43.474 2.294 0.932 0.648 0.914 0.743 CB 1.579 36 residues pruned to eliminate duplicates Z: 54 43.430 2.263 0.846 0.526 0.906 0.623 CB 1.537 54 residues pruned to eliminate duplicates Z: 63 48.057 2.322 0.824 0.547 0.919 0.645 CB 1.498 63 residues pruned to eliminate duplicates Z: 40 44.372 2.306 1.013 0.573 0.949 0.564 CB 1.504 40 residues pruned to eliminate duplicates Z: 78 45.671 2.122 0.824 0.551 0.883 0.610 CB 1.449 78 residues pruned to eliminate duplicates Z: 52 46.261 2.281 0.898 0.571 0.941 0.588 CB 1.485 52 residues pruned to eliminate duplicates Z: 49 49.844 2.319 0.940 0.607 0.958 0.750 CB 1.507 49 residues pruned to eliminate duplicates Z: 36 43.896 2.295 1.119 0.604 0.886 0.571 CB 1.560 36 residues pruned to eliminate duplicates Z: 39 41.011 2.195 1.144 0.583 0.921 0.579 CB 1.418 39 residues pruned to eliminate duplicates Z: 52 41.604 2.288 0.850 0.569 0.882 0.569 CB 1.459 52 residues pruned to eliminate duplicates Z: 51 46.059 2.322 0.831 0.589 0.920 0.660 CB 1.529 51 residues pruned to eliminate duplicates Z: 148 96.893 2.392 0.921 0.648 0.912 0.646 CB 1.663 148 residues pruned to eliminate duplicates Z: 64 50.959 2.329 0.816 0.561 0.921 0.508 CB 1.554 64 residues pruned to eliminate duplicates Z: 32 51.656 2.371 1.142 0.703 0.968 0.742 CB 1.568 32 residues pruned to eliminate duplicates Z: 38 43.921 2.302 0.981 0.611 0.946 0.649 CB 1.507 38 residues pruned to eliminate duplicates Z: 50 43.688 2.323 0.776 0.602 0.898 0.673 CB 1.529 50 residues pruned to eliminate duplicates Z: 45 36.996 2.285 0.760 0.513 0.886 0.477 CB 1.544 45 residues pruned to eliminate duplicates Z: 39 44.467 2.302 1.063 0.599 0.921 0.579 CB 1.500 39 residues pruned to eliminate duplicates Z: 145 92.332 2.373 0.940 0.641 0.903 0.660 CB 1.623 145 residues pruned to eliminate duplicates Z: 50 46.545 2.311 0.819 0.600 0.959 0.694 CB 1.500 50 residues pruned to eliminate duplicates Z: 52 45.536 2.277 0.908 0.576 0.922 0.549 CB 1.480 52 residues pruned to eliminate duplicates Z: 50 46.265 2.329 0.849 0.595 0.939 0.714 CB 1.494 50 residues pruned to eliminate duplicates Z: 65 49.239 2.306 0.761 0.542 0.938 0.656 CB 1.552 65 residues pruned to eliminate duplicates Z: 48 50.445 2.342 0.890 0.592 0.979 0.660 CB 1.555 48 residues pruned to eliminate duplicates Z: 49 49.447 2.321 0.838 0.622 0.958 0.688 CB 1.557 49 residues pruned to eliminate duplicates Z: 38 45.288 2.322 0.990 0.603 0.973 0.757 CB 1.502 38 residues pruned to eliminate duplicates Z: 51 46.675 2.312 0.878 0.598 0.920 0.660 CB 1.505 51 residues pruned to eliminate duplicates Z: 50 46.219 2.311 0.853 0.588 0.939 0.612 CB 1.510 50 residues pruned to eliminate duplicates Z: 151 97.915 2.403 0.933 0.644 0.933 0.627 CB 1.612 151 residues pruned to eliminate duplicates Z: 96 63.916 2.388 0.812 0.574 0.905 0.632 CB 1.559 96 residues pruned to eliminate duplicates Z: 50 46.432 2.306 0.894 0.605 0.939 0.714 CB 1.464 50 residues pruned to eliminate duplicates Z: 13 13.079 2.108 0.517 0.613 0.833 0.750 CB 1.273 13 residues pruned to eliminate duplicates Z: 228 115.028 2.411 0.857 0.615 0.925 0.674 CB 1.653 228 residues pruned to eliminate duplicates Z: 50 42.868 2.299 0.801 0.566 0.939 0.551 CB 1.478 50 residues pruned to eliminate duplicates Z: 54 47.915 2.422 0.773 0.582 0.906 0.642 CB 1.564 54 residues pruned to eliminate duplicates Z: 49 50.270 2.318 0.928 0.609 0.958 0.625 CB 1.527 49 residues pruned to eliminate duplicates Z: 100 84.172 2.442 0.830 0.699 0.939 0.758 CB 1.680 100 residues pruned to eliminate duplicates Z: 230 111.950 2.395 0.829 0.613 0.930 0.633 CB 1.631 230 residues pruned to eliminate duplicates Z: 11 12.104 2.174 0.545 0.600 0.800 0.500 CB 1.294 11 residues pruned to eliminate duplicates Z: 161 99.535 2.410 0.954 0.622 0.919 0.694 CB 1.621 161 residues pruned to eliminate duplicates Z: 28 20.733 2.216 0.557 0.472 0.852 0.667 CB 1.397 28 residues pruned to eliminate duplicates Z: 89 93.637 2.468 0.989 0.728 0.966 0.750 CB 1.714 89 residues pruned to eliminate duplicates Z: 46 47.889 2.422 0.890 0.570 0.933 0.622 CB 1.561 46 residues pruned to eliminate duplicates Z: 17 20.669 2.172 0.574 0.434 1.000 0.500 CB 1.618 17 residues pruned to eliminate duplicates Z: 91 84.282 2.433 0.883 0.707 0.922 0.733 CB 1.743 91 residues pruned to eliminate duplicates Z: 106 79.762 2.431 0.852 0.642 0.886 0.657 CB 1.709 106 residues pruned to eliminate duplicates Z: 17 20.956 2.222 0.649 0.487 0.875 0.500 CB 1.655 17 residues pruned to eliminate duplicates Z: 17 24.447 2.221 0.698 0.509 1.000 0.812 CB 1.606 17 residues pruned to eliminate duplicates Z: 126 91.834 2.452 0.901 0.651 0.904 0.664 CB 1.693 126 residues pruned to eliminate duplicates Z: 41 47.899 2.435 0.745 0.647 0.950 0.825 CB 1.637 41 residues pruned to eliminate duplicates Z: 103 88.267 2.449 0.907 0.682 0.931 0.716 CB 1.700 103 residues pruned to eliminate duplicates Z: 41 46.774 2.432 0.802 0.635 0.900 0.725 CB 1.652 41 residues pruned to eliminate duplicates Z: 45 48.113 2.382 0.913 0.604 0.886 0.636 CB 1.628 45 residues pruned to eliminate duplicates Z: 39 52.148 2.495 0.873 0.654 0.947 0.711 CB 1.656 39 residues pruned to eliminate duplicates Z: 155 93.490 2.429 0.864 0.593 0.916 0.649 CB 1.663 155 residues pruned to eliminate duplicates Z: 44 45.473 2.400 0.816 0.581 0.884 0.744 CB 1.664 44 residues pruned to eliminate duplicates Z: 39 55.022 2.478 0.959 0.671 0.947 0.684 CB 1.657 39 residues pruned to eliminate duplicates Z: 175 106.340 2.463 0.861 0.634 0.897 0.678 CB 1.729 175 residues pruned to eliminate duplicates Z: 45 46.736 2.413 0.757 0.600 0.932 0.659 CB 1.621 45 residues pruned to eliminate duplicates Z: 87 86.679 2.484 0.910 0.726 0.919 0.663 CB 1.749 87 residues pruned to eliminate duplicates Z: 40 48.212 2.489 0.812 0.650 0.897 0.718 CB 1.659 40 residues pruned to eliminate duplicates Z: 90 84.093 2.465 0.930 0.673 0.944 0.663 CB 1.692 90 residues pruned to eliminate duplicates Z: 31 39.588 2.407 0.812 0.648 0.900 0.700 CB 1.603 31 residues pruned to eliminate duplicates Z: 43 46.727 2.422 0.791 0.633 0.905 0.714 CB 1.621 43 residues pruned to eliminate duplicates Z: 45 49.370 2.389 0.881 0.640 0.955 0.636 CB 1.521 45 residues pruned to eliminate duplicates Z: 101 84.276 2.452 0.867 0.667 0.920 0.690 CB 1.715 101 residues pruned to eliminate duplicates Z: 94 79.141 2.427 0.877 0.680 0.914 0.710 CB 1.670 94 residues pruned to eliminate duplicates Z: 40 47.891 2.483 0.789 0.654 0.923 0.692 CB 1.620 40 residues pruned to eliminate duplicates Z: 28 48.988 2.521 0.981 0.701 0.963 0.704 CB 1.632 28 residues pruned to eliminate duplicates Z: 113 83.726 2.429 0.913 0.638 0.893 0.571 CB 1.676 113 residues pruned to eliminate duplicates Z: 162 101.564 2.435 0.837 0.655 0.907 0.689 CB 1.709 162 residues pruned to eliminate duplicates Z: 92 87.767 2.446 0.963 0.699 0.934 0.659 CB 1.711 92 residues pruned to eliminate duplicates Z: 86 83.900 2.416 1.007 0.725 0.929 0.694 CB 1.648 86 residues pruned to eliminate duplicates Z: 43 47.706 2.402 0.903 0.585 0.929 0.595 CB 1.599 43 residues pruned to eliminate duplicates Z: 43 53.368 2.432 0.981 0.633 0.929 0.667 CB 1.625 43 residues pruned to eliminate duplicates Z: 154 91.576 2.415 0.859 0.591 0.915 0.660 CB 1.652 154 residues pruned to eliminate duplicates Z: 163 114.190 2.470 0.929 0.661 0.951 0.698 CB 1.706 163 residues pruned to eliminate duplicates Z: 113 96.906 2.480 1.022 0.658 0.929 0.643 CB 1.699 113 residues pruned to eliminate duplicates Z: 29 47.618 2.501 1.111 0.682 0.893 0.714 CB 1.615 29 residues pruned to eliminate duplicates Z: 102 93.536 2.464 1.000 0.680 0.941 0.683 CB 1.702 102 residues pruned to eliminate duplicates Z: 107 84.809 2.424 0.986 0.642 0.906 0.651 CB 1.655 107 residues pruned to eliminate duplicates Z: 110 95.833 2.467 1.039 0.659 0.936 0.651 CB 1.683 110 residues pruned to eliminate duplicates Z: 92 89.077 2.452 1.051 0.687 0.923 0.593 CB 1.695 92 residues pruned to eliminate duplicates Z: 137 99.670 2.460 0.941 0.634 0.926 0.669 CB 1.704 137 residues pruned to eliminate duplicates Z: 89 87.362 2.484 1.025 0.687 0.920 0.705 CB 1.694 89 residues pruned to eliminate duplicates Z: 104 84.129 2.424 0.940 0.662 0.922 0.650 CB 1.644 104 residues pruned to eliminate duplicates Z: 176 109.849 2.452 0.863 0.641 0.931 0.663 CB 1.711 176 residues pruned to eliminate duplicates Z: 93 87.413 2.449 1.052 0.663 0.924 0.696 CB 1.688 93 residues pruned to eliminate duplicates Z: 177 117.484 2.468 0.921 0.651 0.955 0.670 CB 1.700 177 residues pruned to eliminate duplicates Z: 103 85.057 2.414 0.926 0.641 0.931 0.716 CB 1.704 103 residues pruned to eliminate duplicates Z: 111 83.518 2.416 0.945 0.667 0.891 0.591 CB 1.630 111 residues pruned to eliminate duplicates Z: 89 87.172 2.485 1.015 0.686 0.932 0.682 CB 1.679 89 residues pruned to eliminate duplicates Z: 75 91.801 2.510 1.052 0.765 0.946 0.743 CB 1.731 75 residues pruned to eliminate duplicates Z: 78 91.584 2.482 1.049 0.767 0.961 0.779 CB 1.685 78 residues pruned to eliminate duplicates Z: 84 95.067 2.500 1.076 0.713 0.964 0.651 CB 1.720 84 residues pruned to eliminate duplicates Z: 101 83.945 2.428 0.960 0.672 0.920 0.660 CB 1.636 101 residues pruned to eliminate duplicates Z: 107 82.709 2.411 0.918 0.634 0.925 0.651 CB 1.656 107 residues pruned to eliminate duplicates Z: 154 98.394 2.436 0.906 0.606 0.908 0.627 CB 1.704 154 residues pruned to eliminate duplicates Z: 90 90.442 2.483 1.061 0.685 0.933 0.697 CB 1.696 90 residues pruned to eliminate duplicates Z: 87 89.860 2.462 1.110 0.687 0.942 0.640 CB 1.668 87 residues pruned to eliminate duplicates Z: 114 92.952 2.470 0.959 0.668 0.920 0.646 CB 1.681 114 residues pruned to eliminate duplicates Z: 91 88.934 2.470 1.073 0.672 0.922 0.667 CB 1.695 91 residues pruned to eliminate duplicates Z: 113 93.129 2.444 0.967 0.658 0.929 0.625 CB 1.703 113 residues pruned to eliminate duplicates Z: 85 94.190 2.480 1.124 0.714 0.940 0.679 CB 1.708 85 residues pruned to eliminate duplicates Z: 88 93.024 2.475 1.001 0.719 0.966 0.736 CB 1.711 88 residues pruned to eliminate duplicates Z: 96 90.827 2.435 1.045 0.706 0.926 0.684 CB 1.675 96 residues pruned to eliminate duplicates Z: 81 82.534 2.434 1.055 0.729 0.900 0.750 CB 1.668 81 residues pruned to eliminate duplicates Z: 89 91.159 2.484 1.059 0.688 0.943 0.636 CB 1.696 89 residues pruned to eliminate duplicates Z: 74 95.461 2.487 1.168 0.753 0.959 0.726 CB 1.726 74 residues pruned to eliminate duplicates Z: 89 98.849 2.486 1.111 0.722 0.977 0.716 CB 1.680 89 residues pruned to eliminate duplicates Z: 84 71.236 2.405 0.884 0.581 0.940 0.675 CB 1.700 84 residues pruned to eliminate duplicates Z: 94 93.648 2.428 1.035 0.713 0.968 0.624 CB 1.675 94 residues pruned to eliminate duplicates Z: 62 61.192 2.398 0.912 0.626 0.902 0.623 CB 1.684 62 residues pruned to eliminate duplicates Z: 35 44.775 2.295 0.978 0.650 0.941 0.529 CB 1.563 35 residues pruned to eliminate duplicates Z: 94 93.536 2.445 1.042 0.709 0.946 0.613 CB 1.698 94 residues pruned to eliminate duplicates Z: 84 97.073 2.491 1.150 0.726 0.952 0.663 CB 1.704 84 residues pruned to eliminate duplicates Z: 22 60.689 2.366 1.451 0.864 1.000 0.381 CB 1.675 22 residues pruned to eliminate duplicates Z: 86 69.838 2.382 0.884 0.647 0.918 0.612 CB 1.604 86 residues pruned to eliminate duplicates Z: 88 95.966 2.478 1.116 0.714 0.943 0.701 CB 1.715 88 residues pruned to eliminate duplicates Z: 104 88.600 2.427 1.086 0.633 0.922 0.631 CB 1.650 104 residues pruned to eliminate duplicates Z: 163 107.792 2.463 0.938 0.656 0.914 0.630 CB 1.680 163 residues pruned to eliminate duplicates Z: 127 98.478 2.463 0.960 0.656 0.929 0.579 CB 1.694 127 residues pruned to eliminate duplicates Z: 87 84.624 2.467 0.978 0.696 0.907 0.674 CB 1.724 87 residues pruned to eliminate duplicates Z: 114 91.865 2.463 0.998 0.664 0.894 0.628 CB 1.689 114 residues pruned to eliminate duplicates Z: 180 111.359 2.448 0.931 0.637 0.916 0.615 CB 1.691 180 residues pruned to eliminate duplicates Z: 32 58.719 2.326 1.002 0.916 0.935 0.645 CB 1.710 32 residues pruned to eliminate duplicates Z: 154 95.924 2.424 0.922 0.596 0.922 0.595 CB 1.648 154 residues pruned to eliminate duplicates Z: 101 87.722 2.460 0.917 0.673 0.930 0.690 CB 1.706 101 residues pruned to eliminate duplicates Z: 102 94.020 2.457 1.022 0.684 0.931 0.634 CB 1.709 102 residues pruned to eliminate duplicates Z: 90 89.095 2.467 1.069 0.686 0.910 0.685 CB 1.713 90 residues pruned to eliminate duplicates Z: 109 86.898 2.423 1.047 0.645 0.889 0.602 CB 1.657 109 residues pruned to eliminate duplicates Z: 105 86.596 2.442 1.027 0.649 0.894 0.606 CB 1.669 105 residues pruned to eliminate duplicates Z: 131 99.594 2.443 0.943 0.645 0.946 0.608 CB 1.700 131 residues pruned to eliminate duplicates Z: 125 102.530 2.472 1.044 0.674 0.919 0.637 CB 1.688 125 residues pruned to eliminate duplicates Z: 86 65.439 2.397 0.734 0.575 0.941 0.682 CB 1.688 86 residues pruned to eliminate duplicates Z: 14 13.610 2.199 0.487 0.354 0.846 0.538 CB 1.597 14 residues pruned to eliminate duplicates Z: 98 94.574 2.470 1.042 0.694 0.928 0.608 CB 1.719 98 residues pruned to eliminate duplicates Z: 62 46.565 2.381 0.653 0.463 0.934 0.574 CB 1.683 62 residues pruned to eliminate duplicates Z: 137 97.856 2.460 0.936 0.611 0.941 0.625 CB 1.685 137 residues pruned to eliminate duplicates Z: 38 41.330 2.338 0.827 0.622 0.892 0.541 CB 1.589 38 residues pruned to eliminate duplicates Z: 180 109.599 2.439 0.892 0.612 0.933 0.609 CB 1.712 180 residues pruned to eliminate duplicates Z: 26 32.380 2.465 0.671 0.582 0.840 0.640 CB 1.730 26 residues pruned to eliminate duplicates Z: 45 43.012 2.299 0.950 0.582 0.909 0.614 CB 1.471 45 residues pruned to eliminate duplicates Z: 12 13.927 2.194 0.632 0.460 0.818 0.545 CA 1.492 12 residues pruned to eliminate duplicates Z: 52 40.606 2.405 0.652 0.474 0.902 0.588 CB 1.629 52 residues pruned to eliminate duplicates Z: 77 68.471 2.446 0.788 0.624 0.921 0.671 CB 1.735 77 residues pruned to eliminate duplicates Z: 27 35.564 2.424 0.755 0.628 0.885 0.654 CB 1.643 27 residues pruned to eliminate duplicates Z: 164 111.926 2.440 0.961 0.656 0.945 0.644 CB 1.678 163 residues pruned to eliminate duplicates Z: 11 26.585 2.355 0.774 0.655 1.000 0.700 CA 1.744 11 residues pruned to eliminate duplicates Z: 50 45.858 2.426 0.765 0.491 0.878 0.571 CB 1.759 50 residues pruned to eliminate duplicates Z: 26 46.300 2.450 1.015 0.630 0.960 0.600 CB 1.730 26 residues pruned to eliminate duplicates Z: 29 29.035 2.223 0.782 0.566 0.857 0.607 CB 1.517 29 residues pruned to eliminate duplicates Z: 49 53.156 2.440 0.810 0.542 0.958 0.646 CB 1.741 49 residues pruned to eliminate duplicates Z: 79 69.835 2.392 0.799 0.616 0.962 0.667 CB 1.712 80 residues pruned to eliminate duplicates Z: 13 35.867 2.505 0.742 0.842 1.000 0.500 CB 1.769 13 residues pruned to eliminate duplicates Z: 77 70.264 2.441 0.770 0.628 0.961 0.697 CB 1.721 77 residues pruned to eliminate duplicates Z: 16 27.945 2.190 0.758 0.771 0.933 0.533 CB 1.580 16 residues pruned to eliminate duplicates Z: 52 44.152 2.340 0.765 0.501 0.902 0.647 CB 1.657 52 residues pruned to eliminate duplicates Z: 68 66.554 2.438 0.767 0.631 0.970 0.687 CB 1.720 68 residues pruned to eliminate duplicates Z: 49 52.147 2.438 0.819 0.529 0.958 0.729 CB 1.722 49 residues pruned to eliminate duplicates Z: 29 35.795 2.369 0.877 0.598 0.821 0.536 CB 1.687 29 residues pruned to eliminate duplicates Z: 38 40.601 2.410 0.772 0.561 0.892 0.514 CB 1.651 38 residues pruned to eliminate duplicates Z: 77 70.552 2.423 0.884 0.634 0.921 0.658 CB 1.697 76 residues pruned to eliminate duplicates Z: 9 12.683 2.064 0.746 0.572 1.000 0.625 CB 1.161 9 residues pruned to eliminate duplicates Z: 53 59.127 2.398 0.812 0.623 0.981 0.673 CB 1.714 54 residues pruned to eliminate duplicates Z: 8 12.767 1.695 0.717 0.833 1.000 0.714 CA 1.244 8 residues pruned to eliminate duplicates Z: 49 45.116 2.370 0.744 0.491 0.938 0.646 CB 1.695 49 residues pruned to eliminate duplicates Z: 54 57.006 2.384 0.763 0.631 0.962 0.698 CB 1.711 54 residues pruned to eliminate duplicates Z: 89 60.932 2.331 0.760 0.554 0.920 0.670 CB 1.632 89 residues pruned to eliminate duplicates Z: 28 32.316 2.371 0.733 0.446 0.963 0.704 CB 1.663 28 residues pruned to eliminate duplicates Z: 26 28.436 2.388 0.728 0.384 0.920 0.640 CB 1.694 26 residues pruned to eliminate duplicates Z: 68 68.816 2.427 0.887 0.627 0.940 0.657 CB 1.733 68 residues pruned to eliminate duplicates Z: 52 56.319 2.409 0.749 0.590 0.980 0.706 CB 1.752 52 residues pruned to eliminate duplicates Z: 56 51.394 2.327 0.734 0.583 0.945 0.582 CB 1.677 56 residues pruned to eliminate duplicates Z: 8 6.715 1.749 0.760 0.369 0.857 0.571 CA 1.107 8 residues pruned to eliminate duplicates Z: 51 50.217 2.407 0.798 0.523 0.940 0.660 CB 1.707 51 residues pruned to eliminate duplicates Z: 42 44.473 2.408 0.760 0.493 0.951 0.732 CB 1.735 42 residues pruned to eliminate duplicates Z: 78 65.113 2.395 0.750 0.615 0.935 0.675 CB 1.698 78 residues pruned to eliminate duplicates Z: 56 53.185 2.377 0.703 0.576 0.945 0.745 CB 1.741 56 residues pruned to eliminate duplicates Z: 56 52.386 2.332 0.779 0.595 0.927 0.709 CB 1.677 56 residues pruned to eliminate duplicates Z: 56 54.515 2.359 0.766 0.591 0.964 0.727 CB 1.679 56 residues pruned to eliminate duplicates Z: 54 55.092 2.410 0.708 0.599 0.962 0.717 CB 1.739 54 residues pruned to eliminate duplicates Z: 53 54.452 2.405 0.736 0.609 0.942 0.673 CB 1.731 53 residues pruned to eliminate duplicates Z: 76 69.072 2.423 0.727 0.619 0.973 0.707 CB 1.750 76 residues pruned to eliminate duplicates Z: 56 58.375 2.379 0.780 0.582 1.000 0.600 CB 1.717 56 residues pruned to eliminate duplicates Z: 56 53.616 2.377 0.693 0.599 0.945 0.655 CB 1.728 56 residues pruned to eliminate duplicates Z: 68 68.404 2.438 0.765 0.634 1.000 0.716 CB 1.712 68 residues pruned to eliminate duplicates Z: 32 48.159 2.384 0.903 0.748 0.968 0.677 CB 1.578 32 residues pruned to eliminate duplicates Z: 24 42.550 2.382 0.649 0.939 0.957 0.870 CB 1.642 24 residues pruned to eliminate duplicates Z: 78 70.236 2.395 0.894 0.617 0.961 0.662 CB 1.644 78 residues pruned to eliminate duplicates Z: 51 55.829 2.414 0.756 0.598 1.000 0.720 CB 1.697 51 residues pruned to eliminate duplicates Z: 30 46.196 2.401 0.734 0.746 1.000 0.621 CB 1.654 30 residues pruned to eliminate duplicates Z: 51 49.712 2.395 0.786 0.560 0.940 0.620 CB 1.650 51 residues pruned to eliminate duplicates Z: 52 56.585 2.397 0.777 0.627 0.961 0.627 CB 1.717 52 residues pruned to eliminate duplicates Z: 77 66.634 2.406 0.779 0.606 0.961 0.566 CB 1.681 77 residues pruned to eliminate duplicates Z: 176 119.298 2.430 0.963 0.657 0.960 0.651 CB 1.703 176 residues pruned to eliminate duplicates Z: 78 69.903 2.430 0.840 0.616 0.948 0.584 CB 1.685 78 residues pruned to eliminate duplicates Z: 84 56.301 2.269 0.757 0.587 0.928 0.554 CB 1.537 84 residues pruned to eliminate duplicates Z: 29 56.554 2.446 0.996 0.780 1.000 0.464 CB 1.710 29 residues pruned to eliminate duplicates Z: 53 58.974 2.379 0.910 0.611 0.962 0.538 CB 1.684 53 residues pruned to eliminate duplicates Z: 32 51.052 2.369 1.042 0.771 0.968 0.548 CB 1.541 32 residues pruned to eliminate duplicates Z: 25 54.738 2.381 1.100 0.914 0.958 0.667 CB 1.649 25 residues pruned to eliminate duplicates Z: 29 57.901 2.455 1.006 0.776 1.000 0.536 CB 1.742 29 residues pruned to eliminate duplicates Z: 25 56.209 2.373 1.138 0.929 0.958 0.667 CB 1.651 25 residues pruned to eliminate duplicates Z: 31 55.444 2.403 1.098 0.730 1.000 0.567 CB 1.632 31 residues pruned to eliminate duplicates Z: 32 51.654 2.385 0.986 0.752 1.000 0.581 CB 1.564 32 residues pruned to eliminate duplicates Z: 24 61.873 2.427 1.368 0.950 0.957 0.435 CB 1.619 26 residues pruned to eliminate duplicates Z: 25 60.895 2.371 1.401 0.908 0.958 0.750 CB 1.618 25 residues pruned to eliminate duplicates Z: 52 56.099 2.366 0.923 0.574 0.961 0.529 CB 1.674 52 residues pruned to eliminate duplicates Z: 76 75.167 2.425 0.934 0.638 0.947 0.640 CB 1.718 76 residues pruned to eliminate duplicates Z: 30 54.848 2.417 1.061 0.772 0.966 0.621 CB 1.664 30 residues pruned to eliminate duplicates Z: 20 17.679 2.094 0.487 0.492 0.947 0.632 CB 1.386 20 residues pruned to eliminate duplicates Z: 19 18.186 2.087 0.447 0.498 0.944 0.611 CB 1.506 19 residues pruned to eliminate duplicates Z: 44 40.049 2.309 0.759 0.558 0.953 0.605 CB 1.491 44 residues pruned to eliminate duplicates Z: 19 18.124 2.140 0.472 0.528 0.944 0.556 CB 1.397 19 residues pruned to eliminate duplicates Z: 19 18.107 2.170 0.538 0.525 0.889 0.611 CB 1.403 19 residues pruned to eliminate duplicates Z: 56 48.025 2.372 0.744 0.552 0.927 0.473 CB 1.606 56 residues pruned to eliminate duplicates Z: 19 18.379 2.062 0.408 0.524 0.944 0.611 CB 1.542 19 residues pruned to eliminate duplicates Z: 20 15.293 2.096 0.337 0.442 0.895 0.579 CB 1.486 20 residues pruned to eliminate duplicates Z: 18 16.348 2.171 0.434 0.501 0.824 0.588 CB 1.545 18 residues pruned to eliminate duplicates Z: 18 16.774 2.183 0.443 0.505 0.824 0.588 CB 1.561 18 residues pruned to eliminate duplicates Z: 20 17.453 2.027 0.497 0.499 0.895 0.632 CB 1.477 18 residues pruned to eliminate duplicates Z: 6 4.537 1.704 0.374 0.376 0.800 0.400 CA 1.237 6 residues pruned to eliminate duplicates Z: 18 15.642 2.190 0.331 0.559 0.882 0.588 CB 1.393 18 residues pruned to eliminate duplicates Z: 21 14.786 2.019 0.244 0.531 0.950 0.600 CB 1.345 21 residues pruned to eliminate duplicates Z: 19 16.668 2.072 0.392 0.487 0.944 0.556 CB 1.460 19 residues pruned to eliminate duplicates Z: 19 13.949 2.147 0.388 0.465 0.833 0.556 CB 1.371 19 residues pruned to eliminate duplicates Z: 25 40.385 2.407 1.001 0.649 0.917 0.417 CB 1.626 25 residues pruned to eliminate duplicates Z: 36 59.257 2.488 1.124 0.629 0.943 0.571 CB 1.781 36 residues pruned to eliminate duplicates Z: 23 48.665 2.499 1.001 0.719 1.000 0.500 CB 1.702 23 residues pruned to eliminate duplicates Z: 39 53.921 2.447 0.899 0.601 0.974 0.684 CB 1.755 39 residues pruned to eliminate duplicates Z: 36 56.624 2.505 1.091 0.623 0.914 0.600 CB 1.779 36 residues pruned to eliminate duplicates Z: 78 64.120 2.390 0.773 0.618 0.909 0.714 CB 1.697 100 residues pruned to eliminate duplicates Z: 8 13.050 1.826 1.012 0.681 0.857 0.571 CA 1.326 8 residues pruned to eliminate duplicates Z: 36 59.755 2.479 1.019 0.644 0.971 0.686 CB 1.816 36 residues pruned to eliminate duplicates Z: 67 55.510 2.336 0.906 0.562 0.894 0.576 CB 1.616 67 residues pruned to eliminate duplicates Z: 67 68.412 2.401 0.902 0.610 0.939 0.712 CB 1.769 67 residues pruned to eliminate duplicates Z: 21 47.403 2.335 1.061 0.852 0.900 0.750 CB 1.810 21 residues pruned to eliminate duplicates Z: 55 46.964 2.381 0.726 0.551 0.926 0.537 CB 1.598 55 residues pruned to eliminate duplicates Z: 35 58.154 2.522 0.901 0.663 0.971 0.735 CB 1.843 35 residues pruned to eliminate duplicates Z: 53 59.033 2.415 0.691 0.674 0.981 0.654 CB 1.742 53 residues pruned to eliminate duplicates Z: 113 59.769 2.275 0.659 0.559 0.902 0.616 CB 1.567 113 residues pruned to eliminate duplicates Z: 36 58.152 2.473 0.960 0.666 0.943 0.686 CB 1.845 36 residues pruned to eliminate duplicates Z: 36 50.407 2.482 0.799 0.626 0.971 0.657 CB 1.744 36 residues pruned to eliminate duplicates Z: 35 64.827 2.537 1.017 0.688 0.971 0.706 CB 1.885 35 residues pruned to eliminate duplicates Z: 67 58.376 2.349 0.901 0.554 0.939 0.591 CB 1.626 67 residues pruned to eliminate duplicates Z: 48 54.257 2.456 0.882 0.582 0.957 0.745 CB 1.653 40 residues pruned to eliminate duplicates Z: 15 44.947 2.406 0.982 0.899 1.000 0.786 CA 1.800 15 residues pruned to eliminate duplicates Z: 66 61.382 2.374 0.808 0.615 0.923 0.631 CB 1.724 66 residues pruned to eliminate duplicates Z: 37 60.449 2.486 1.060 0.648 0.972 0.667 CB 1.763 37 residues pruned to eliminate duplicates Z: 35 60.750 2.513 0.827 0.697 1.000 0.765 CB 1.896 35 residues pruned to eliminate duplicates Z: 45 45.129 2.278 0.803 0.558 0.932 0.568 CB 1.680 45 residues pruned to eliminate duplicates Z: 34 58.772 2.508 0.886 0.675 0.970 0.636 CB 1.899 34 residues pruned to eliminate duplicates Z: 45 42.415 2.330 0.827 0.509 0.909 0.523 CB 1.637 45 residues pruned to eliminate duplicates Z: 12 32.780 2.534 0.974 0.552 1.000 0.636 CB 1.879 12 residues pruned to eliminate duplicates Z: 37 52.822 2.469 0.835 0.632 1.000 0.500 CB 1.717 37 residues pruned to eliminate duplicates Z: 58 54.375 2.357 0.764 0.607 0.930 0.632 CB 1.683 58 residues pruned to eliminate duplicates Z: 13 36.176 2.553 1.018 0.530 1.000 0.417 CB 1.968 13 residues pruned to eliminate duplicates Z: 13 32.593 2.528 0.900 0.542 1.000 0.500 CB 1.881 13 residues pruned to eliminate duplicates Z: 31 40.149 2.360 0.732 0.626 0.933 0.667 CB 1.707 31 residues pruned to eliminate duplicates Z: 86 58.847 2.309 0.701 0.563 0.929 0.671 CB 1.645 86 residues pruned to eliminate duplicates Z: 68 58.784 2.382 0.747 0.581 0.940 0.687 CB 1.698 68 residues pruned to eliminate duplicates Z: 45 38.730 2.285 0.720 0.516 0.886 0.545 CB 1.650 45 residues pruned to eliminate duplicates Z: 86 61.938 2.297 0.855 0.557 0.906 0.565 CB 1.648 86 residues pruned to eliminate duplicates Z: 269 114.515 2.376 0.818 0.579 0.910 0.627 CB 1.648 634 residues pruned to eliminate duplicates Z: 17 29.263 2.182 0.365 0.871 1.000 0.688 CA 1.791 17 residues pruned to eliminate duplicates Z: 31 39.369 2.309 0.751 0.593 0.967 0.733 CB 1.682 31 residues pruned to eliminate duplicates Z: 82 50.970 2.197 0.769 0.549 0.926 0.580 CB 1.500 82 residues pruned to eliminate duplicates Z: 33 32.766 2.234 0.671 0.531 0.906 0.656 CB 1.661 33 residues pruned to eliminate duplicates Z: 65 47.008 2.245 0.744 0.582 0.891 0.719 CB 1.557 65 residues pruned to eliminate duplicates Z: 33 31.055 2.198 0.614 0.572 0.906 0.562 CB 1.593 33 residues pruned to eliminate duplicates Z: 45 40.562 2.297 0.737 0.494 0.955 0.477 CB 1.616 45 residues pruned to eliminate duplicates Z: 108 69.186 2.325 0.803 0.562 0.925 0.589 CB 1.624 108 residues pruned to eliminate duplicates Z: 19 25.240 2.105 0.521 0.734 1.000 0.722 CB 1.505 19 residues pruned to eliminate duplicates Z: 31 32.907 2.248 0.707 0.590 0.900 0.700 CB 1.596 31 residues pruned to eliminate duplicates Z: 44 37.450 2.297 0.767 0.559 0.837 0.558 CB 1.586 44 residues pruned to eliminate duplicates Z: 33 35.174 2.259 0.814 0.590 0.875 0.750 CB 1.591 33 residues pruned to eliminate duplicates Z: 19 29.419 2.211 0.696 0.733 0.889 0.667 CB 1.688 19 residues pruned to eliminate duplicates Z: 32 36.035 2.267 0.779 0.574 0.935 0.677 CB 1.597 32 residues pruned to eliminate duplicates Z: 19 33.500 2.255 0.771 0.715 1.000 0.722 CB 1.627 19 residues pruned to eliminate duplicates Z: 33 32.409 2.196 0.812 0.531 0.906 0.625 CB 1.540 33 residues pruned to eliminate duplicates Z: 45 42.059 2.276 0.876 0.532 0.932 0.432 CB 1.543 45 residues pruned to eliminate duplicates Z: 34 32.538 2.164 0.792 0.567 0.909 0.455 CB 1.505 34 residues pruned to eliminate duplicates Z: 88 55.888 2.296 0.686 0.575 0.943 0.609 CB 1.528 88 residues pruned to eliminate duplicates Z: 13 15.663 2.149 0.907 0.426 0.833 0.417 CB 1.429 13 residues pruned to eliminate duplicates Z: 12 21.324 2.163 1.072 0.451 0.909 0.727 CB 1.658 12 residues pruned to eliminate duplicates Z: 19 13.974 2.017 0.758 0.305 0.944 0.444 CB 1.222 19 residues pruned to eliminate duplicates Z: 16 22.876 2.190 1.123 0.441 0.867 0.667 CB 1.558 16 residues pruned to eliminate duplicates Z: 18 15.686 2.158 0.844 0.313 0.765 0.412 CB 1.538 18 residues pruned to eliminate duplicates Z: 31 32.088 2.196 0.929 0.540 0.833 0.533 CB 1.595 31 residues pruned to eliminate duplicates Z: 41 37.533 2.303 0.904 0.484 0.875 0.375 CB 1.571 41 residues pruned to eliminate duplicates Z: 32 38.384 2.298 0.881 0.602 0.903 0.613 CB 1.602 32 residues pruned to eliminate duplicates Z: 13 18.203 2.255 0.777 0.426 0.833 0.417 CB 1.699 13 residues pruned to eliminate duplicates Z: 46 46.978 2.323 0.806 0.632 0.911 0.644 CB 1.619 46 residues pruned to eliminate duplicates Z: 32 29.145 2.210 0.684 0.531 0.871 0.548 CB 1.567 32 residues pruned to eliminate duplicates Z: 69 46.055 2.226 0.703 0.556 0.926 0.500 CB 1.505 69 residues pruned to eliminate duplicates Z: 53 45.026 2.261 0.737 0.566 0.942 0.673 CB 1.583 53 residues pruned to eliminate duplicates Z: 43 37.885 2.193 0.649 0.576 0.929 0.595 CB 1.619 43 residues pruned to eliminate duplicates Z: 57 43.149 2.242 0.789 0.541 0.875 0.571 CB 1.578 57 residues pruned to eliminate duplicates Z: 42 42.850 2.225 0.747 0.629 0.976 0.659 CB 1.562 42 residues pruned to eliminate duplicates Z: 15 24.333 2.356 0.657 0.734 0.929 0.643 CB 1.455 15 residues pruned to eliminate duplicates Z: 13 32.660 2.433 0.860 0.869 0.917 0.750 CB 1.661 13 residues pruned to eliminate duplicates Z: 100 58.782 2.288 0.705 0.588 0.909 0.576 CB 1.532 95 residues pruned to eliminate duplicates Z: 14 27.869 2.328 0.908 0.897 0.923 0.692 CB 1.349 14 residues pruned to eliminate duplicates Z: 69 50.447 2.356 0.735 0.605 0.897 0.529 CB 1.510 69 residues pruned to eliminate duplicates Z: 43 44.200 2.247 0.811 0.601 0.952 0.690 CB 1.598 43 residues pruned to eliminate duplicates Z: 57 41.572 2.267 0.698 0.522 0.911 0.554 CB 1.551 57 residues pruned to eliminate duplicates Z: 46 34.761 2.191 0.655 0.550 0.911 0.578 CB 1.494 46 residues pruned to eliminate duplicates Z: 59 46.680 2.243 0.819 0.550 0.914 0.569 CB 1.566 59 residues pruned to eliminate duplicates Z: 68 53.587 2.346 0.778 0.604 0.925 0.567 CB 1.536 68 residues pruned to eliminate duplicates Z: 81 63.943 2.388 0.782 0.592 0.963 0.412 CB 1.598 81 residues pruned to eliminate duplicates Z: 37 23.241 2.056 0.582 0.500 0.889 0.611 CB 1.341 37 residues pruned to eliminate duplicates Z: 72 55.018 2.319 0.756 0.553 0.972 0.521 CB 1.567 72 residues pruned to eliminate duplicates Z: 62 44.574 2.252 0.695 0.606 0.967 0.459 CB 1.398 62 residues pruned to eliminate duplicates Z: 34 25.799 2.110 0.578 0.515 0.939 0.545 CB 1.415 34 residues pruned to eliminate duplicates Z: 35 25.170 2.062 0.555 0.511 0.912 0.588 CB 1.460 35 residues pruned to eliminate duplicates Z: 61 46.366 2.246 0.768 0.583 0.950 0.567 CB 1.465 61 residues pruned to eliminate duplicates Z: 36 25.823 2.058 0.508 0.557 0.971 0.600 CB 1.369 36 residues pruned to eliminate duplicates Z: 34 28.908 2.127 0.720 0.545 0.939 0.545 CB 1.401 34 residues pruned to eliminate duplicates Z: 62 34.126 2.119 0.599 0.473 0.902 0.541 CB 1.470 62 residues pruned to eliminate duplicates Z: 36 27.233 2.058 0.665 0.568 0.943 0.657 CB 1.334 36 residues pruned to eliminate duplicates Z: 73 51.990 2.275 0.731 0.574 0.931 0.500 CB 1.558 73 residues pruned to eliminate duplicates Z: 25 26.048 2.153 0.727 0.541 0.917 0.542 CB 1.498 25 residues pruned to eliminate duplicates Z: 37 31.039 2.028 0.792 0.575 0.944 0.611 CB 1.402 37 residues pruned to eliminate duplicates Z: 30 24.346 2.201 0.481 0.473 0.966 0.586 CB 1.475 30 residues pruned to eliminate duplicates Z: 74 48.198 2.286 0.694 0.574 0.890 0.534 CB 1.523 74 residues pruned to eliminate duplicates Z: 87 55.411 2.238 0.639 0.585 0.965 0.558 CB 1.556 87 residues pruned to eliminate duplicates Z: 31 26.069 2.106 0.614 0.497 0.933 0.467 CB 1.504 31 residues pruned to eliminate duplicates Z: 59 43.386 2.299 0.692 0.574 0.931 0.552 CB 1.464 59 residues pruned to eliminate duplicates Z: 37 30.331 2.026 0.754 0.581 0.944 0.528 CB 1.393 37 residues pruned to eliminate duplicates Z: 31 27.890 2.146 0.677 0.523 0.900 0.633 CB 1.538 31 residues pruned to eliminate duplicates Z: 62 40.344 2.238 0.589 0.566 0.951 0.541 CB 1.433 62 residues pruned to eliminate duplicates Z: 61 40.420 2.247 0.638 0.572 0.933 0.517 CB 1.417 61 residues pruned to eliminate duplicates Z: 62 42.793 2.238 0.664 0.597 0.951 0.574 CB 1.411 62 residues pruned to eliminate duplicates Z: 72 54.745 2.271 0.719 0.597 0.986 0.606 CB 1.539 72 residues pruned to eliminate duplicates Z: 37 26.321 2.053 0.526 0.608 0.972 0.528 CB 1.300 37 residues pruned to eliminate duplicates Z: 71 59.348 2.331 0.818 0.614 0.957 0.629 CB 1.570 71 residues pruned to eliminate duplicates Z: 68 70.243 2.437 0.916 0.606 0.955 0.597 CB 1.739 68 residues pruned to eliminate duplicates Z: 63 42.663 2.215 0.655 0.582 0.952 0.597 CB 1.435 63 residues pruned to eliminate duplicates Z: 67 59.569 2.409 0.812 0.573 0.909 0.530 CB 1.722 67 residues pruned to eliminate duplicates Z: 24 47.240 2.538 0.964 0.676 0.913 0.609 CB 1.839 24 residues pruned to eliminate duplicates Z: 62 43.769 2.238 0.701 0.594 0.934 0.574 CB 1.440 62 residues pruned to eliminate duplicates Z: 73 51.815 2.310 0.705 0.580 0.917 0.569 CB 1.566 73 residues pruned to eliminate duplicates Z: 11 20.449 2.459 0.690 0.381 1.000 0.500 CA 1.766 11 residues pruned to eliminate duplicates Z: 62 45.129 2.254 0.623 0.612 0.984 0.672 CB 1.445 62 residues pruned to eliminate duplicates Z: 71 58.417 2.343 0.801 0.605 0.957 0.657 CB 1.564 71 residues pruned to eliminate duplicates Z: 66 54.243 2.389 0.746 0.556 0.954 0.600 CB 1.601 66 residues pruned to eliminate duplicates Z: 24 41.673 2.543 0.745 0.691 0.913 0.652 CB 1.800 24 residues pruned to eliminate duplicates Z: 63 39.796 2.216 0.646 0.591 0.919 0.532 CB 1.382 63 residues pruned to eliminate duplicates Z: 72 48.343 2.298 0.674 0.565 0.915 0.563 CB 1.530 72 residues pruned to eliminate duplicates Z: 72 55.925 2.322 0.797 0.586 0.972 0.620 CB 1.507 72 residues pruned to eliminate duplicates Z: 62 47.899 2.247 0.757 0.614 0.984 0.607 CB 1.418 62 residues pruned to eliminate duplicates Z: 62 38.459 2.214 0.563 0.597 0.934 0.607 CB 1.388 62 residues pruned to eliminate duplicates Z: 67 62.474 2.455 0.861 0.603 0.894 0.636 CB 1.707 67 residues pruned to eliminate duplicates Z: 90 62.452 2.292 0.719 0.634 0.944 0.663 CB 1.570 90 residues pruned to eliminate duplicates Z: 35 60.584 2.576 0.904 0.665 0.941 0.647 CB 1.932 35 residues pruned to eliminate duplicates Z: 75 51.369 2.269 0.731 0.594 0.932 0.554 CB 1.490 75 residues pruned to eliminate duplicates Z: 73 49.624 2.281 0.657 0.605 0.917 0.694 CB 1.528 73 residues pruned to eliminate duplicates Z: 36 53.368 2.513 0.761 0.655 0.943 0.543 CB 1.871 36 residues pruned to eliminate duplicates Z: 71 53.357 2.319 0.715 0.600 0.943 0.600 CB 1.545 71 residues pruned to eliminate duplicates Z: 36 55.866 2.565 0.800 0.664 0.943 0.486 CB 1.863 36 residues pruned to eliminate duplicates Z: 67 66.635 2.470 0.854 0.590 0.924 0.561 CB 1.778 67 residues pruned to eliminate duplicates Z: 104 64.055 2.314 0.701 0.594 0.932 0.660 CB 1.572 104 residues pruned to eliminate duplicates Z: 35 53.302 2.559 0.765 0.648 0.941 0.618 CB 1.873 35 residues pruned to eliminate duplicates Z: 35 57.602 2.552 0.760 0.671 0.971 0.647 CB 1.935 35 residues pruned to eliminate duplicates Z: 35 58.350 2.573 0.898 0.672 0.941 0.706 CB 1.857 35 residues pruned to eliminate duplicates Z: 75 52.352 2.269 0.726 0.594 0.959 0.595 CB 1.481 75 residues pruned to eliminate duplicates Z: 124 66.702 2.285 0.689 0.596 0.959 0.634 CB 1.482 124 residues pruned to eliminate duplicates Z: 74 52.278 2.277 0.649 0.584 0.973 0.658 CB 1.545 74 residues pruned to eliminate duplicates Z: 74 47.449 2.287 0.599 0.582 0.932 0.630 CB 1.507 74 residues pruned to eliminate duplicates Z: 50 52.085 2.373 0.859 0.613 0.857 0.490 CB 1.768 50 residues pruned to eliminate duplicates Z: 64 60.017 2.414 0.809 0.598 0.921 0.651 CB 1.713 64 residues pruned to eliminate duplicates Z: 41 42.611 2.322 0.841 0.521 0.900 0.500 CB 1.714 41 residues pruned to eliminate duplicates Z: 17 39.476 2.299 0.891 0.846 0.938 0.625 CB 1.800 17 residues pruned to eliminate duplicates Z: 34 32.004 2.191 0.847 0.529 0.848 0.545 CB 1.576 34 residues pruned to eliminate duplicates Z: 35 31.187 2.260 0.764 0.567 0.824 0.471 CB 1.527 35 residues pruned to eliminate duplicates Z: 97 63.970 2.293 0.934 0.596 0.906 0.552 CB 1.482 97 residues pruned to eliminate duplicates Z: 18 33.568 2.244 0.733 0.806 1.000 0.588 CA 1.603 18 residues pruned to eliminate duplicates Z: 41 32.883 2.234 0.764 0.486 0.825 0.500 CB 1.621 41 residues pruned to eliminate duplicates Z: 24 31.071 2.126 0.821 0.693 0.913 0.565 CB 1.537 24 residues pruned to eliminate duplicates Z: 46 47.070 2.331 0.914 0.540 0.889 0.489 CB 1.702 46 residues pruned to eliminate duplicates Z: 33 38.604 2.213 0.893 0.582 0.938 0.531 CB 1.606 33 residues pruned to eliminate duplicates Z: 32 40.323 2.315 0.977 0.594 0.903 0.484 CB 1.601 32 residues pruned to eliminate duplicates Z: 98 65.731 2.347 0.727 0.575 0.938 0.619 CB 1.633 98 residues pruned to eliminate duplicates Z: 104 64.989 2.284 0.755 0.577 0.961 0.602 CB 1.543 104 residues pruned to eliminate duplicates Z: 105 60.446 2.282 0.684 0.598 0.933 0.625 CB 1.506 105 residues pruned to eliminate duplicates Z: 7 3.863 1.798 0.250 0.256 0.667 0.333 CB 1.393 7 residues pruned to eliminate duplicates Z: 52 41.052 2.213 0.921 0.557 0.882 0.627 CB 1.450 52 residues pruned to eliminate duplicates Z: 104 68.232 2.317 0.774 0.588 0.951 0.583 CB 1.580 104 residues pruned to eliminate duplicates Z: 32 38.746 2.314 1.005 0.580 0.839 0.548 CB 1.655 32 residues pruned to eliminate duplicates Z: 33 32.840 2.267 1.016 0.505 0.781 0.281 CB 1.618 33 residues pruned to eliminate duplicates Z: 33 37.918 2.289 0.873 0.590 0.875 0.531 CB 1.640 33 residues pruned to eliminate duplicates Z: 37 37.892 2.224 0.875 0.542 0.861 0.556 CB 1.687 37 residues pruned to eliminate duplicates Z: 67 64.637 2.405 0.831 0.599 0.939 0.591 CB 1.750 67 residues pruned to eliminate duplicates Z: 18 19.043 2.283 0.965 0.337 0.824 0.471 CB 1.494 18 residues pruned to eliminate duplicates Z: 105 65.218 2.309 0.745 0.579 0.933 0.548 CB 1.578 105 residues pruned to eliminate duplicates Z: 31 36.424 2.316 0.719 0.613 0.867 0.567 CB 1.732 31 residues pruned to eliminate duplicates Z: 89 76.483 2.375 0.887 0.619 0.966 0.625 CB 1.683 89 residues pruned to eliminate duplicates Z: 104 65.797 2.286 0.785 0.602 0.932 0.621 CB 1.546 104 residues pruned to eliminate duplicates Z: 101 65.290 2.314 0.735 0.574 0.950 0.510 CB 1.594 101 residues pruned to eliminate duplicates Z: 35 37.671 2.268 0.787 0.613 0.912 0.441 CB 1.571 35 residues pruned to eliminate duplicates Z: 33 40.435 2.335 0.814 0.621 0.906 0.531 CB 1.661 33 residues pruned to eliminate duplicates Z: 15 14.090 2.002 0.445 0.496 1.000 0.571 CB 1.306 15 residues pruned to eliminate duplicates Z: 27 28.021 2.175 0.604 0.613 0.923 0.692 CB 1.533 27 residues pruned to eliminate duplicates Z: 14 14.608 1.963 0.623 0.476 1.000 0.462 CB 1.303 Z: 6 4.088 1.383 0.799 0.415 0.800 0.600 CA 1.003 6 residues pruned to eliminate duplicates Z: 47 30.926 2.104 0.700 0.489 0.891 0.543 CB 1.446 61 residues pruned to eliminate duplicates Z: 47 32.206 2.133 0.760 0.490 0.870 0.543 CB 1.470 47 residues pruned to eliminate duplicates Z: 40 32.828 2.244 0.703 0.500 0.897 0.615 CB 1.534 40 residues pruned to eliminate duplicates Z: 59 38.968 2.140 0.662 0.542 0.931 0.569 CB 1.483 59 residues pruned to eliminate duplicates Z: 17 24.984 2.174 0.597 0.704 1.000 0.500 CB 1.494 Z: 13 20.589 2.045 0.649 0.819 1.000 0.417 CB 1.337 13 residues pruned to eliminate duplicates Z: 19 22.843 2.203 0.589 0.575 0.944 0.611 CB 1.515 17 residues pruned to eliminate duplicates Z: 13 24.006 2.162 0.895 0.891 0.917 0.750 CB 1.327 13 residues pruned to eliminate duplicates Z: 19 22.403 2.168 0.661 0.571 0.889 0.722 CB 1.541 19 residues pruned to eliminate duplicates Z: 13 20.553 2.120 0.897 0.811 0.833 0.500 CB 1.350 13 residues pruned to eliminate duplicates Z: 22 15.086 1.963 0.470 0.470 0.857 0.714 CB 1.372 22 residues pruned to eliminate duplicates Z: 21 19.216 2.089 0.558 0.541 0.850 0.600 CB 1.492 21 residues pruned to eliminate duplicates Z: 38 20.660 1.900 0.561 0.508 0.892 0.595 CB 1.274 21 residues pruned to eliminate duplicates Z: 11 26.399 2.350 0.925 0.889 0.900 0.700 CB 1.477 11 residues pruned to eliminate duplicates Z: 20 19.590 2.116 0.589 0.586 0.895 0.632 CB 1.376 20 residues pruned to eliminate duplicates Z: 18 27.682 2.200 0.756 0.620 1.000 0.765 CB 1.551 18 residues pruned to eliminate duplicates Z: 20 19.352 2.082 0.542 0.556 0.842 0.579 CB 1.554 20 residues pruned to eliminate duplicates Z: 22 18.811 2.014 0.568 0.564 0.905 0.524 CB 1.350 22 residues pruned to eliminate duplicates Z: 27 18.991 2.083 0.315 0.588 0.923 0.538 CB 1.354 27 residues pruned to eliminate duplicates Z: 12 6.014 1.745 0.292 0.503 0.818 0.545 CB 0.980 Z: 17 17.407 1.877 0.386 0.795 1.000 0.688 CB 1.292 17 residues pruned to eliminate duplicates Z: 40 25.783 2.031 0.576 0.579 0.923 0.590 CB 1.294 33 residues pruned to eliminate duplicates Z: 16 22.447 1.878 0.546 0.906 1.000 0.733 CB 1.420 16 residues pruned to eliminate duplicates Z: 25 22.529 1.885 0.759 0.668 0.958 0.708 CB 1.239 25 residues pruned to eliminate duplicates Z: 56 29.089 1.941 0.628 0.565 0.964 0.527 CB 1.209 44 residues pruned to eliminate duplicates Z: 14 21.710 1.992 0.518 0.944 1.000 0.846 CB 1.379 14 residues pruned to eliminate duplicates Z: 33 23.339 1.914 0.682 0.572 0.938 0.500 CB 1.275 33 residues pruned to eliminate duplicates Z: 32 21.917 1.965 0.709 0.581 0.903 0.710 CB 1.200 32 residues pruned to eliminate duplicates Z: 24 21.401 1.899 0.793 0.662 0.913 0.696 CB 1.235 24 residues pruned to eliminate duplicates Z: 24 22.285 1.884 0.787 0.650 0.957 0.696 CB 1.255 24 residues pruned to eliminate duplicates Z: 27 25.833 1.994 0.628 0.721 0.962 0.731 CB 1.329 41 residues pruned to eliminate duplicates Z: 14 26.698 2.000 0.820 0.946 1.000 0.769 CB 1.406 14 residues pruned to eliminate duplicates Z: 33 22.557 1.930 0.838 0.563 0.906 0.438 CB 1.167 33 residues pruned to eliminate duplicates Z: 41 26.820 1.983 0.670 0.596 0.925 0.600 CB 1.263 41 residues pruned to eliminate duplicates Z: 35 22.836 1.940 0.667 0.603 0.912 0.647 CB 1.203 35 residues pruned to eliminate duplicates Z: 30 22.657 1.918 0.732 0.586 0.931 0.483 CB 1.252 30 residues pruned to eliminate duplicates Z: 51 31.085 2.010 0.648 0.603 0.940 0.640 CB 1.280 34 residues pruned to eliminate duplicates Z: 7 6.642 1.543 0.618 0.660 1.000 0.333 CB 0.936 7 residues pruned to eliminate duplicates Z: 9 6.281 1.674 0.688 0.315 0.750 0.375 CB 1.286 9 residues pruned to eliminate duplicates Z: 25 24.692 1.886 1.009 0.674 0.958 0.458 CB 1.182 25 residues pruned to eliminate duplicates Z: 24 18.548 1.873 0.845 0.563 0.870 0.261 CB 1.211 24 residues pruned to eliminate duplicates Z: 40 23.726 1.979 0.682 0.582 0.923 0.436 CB 1.143 40 residues pruned to eliminate duplicates Z: 135 61.641 2.286 0.701 0.560 0.873 0.672 CB 1.480 205 residues pruned to eliminate duplicates Z: 15 10.643 2.014 0.752 0.321 0.857 0.357 CB 1.146 Z: 6 3.958 1.871 0.438 0.653 1.000 0.200 CB 0.570 Z: 7 4.355 1.893 0.262 0.287 0.833 0.333 CB 1.135 2 residues pruned to eliminate duplicates Z: 6 7.526 1.969 0.613 0.280 1.000 0.800 CB 1.359 6 residues pruned to eliminate duplicates Z: 6 3.049 1.786 0.474 0.316 0.800 0.800 CB 0.794 4 residues pruned to eliminate duplicates Z: 18 35.927 2.193 1.007 0.811 1.000 0.824 CB 1.510 Z: 18 22.698 2.110 0.647 0.773 0.941 0.765 CB 1.322 18 residues pruned to eliminate duplicates Z: 38 37.711 2.316 0.739 0.607 1.000 0.757 CB 1.390 26 residues pruned to eliminate duplicates Z: 16 24.755 2.240 0.691 0.908 0.933 0.933 CB 1.284 16 residues pruned to eliminate duplicates Z: 40 34.143 2.255 0.786 0.578 0.949 0.641 CB 1.327 40 residues pruned to eliminate duplicates Z: 52 35.924 2.269 0.711 0.537 0.902 0.647 CB 1.385 43 residues pruned to eliminate duplicates Z: 14 20.238 2.251 0.416 0.936 0.923 0.923 CB 1.329 14 residues pruned to eliminate duplicates Z: 37 43.066 2.318 0.867 0.624 1.000 0.639 CB 1.476 52 residues pruned to eliminate duplicates Z: 15 31.871 2.190 1.069 0.924 0.929 0.857 CB 1.422 15 residues pruned to eliminate duplicates Z: 44 40.882 2.289 0.835 0.547 0.930 0.628 CB 1.523 37 residues pruned to eliminate duplicates Z: 16 31.376 2.140 0.867 0.933 1.000 0.800 CB 1.415 16 residues pruned to eliminate duplicates Z: 37 44.639 2.314 0.898 0.626 1.000 0.694 CB 1.504 44 residues pruned to eliminate duplicates Z: 15 32.574 2.274 1.185 0.919 0.929 0.857 CB 1.330 15 residues pruned to eliminate duplicates Z: 38 42.620 2.312 0.904 0.611 0.973 0.676 CB 1.473 38 residues pruned to eliminate duplicates Z: 63 43.903 2.266 0.748 0.564 0.935 0.661 CB 1.414 37 residues pruned to eliminate duplicates Z: 17 33.103 2.109 1.193 0.764 1.000 0.750 CB 1.416 17 residues pruned to eliminate duplicates Z: 56 34.162 2.227 0.758 0.508 0.891 0.636 CB 1.309 56 residues pruned to eliminate duplicates Z: 41 39.163 2.261 0.803 0.579 0.975 0.625 CB 1.445 41 residues pruned to eliminate duplicates Z: 49 38.999 2.263 0.765 0.595 0.958 0.729 CB 1.343 49 residues pruned to eliminate duplicates Z: 10 9.459 1.647 0.713 0.472 0.778 0.444 CA 1.479 10 residues pruned to eliminate duplicates Z: 33 39.617 2.323 0.813 0.682 1.000 0.781 CB 1.407 33 residues pruned to eliminate duplicates Z: 55 39.651 2.263 0.776 0.537 0.944 0.648 CB 1.371 49 residues pruned to eliminate duplicates Z: 8 8.897 1.996 0.921 0.404 0.857 0.571 CB 1.131 8 residues pruned to eliminate duplicates Z: 39 39.722 2.278 0.970 0.586 0.947 0.632 CB 1.395 39 residues pruned to eliminate duplicates Z: 39 38.139 2.277 0.878 0.575 0.947 0.684 CB 1.421 39 residues pruned to eliminate duplicates Z: 81 40.912 2.137 0.744 0.542 0.887 0.562 CB 1.328 70 residues pruned to eliminate duplicates Z: 7 7.831 1.934 0.533 0.505 1.000 0.333 CB 1.072 7 residues pruned to eliminate duplicates Z: 39 36.747 2.279 0.824 0.560 0.947 0.632 CB 1.429 39 residues pruned to eliminate duplicates Z: 137 87.788 2.371 0.771 0.661 0.956 0.669 CB 1.615 64 residues pruned to eliminate duplicates Z: 9 9.448 1.858 0.834 0.351 0.875 0.500 CA 1.316 9 residues pruned to eliminate duplicates Z: 48 40.156 2.248 0.783 0.573 0.957 0.681 CB 1.423 48 residues pruned to eliminate duplicates Z: 49 37.431 2.259 0.802 0.584 0.938 0.688 CB 1.305 49 residues pruned to eliminate duplicates Z: 56 33.557 2.245 0.645 0.513 0.909 0.636 CB 1.331 56 residues pruned to eliminate duplicates Z: 96 58.658 2.319 0.742 0.580 0.916 0.695 CB 1.506 96 residues pruned to eliminate duplicates Z: 53 39.653 2.231 0.866 0.549 0.923 0.615 CB 1.363 53 residues pruned to eliminate duplicates Z: 42 32.385 2.261 0.829 0.573 0.902 0.634 CB 1.262 42 residues pruned to eliminate duplicates Z: 49 35.467 2.257 0.800 0.515 0.896 0.562 CB 1.387 49 residues pruned to eliminate duplicates Z: 18 21.589 2.137 0.461 0.477 1.000 0.824 CB 1.717 18 residues pruned to eliminate duplicates Z: 67 39.793 2.182 0.687 0.490 0.939 0.621 CB 1.432 67 residues pruned to eliminate duplicates Z: 142 80.531 2.331 0.726 0.612 0.929 0.638 CB 1.632 129 residues pruned to eliminate duplicates Z: 6 4.556 1.707 0.166 0.460 1.000 0.200 CB 1.067 6 residues pruned to eliminate duplicates Z: 16 19.840 2.208 0.458 0.507 0.933 0.733 CB 1.693 16 residues pruned to eliminate duplicates Z: 104 79.924 2.352 0.813 0.651 0.932 0.718 CB 1.722 104 residues pruned to eliminate duplicates Z: 47 50.238 2.392 0.818 0.599 0.913 0.739 CB 1.698 47 residues pruned to eliminate duplicates Z: 101 77.215 2.383 0.786 0.651 0.900 0.690 CB 1.752 101 residues pruned to eliminate duplicates Z: 92 84.239 2.407 0.785 0.717 0.945 0.747 CB 1.787 92 residues pruned to eliminate duplicates Z: 89 86.677 2.419 0.850 0.725 0.943 0.727 CB 1.787 89 residues pruned to eliminate duplicates Z: 42 52.400 2.395 0.865 0.637 0.951 0.756 CB 1.693 42 residues pruned to eliminate duplicates Z: 103 73.089 2.368 0.763 0.634 0.902 0.676 CB 1.694 103 residues pruned to eliminate duplicates Z: 103 79.543 2.383 0.794 0.647 0.931 0.696 CB 1.725 103 residues pruned to eliminate duplicates Z: 44 50.910 2.365 0.902 0.647 0.907 0.698 CB 1.660 44 residues pruned to eliminate duplicates Z: 140 90.154 2.349 0.817 0.673 0.957 0.640 CB 1.596 140 residues pruned to eliminate duplicates Z: 87 87.894 2.461 0.830 0.734 0.930 0.721 CB 1.833 87 residues pruned to eliminate duplicates Z: 92 89.081 2.417 0.848 0.738 0.945 0.769 CB 1.788 92 residues pruned to eliminate duplicates Z: 92 89.051 2.411 0.887 0.717 0.945 0.736 CB 1.784 92 residues pruned to eliminate duplicates Z: 102 80.858 2.388 0.765 0.670 0.950 0.683 CB 1.717 102 residues pruned to eliminate duplicates Z: 151 85.357 2.327 0.812 0.638 0.927 0.667 CB 1.566 151 residues pruned to eliminate duplicates Z: 73 87.749 2.470 0.898 0.765 0.958 0.708 CB 1.819 73 residues pruned to eliminate duplicates Z: 88 91.419 2.442 0.869 0.747 0.954 0.759 CB 1.805 88 residues pruned to eliminate duplicates Z: 92 83.105 2.414 0.764 0.717 0.934 0.747 CB 1.799 92 residues pruned to eliminate duplicates Z: 153 82.145 2.328 0.800 0.594 0.914 0.612 CB 1.590 153 residues pruned to eliminate duplicates Z: 100 84.009 2.400 0.813 0.684 0.939 0.737 CB 1.745 100 residues pruned to eliminate duplicates Z: 90 84.870 2.427 0.824 0.714 0.933 0.674 CB 1.795 90 residues pruned to eliminate duplicates Z: 90 90.115 2.426 0.861 0.722 0.966 0.742 CB 1.792 90 residues pruned to eliminate duplicates Z: 44 53.112 2.410 0.837 0.621 0.930 0.721 CB 1.754 44 residues pruned to eliminate duplicates Z: 137 89.507 2.348 0.845 0.659 0.949 0.684 CB 1.612 137 residues pruned to eliminate duplicates Z: 87 73.915 2.397 0.779 0.682 0.942 0.674 CB 1.678 87 residues pruned to eliminate duplicates Z: 97 60.436 2.327 0.833 0.549 0.906 0.604 CB 1.522 97 residues pruned to eliminate duplicates Z: 89 91.491 2.417 0.935 0.738 0.943 0.750 CB 1.785 89 residues pruned to eliminate duplicates Z: 88 73.880 2.404 0.820 0.669 0.908 0.678 CB 1.705 88 residues pruned to eliminate duplicates Z: 76 84.666 2.448 0.895 0.763 0.947 0.707 CB 1.763 76 residues pruned to eliminate duplicates Z: 43 54.519 2.385 0.977 0.642 0.929 0.738 CB 1.684 43 residues pruned to eliminate duplicates Z: 103 78.968 2.382 0.778 0.665 0.922 0.637 CB 1.720 103 residues pruned to eliminate duplicates Z: 103 77.411 2.375 0.813 0.650 0.902 0.569 CB 1.716 103 residues pruned to eliminate duplicates Z: 73 87.961 2.472 1.027 0.772 0.917 0.639 CB 1.775 73 residues pruned to eliminate duplicates Z: 46 52.068 2.310 0.956 0.621 0.933 0.533 CB 1.642 46 residues pruned to eliminate duplicates Z: 90 90.359 2.420 0.908 0.724 0.966 0.652 CB 1.754 90 residues pruned to eliminate duplicates Z: 90 91.771 2.421 0.953 0.719 0.944 0.652 CB 1.788 90 residues pruned to eliminate duplicates Z: 93 61.045 2.275 0.926 0.567 0.935 0.630 CB 1.456 93 residues pruned to eliminate duplicates Z: 88 86.606 2.452 0.881 0.735 0.920 0.644 CB 1.772 88 residues pruned to eliminate duplicates Z: 91 88.284 2.408 0.934 0.718 0.933 0.678 CB 1.759 91 residues pruned to eliminate duplicates Z: 89 93.909 2.428 0.955 0.730 0.955 0.625 CB 1.797 89 residues pruned to eliminate duplicates Z: 91 89.397 2.433 0.903 0.714 0.933 0.756 CB 1.796 91 residues pruned to eliminate duplicates Z: 91 89.541 2.412 0.877 0.716 0.956 0.722 CB 1.794 91 residues pruned to eliminate duplicates Z: 90 87.619 2.398 0.907 0.711 0.955 0.573 CB 1.756 90 residues pruned to eliminate duplicates Z: 46 71.143 2.454 0.755 0.814 1.000 0.689 CB 1.874 46 residues pruned to eliminate duplicates Z: 90 90.551 2.423 0.932 0.728 0.944 0.708 CB 1.770 90 residues pruned to eliminate duplicates Z: 90 88.342 2.386 0.930 0.718 0.966 0.663 CB 1.728 90 residues pruned to eliminate duplicates Z: 61 58.544 2.321 0.722 0.680 0.933 0.583 CB 1.717 61 residues pruned to eliminate duplicates Z: 73 89.042 2.462 0.960 0.780 0.972 0.639 CB 1.747 73 residues pruned to eliminate duplicates Z: 90 89.241 2.401 0.890 0.715 0.966 0.685 CB 1.775 90 residues pruned to eliminate duplicates Z: 89 88.189 2.426 0.881 0.730 0.943 0.727 CB 1.775 89 residues pruned to eliminate duplicates Z: 90 89.685 2.406 0.906 0.718 0.955 0.685 CB 1.782 90 residues pruned to eliminate duplicates Z: 93 86.056 2.401 0.833 0.704 0.946 0.674 CB 1.791 93 residues pruned to eliminate duplicates Z: 89 93.250 2.427 0.986 0.728 0.943 0.648 CB 1.780 89 residues pruned to eliminate duplicates Z: 73 94.250 2.443 1.027 0.783 0.986 0.653 CB 1.774 73 residues pruned to eliminate duplicates Z: 90 95.107 2.428 0.956 0.724 0.966 0.685 CB 1.795 90 residues pruned to eliminate duplicates Z: 90 90.650 2.424 0.903 0.718 0.955 0.629 CB 1.791 90 residues pruned to eliminate duplicates Z: 101 81.118 2.370 0.807 0.684 0.940 0.670 CB 1.702 101 residues pruned to eliminate duplicates Z: 90 88.608 2.428 0.886 0.729 0.944 0.719 CB 1.768 90 residues pruned to eliminate duplicates Z: 87 91.820 2.443 0.987 0.738 0.942 0.709 CB 1.748 87 residues pruned to eliminate duplicates Z: 89 93.294 2.439 0.934 0.722 0.966 0.636 CB 1.787 89 residues pruned to eliminate duplicates Z: 90 89.284 2.420 0.900 0.718 0.933 0.697 CB 1.812 90 residues pruned to eliminate duplicates Z: 102 78.131 2.393 0.771 0.672 0.931 0.663 CB 1.682 102 residues pruned to eliminate duplicates Z: 103 81.203 2.377 0.814 0.666 0.931 0.657 CB 1.717 103 residues pruned to eliminate duplicates Z: 100 81.838 2.395 0.803 0.674 0.939 0.707 CB 1.728 100 residues pruned to eliminate duplicates Z: 46 72.272 2.464 0.758 0.830 1.000 0.822 CB 1.871 46 residues pruned to eliminate duplicates Z: 73 91.802 2.479 0.897 0.776 0.986 0.764 CB 1.828 73 residues pruned to eliminate duplicates Z: 92 86.197 2.406 0.828 0.720 0.945 0.736 CB 1.782 92 residues pruned to eliminate duplicates Z: 136 77.124 2.356 0.717 0.606 0.919 0.674 CB 1.615 136 residues pruned to eliminate duplicates Z: 137 89.931 2.352 0.836 0.653 0.956 0.640 CB 1.621 137 residues pruned to eliminate duplicates Z: 104 80.568 2.382 0.799 0.660 0.932 0.709 CB 1.713 104 residues pruned to eliminate duplicates Z: 153 84.519 2.338 0.728 0.605 0.941 0.645 CB 1.632 153 residues pruned to eliminate duplicates Z: 48 68.062 2.445 0.743 0.803 0.957 0.766 CB 1.867 48 residues pruned to eliminate duplicates Z: 89 87.128 2.432 0.885 0.713 0.932 0.705 CB 1.793 89 residues pruned to eliminate duplicates Z: 73 93.146 2.482 0.962 0.777 0.972 0.694 CB 1.816 73 residues pruned to eliminate duplicates Z: 89 88.910 2.431 0.855 0.725 0.955 0.716 CB 1.797 89 residues pruned to eliminate duplicates Z: 88 91.087 2.445 0.900 0.732 0.966 0.667 CB 1.768 88 residues pruned to eliminate duplicates Z: 90 92.217 2.427 0.939 0.734 0.944 0.674 CB 1.783 90 residues pruned to eliminate duplicates Z: 91 91.303 2.416 0.949 0.713 0.956 0.556 CB 1.764 91 residues pruned to eliminate duplicates Z: 73 91.942 2.484 0.966 0.774 0.958 0.681 CB 1.818 73 residues pruned to eliminate duplicates Z: 76 87.263 2.438 0.964 0.742 0.960 0.587 CB 1.765 76 residues pruned to eliminate duplicates Z: 73 95.076 2.482 1.023 0.775 0.972 0.653 CB 1.800 73 residues pruned to eliminate duplicates Z: 73 96.261 2.475 1.054 0.773 0.972 0.625 CB 1.803 73 residues pruned to eliminate duplicates Z: 88 93.652 2.443 0.994 0.733 0.954 0.575 CB 1.753 88 residues pruned to eliminate duplicates Z: 74 91.423 2.465 0.994 0.761 0.959 0.616 CB 1.801 74 residues pruned to eliminate duplicates Z: 73 89.685 2.469 1.033 0.771 0.944 0.639 CB 1.754 73 residues pruned to eliminate duplicates Z: 99 86.992 2.395 0.931 0.676 0.929 0.633 CB 1.741 99 residues pruned to eliminate duplicates Z: 68 49.920 2.270 0.670 0.616 0.881 0.522 CB 1.636 68 residues pruned to eliminate duplicates Z: 104 68.650 2.312 0.754 0.606 0.942 0.602 CB 1.601 104 residues pruned to eliminate duplicates Z: 8 6.285 2.133 0.320 0.289 0.714 0.429 CB 1.497 8 residues pruned to eliminate duplicates Z: 12 5.444 2.066 0.205 0.278 0.636 0.364 CB 1.332 12 residues pruned to eliminate duplicates Z: 12 4.668 2.167 0.248 0.178 0.636 0.455 CB 1.206 12 residues pruned to eliminate duplicates Z: 172 87.280 2.324 0.746 0.628 0.906 0.626 CB 1.609 172 residues pruned to eliminate duplicates Z: 153 86.739 2.332 0.853 0.603 0.934 0.586 CB 1.580 153 residues pruned to eliminate duplicates Z: 89 74.891 2.395 0.841 0.673 0.909 0.625 CB 1.699 89 residues pruned to eliminate duplicates Z: 67 53.861 2.283 0.741 0.634 0.924 0.500 CB 1.591 67 residues pruned to eliminate duplicates Z: 153 83.572 2.331 0.805 0.609 0.901 0.625 CB 1.613 153 residues pruned to eliminate duplicates Z: 149 83.800 2.332 0.798 0.637 0.926 0.642 CB 1.560 149 residues pruned to eliminate duplicates Z: 153 85.039 2.321 0.768 0.615 0.914 0.618 CB 1.648 153 residues pruned to eliminate duplicates Z: 104 85.754 2.374 0.923 0.655 0.942 0.573 CB 1.702 104 residues pruned to eliminate duplicates Z: 11 14.278 2.159 0.685 0.504 0.900 0.400 CB 1.373 11 residues pruned to eliminate duplicates Z: 61 28.249 2.194 0.475 0.418 0.883 0.550 CB 1.390 61 residues pruned to eliminate duplicates Z: 50 34.614 2.278 0.563 0.509 0.918 0.673 CB 1.499 50 residues pruned to eliminate duplicates Z: 72 48.226 2.253 0.678 0.595 0.915 0.676 CB 1.510 72 residues pruned to eliminate duplicates Z: 72 46.151 2.236 0.613 0.602 0.930 0.648 CB 1.483 72 residues pruned to eliminate duplicates Z: 153 85.923 2.324 0.796 0.608 0.921 0.599 CB 1.637 153 residues pruned to eliminate duplicates Z: 10 13.391 2.149 0.796 0.570 0.778 0.556 CB 1.390 10 residues pruned to eliminate duplicates Z: 27 30.316 2.201 0.726 0.611 0.962 0.654 CB 1.466 27 residues pruned to eliminate duplicates Z: 28 26.194 2.207 0.716 0.610 0.852 0.630 CB 1.408 28 residues pruned to eliminate duplicates Z: 51 36.920 2.225 0.759 0.520 0.920 0.640 CB 1.422 51 residues pruned to eliminate duplicates Z: 49 35.420 2.277 0.606 0.522 0.938 0.729 CB 1.459 49 residues pruned to eliminate duplicates Z: 50 37.287 2.263 0.712 0.527 0.898 0.592 CB 1.491 50 residues pruned to eliminate duplicates Z: 41 34.565 2.276 0.687 0.492 0.950 0.725 CB 1.511 41 residues pruned to eliminate duplicates Z: 51 36.207 2.275 0.670 0.518 0.920 0.640 CB 1.439 51 residues pruned to eliminate duplicates Z: 51 37.730 2.263 0.692 0.511 0.920 0.620 CB 1.498 51 residues pruned to eliminate duplicates Z: 76 49.970 2.215 0.717 0.603 0.947 0.720 CB 1.454 76 residues pruned to eliminate duplicates Z: 44 28.330 2.180 0.550 0.454 0.907 0.674 CB 1.478 44 residues pruned to eliminate duplicates Z: 50 35.339 2.258 0.581 0.532 0.918 0.714 CB 1.493 50 residues pruned to eliminate duplicates Z: 49 37.247 2.260 0.676 0.528 0.917 0.729 CB 1.507 49 residues pruned to eliminate duplicates Z: 49 40.584 2.259 0.752 0.556 0.938 0.667 CB 1.495 49 residues pruned to eliminate duplicates Z: 52 37.911 2.232 0.692 0.516 0.941 0.647 CB 1.470 52 residues pruned to eliminate duplicates Z: 133 71.998 2.293 0.662 0.645 0.902 0.720 CB 1.592 133 residues pruned to eliminate duplicates Z: 72 48.122 2.255 0.708 0.640 0.887 0.746 CB 1.466 72 residues pruned to eliminate duplicates Z: 40 31.517 2.222 0.716 0.552 0.897 0.615 CB 1.402 40 residues pruned to eliminate duplicates Z: 72 49.226 2.255 0.644 0.648 0.944 0.718 CB 1.455 72 residues pruned to eliminate duplicates Z: 47 29.855 2.213 0.526 0.493 0.891 0.587 CB 1.473 47 residues pruned to eliminate duplicates Z: 49 37.944 2.278 0.681 0.563 0.938 0.708 CB 1.436 49 residues pruned to eliminate duplicates Z: 25 20.888 2.289 0.585 0.379 0.917 0.667 CB 1.458 25 residues pruned to eliminate duplicates Z: 49 38.219 2.272 0.686 0.545 0.917 0.729 CB 1.504 49 residues pruned to eliminate duplicates Z: 50 34.421 2.191 0.597 0.537 0.939 0.714 CB 1.444 50 residues pruned to eliminate duplicates Z: 76 48.464 2.199 0.668 0.616 0.960 0.733 CB 1.423 76 residues pruned to eliminate duplicates Z: 28 24.914 2.270 0.565 0.401 0.963 0.741 CB 1.556 28 residues pruned to eliminate duplicates Z: 37 30.298 2.189 0.663 0.592 0.917 0.639 CB 1.386 37 residues pruned to eliminate duplicates Z: 50 37.404 2.244 0.713 0.535 0.939 0.673 CB 1.430 50 residues pruned to eliminate duplicates Z: 49 38.930 2.272 0.724 0.556 0.917 0.708 CB 1.481 49 residues pruned to eliminate duplicates Z: 49 30.982 2.199 0.622 0.493 0.875 0.625 CB 1.443 49 residues pruned to eliminate duplicates Z: 50 37.927 2.267 0.643 0.534 0.918 0.633 CB 1.532 50 residues pruned to eliminate duplicates Z: 26 20.363 2.185 0.522 0.400 0.880 0.640 CB 1.548 26 residues pruned to eliminate duplicates Z: 73 49.386 2.214 0.774 0.647 0.903 0.778 CB 1.431 73 residues pruned to eliminate duplicates Z: 50 38.237 2.204 0.656 0.533 0.959 0.694 CB 1.511 50 residues pruned to eliminate duplicates Z: 29 23.399 2.231 0.570 0.384 0.964 0.643 CB 1.482 29 residues pruned to eliminate duplicates Z: 63 49.030 2.245 0.714 0.655 0.968 0.806 CB 1.448 63 residues pruned to eliminate duplicates Z: 26 22.380 2.243 0.594 0.421 0.960 0.800 CB 1.416 26 residues pruned to eliminate duplicates Z: 40 35.870 2.283 0.705 0.561 0.923 0.641 CB 1.508 40 residues pruned to eliminate duplicates Z: 75 48.416 2.206 0.658 0.639 0.946 0.730 CB 1.429 75 residues pruned to eliminate duplicates Z: 70 50.881 2.249 0.782 0.640 0.913 0.667 CB 1.468 70 residues pruned to eliminate duplicates Z: 76 46.812 2.219 0.630 0.622 0.933 0.693 CB 1.428 76 residues pruned to eliminate duplicates Z: 72 50.799 2.257 0.675 0.650 0.944 0.718 CB 1.469 72 residues pruned to eliminate duplicates Z: 74 52.008 2.248 0.734 0.632 0.932 0.630 CB 1.481 74 residues pruned to eliminate duplicates Z: 39 41.455 2.199 0.705 0.689 1.000 0.737 CB 1.508 39 residues pruned to eliminate duplicates Z: 49 42.247 2.251 0.609 0.666 0.979 0.729 CB 1.475 49 residues pruned to eliminate duplicates Z: 23 36.912 2.214 0.772 0.853 1.000 0.773 CB 1.483 23 residues pruned to eliminate duplicates Z: 26 36.102 2.140 0.819 0.825 1.000 0.720 CB 1.400 26 residues pruned to eliminate duplicates Z: 74 51.695 2.241 0.727 0.649 0.945 0.699 CB 1.440 74 residues pruned to eliminate duplicates Z: 73 50.534 2.229 0.762 0.645 0.931 0.736 CB 1.424 73 residues pruned to eliminate duplicates Z: 22 42.713 2.228 0.889 0.892 1.000 0.667 CB 1.591 22 residues pruned to eliminate duplicates Z: 51 40.317 2.214 0.663 0.604 0.980 0.680 CB 1.431 51 residues pruned to eliminate duplicates Z: 25 37.864 2.191 0.784 0.860 1.000 0.667 CB 1.454 25 residues pruned to eliminate duplicates Z: 25 33.090 2.188 0.699 0.842 0.875 0.583 CB 1.547 25 residues pruned to eliminate duplicates Z: 67 51.086 2.213 0.767 0.656 0.955 0.667 CB 1.458 67 residues pruned to eliminate duplicates Z: 22 46.056 2.247 1.076 0.902 1.000 0.476 CB 1.537 22 residues pruned to eliminate duplicates Z: 25 39.105 2.159 1.101 0.825 0.958 0.750 CB 1.385 22 residues pruned to eliminate duplicates Z: 21 35.600 2.167 1.049 0.931 0.900 0.550 CB 1.393 21 residues pruned to eliminate duplicates Z: 25 39.399 2.185 0.977 0.821 0.958 0.583 CB 1.471 25 residues pruned to eliminate duplicates Z: 74 51.356 2.201 0.815 0.622 0.945 0.616 CB 1.419 76 residues pruned to eliminate duplicates Z: 23 41.527 2.191 1.158 0.925 0.955 0.500 CB 1.377 22 residues pruned to eliminate duplicates Z: 23 43.163 2.191 1.134 0.935 0.955 0.500 CB 1.437 23 residues pruned to eliminate duplicates Z: 24 40.184 2.129 1.180 0.913 0.913 0.478 CB 1.399 24 residues pruned to eliminate duplicates Z: 30 38.814 2.154 0.978 0.745 0.966 0.483 CB 1.407 28 residues pruned to eliminate duplicates Z: 23 34.548 2.142 1.024 0.908 0.909 0.500 CB 1.327 23 residues pruned to eliminate duplicates Z: 26 32.235 2.124 0.835 0.819 0.920 0.440 CB 1.363 26 residues pruned to eliminate duplicates Z: 76 54.755 2.233 0.794 0.651 0.947 0.693 CB 1.449 76 residues pruned to eliminate duplicates Z: 27 37.212 2.115 1.010 0.805 0.923 0.654 CB 1.425 27 residues pruned to eliminate duplicates 8 1.791 1.210 0.288 0.254 0.857 0.286 CB 0.672 ? 630 residues left after pruning, divided into chains as follows: A: 8 B: 17 C: 348 D: 257 CC for partial structure against native data = 36.57 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.575, Connect. = 0.782 for dens.mod. cycle 1 = 0.300, Contrast = 0.654, Connect. = 0.805 for dens.mod. cycle 2 = 0.300, Contrast = 0.780, Connect. = 0.830 for dens.mod. cycle 3 = 0.300, Contrast = 0.791, Connect. = 0.831 for dens.mod. cycle 4 = 0.300, Contrast = 0.805, Connect. = 0.833 for dens.mod. cycle 5 = 0.300, Contrast = 0.809, Connect. = 0.835 for dens.mod. cycle 6 = 0.300, Contrast = 0.815, Connect. = 0.836 for dens.mod. cycle 7 = 0.300, Contrast = 0.816, Connect. = 0.837 for dens.mod. cycle 8 = 0.300, Contrast = 0.818, Connect. = 0.838 for dens.mod. cycle 9 = 0.300, Contrast = 0.818, Connect. = 0.838 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4253 peaks > 0.5 sigma used to seed fragment search Space for about 1184 unique residues taking solvent into account 990 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 19 46.424 2.263 0.995 0.896 0.944 0.722 CB 1.839 B: 16 46.672 2.356 1.033 0.910 1.000 0.933 CA 1.785 C: 18 42.223 2.266 0.762 0.911 1.000 1.000 CA 1.818 18 residues pruned to eliminate duplicates D: 16 41.224 2.492 0.970 0.902 0.867 0.733 CB 1.785 E: 23 56.035 2.436 0.967 0.846 1.000 0.909 CA 1.853 16 residues pruned to eliminate duplicates F: 30 55.628 2.396 0.663 0.930 0.966 0.828 CB 1.878 G: 15 35.251 2.319 0.560 0.889 1.000 1.000 CB 1.875 H: 16 53.792 2.540 1.082 0.890 1.000 0.733 CB 1.889 16 residues pruned to eliminate duplicates I: 24 50.250 2.467 0.847 0.951 0.957 0.826 CB 1.657 J: 17 50.862 2.390 1.021 0.944 1.000 0.812 CB 1.824 K: 13 39.467 2.483 0.769 0.917 1.000 0.833 CA 1.830 L: 17 28.713 2.244 0.407 0.883 0.938 0.625 CB 1.753 15 residues pruned to eliminate duplicates M: 18 51.997 2.374 0.963 0.941 1.000 0.824 CB 1.877 17 residues pruned to eliminate duplicates N: 24 52.793 2.454 1.083 0.945 0.957 0.565 CB 1.558 24 residues pruned to eliminate duplicates O: 26 43.397 2.338 0.713 0.873 0.960 0.680 CB 1.644 26 residues pruned to eliminate duplicates P: 16 30.596 2.302 0.409 0.869 1.000 0.867 CB 1.780 16 residues pruned to eliminate duplicates Q: 27 53.883 2.431 0.683 0.920 0.962 0.769 CA 1.892 27 residues pruned to eliminate duplicates R: 31 63.601 2.404 0.919 0.933 1.000 0.767 CB 1.757 30 residues pruned to eliminate duplicates S: 33 43.978 2.229 0.460 0.888 1.000 0.781 CB 1.720 T: 25 47.680 2.373 0.962 0.911 0.917 0.625 CB 1.616 25 residues pruned to eliminate duplicates U: 76 69.695 2.471 0.778 0.617 0.933 0.733 CB 1.757 26 residues pruned to eliminate duplicates V: 21 49.652 2.359 0.919 0.871 0.950 0.750 CB 1.884 21 residues pruned to eliminate duplicates W: 29 55.847 2.393 0.738 0.892 0.964 0.679 CB 1.891 29 residues pruned to eliminate duplicates X: 17 44.826 2.336 1.204 0.877 0.938 0.750 CB 1.687 17 residues pruned to eliminate duplicates Y: 23 50.411 2.401 0.862 0.879 0.955 0.773 CB 1.826 23 residues pruned to eliminate duplicates Z: 17 44.882 2.339 0.972 0.919 1.000 0.938 CB 1.715 17 residues pruned to eliminate duplicates Z: 35 19.745 2.026 0.586 0.502 0.853 0.441 CB 1.233 Z: 15 51.037 2.555 0.889 0.939 1.000 1.000 CB 1.963 18 residues pruned to eliminate duplicates Z: 18 34.609 2.405 0.608 0.835 0.941 0.706 CB 1.727 Z: 22 50.452 2.326 1.010 0.827 1.000 0.714 CB 1.775 22 residues pruned to eliminate duplicates Z: 14 29.808 2.438 0.508 0.855 0.923 0.846 CA 1.799 14 residues pruned to eliminate duplicates Z: 14 26.058 2.250 0.342 0.930 1.000 0.769 CB 1.674 Z: 16 45.940 2.436 1.052 0.889 0.933 0.800 CB 1.831 16 residues pruned to eliminate duplicates Z: 24 58.617 2.459 1.058 0.939 1.000 0.652 CB 1.679 24 residues pruned to eliminate duplicates Z: 27 56.885 2.312 0.955 0.909 0.962 0.846 CB 1.822 33 residues pruned to eliminate duplicates Z: 16 34.605 2.318 0.759 0.896 0.933 0.733 CB 1.682 13 residues pruned to eliminate duplicates Z: 33 51.439 2.232 0.742 0.858 0.969 0.656 CB 1.778 28 residues pruned to eliminate duplicates Z: 32 69.049 2.401 0.979 0.912 1.000 0.710 CB 1.848 31 residues pruned to eliminate duplicates Z: 18 49.181 2.355 1.013 0.897 1.000 0.824 CA 1.801 18 residues pruned to eliminate duplicates Z: 22 46.196 2.357 0.896 0.863 0.952 0.619 CB 1.738 18 residues pruned to eliminate duplicates Z: 48 48.952 2.330 0.852 0.588 0.936 0.660 CB 1.624 16 residues pruned to eliminate duplicates Z: 17 26.189 2.235 0.331 0.862 1.000 0.875 CB 1.615 17 residues pruned to eliminate duplicates Z: 30 71.484 2.455 0.992 0.918 1.000 0.828 CB 1.914 32 residues pruned to eliminate duplicates Z: 18 36.984 2.322 0.570 0.937 1.000 0.824 CB 1.713 18 residues pruned to eliminate duplicates Z: 25 34.443 2.057 0.787 0.892 0.958 0.833 CB 1.434 Z: 21 40.174 2.451 0.846 0.822 0.900 0.550 CB 1.670 21 residues pruned to eliminate duplicates Z: 12 22.980 2.304 0.307 0.902 1.000 0.818 CB 1.641 Z: 31 45.886 2.290 0.404 0.917 1.000 0.833 CB 1.839 31 residues pruned to eliminate duplicates Z: 15 36.421 2.524 0.464 0.938 1.000 1.000 CB 1.832 15 residues pruned to eliminate duplicates Z: 16 53.454 2.555 1.211 0.867 1.000 0.667 CB 1.787 19 residues pruned to eliminate duplicates Z: 30 56.400 2.417 0.692 0.926 0.966 0.862 CB 1.859 30 residues pruned to eliminate duplicates Z: 30 62.573 2.409 1.012 0.923 0.966 0.690 CB 1.745 30 residues pruned to eliminate duplicates Z: 15 28.128 2.338 0.448 0.855 0.929 0.714 CB 1.765 15 residues pruned to eliminate duplicates Z: 17 40.177 2.315 1.090 0.873 0.938 0.812 CB 1.614 17 residues pruned to eliminate duplicates Z: 17 46.628 2.375 1.014 0.899 0.938 0.750 CB 1.857 17 residues pruned to eliminate duplicates Z: 15 37.659 2.498 0.780 0.898 0.929 0.857 CB 1.743 15 residues pruned to eliminate duplicates Z: 31 75.046 2.412 1.162 0.928 1.000 0.667 CB 1.839 30 residues pruned to eliminate duplicates Z: 16 51.939 2.536 0.947 0.944 1.000 0.867 CB 1.882 16 residues pruned to eliminate duplicates Z: 23 53.177 2.461 0.885 0.832 1.000 0.864 CA 1.835 23 residues pruned to eliminate duplicates Z: 15 45.746 2.513 0.851 0.916 1.000 0.714 CB 1.856 15 residues pruned to eliminate duplicates Z: 7 7.874 1.713 0.476 0.753 0.833 0.667 CB 1.218 Z: 18 42.218 2.215 1.059 0.848 0.941 0.824 CB 1.770 18 residues pruned to eliminate duplicates Z: 26 42.750 2.302 0.813 0.863 0.880 0.680 CB 1.708 26 residues pruned to eliminate duplicates Z: 17 26.217 2.172 0.377 0.895 1.000 0.812 CB 1.571 17 residues pruned to eliminate duplicates Z: 31 54.725 2.307 0.711 0.913 1.000 0.800 CB 1.791 31 residues pruned to eliminate duplicates Z: 18 40.347 2.421 0.782 0.886 0.941 0.882 CB 1.738 18 residues pruned to eliminate duplicates Z: 21 40.619 2.307 0.905 0.826 0.850 0.750 CB 1.834 21 residues pruned to eliminate duplicates Z: 16 15.577 2.126 0.410 0.518 0.933 0.467 CB 1.413 Z: 16 42.365 2.457 0.934 0.911 0.933 0.933 CB 1.748 16 residues pruned to eliminate duplicates Z: 18 29.807 2.200 0.481 0.876 1.000 0.824 CA 1.613 12 residues pruned to eliminate duplicates Z: 70 43.538 2.268 0.687 0.532 0.913 0.609 CB 1.455 19 residues pruned to eliminate duplicates Z: 49 36.462 2.277 0.607 0.575 0.938 0.646 CB 1.427 49 residues pruned to eliminate duplicates Z: 111 62.230 2.274 0.736 0.572 0.927 0.591 CB 1.512 75 residues pruned to eliminate duplicates Z: 17 33.809 2.325 0.601 0.910 0.938 0.938 CB 1.718 17 residues pruned to eliminate duplicates Z: 73 92.231 2.515 0.883 0.773 0.972 0.764 CB 1.855 72 residues pruned to eliminate duplicates Z: 13 29.404 2.530 0.528 0.861 0.917 0.750 CB 1.759 13 residues pruned to eliminate duplicates Z: 18 45.841 2.299 0.912 0.901 1.000 0.882 CB 1.806 15 residues pruned to eliminate duplicates Z: 6 15.272 2.369 0.861 0.675 0.800 0.400 CA 1.648 Z: 7 15.783 2.075 0.499 0.825 1.000 0.833 CB 1.563 7 residues pruned to eliminate duplicates Z: 29 61.783 2.391 0.968 0.926 0.964 0.786 CB 1.805 29 residues pruned to eliminate duplicates Z: 90 89.574 2.474 0.761 0.725 0.966 0.787 CB 1.840 90 residues pruned to eliminate duplicates Z: 16 30.961 2.287 0.755 0.852 0.867 0.733 CA 1.699 16 residues pruned to eliminate duplicates Z: 18 39.378 2.242 1.039 0.848 0.941 0.588 CB 1.646 18 residues pruned to eliminate duplicates Z: 30 48.218 2.360 0.838 0.781 0.966 0.759 CB 1.669 30 residues pruned to eliminate duplicates Z: 17 42.354 2.391 0.772 0.902 1.000 0.812 CA 1.782 17 residues pruned to eliminate duplicates Z: 15 39.653 2.545 0.716 0.885 1.000 0.857 CB 1.753 15 residues pruned to eliminate duplicates Z: 76 70.734 2.475 0.817 0.611 0.960 0.747 CB 1.703 76 residues pruned to eliminate duplicates Z: 24 36.676 2.094 0.778 0.904 1.000 0.957 CB 1.463 25 residues pruned to eliminate duplicates Z: 15 39.772 2.522 0.732 0.900 1.000 0.857 CB 1.738 15 residues pruned to eliminate duplicates Z: 17 44.197 2.354 0.831 0.921 1.000 0.875 CB 1.804 17 residues pruned to eliminate duplicates Z: 14 31.155 2.379 0.753 0.838 0.923 0.692 CB 1.678 14 residues pruned to eliminate duplicates Z: 32 50.300 2.301 0.558 0.906 1.000 0.806 CB 1.792 32 residues pruned to eliminate duplicates Z: 7 13.298 2.128 0.248 0.853 1.000 0.833 CA 1.511 7 residues pruned to eliminate duplicates Z: 26 46.636 2.323 0.914 0.886 0.920 0.600 CB 1.646 26 residues pruned to eliminate duplicates Z: 17 45.513 2.276 1.321 0.868 0.938 0.812 CB 1.679 17 residues pruned to eliminate duplicates Z: 16 31.441 2.307 0.532 0.866 1.000 0.667 CB 1.682 16 residues pruned to eliminate duplicates Z: 180 104.522 2.442 0.806 0.638 0.911 0.665 CB 1.710 160 residues pruned to eliminate duplicates Z: 21 13.724 1.846 0.351 0.538 0.900 0.600 CB 1.317 16 residues pruned to eliminate duplicates Z: 17 41.364 2.353 1.076 0.901 0.875 0.688 CB 1.727 17 residues pruned to eliminate duplicates Z: 89 91.634 2.468 0.810 0.721 0.955 0.761 CB 1.876 89 residues pruned to eliminate duplicates Z: 49 37.957 2.283 0.658 0.539 0.917 0.688 CB 1.520 Z: 31 51.754 2.324 0.553 0.903 1.000 0.933 CB 1.866 31 residues pruned to eliminate duplicates Z: 31 47.470 2.314 0.473 0.883 1.000 0.833 CB 1.839 31 residues pruned to eliminate duplicates Z: 25 17.602 2.252 0.284 0.397 0.875 0.625 CB 1.583 25 residues pruned to eliminate duplicates Z: 16 36.137 2.371 0.744 0.900 0.933 0.733 CB 1.727 16 residues pruned to eliminate duplicates Z: 22 32.192 2.102 0.683 0.903 0.952 0.810 CA 1.487 22 residues pruned to eliminate duplicates Z: 17 29.035 2.178 0.733 0.842 0.875 0.688 CB 1.638 17 residues pruned to eliminate duplicates Z: 15 27.719 2.353 0.530 0.859 0.857 0.714 CB 1.767 15 residues pruned to eliminate duplicates Z: 26 43.741 2.314 0.659 0.885 0.960 0.920 CB 1.713 26 residues pruned to eliminate duplicates Z: 70 51.606 2.284 0.681 0.639 0.942 0.710 CB 1.508 70 residues pruned to eliminate duplicates Z: 31 65.698 2.361 1.118 0.939 0.933 0.600 CB 1.786 31 residues pruned to eliminate duplicates Z: 26 57.680 2.327 1.182 0.914 1.000 0.680 CB 1.606 25 residues pruned to eliminate duplicates Z: 17 44.617 2.369 0.764 0.920 1.000 0.812 CA 1.880 17 residues pruned to eliminate duplicates Z: 16 36.619 2.438 0.696 0.877 1.000 0.867 CB 1.661 16 residues pruned to eliminate duplicates Z: 17 48.579 2.394 0.924 0.920 1.000 0.875 CB 1.857 17 residues pruned to eliminate duplicates Z: 15 38.932 2.442 0.741 0.898 0.929 0.857 CA 1.885 15 residues pruned to eliminate duplicates Z: 15 43.176 2.444 0.759 0.904 1.000 0.857 CA 1.913 15 residues pruned to eliminate duplicates Z: 27 52.891 2.333 0.648 0.928 1.000 0.885 CB 1.890 27 residues pruned to eliminate duplicates Z: 165 117.525 2.481 0.963 0.648 0.939 0.677 CB 1.749 164 residues pruned to eliminate duplicates Z: 32 44.604 2.429 0.868 0.582 0.935 0.613 CB 1.745 31 residues pruned to eliminate duplicates Z: 23 50.789 2.371 0.938 0.811 1.000 0.591 CB 1.797 23 residues pruned to eliminate duplicates Z: 18 38.484 2.255 0.846 0.896 0.941 0.824 CB 1.706 18 residues pruned to eliminate duplicates Z: 13 21.674 2.226 0.499 0.909 0.917 0.917 CB 1.451 13 residues pruned to eliminate duplicates Z: 136 70.069 2.349 0.626 0.594 0.904 0.652 CB 1.596 126 residues pruned to eliminate duplicates Z: 25 44.922 2.333 0.705 0.934 0.958 0.875 CB 1.677 25 residues pruned to eliminate duplicates Z: 32 48.933 2.279 0.590 0.889 1.000 0.806 CB 1.746 32 residues pruned to eliminate duplicates Z: 15 44.006 2.485 0.944 0.917 0.929 0.929 CB 1.850 15 residues pruned to eliminate duplicates Z: 17 47.412 2.360 1.000 0.903 1.000 0.812 CA 1.791 17 residues pruned to eliminate duplicates Z: 15 31.630 2.369 0.643 0.929 0.929 0.571 CB 1.637 15 residues pruned to eliminate duplicates Z: 7 14.375 2.184 0.367 0.810 1.000 0.833 CA 1.501 7 residues pruned to eliminate duplicates Z: 17 36.272 2.180 1.027 0.858 0.875 0.625 CB 1.726 17 residues pruned to eliminate duplicates Z: 27 51.394 2.390 0.602 0.906 1.000 0.846 CA 1.871 27 residues pruned to eliminate duplicates Z: 17 31.365 2.203 0.702 0.864 0.938 0.750 CB 1.635 17 residues pruned to eliminate duplicates Z: 17 37.137 2.311 0.680 0.888 1.000 0.812 CB 1.722 17 residues pruned to eliminate duplicates Z: 28 65.050 2.363 0.924 0.950 1.000 0.741 CA 1.898 28 residues pruned to eliminate duplicates Z: 23 52.342 2.421 0.934 0.840 0.955 0.727 CA 1.863 23 residues pruned to eliminate duplicates Z: 50 35.487 2.255 0.613 0.537 0.898 0.694 CB 1.496 50 residues pruned to eliminate duplicates Z: 18 54.270 2.302 1.208 0.942 1.000 0.765 CA 1.796 18 residues pruned to eliminate duplicates Z: 20 49.925 2.187 1.126 0.912 1.000 0.632 CB 1.744 20 residues pruned to eliminate duplicates Z: 15 16.702 2.118 0.789 0.420 0.786 0.500 CB 1.630 7 residues pruned to eliminate duplicates Z: 15 40.483 2.546 0.668 0.921 1.000 0.857 CB 1.794 15 residues pruned to eliminate duplicates Z: 19 44.066 2.242 0.956 0.895 0.944 0.722 CA 1.798 19 residues pruned to eliminate duplicates Z: 23 38.966 2.124 1.013 0.895 0.955 0.500 CB 1.459 24 residues pruned to eliminate duplicates Z: 15 37.716 2.414 0.615 0.906 1.000 1.000 CA 1.838 15 residues pruned to eliminate duplicates Z: 16 30.792 2.344 0.471 0.903 1.000 1.000 CB 1.643 16 residues pruned to eliminate duplicates Z: 17 42.776 2.382 0.655 0.921 1.000 0.875 CA 1.909 17 residues pruned to eliminate duplicates Z: 13 21.287 2.332 0.338 0.856 0.917 0.750 CB 1.583 13 residues pruned to eliminate duplicates Z: 30 67.504 2.411 1.003 0.915 1.000 0.759 CB 1.835 30 residues pruned to eliminate duplicates Z: 50 37.034 2.274 0.690 0.548 0.959 0.571 CB 1.370 55 residues pruned to eliminate duplicates Z: 32 48.745 2.283 0.490 0.904 1.000 0.839 CB 1.832 32 residues pruned to eliminate duplicates Z: 14 28.713 2.144 1.153 0.849 1.000 0.538 CB 1.279 13 residues pruned to eliminate duplicates Z: 9 11.968 2.232 0.704 0.337 0.750 0.375 CB 1.772 9 residues pruned to eliminate duplicates Z: 23 53.884 2.426 0.968 0.850 0.955 0.818 CA 1.868 23 residues pruned to eliminate duplicates Z: 31 48.032 2.313 0.531 0.898 0.967 0.800 CB 1.832 31 residues pruned to eliminate duplicates Z: 22 45.299 2.255 0.886 0.878 0.952 0.667 CB 1.772 22 residues pruned to eliminate duplicates Z: 31 54.523 2.296 0.828 0.886 0.967 0.767 CB 1.770 31 residues pruned to eliminate duplicates Z: 14 23.941 2.388 0.355 0.838 0.846 0.692 CB 1.812 14 residues pruned to eliminate duplicates Z: 68 48.128 2.451 0.624 0.486 0.866 0.582 CB 1.730 68 residues pruned to eliminate duplicates Z: 38 37.888 2.255 0.914 0.597 0.946 0.676 CB 1.391 38 residues pruned to eliminate duplicates Z: 24 43.292 2.334 0.801 0.832 0.957 0.609 CB 1.686 24 residues pruned to eliminate duplicates Z: 26 40.519 2.298 0.695 0.885 0.920 0.840 CB 1.632 26 residues pruned to eliminate duplicates Z: 15 31.205 2.213 0.783 0.904 1.000 0.857 CB 1.506 15 residues pruned to eliminate duplicates Z: 16 22.866 2.214 0.526 0.919 1.000 0.933 CB 1.232 16 residues pruned to eliminate duplicates Z: 6 18.791 2.623 0.773 0.658 0.800 0.400 CB 1.951 6 residues pruned to eliminate duplicates Z: 17 32.052 2.193 0.624 0.927 1.000 0.625 CB 1.576 17 residues pruned to eliminate duplicates Z: 24 53.000 2.351 0.823 0.920 0.957 0.696 CA 1.899 24 residues pruned to eliminate duplicates Z: 6 11.057 2.198 0.354 0.773 0.800 0.600 CB 1.631 6 residues pruned to eliminate duplicates Z: 16 31.767 2.341 0.458 0.895 1.000 0.933 CA 1.723 16 residues pruned to eliminate duplicates Z: 33 37.162 2.309 0.869 0.609 0.844 0.594 CB 1.627 33 residues pruned to eliminate duplicates Z: 16 35.887 2.280 0.968 0.875 0.867 0.867 CA 1.733 16 residues pruned to eliminate duplicates Z: 18 27.332 2.172 0.502 0.838 0.941 0.765 CB 1.613 18 residues pruned to eliminate duplicates Z: 49 35.535 2.271 0.673 0.543 0.875 0.688 CB 1.478 49 residues pruned to eliminate duplicates Z: 15 25.730 2.136 0.691 0.863 1.000 0.929 CB 1.397 15 residues pruned to eliminate duplicates Z: 28 70.369 2.423 1.084 0.934 1.000 0.926 CB 1.870 28 residues pruned to eliminate duplicates Z: 32 56.448 2.295 0.770 0.893 1.000 0.710 CB 1.791 32 residues pruned to eliminate duplicates Z: 8 12.683 2.410 0.054 0.670 0.857 0.429 CA 1.881 8 residues pruned to eliminate duplicates Z: 23 55.821 2.414 1.038 0.848 0.955 0.773 CA 1.880 23 residues pruned to eliminate duplicates Z: 17 44.187 2.309 1.126 0.886 0.938 0.812 CB 1.732 17 residues pruned to eliminate duplicates Z: 30 59.662 2.424 0.792 0.930 0.966 0.828 CB 1.848 30 residues pruned to eliminate duplicates Z: 54 59.377 2.444 0.685 0.677 0.943 0.811 CB 1.785 49 residues pruned to eliminate duplicates Z: 15 31.713 2.171 0.835 0.933 1.000 0.857 CB 1.485 15 residues pruned to eliminate duplicates Z: 15 42.161 2.519 0.762 0.905 1.000 0.929 CB 1.806 15 residues pruned to eliminate duplicates Z: 25 41.117 2.337 0.553 0.912 1.000 0.917 CB 1.638 25 residues pruned to eliminate duplicates Z: 17 30.268 2.217 0.407 0.866 1.000 0.750 CB 1.775 17 residues pruned to eliminate duplicates Z: 32 50.420 2.242 0.674 0.905 0.968 0.871 CB 1.774 32 residues pruned to eliminate duplicates Z: 43 51.353 2.440 0.720 0.618 0.952 0.762 CB 1.773 43 residues pruned to eliminate duplicates Z: 39 49.115 2.534 0.736 0.589 0.921 0.605 CB 1.806 39 residues pruned to eliminate duplicates Z: 51 35.163 2.223 0.513 0.509 0.960 0.720 CB 1.526 51 residues pruned to eliminate duplicates Z: 18 45.589 2.352 1.055 0.915 0.941 0.765 CB 1.718 18 residues pruned to eliminate duplicates Z: 13 23.077 2.036 0.737 0.865 0.917 0.750 CB 1.505 Z: 14 21.117 2.119 0.769 0.840 1.000 0.615 CB 1.166 14 residues pruned to eliminate duplicates Z: 6 10.678 2.077 0.491 0.718 0.800 0.800 N 1.582 6 residues pruned to eliminate duplicates Z: 6 8.803 1.944 0.271 0.679 0.800 0.800 CB 1.689 6 residues pruned to eliminate duplicates Z: 22 40.604 2.207 0.974 0.920 0.952 0.762 CB 1.504 22 residues pruned to eliminate duplicates Z: 15 27.574 2.331 0.414 0.870 0.929 0.786 CB 1.757 15 residues pruned to eliminate duplicates Z: 9 12.552 1.950 0.827 0.411 0.875 0.375 CB 1.562 9 residues pruned to eliminate duplicates Z: 22 39.933 2.372 0.591 0.852 1.000 0.857 CA 1.709 22 residues pruned to eliminate duplicates Z: 14 11.482 2.116 0.582 0.408 0.769 0.308 CB 1.362 14 residues pruned to eliminate duplicates Z: 31 60.829 2.314 0.920 0.891 1.000 0.733 CB 1.797 31 residues pruned to eliminate duplicates Z: 23 32.724 2.096 0.687 0.907 0.955 0.773 CB 1.469 23 residues pruned to eliminate duplicates Z: 39 33.797 2.244 0.812 0.506 0.868 0.474 CB 1.543 39 residues pruned to eliminate duplicates Z: 23 47.846 2.490 0.963 0.731 0.955 0.636 CB 1.776 23 residues pruned to eliminate duplicates Z: 54 37.343 2.280 0.673 0.546 0.943 0.660 CB 1.364 54 residues pruned to eliminate duplicates Z: 11 22.478 2.282 0.815 0.598 0.900 0.600 CB 1.737 11 residues pruned to eliminate duplicates Z: 10 17.681 1.974 0.733 0.860 0.778 0.444 CA 1.628 10 residues pruned to eliminate duplicates Z: 15 21.322 2.300 0.112 0.931 1.000 0.929 CB 1.557 15 residues pruned to eliminate duplicates Z: 64 43.968 2.231 0.607 0.640 0.905 0.714 CB 1.498 64 residues pruned to eliminate duplicates Z: 24 43.997 2.346 0.756 0.878 0.957 0.652 CB 1.689 24 residues pruned to eliminate duplicates Z: 8 14.447 2.028 0.529 0.853 1.000 0.429 CA 1.301 8 residues pruned to eliminate duplicates Z: 9 14.369 1.982 0.877 0.518 0.875 0.500 CA 1.533 9 residues pruned to eliminate duplicates Z: 90 89.434 2.463 0.834 0.711 0.944 0.730 CB 1.836 90 residues pruned to eliminate duplicates Z: 25 50.632 2.387 0.780 0.910 1.000 0.917 CB 1.725 25 residues pruned to eliminate duplicates Z: 85 68.028 2.458 0.779 0.552 0.917 0.631 CB 1.760 85 residues pruned to eliminate duplicates Z: 29 45.297 2.145 0.626 0.938 1.000 0.786 CB 1.708 29 residues pruned to eliminate duplicates Z: 44 47.745 2.393 0.765 0.608 0.907 0.674 CB 1.717 44 residues pruned to eliminate duplicates Z: 52 50.976 2.449 0.748 0.539 0.922 0.706 CB 1.742 52 residues pruned to eliminate duplicates Z: 25 57.168 2.389 1.239 0.919 0.958 0.750 CB 1.605 25 residues pruned to eliminate duplicates Z: 76 79.349 2.489 0.844 0.647 0.987 0.680 CB 1.764 76 residues pruned to eliminate duplicates Z: 26 48.373 2.307 1.100 0.889 0.920 0.600 CB 1.562 27 residues pruned to eliminate duplicates Z: 14 25.390 2.259 0.674 0.581 0.923 0.769 CA 1.866 14 residues pruned to eliminate duplicates Z: 36 40.726 2.320 0.695 0.683 0.914 0.743 CB 1.620 36 residues pruned to eliminate duplicates Z: 10 12.429 1.919 0.150 0.789 1.000 0.333 CB 1.456 10 residues pruned to eliminate duplicates Z: 51 49.455 2.441 0.760 0.500 0.920 0.600 CB 1.769 51 residues pruned to eliminate duplicates Z: 30 54.939 2.401 0.674 0.915 0.966 0.862 CB 1.858 30 residues pruned to eliminate duplicates Z: 49 41.108 2.312 0.727 0.570 0.958 0.583 CB 1.450 49 residues pruned to eliminate duplicates Z: 9 12.329 2.077 0.217 0.794 0.750 0.625 CB 1.778 9 residues pruned to eliminate duplicates Z: 31 62.172 2.320 0.912 0.904 1.000 0.667 CB 1.823 31 residues pruned to eliminate duplicates Z: 23 36.803 2.407 0.822 0.826 0.864 0.409 CB 1.562 23 residues pruned to eliminate duplicates Z: 14 27.791 2.148 0.918 0.910 1.000 0.692 CB 1.326 13 residues pruned to eliminate duplicates Z: 39 44.948 2.381 0.860 0.664 0.895 0.684 CB 1.580 39 residues pruned to eliminate duplicates Z: 31 56.622 2.313 0.802 0.906 1.000 0.700 CB 1.763 31 residues pruned to eliminate duplicates Z: 65 46.949 2.188 0.858 0.564 0.969 0.625 CB 1.401 65 residues pruned to eliminate duplicates Z: 75 72.647 2.492 0.775 0.620 0.959 0.662 CB 1.776 75 residues pruned to eliminate duplicates Z: 19 33.249 2.324 0.632 0.835 0.944 0.833 CB 1.638 19 residues pruned to eliminate duplicates Z: 8 8.971 1.956 0.814 0.333 0.857 0.571 CA 1.338 8 residues pruned to eliminate duplicates Z: 52 36.075 2.282 0.529 0.527 0.922 0.627 CB 1.529 52 residues pruned to eliminate duplicates Z: 14 21.832 2.061 0.527 0.872 0.923 0.846 CB 1.519 14 residues pruned to eliminate duplicates Z: 14 29.967 2.286 0.918 0.898 1.000 0.538 CB 1.355 14 residues pruned to eliminate duplicates Z: 8 12.067 2.158 0.121 0.856 0.857 0.571 CB 1.623 8 residues pruned to eliminate duplicates Z: 13 34.097 2.161 1.406 0.892 1.000 0.917 CB 1.360 12 residues pruned to eliminate duplicates Z: 17 45.204 2.373 0.961 0.935 1.000 0.875 CB 1.692 17 residues pruned to eliminate duplicates Z: 12 18.621 2.156 0.728 0.572 0.909 0.636 CB 1.547 12 residues pruned to eliminate duplicates Z: 17 47.032 2.324 1.066 0.901 1.000 0.875 CB 1.749 17 residues pruned to eliminate duplicates Z: 17 13.332 1.827 0.333 0.713 0.938 0.688 CB 1.203 Z: 8 9.785 1.686 0.942 0.730 0.857 0.571 CB 1.072 8 residues pruned to eliminate duplicates Z: 8 4.611 1.914 0.174 0.718 0.714 0.571 CB 0.892 8 residues pruned to eliminate duplicates Z: 17 39.373 2.214 0.966 0.909 1.000 0.750 CB 1.604 17 residues pruned to eliminate duplicates Z: 13 14.439 1.868 0.149 0.932 1.000 1.000 CB 1.356 Z: 24 38.235 2.135 0.736 0.905 1.000 0.913 CB 1.532 23 residues pruned to eliminate duplicates Z: 15 17.233 2.040 0.307 0.870 0.929 0.786 CB 1.358 15 residues pruned to eliminate duplicates Z: 15 29.995 2.258 0.850 0.910 1.000 0.714 CB 1.361 15 residues pruned to eliminate duplicates Z: 15 37.942 2.393 0.702 0.935 1.000 0.786 CB 1.735 16 residues pruned to eliminate duplicates Z: 14 13.712 2.092 0.192 0.798 1.000 0.692 CB 1.174 14 residues pruned to eliminate duplicates Z: 22 10.541 2.129 0.624 0.249 0.667 0.333 CB 1.333 22 residues pruned to eliminate duplicates Z: 24 39.720 2.168 0.910 0.890 0.957 0.565 CB 1.505 24 residues pruned to eliminate duplicates Z: 16 20.853 1.922 0.916 0.873 0.933 0.867 CB 1.141 Z: 23 37.928 2.099 0.983 0.879 0.955 0.409 CB 1.475 23 residues pruned to eliminate duplicates Z: 15 28.733 2.291 0.324 0.905 1.000 0.929 CB 1.803 15 residues pruned to eliminate duplicates Z: 31 49.682 2.286 0.598 0.893 1.000 0.800 CB 1.782 31 residues pruned to eliminate duplicates Z: 49 50.505 2.369 0.841 0.549 0.917 0.583 CB 1.739 49 residues pruned to eliminate duplicates Z: 9 19.793 2.140 0.658 0.887 1.000 0.625 CB 1.422 Z: 6 11.750 2.014 0.430 0.835 1.000 0.800 CB 1.366 6 residues pruned to eliminate duplicates Z: 34 36.709 2.284 0.715 0.684 0.970 0.788 CB 1.420 34 residues pruned to eliminate duplicates Z: 16 19.611 2.174 0.281 0.920 1.000 0.933 CB 1.280 16 residues pruned to eliminate duplicates Z: 26 26.524 2.255 0.368 0.591 0.920 0.600 CB 1.714 26 residues pruned to eliminate duplicates Z: 13 19.696 2.496 0.438 0.495 0.833 0.500 CB 1.910 13 residues pruned to eliminate duplicates Z: 15 37.065 2.252 1.265 0.898 1.000 0.643 CB 1.390 15 residues pruned to eliminate duplicates Z: 18 34.631 2.322 0.604 0.905 0.941 0.882 CA 1.706 18 residues pruned to eliminate duplicates Z: 39 33.918 2.353 0.651 0.461 0.895 0.605 CB 1.647 39 residues pruned to eliminate duplicates Z: 14 17.204 1.916 0.322 0.940 1.000 0.923 CB 1.308 13 residues pruned to eliminate duplicates Z: 8 11.793 1.835 0.723 0.858 0.857 0.571 CB 1.211 Z: 34 19.135 2.008 0.430 0.464 0.939 0.545 CB 1.280 34 residues pruned to eliminate duplicates Z: 7 10.609 1.753 0.492 0.704 1.000 0.500 CB 1.375 7 residues pruned to eliminate duplicates Z: 28 57.796 2.406 0.773 0.922 0.963 0.852 CB 1.904 28 residues pruned to eliminate duplicates Z: 13 30.572 2.144 1.205 0.884 1.000 0.667 CB 1.349 13 residues pruned to eliminate duplicates Z: 18 19.154 1.873 0.622 0.834 0.941 0.882 CB 1.217 16 residues pruned to eliminate duplicates Z: 31 67.356 2.440 0.901 0.922 1.000 0.833 CB 1.865 31 residues pruned to eliminate duplicates Z: 16 41.951 2.405 0.692 0.925 1.000 0.933 CB 1.867 16 residues pruned to eliminate duplicates Z: 30 54.199 2.355 0.731 0.898 1.000 0.828 CB 1.766 30 residues pruned to eliminate duplicates Z: 20 28.422 2.452 0.563 0.797 0.789 0.526 CB 1.662 20 residues pruned to eliminate duplicates Z: 66 36.505 2.046 0.645 0.582 0.954 0.723 CB 1.304 92 residues pruned to eliminate duplicates Z: 13 24.321 2.355 0.812 0.895 0.833 0.500 CB 1.415 13 residues pruned to eliminate duplicates Z: 6 18.352 2.268 0.581 0.816 1.000 0.800 CA 1.739 6 residues pruned to eliminate duplicates Z: 49 32.168 2.278 0.454 0.610 0.938 0.729 CB 1.347 49 residues pruned to eliminate duplicates Z: 47 39.484 2.286 0.717 0.611 0.957 0.717 CB 1.396 47 residues pruned to eliminate duplicates Z: 14 21.419 2.326 0.544 0.701 0.846 0.462 CB 1.627 14 residues pruned to eliminate duplicates Z: 17 40.285 2.340 0.908 0.861 1.000 0.750 CB 1.657 17 residues pruned to eliminate duplicates Z: 26 54.100 2.347 1.157 0.907 0.920 0.680 CB 1.651 26 residues pruned to eliminate duplicates Z: 13 24.166 2.320 0.294 0.884 1.000 1.000 CB 1.678 13 residues pruned to eliminate duplicates Z: 55 42.624 2.254 0.906 0.508 0.944 0.667 CB 1.419 38 residues pruned to eliminate duplicates Z: 31 31.684 2.262 0.825 0.594 0.833 0.500 CB 1.537 31 residues pruned to eliminate duplicates Z: 25 40.195 2.329 0.902 0.784 0.917 0.625 CB 1.573 25 residues pruned to eliminate duplicates Z: 15 18.218 2.192 0.382 0.905 0.929 0.929 CB 1.232 15 residues pruned to eliminate duplicates Z: 17 18.170 1.897 0.427 0.871 1.000 0.812 CB 1.223 Z: 90 93.460 2.468 0.873 0.708 0.966 0.719 CB 1.836 90 residues pruned to eliminate duplicates Z: 25 37.754 2.479 0.861 0.619 0.833 0.625 CB 1.792 25 residues pruned to eliminate duplicates Z: 115 82.250 2.411 0.819 0.633 0.930 0.667 CB 1.666 115 residues pruned to eliminate duplicates Z: 24 46.084 2.402 0.865 0.837 0.913 0.522 CB 1.756 24 residues pruned to eliminate duplicates Z: 39 40.989 2.393 0.631 0.677 0.895 0.737 CB 1.617 39 residues pruned to eliminate duplicates Z: 7 10.912 2.108 0.059 0.866 1.000 0.833 CB 1.460 7 residues pruned to eliminate duplicates Z: 19 18.239 1.940 0.520 0.672 0.944 0.833 CB 1.317 16 residues pruned to eliminate duplicates Z: 27 68.899 2.418 1.160 0.919 1.000 0.654 CB 1.822 27 residues pruned to eliminate duplicates Z: 13 23.538 2.316 0.431 0.893 0.917 0.833 CB 1.606 13 residues pruned to eliminate duplicates Z: 7 9.815 1.985 0.361 0.866 1.000 0.833 CB 1.086 7 residues pruned to eliminate duplicates Z: 12 21.824 2.216 0.523 0.512 1.000 0.727 CB 1.928 12 residues pruned to eliminate duplicates Z: 17 32.558 2.320 0.439 0.931 1.000 0.938 CB 1.703 17 residues pruned to eliminate duplicates Z: 51 37.809 2.284 0.757 0.527 0.920 0.520 CB 1.410 51 residues pruned to eliminate duplicates Z: 48 73.039 2.428 0.915 0.809 0.936 0.702 CB 1.869 48 residues pruned to eliminate duplicates Z: 87 86.521 2.501 0.899 0.700 0.953 0.733 CB 1.716 87 residues pruned to eliminate duplicates Z: 55 34.130 2.052 0.749 0.556 0.926 0.611 CB 1.324 20 residues pruned to eliminate duplicates Z: 70 56.993 2.455 0.681 0.584 0.928 0.638 CB 1.653 70 residues pruned to eliminate duplicates Z: 17 40.699 2.312 0.933 0.880 0.938 0.562 CA 1.761 17 residues pruned to eliminate duplicates Z: 7 12.021 1.857 0.813 0.841 0.833 0.333 CA 1.304 7 residues pruned to eliminate duplicates Z: 67 73.847 2.483 0.901 0.627 0.970 0.727 CB 1.762 67 residues pruned to eliminate duplicates Z: 16 40.094 2.373 0.912 0.925 0.933 0.867 CB 1.716 16 residues pruned to eliminate duplicates Z: 14 24.221 2.267 0.531 0.640 0.923 0.769 CB 1.840 14 residues pruned to eliminate duplicates Z: 45 30.951 2.004 0.903 0.577 0.886 0.568 CB 1.281 45 residues pruned to eliminate duplicates Z: 76 67.120 2.455 0.709 0.632 0.920 0.707 CB 1.773 76 residues pruned to eliminate duplicates Z: 17 44.716 2.324 1.021 0.904 1.000 0.625 CB 1.695 17 residues pruned to eliminate duplicates Z: 23 50.234 2.506 1.009 0.713 0.955 0.591 CB 1.838 23 residues pruned to eliminate duplicates Z: 24 50.815 2.417 1.252 0.949 0.913 0.261 CB 1.471 25 residues pruned to eliminate duplicates Z: 8 9.744 2.030 0.196 0.719 0.857 0.714 CB 1.451 8 residues pruned to eliminate duplicates Z: 50 37.062 2.273 0.655 0.588 0.898 0.694 CB 1.440 50 residues pruned to eliminate duplicates Z: 12 14.487 2.303 0.578 0.466 0.818 0.545 CB 1.521 12 residues pruned to eliminate duplicates Z: 34 58.231 2.594 0.773 0.658 0.970 0.606 CB 1.963 34 residues pruned to eliminate duplicates Z: 23 37.574 2.302 0.652 0.863 0.909 0.591 CB 1.700 23 residues pruned to eliminate duplicates Z: 70 82.041 2.487 0.760 0.762 0.971 0.739 CB 1.841 70 residues pruned to eliminate duplicates Z: 32 53.014 2.289 0.800 0.873 0.968 0.613 CB 1.739 32 residues pruned to eliminate duplicates Z: 21 37.580 2.215 0.831 0.903 0.950 0.750 CB 1.554 21 residues pruned to eliminate duplicates Z: 17 28.036 2.118 0.901 0.911 1.000 0.750 CB 1.234 17 residues pruned to eliminate duplicates Z: 14 18.292 2.111 0.506 0.790 0.923 0.538 CB 1.341 14 residues pruned to eliminate duplicates Z: 153 94.621 2.376 0.857 0.626 0.941 0.618 CB 1.642 153 residues pruned to eliminate duplicates Z: 27 50.134 2.309 0.617 0.929 1.000 0.846 CB 1.842 27 residues pruned to eliminate duplicates Z: 11 19.752 2.034 0.506 0.922 1.000 1.000 CB 1.434 Z: 66 50.421 2.312 0.757 0.574 0.938 0.477 CB 1.527 66 residues pruned to eliminate duplicates Z: 12 25.829 2.052 0.985 0.895 0.909 0.636 CA 1.507 9 residues pruned to eliminate duplicates Z: 14 22.489 2.113 0.802 0.808 1.000 0.769 CB 1.253 14 residues pruned to eliminate duplicates Z: 27 35.433 2.469 0.658 0.607 0.885 0.577 CB 1.733 27 residues pruned to eliminate duplicates Z: 17 42.422 2.288 0.896 0.893 1.000 0.500 CB 1.755 17 residues pruned to eliminate duplicates Z: 9 9.699 1.895 0.548 0.567 0.875 0.375 CB 1.253 Z: 16 40.683 2.323 1.037 0.881 1.000 0.533 CB 1.607 16 residues pruned to eliminate duplicates Z: 17 39.748 2.286 0.786 0.921 1.000 0.812 CB 1.712 17 residues pruned to eliminate duplicates Z: 10 15.657 2.119 0.821 0.711 0.889 0.556 CB 1.256 10 residues pruned to eliminate duplicates Z: 26 43.782 2.280 0.613 0.917 1.000 0.880 CB 1.680 25 residues pruned to eliminate duplicates Z: 7 6.965 2.174 0.093 0.434 1.000 0.667 CB 1.281 7 residues pruned to eliminate duplicates Z: 23 32.528 2.124 0.708 0.890 0.955 0.773 CB 1.441 23 residues pruned to eliminate duplicates Z: 16 43.902 2.408 0.906 0.916 1.000 0.600 CB 1.745 16 residues pruned to eliminate duplicates Z: 13 22.822 1.956 1.017 0.831 0.917 0.667 CB 1.368 13 residues pruned to eliminate duplicates Z: 38 27.671 2.040 0.683 0.613 0.946 0.649 CB 1.258 38 residues pruned to eliminate duplicates Z: 7 6.933 1.980 -0.040 0.860 0.833 0.667 CA 1.313 7 residues pruned to eliminate duplicates Z: 31 34.801 2.202 0.827 0.657 0.933 0.733 CB 1.463 31 residues pruned to eliminate duplicates Z: 9 10.262 1.707 0.313 0.900 1.000 1.000 CB 1.157 9 residues pruned to eliminate duplicates Z: 40 31.738 2.253 0.636 0.603 0.949 0.538 CB 1.318 40 residues pruned to eliminate duplicates Z: 13 20.766 2.000 0.662 0.846 0.917 0.750 CA 1.461 13 residues pruned to eliminate duplicates Z: 26 33.635 2.245 0.343 0.855 0.960 0.840 CB 1.715 26 residues pruned to eliminate duplicates Z: 9 12.178 2.295 0.662 0.487 0.875 0.750 CB 1.306 9 residues pruned to eliminate duplicates Z: 25 37.847 2.073 0.984 0.876 0.958 0.583 CB 1.424 25 residues pruned to eliminate duplicates Z: 75 65.278 2.438 0.814 0.586 0.932 0.703 CB 1.694 75 residues pruned to eliminate duplicates Z: 33 23.608 2.122 0.677 0.511 0.969 0.594 CB 1.196 33 residues pruned to eliminate duplicates Z: 32 47.514 2.296 0.463 0.883 1.000 0.774 CB 1.837 32 residues pruned to eliminate duplicates Z: 8 13.542 2.045 0.317 0.867 1.000 0.857 CB 1.389 8 residues pruned to eliminate duplicates Z: 6 3.898 1.608 0.416 0.297 0.800 0.400 CB 1.202 Z: 31 50.977 2.300 0.581 0.907 1.000 0.867 CB 1.820 31 residues pruned to eliminate duplicates Z: 14 29.050 2.152 0.815 0.881 1.000 0.615 CB 1.494 14 residues pruned to eliminate duplicates Z: 25 34.536 2.044 0.884 0.880 0.958 0.583 CB 1.384 25 residues pruned to eliminate duplicates Z: 22 35.563 2.172 0.781 0.926 0.952 0.667 CB 1.477 22 residues pruned to eliminate duplicates Z: 89 83.210 2.440 0.860 0.698 0.955 0.727 CB 1.709 89 residues pruned to eliminate duplicates Z: 29 29.745 2.190 0.716 0.650 0.929 0.643 CB 1.400 29 residues pruned to eliminate duplicates Z: 7 8.668 1.869 0.439 0.725 0.833 0.500 CB 1.289 7 residues pruned to eliminate duplicates Z: 15 8.650 1.738 0.476 0.364 0.786 0.429 CB 1.328 Z: 9 9.175 1.890 0.496 0.490 0.875 0.750 N 1.325 11 residues pruned to eliminate duplicates Z: 13 4.024 1.959 0.422 0.253 0.667 0.417 CB 0.831 13 residues pruned to eliminate duplicates Z: 63 46.598 2.389 0.739 0.545 0.839 0.565 CB 1.626 63 residues pruned to eliminate duplicates Z: 42 34.747 2.283 0.636 0.518 0.927 0.707 CB 1.540 42 residues pruned to eliminate duplicates Z: 14 24.179 2.161 0.560 0.875 1.000 0.769 CB 1.447 14 residues pruned to eliminate duplicates Z: 16 40.437 2.379 0.753 0.916 1.000 0.600 CB 1.767 16 residues pruned to eliminate duplicates Z: 23 51.736 2.419 0.823 0.864 1.000 0.727 CA 1.834 23 residues pruned to eliminate duplicates Z: 16 38.027 2.314 0.791 0.886 1.000 0.733 CA 1.710 16 residues pruned to eliminate duplicates Z: 13 22.708 2.308 0.559 0.840 0.917 0.583 CB 1.484 13 residues pruned to eliminate duplicates Z: 23 19.356 2.067 0.981 0.522 0.818 0.545 CB 1.206 23 residues pruned to eliminate duplicates Z: 17 42.999 2.248 0.892 0.899 1.000 0.812 CA 1.806 17 residues pruned to eliminate duplicates Z: 57 44.120 2.314 0.631 0.539 0.911 0.696 CB 1.652 57 residues pruned to eliminate duplicates Z: 16 36.691 2.163 1.136 0.923 1.000 0.867 CB 1.440 16 residues pruned to eliminate duplicates Z: 31 46.584 2.307 0.416 0.903 1.000 0.867 CB 1.856 31 residues pruned to eliminate duplicates Z: 17 24.661 1.976 0.820 0.870 1.000 0.688 CB 1.251 17 residues pruned to eliminate duplicates Z: 7 8.699 2.035 0.533 0.572 0.833 0.333 CA 1.274 7 residues pruned to eliminate duplicates Z: 17 44.464 2.332 1.000 0.874 1.000 0.438 CB 1.735 17 residues pruned to eliminate duplicates Z: 37 25.725 2.115 0.601 0.537 0.889 0.639 CB 1.375 37 residues pruned to eliminate duplicates Z: 26 27.039 2.361 0.704 0.364 0.920 0.520 CB 1.690 26 residues pruned to eliminate duplicates Z: 25 43.837 2.440 1.047 0.648 0.917 0.625 CB 1.702 25 residues pruned to eliminate duplicates Z: 14 21.646 1.987 0.905 0.916 1.000 1.000 CB 1.120 14 residues pruned to eliminate duplicates Z: 10 12.758 2.115 0.233 0.713 1.000 0.778 CB 1.345 10 residues pruned to eliminate duplicates Z: 40 40.124 2.357 0.691 0.653 0.897 0.769 CB 1.557 40 residues pruned to eliminate duplicates Z: 32 48.077 2.306 0.621 0.859 0.935 0.613 CB 1.816 32 residues pruned to eliminate duplicates Z: 10 25.252 2.517 0.676 0.574 1.000 0.444 CB 1.858 10 residues pruned to eliminate duplicates Z: 37 45.642 2.435 0.937 0.578 0.944 0.694 CB 1.585 37 residues pruned to eliminate duplicates Z: 16 32.494 2.117 1.234 0.898 1.000 0.467 CB 1.269 16 residues pruned to eliminate duplicates Z: 13 27.907 2.503 0.420 0.890 0.917 0.667 CB 1.779 13 residues pruned to eliminate duplicates Z: 17 40.726 2.372 0.949 0.909 0.938 0.562 CB 1.668 17 residues pruned to eliminate duplicates Z: 8 10.373 2.080 0.495 0.462 1.000 0.857 CB 1.310 8 residues pruned to eliminate duplicates Z: 10 8.879 2.114 0.384 0.424 0.889 0.556 CB 1.231 10 residues pruned to eliminate duplicates Z: 24 37.492 2.114 0.985 0.912 0.913 0.478 CB 1.445 24 residues pruned to eliminate duplicates Z: 50 46.326 2.456 0.692 0.491 0.918 0.592 CB 1.749 50 residues pruned to eliminate duplicates Z: 33 19.326 1.751 0.683 0.582 0.875 0.438 CB 1.225 13 residues pruned to eliminate duplicates Z: 8 16.163 1.873 0.678 0.838 1.000 0.571 CA 1.452 8 residues pruned to eliminate duplicates Z: 8 8.215 1.987 0.250 0.681 0.857 0.714 CB 1.235 Z: 10 14.107 2.125 0.522 0.881 0.778 0.556 CB 1.353 10 residues pruned to eliminate duplicates Z: 31 56.302 2.292 0.933 0.902 0.933 0.600 CB 1.773 31 residues pruned to eliminate duplicates Z: 15 20.321 1.866 0.456 0.936 1.000 1.000 CB 1.391 14 residues pruned to eliminate duplicates Z: 31 29.253 2.182 0.757 0.568 0.867 0.567 CB 1.506 31 residues pruned to eliminate duplicates Z: 12 25.486 1.951 0.997 0.870 1.000 0.636 CB 1.440 11 residues pruned to eliminate duplicates Z: 12 16.889 1.988 0.502 0.711 1.000 0.727 CB 1.408 12 residues pruned to eliminate duplicates Z: 20 61.417 2.461 1.360 0.921 1.000 0.579 CB 1.707 20 residues pruned to eliminate duplicates Z: 13 14.036 2.099 0.630 0.534 0.833 0.750 CB 1.374 13 residues pruned to eliminate duplicates Z: 17 41.030 2.325 0.813 0.888 1.000 0.688 CB 1.753 17 residues pruned to eliminate duplicates Z: 52 30.407 2.026 0.557 0.599 0.961 0.725 CB 1.278 54 residues pruned to eliminate duplicates Z: 94 84.480 2.410 0.905 0.698 0.935 0.645 CB 1.702 156 residues pruned to eliminate duplicates Z: 15 12.849 1.926 0.558 0.391 0.929 0.429 CB 1.383 15 residues pruned to eliminate duplicates Z: 15 27.788 2.202 0.539 0.903 1.000 0.857 CB 1.562 15 residues pruned to eliminate duplicates Z: 11 11.835 1.940 0.451 0.604 0.900 0.700 CB 1.338 12 residues pruned to eliminate duplicates Z: 56 38.911 2.291 0.741 0.530 0.891 0.564 CB 1.433 56 residues pruned to eliminate duplicates Z: 17 42.145 2.311 1.046 0.896 0.938 0.750 CB 1.703 17 residues pruned to eliminate duplicates Z: 27 71.535 2.445 1.120 0.927 1.000 0.654 CB 1.897 27 residues pruned to eliminate duplicates Z: 11 23.613 2.021 1.034 0.862 1.000 0.700 CB 1.334 11 residues pruned to eliminate duplicates Z: 16 23.566 1.939 0.753 0.890 1.000 0.867 CB 1.288 Z: 7 11.988 1.872 0.528 0.804 1.000 0.667 CB 1.311 7 residues pruned to eliminate duplicates Z: 33 53.964 2.304 0.869 0.906 0.906 0.719 CB 1.739 33 residues pruned to eliminate duplicates Z: 23 23.529 2.003 0.560 0.729 1.000 0.545 CB 1.307 23 residues pruned to eliminate duplicates Z: 22 26.739 2.212 0.530 0.723 0.905 0.714 CB 1.557 22 residues pruned to eliminate duplicates Z: 14 17.023 1.753 0.334 0.935 1.000 0.846 CA 1.408 17 residues pruned to eliminate duplicates Z: 10 7.036 1.776 0.473 0.455 0.778 0.444 CB 1.207 Z: 18 23.280 1.887 0.854 0.833 1.000 0.824 CB 1.211 17 residues pruned to eliminate duplicates Z: 26 32.057 2.351 0.585 0.657 0.960 0.880 CB 1.549 26 residues pruned to eliminate duplicates Z: 27 41.719 2.433 0.909 0.593 0.923 0.846 CB 1.746 27 residues pruned to eliminate duplicates Z: 11 14.665 2.136 0.707 0.486 0.900 0.500 CB 1.434 11 residues pruned to eliminate duplicates Z: 10 16.027 2.108 0.503 0.621 1.000 0.556 CB 1.505 12 residues pruned to eliminate duplicates Z: 9 9.684 1.775 0.240 0.917 1.000 0.750 CB 1.098 9 residues pruned to eliminate duplicates Z: 12 24.726 1.955 1.058 0.891 0.909 0.636 CB 1.465 12 residues pruned to eliminate duplicates Z: 43 43.341 2.301 0.851 0.639 0.905 0.714 CB 1.524 43 residues pruned to eliminate duplicates Z: 10 14.469 2.270 0.938 0.387 0.778 0.444 CB 1.590 10 residues pruned to eliminate duplicates Z: 10 17.948 1.892 0.730 0.900 1.000 0.889 CA 1.305 10 residues pruned to eliminate duplicates Z: 14 17.474 1.918 0.296 0.917 1.000 1.000 CB 1.376 14 residues pruned to eliminate duplicates Z: 14 11.127 1.924 0.553 0.421 0.846 0.385 CB 1.325 14 residues pruned to eliminate duplicates Z: 6 11.867 1.736 0.896 0.750 1.000 0.400 CA 1.290 6 residues pruned to eliminate duplicates Z: 6 14.508 2.137 1.155 0.842 1.000 1.000 CB 1.050 Z: 23 32.785 2.085 0.846 0.878 0.909 0.500 CB 1.449 23 residues pruned to eliminate duplicates Z: 8 9.752 1.648 0.656 0.695 0.857 0.571 CA 1.318 8 residues pruned to eliminate duplicates Z: 50 66.920 2.393 0.722 0.783 0.959 0.755 CB 1.885 50 residues pruned to eliminate duplicates Z: 7 12.085 2.137 0.453 0.663 0.833 0.500 CA 1.640 7 residues pruned to eliminate duplicates Z: 9 5.024 1.484 0.355 0.486 0.875 0.500 CB 1.023 9 residues pruned to eliminate duplicates Z: 28 28.185 2.111 0.433 0.783 0.926 0.852 CB 1.510 28 residues pruned to eliminate duplicates Z: 17 39.534 2.172 1.058 0.915 1.000 0.688 CB 1.562 17 residues pruned to eliminate duplicates Z: 7 3.189 1.644 0.112 0.470 0.833 0.500 CB 0.881 Z: 11 19.099 1.933 0.718 0.866 1.000 0.800 CB 1.331 11 residues pruned to eliminate duplicates Z: 7 9.079 1.802 0.623 0.772 1.000 0.667 CB 0.996 7 residues pruned to eliminate duplicates Z: 32 49.117 2.373 0.877 0.752 0.935 0.645 CB 1.691 32 residues pruned to eliminate duplicates Z: 14 20.261 1.924 0.516 0.928 1.000 0.846 CB 1.349 15 residues pruned to eliminate duplicates Z: 16 37.941 2.208 1.116 0.910 1.000 0.600 CB 1.486 16 residues pruned to eliminate duplicates Z: 52 55.108 2.486 0.747 0.556 0.922 0.627 CB 1.825 52 residues pruned to eliminate duplicates Z: 14 21.074 1.924 0.542 0.940 1.000 0.923 CB 1.368 14 residues pruned to eliminate duplicates Z: 11 25.716 2.128 0.882 0.902 1.000 0.700 CB 1.448 11 residues pruned to eliminate duplicates Z: 8 10.555 1.914 0.712 0.426 1.000 0.714 CB 1.315 8 residues pruned to eliminate duplicates Z: 29 60.338 2.419 1.077 0.936 0.929 0.571 CB 1.703 29 residues pruned to eliminate duplicates Z: 14 28.076 2.319 0.253 0.947 1.000 0.923 CB 1.852 14 residues pruned to eliminate duplicates Z: 15 17.644 1.697 0.802 0.930 0.929 0.500 CB 1.162 15 residues pruned to eliminate duplicates Z: 21 12.724 1.828 0.566 0.626 0.800 0.600 CB 1.103 20 residues pruned to eliminate duplicates Z: 90 91.684 2.465 0.840 0.714 0.955 0.719 CB 1.847 90 residues pruned to eliminate duplicates Z: 7 8.182 1.877 0.382 0.851 1.000 1.000 CB 0.953 7 residues pruned to eliminate duplicates Z: 13 21.581 1.891 0.850 0.940 1.000 0.750 CB 1.237 13 residues pruned to eliminate duplicates Z: 22 13.256 1.682 0.603 0.529 0.857 0.476 CB 1.216 22 residues pruned to eliminate duplicates Z: 6 9.929 1.986 0.615 0.768 0.800 0.600 CB 1.365 6 residues pruned to eliminate duplicates Z: 32 47.253 2.208 0.739 0.874 0.968 0.484 CB 1.661 32 residues pruned to eliminate duplicates Z: 24 21.184 2.254 0.369 0.453 0.957 0.739 CB 1.571 24 residues pruned to eliminate duplicates Z: 20 27.485 2.286 0.595 0.554 1.000 0.737 CA 1.641 20 residues pruned to eliminate duplicates Z: 13 24.553 2.251 0.660 0.904 1.000 0.583 CB 1.351 13 residues pruned to eliminate duplicates Z: 29 21.443 1.863 0.733 0.546 0.929 0.500 CB 1.292 27 residues pruned to eliminate duplicates Z: 14 16.834 1.741 0.466 0.919 1.000 0.846 CB 1.289 15 residues pruned to eliminate duplicates Z: 15 20.160 1.860 0.491 0.921 1.000 0.929 CB 1.367 15 residues pruned to eliminate duplicates Z: 13 11.863 1.894 0.355 0.654 0.833 0.667 CB 1.388 13 residues pruned to eliminate duplicates Z: 14 16.811 1.734 0.802 0.888 0.923 0.538 CB 1.164 14 residues pruned to eliminate duplicates Z: 21 12.274 2.051 0.592 0.222 0.800 0.500 CB 1.456 21 residues pruned to eliminate duplicates Z: 19 18.691 1.986 0.608 0.628 0.944 0.722 CB 1.294 19 residues pruned to eliminate duplicates Z: 48 35.736 2.058 0.761 0.632 0.979 0.723 CB 1.298 27 residues pruned to eliminate duplicates Z: 12 18.169 1.910 0.688 0.827 1.000 0.818 CB 1.281 12 residues pruned to eliminate duplicates Z: 9 9.801 1.983 0.476 0.302 1.000 0.750 CA 1.477 9 residues pruned to eliminate duplicates Z: 23 21.941 2.317 0.490 0.488 0.955 0.682 CB 1.437 23 residues pruned to eliminate duplicates Z: 17 36.109 2.299 0.577 0.909 1.000 0.938 CA 1.768 17 residues pruned to eliminate duplicates Z: 26 20.462 2.230 0.511 0.423 0.880 0.760 CB 1.495 26 residues pruned to eliminate duplicates Z: 24 27.307 1.978 0.873 0.688 1.000 0.652 CB 1.293 24 residues pruned to eliminate duplicates Z: 8 16.358 2.253 0.305 0.759 1.000 0.857 CB 1.671 8 residues pruned to eliminate duplicates Z: 165 102.337 2.443 0.902 0.611 0.902 0.549 CB 1.715 165 residues pruned to eliminate duplicates Z: 9 13.321 2.210 0.817 0.566 0.750 0.500 CA 1.468 9 residues pruned to eliminate duplicates Z: 64 46.704 2.213 0.715 0.602 0.921 0.587 CB 1.529 56 residues pruned to eliminate duplicates Z: 21 36.749 2.322 0.637 0.767 1.000 0.800 CB 1.706 21 residues pruned to eliminate duplicates Z: 6 4.361 1.547 0.322 0.614 1.000 0.600 CB 0.857 6 residues pruned to eliminate duplicates Z: 28 58.451 2.348 0.934 0.935 1.000 0.481 CB 1.726 28 residues pruned to eliminate duplicates Z: 15 53.570 2.525 0.949 0.939 1.000 0.929 CB 2.022 15 residues pruned to eliminate duplicates Z: 13 18.776 1.905 0.573 0.937 1.000 0.917 CB 1.259 13 residues pruned to eliminate duplicates Z: 29 23.947 1.837 0.843 0.630 0.929 0.571 CB 1.275 29 residues pruned to eliminate duplicates Z: 7 2.976 1.471 0.139 0.401 0.833 0.333 O 0.966 Z: 16 15.536 2.272 0.771 0.352 0.800 0.467 CB 1.462 16 residues pruned to eliminate duplicates Z: 7 6.138 1.808 -0.097 0.811 1.000 1.000 N 1.170 Z: 13 13.686 2.053 0.571 0.528 0.917 0.750 CB 1.300 13 residues pruned to eliminate duplicates Z: 6 3.213 1.755 0.404 0.521 0.800 0.600 CB 0.714 5 residues pruned to eliminate duplicates Z: 15 22.463 2.358 0.849 0.537 0.929 0.643 CB 1.430 15 residues pruned to eliminate duplicates Z: 19 17.850 1.874 0.724 0.609 0.944 0.444 CB 1.243 19 residues pruned to eliminate duplicates Z: 11 26.993 2.538 0.460 0.890 0.900 0.800 CA 1.841 11 residues pruned to eliminate duplicates Z: 8 6.248 1.563 0.224 0.452 1.000 0.714 O 1.297 Z: 50 33.962 2.264 0.593 0.495 0.878 0.653 CB 1.540 50 residues pruned to eliminate duplicates Z: 18 36.850 2.334 0.493 0.911 1.000 0.824 CB 1.818 18 residues pruned to eliminate duplicates Z: 9 10.181 1.998 0.200 0.644 1.000 0.375 CB 1.312 8 residues pruned to eliminate duplicates Z: 7 19.589 2.443 0.484 0.762 1.000 0.500 CB 1.749 7 residues pruned to eliminate duplicates Z: 14 18.225 1.961 0.597 0.808 0.846 0.231 CB 1.459 14 residues pruned to eliminate duplicates Z: 72 71.130 2.445 0.775 0.649 0.930 0.676 CB 1.822 72 residues pruned to eliminate duplicates Z: 12 25.095 2.289 0.678 0.655 1.000 0.636 CA 1.706 12 residues pruned to eliminate duplicates Z: 39 36.710 2.330 0.725 0.547 0.842 0.658 CB 1.680 39 residues pruned to eliminate duplicates Z: 11 24.701 2.075 0.806 0.912 1.000 0.600 CB 1.477 11 residues pruned to eliminate duplicates Z: 16 5.754 1.810 0.406 0.090 0.667 0.400 CA 1.485 16 residues pruned to eliminate duplicates Z: 6 2.269 1.319 0.196 0.414 1.000 0.600 N 0.704 Z: 13 20.177 2.249 0.359 0.892 1.000 0.750 CB 1.369 13 residues pruned to eliminate duplicates Z: 31 57.805 2.359 0.758 0.877 1.000 0.733 CB 1.848 31 residues pruned to eliminate duplicates Z: 19 22.398 2.058 0.614 0.672 0.944 0.667 CB 1.435 18 residues pruned to eliminate duplicates Z: 8 9.095 1.682 0.126 0.895 1.000 0.571 CB 1.301 8 residues pruned to eliminate duplicates Z: 30 43.656 2.194 0.606 0.887 0.966 0.759 CB 1.717 30 residues pruned to eliminate duplicates Z: 14 18.200 1.784 0.534 0.932 0.923 0.769 CB 1.395 14 residues pruned to eliminate duplicates Z: 56 53.667 2.387 0.754 0.602 0.927 0.727 CB 1.691 56 residues pruned to eliminate duplicates Z: 63 31.766 2.232 0.507 0.434 0.855 0.548 CB 1.502 63 residues pruned to eliminate duplicates Z: 11 18.395 1.918 0.833 0.865 1.000 0.600 CB 1.212 11 residues pruned to eliminate duplicates Z: 36 38.899 2.320 0.708 0.648 0.943 0.771 CB 1.533 36 residues pruned to eliminate duplicates Z: 16 22.257 2.047 0.798 0.702 0.933 0.867 CB 1.392 16 residues pruned to eliminate duplicates Z: 26 28.152 2.093 0.633 0.660 1.000 0.640 CB 1.421 23 residues pruned to eliminate duplicates Z: 27 12.398 1.840 0.370 0.392 0.923 0.577 CB 1.171 11 residues pruned to eliminate duplicates Z: 14 19.963 1.754 0.703 0.894 1.000 0.769 CB 1.329 14 residues pruned to eliminate duplicates Z: 29 54.232 2.388 0.882 0.818 1.000 0.750 CB 1.730 29 residues pruned to eliminate duplicates Z: 18 13.431 2.136 0.276 0.468 0.882 0.588 CB 1.400 18 residues pruned to eliminate duplicates Z: 12 4.409 2.100 0.092 0.253 0.636 0.273 CB 1.209 12 residues pruned to eliminate duplicates Z: 21 11.655 1.888 0.524 0.484 0.850 0.450 CB 1.083 21 residues pruned to eliminate duplicates Z: 47 32.202 2.022 0.739 0.630 0.935 0.739 CB 1.278 50 residues pruned to eliminate duplicates Z: 9 5.196 1.563 0.265 0.681 0.750 0.625 CB 1.049 9 residues pruned to eliminate duplicates Z: 47 47.083 2.429 0.724 0.521 0.935 0.565 CB 1.737 47 residues pruned to eliminate duplicates Z: 14 15.507 1.861 0.210 0.938 1.000 0.923 CB 1.328 14 residues pruned to eliminate duplicates Z: 12 10.867 2.062 0.609 0.294 0.909 0.455 CB 1.369 12 residues pruned to eliminate duplicates Z: 14 14.969 1.673 0.472 0.891 1.000 0.769 CB 1.212 14 residues pruned to eliminate duplicates Z: 63 46.451 2.305 0.648 0.568 0.968 0.774 CB 1.503 63 residues pruned to eliminate duplicates Z: 50 33.075 2.266 0.487 0.545 0.918 0.612 CB 1.462 50 residues pruned to eliminate duplicates Z: 24 44.333 2.388 0.824 0.912 0.957 0.609 CB 1.572 24 residues pruned to eliminate duplicates Z: 26 17.764 1.817 0.552 0.676 0.960 0.800 CB 1.115 25 residues pruned to eliminate duplicates Z: 7 3.852 1.410 0.147 0.705 0.833 0.500 CB 0.968 7 residues pruned to eliminate duplicates Z: 33 39.716 2.125 0.738 0.853 0.875 0.781 CB 1.606 33 residues pruned to eliminate duplicates Z: 14 17.264 1.732 0.709 0.943 1.000 0.692 CB 1.121 14 residues pruned to eliminate duplicates Z: 38 48.606 2.481 0.777 0.502 1.000 0.757 CB 1.809 38 residues pruned to eliminate duplicates Z: 9 5.514 1.770 0.206 0.548 0.875 0.625 CB 0.996 9 residues pruned to eliminate duplicates 7 1.692 1.357 0.023 0.355 0.667 0.500 C 0.873 ? Z: 53 33.295 2.210 0.623 0.525 0.865 0.615 CB 1.451 81 residues pruned to eliminate duplicates Z: 16 42.080 2.348 0.979 0.903 1.000 0.733 CB 1.666 16 residues pruned to eliminate duplicates Z: 31 62.597 2.416 0.918 0.917 0.967 0.600 CB 1.801 31 residues pruned to eliminate duplicates Z: 15 28.208 2.145 0.874 0.875 1.000 0.857 CB 1.364 15 residues pruned to eliminate duplicates Z: 13 17.882 1.885 0.510 0.892 0.917 0.667 CB 1.421 13 residues pruned to eliminate duplicates Z: 10 9.068 2.069 0.619 0.381 0.778 0.444 CB 1.316 5 residues pruned to eliminate duplicates Z: 60 46.933 2.457 0.655 0.439 0.915 0.593 CB 1.749 60 residues pruned to eliminate duplicates Z: 28 19.620 2.078 0.522 0.431 0.889 0.519 CB 1.442 28 residues pruned to eliminate duplicates Z: 26 30.181 2.377 0.664 0.659 0.880 0.800 CB 1.497 26 residues pruned to eliminate duplicates Z: 6 4.702 1.947 0.145 0.797 0.800 0.600 CB 0.909 6 residues pruned to eliminate duplicates Z: 7 6.542 1.755 0.665 0.366 0.833 0.833 C 1.266 7 residues pruned to eliminate duplicates Z: 41 34.856 2.255 0.590 0.593 0.950 0.625 CB 1.481 41 residues pruned to eliminate duplicates Z: 42 33.602 2.054 0.919 0.602 0.951 0.659 CB 1.270 42 residues pruned to eliminate duplicates Z: 8 6.510 1.919 0.018 0.646 0.857 0.714 CB 1.281 8 residues pruned to eliminate duplicates Z: 9 3.468 1.738 0.212 0.239 0.750 0.500 CB 1.050 9 residues pruned to eliminate duplicates Z: 23 15.988 1.873 0.402 0.562 1.000 0.591 CB 1.222 23 residues pruned to eliminate duplicates Z: 8 3.105 1.298 0.257 0.424 0.714 0.286 N 1.089 8 residues pruned to eliminate duplicates Z: 12 27.828 2.304 0.736 0.880 1.000 0.727 CB 1.519 12 residues pruned to eliminate duplicates Z: 54 36.618 2.288 0.692 0.552 0.887 0.698 CB 1.394 54 residues pruned to eliminate duplicates Z: 66 32.832 2.174 0.532 0.452 0.908 0.615 CB 1.415 66 residues pruned to eliminate duplicates Z: 16 25.552 2.017 0.968 0.923 0.933 0.667 CB 1.251 16 residues pruned to eliminate duplicates Z: 16 39.088 2.253 0.910 0.895 1.000 0.400 CB 1.681 16 residues pruned to eliminate duplicates Z: 6 9.626 2.187 0.359 0.376 1.000 0.200 CA 1.655 6 residues pruned to eliminate duplicates Z: 13 22.738 2.181 0.655 0.878 1.000 0.667 CB 1.319 13 residues pruned to eliminate duplicates Z: 17 26.018 1.965 0.981 0.891 1.000 0.750 CB 1.201 17 residues pruned to eliminate duplicates Z: 24 56.709 2.462 1.207 0.955 0.957 0.826 CB 1.563 24 residues pruned to eliminate duplicates Z: 14 15.688 1.633 0.477 0.873 1.000 0.846 CB 1.314 14 residues pruned to eliminate duplicates Z: 9 8.160 1.772 0.171 0.638 0.875 0.750 CB 1.396 Z: 63 35.405 2.030 0.751 0.553 0.919 0.629 CB 1.307 62 residues pruned to eliminate duplicates Z: 11 19.920 2.264 0.597 0.626 0.900 0.600 CB 1.719 11 residues pruned to eliminate duplicates Z: 26 17.282 1.781 0.486 0.686 0.920 0.680 CB 1.197 26 residues pruned to eliminate duplicates Z: 7 10.675 2.167 0.403 0.598 1.000 0.833 CB 1.305 7 residues pruned to eliminate duplicates Z: 41 34.960 2.210 0.812 0.508 0.950 0.700 CB 1.442 41 residues pruned to eliminate duplicates Z: 7 6.950 1.685 0.132 0.738 0.833 0.833 CB 1.442 7 residues pruned to eliminate duplicates 7 1.757 1.126 0.525 0.289 0.667 0.333 CA 0.794 ? Z: 18 26.649 2.338 0.545 0.806 0.882 0.706 CB 1.553 18 residues pruned to eliminate duplicates Z: 8 14.666 2.055 0.391 0.737 1.000 0.857 CB 1.568 Z: 12 20.673 1.968 0.647 0.931 1.000 0.727 CB 1.345 12 residues pruned to eliminate duplicates Z: 6 8.269 1.844 0.145 0.840 1.000 1.000 CB 1.307 Z: 9 6.853 1.747 0.054 0.891 1.000 0.875 CB 0.945 9 residues pruned to eliminate duplicates Z: 6 5.308 1.500 0.454 0.489 1.000 0.600 CB 1.101 6 residues pruned to eliminate duplicates Z: 11 22.470 1.990 0.684 0.908 1.000 1.000 CB 1.506 11 residues pruned to eliminate duplicates Z: 9 5.531 1.780 0.170 0.583 0.875 0.625 CB 0.991 9 residues pruned to eliminate duplicates Z: 12 13.221 2.195 0.213 0.352 1.000 0.545 CA 1.758 12 residues pruned to eliminate duplicates Z: 41 28.468 2.080 0.826 0.544 0.850 0.450 CB 1.336 41 residues pruned to eliminate duplicates Z: 8 12.191 1.799 0.537 0.546 1.000 0.857 CB 1.594 8 residues pruned to eliminate duplicates Z: 14 12.658 1.875 -0.089 0.943 1.000 1.000 CB 1.425 14 residues pruned to eliminate duplicates Z: 30 25.623 2.120 0.786 0.506 0.862 0.586 CB 1.449 30 residues pruned to eliminate duplicates Z: 30 72.379 2.390 1.220 0.924 1.000 0.690 CB 1.779 30 residues pruned to eliminate duplicates Z: 32 30.953 2.200 0.796 0.580 0.871 0.419 CB 1.496 32 residues pruned to eliminate duplicates Z: 9 16.788 2.176 0.860 0.582 0.875 0.625 CB 1.548 9 residues pruned to eliminate duplicates Z: 15 22.067 2.144 0.747 0.906 0.929 0.786 CB 1.206 15 residues pruned to eliminate duplicates Z: 16 31.592 2.260 0.557 0.922 1.000 0.867 CB 1.630 16 residues pruned to eliminate duplicates Z: 6 8.850 1.861 0.547 0.795 1.000 0.600 CB 1.061 6 residues pruned to eliminate duplicates Z: 34 57.312 2.551 0.814 0.665 1.000 0.606 CB 1.851 34 residues pruned to eliminate duplicates Z: 27 14.775 1.888 0.570 0.432 0.846 0.654 CB 1.239 27 residues pruned to eliminate duplicates Z: 7 11.939 1.860 0.606 0.777 1.000 0.667 CB 1.278 7 residues pruned to eliminate duplicates Z: 51 37.665 2.204 0.620 0.579 0.960 0.660 CB 1.440 51 residues pruned to eliminate duplicates Z: 13 25.085 2.345 1.085 0.598 0.917 0.667 CB 1.472 13 residues pruned to eliminate duplicates Z: 14 18.514 1.736 0.571 0.940 1.000 0.923 CB 1.308 14 residues pruned to eliminate duplicates Z: 16 9.190 1.711 0.543 0.471 0.867 0.467 CB 1.068 Z: 17 24.018 1.940 0.834 0.878 1.000 0.750 CB 1.225 17 residues pruned to eliminate duplicates Z: 14 27.240 2.098 1.126 0.898 1.000 0.538 CB 1.212 14 residues pruned to eliminate duplicates Z: 13 19.467 2.247 0.216 0.881 1.000 0.667 CB 1.489 13 residues pruned to eliminate duplicates Z: 6 2.964 1.536 0.344 0.515 0.800 0.400 CA 0.790 6 residues pruned to eliminate duplicates Z: 7 7.224 1.470 0.388 0.626 1.000 0.667 CA 1.283 7 residues pruned to eliminate duplicates Z: 18 12.933 1.986 0.321 0.505 0.882 0.647 CB 1.347 18 residues pruned to eliminate duplicates Z: 7 7.395 1.716 0.236 0.650 1.000 0.667 CA 1.238 7 residues pruned to eliminate duplicates Z: 17 8.409 1.770 0.318 0.548 0.938 0.438 CB 0.917 17 residues pruned to eliminate duplicates Z: 18 18.414 2.115 0.430 0.511 0.941 0.706 CB 1.550 18 residues pruned to eliminate duplicates Z: 9 4.336 1.462 0.352 0.358 0.875 0.500 O 1.033 Z: 40 61.573 2.453 0.895 0.690 0.974 0.769 CB 1.830 40 residues pruned to eliminate duplicates Z: 36 42.859 2.497 0.660 0.590 0.886 0.543 CB 1.811 36 residues pruned to eliminate duplicates Z: 10 6.122 1.762 0.189 0.465 0.889 0.778 CB 1.136 10 residues pruned to eliminate duplicates Z: 17 14.651 1.928 0.549 0.516 0.938 0.750 CB 1.288 17 residues pruned to eliminate duplicates Z: 26 18.881 2.011 0.499 0.595 0.920 0.760 CB 1.243 140 residues pruned to eliminate duplicates Z: 17 43.630 2.391 0.898 0.921 1.000 0.938 CB 1.691 17 residues pruned to eliminate duplicates Z: 34 17.832 1.985 0.522 0.418 0.848 0.485 CB 1.319 34 residues pruned to eliminate duplicates Z: 48 44.490 2.247 0.973 0.589 0.872 0.553 CB 1.541 56 residues pruned to eliminate duplicates Z: 13 18.266 1.783 0.517 0.910 1.000 0.833 CB 1.383 Z: 18 44.259 2.473 0.920 0.786 1.000 0.941 CB 1.757 18 residues pruned to eliminate duplicates Z: 10 9.077 1.766 0.465 0.719 0.889 0.556 CB 1.080 10 residues pruned to eliminate duplicates Z: 19 15.065 1.889 0.510 0.610 0.833 0.722 CB 1.346 15 residues pruned to eliminate duplicates Z: 11 24.177 2.291 0.666 0.679 1.000 0.600 CB 1.699 11 residues pruned to eliminate duplicates Z: 11 8.151 1.797 0.349 0.568 0.900 0.500 CB 1.107 Z: 20 13.415 1.891 0.440 0.548 0.842 0.737 CB 1.280 23 residues pruned to eliminate duplicates Z: 39 33.706 2.230 0.865 0.555 0.868 0.632 CB 1.436 39 residues pruned to eliminate duplicates Z: 17 14.890 1.928 0.641 0.550 0.938 0.688 CB 1.195 Z: 14 13.798 1.802 0.934 0.504 0.769 0.615 CA 1.421 14 residues pruned to eliminate duplicates Z: 6 4.752 1.619 0.621 0.421 1.000 0.600 CB 0.880 Z: 6 3.728 1.774 0.078 0.751 0.800 0.800 CB 0.871 6 residues pruned to eliminate duplicates Z: 9 9.129 1.818 0.080 0.878 1.000 0.875 CB 1.193 9 residues pruned to eliminate duplicates Z: 16 25.362 1.888 1.027 0.906 1.000 0.667 CB 1.217 16 residues pruned to eliminate duplicates Z: 22 27.633 2.130 0.897 0.875 0.810 0.524 CB 1.340 22 residues pruned to eliminate duplicates Z: 59 49.014 2.397 0.715 0.551 0.879 0.672 CB 1.694 59 residues pruned to eliminate duplicates Z: 33 58.299 2.251 0.824 0.915 1.000 0.844 CB 1.774 33 residues pruned to eliminate duplicates Z: 13 12.650 2.095 0.127 0.664 0.917 0.750 CB 1.449 13 residues pruned to eliminate duplicates Z: 64 71.134 2.441 0.893 0.666 0.921 0.683 CB 1.806 64 residues pruned to eliminate duplicates Z: 10 9.293 1.782 0.302 0.847 0.889 0.556 CB 1.114 10 residues pruned to eliminate duplicates Z: 11 29.505 2.416 1.037 0.493 1.000 0.700 CA 1.910 11 residues pruned to eliminate duplicates Z: 33 37.925 2.324 0.714 0.551 0.906 0.594 CB 1.766 33 residues pruned to eliminate duplicates Z: 36 25.530 2.030 0.573 0.564 0.971 0.657 CB 1.307 36 residues pruned to eliminate duplicates Z: 12 7.176 1.783 0.387 0.305 0.727 0.545 O 1.494 12 residues pruned to eliminate duplicates Z: 13 12.897 1.861 0.397 0.678 0.917 0.500 CB 1.327 12 residues pruned to eliminate duplicates Z: 18 14.408 1.963 0.527 0.413 0.824 0.529 CB 1.550 18 residues pruned to eliminate duplicates Z: 12 32.831 2.338 0.834 0.891 1.000 0.636 CB 1.660 12 residues pruned to eliminate duplicates Z: 29 24.093 2.141 0.585 0.546 0.857 0.571 CB 1.495 29 residues pruned to eliminate duplicates Z: 66 33.001 2.206 0.569 0.478 0.892 0.554 CB 1.355 66 residues pruned to eliminate duplicates Z: 50 39.269 2.268 0.738 0.616 0.939 0.673 CB 1.359 50 residues pruned to eliminate duplicates Z: 26 20.450 1.922 0.607 0.673 0.920 0.600 CB 1.227 26 residues pruned to eliminate duplicates Z: 26 42.072 2.338 0.947 0.709 1.000 0.800 CB 1.528 26 residues pruned to eliminate duplicates Z: 46 35.906 2.282 0.565 0.646 0.978 0.733 CB 1.337 46 residues pruned to eliminate duplicates Z: 6 5.850 1.827 0.584 0.846 0.800 0.600 CB 0.840 6 residues pruned to eliminate duplicates Z: 35 65.880 2.378 0.880 0.841 1.000 0.765 CB 1.884 35 residues pruned to eliminate duplicates Z: 7 2.734 1.686 -0.041 0.532 1.000 0.667 CB 0.669 7 residues pruned to eliminate duplicates Z: 64 56.483 2.442 0.741 0.565 0.937 0.603 CB 1.678 64 residues pruned to eliminate duplicates Z: 16 48.260 2.428 0.964 0.926 1.000 0.933 CA 1.832 16 residues pruned to eliminate duplicates Z: 17 10.241 1.923 0.484 0.358 0.812 0.438 CB 1.287 Z: 11 5.078 2.082 0.147 0.248 0.700 0.500 CB 1.286 11 residues pruned to eliminate duplicates Z: 8 8.305 1.746 0.202 0.894 1.000 0.571 CB 1.073 8 residues pruned to eliminate duplicates Z: 7 6.772 1.936 0.118 0.818 1.000 0.667 CB 0.969 7 residues pruned to eliminate duplicates Z: 24 23.104 2.176 0.684 0.500 0.870 0.652 CB 1.512 24 residues pruned to eliminate duplicates Z: 24 36.427 2.061 0.769 0.949 1.000 1.000 CB 1.437 24 residues pruned to eliminate duplicates Z: 14 31.391 2.354 0.807 0.927 0.923 0.308 CB 1.553 14 residues pruned to eliminate duplicates Z: 6 4.640 1.818 0.515 0.813 0.800 0.800 CB 0.717 6 residues pruned to eliminate duplicates Z: 59 78.418 2.552 0.845 0.712 0.966 0.724 CB 1.869 59 residues pruned to eliminate duplicates Z: 13 32.938 2.519 0.546 0.899 0.917 0.833 CA 1.904 13 residues pruned to eliminate duplicates Z: 25 13.998 1.823 0.528 0.506 0.917 0.708 CB 1.113 25 residues pruned to eliminate duplicates Z: 17 10.304 1.744 0.425 0.375 0.938 0.250 CB 1.264 33 residues pruned to eliminate duplicates Z: 10 16.832 2.259 0.932 0.513 0.889 0.556 CA 1.427 10 residues pruned to eliminate duplicates Z: 9 15.109 2.035 0.573 0.749 0.875 0.875 CA 1.528 4 residues pruned to eliminate duplicates Z: 26 27.617 2.020 0.568 0.795 0.960 0.800 CB 1.402 26 residues pruned to eliminate duplicates Z: 29 40.435 2.289 0.787 0.667 0.929 0.714 CB 1.725 29 residues pruned to eliminate duplicates Z: 13 19.105 1.785 0.660 0.936 1.000 0.917 CB 1.295 13 residues pruned to eliminate duplicates Z: 9 6.710 1.773 0.564 0.321 0.750 0.500 CA 1.389 Z: 12 8.688 2.041 0.654 0.366 0.727 0.455 CB 1.232 12 residues pruned to eliminate duplicates Z: 102 86.608 2.342 0.989 0.676 0.950 0.673 CB 1.654 124 residues pruned to eliminate duplicates Z: 23 54.821 2.311 1.123 0.905 0.955 0.773 CA 1.776 23 residues pruned to eliminate duplicates Z: 33 37.945 2.392 0.702 0.625 0.969 0.500 CB 1.513 33 residues pruned to eliminate duplicates Z: 8 7.307 1.882 0.069 0.706 0.857 0.571 C 1.328 8 residues pruned to eliminate duplicates Z: 57 53.252 2.330 0.896 0.539 0.911 0.679 CB 1.701 57 residues pruned to eliminate duplicates Z: 24 52.375 2.445 1.037 0.945 0.957 0.522 CB 1.586 24 residues pruned to eliminate duplicates Z: 7 4.317 1.432 0.229 0.443 1.000 0.500 CB 1.062 Z: 8 3.644 1.699 -0.123 0.440 0.857 0.571 CB 1.147 Z: 7 6.617 1.925 0.383 0.653 0.833 0.667 CB 1.056 7 residues pruned to eliminate duplicates Z: 8 13.341 2.134 0.542 0.574 0.857 0.714 CB 1.665 8 residues pruned to eliminate duplicates Z: 32 66.790 2.360 1.013 0.923 0.968 0.742 CB 1.834 32 residues pruned to eliminate duplicates Z: 6 3.269 1.731 -0.307 0.556 0.800 0.600 C 1.442 6 1.885 1.217 0.295 0.464 0.800 0.400 CB 0.694 ? Z: 139 89.947 2.403 0.773 0.659 0.935 0.710 CB 1.658 139 residues pruned to eliminate duplicates Z: 16 28.501 2.181 0.815 0.916 1.000 0.800 CB 1.313 16 residues pruned to eliminate duplicates Z: 33 17.872 2.049 0.487 0.406 0.875 0.594 CB 1.308 33 residues pruned to eliminate duplicates Z: 11 16.442 2.105 0.521 0.649 1.000 0.700 CB 1.413 12 residues pruned to eliminate duplicates Z: 51 30.526 2.230 0.521 0.495 0.900 0.660 CB 1.422 51 residues pruned to eliminate duplicates Z: 44 42.958 2.346 0.640 0.623 0.907 0.767 CB 1.672 44 residues pruned to eliminate duplicates Z: 27 46.015 2.466 1.035 0.665 0.923 0.692 CB 1.672 27 residues pruned to eliminate duplicates Z: 64 64.499 2.437 0.852 0.595 0.921 0.651 CB 1.785 64 residues pruned to eliminate duplicates Z: 15 34.342 2.310 0.917 0.921 0.929 0.500 CB 1.571 15 residues pruned to eliminate duplicates Z: 11 7.017 1.846 0.421 0.310 0.800 0.200 CB 1.306 11 residues pruned to eliminate duplicates Z: 17 34.110 2.438 1.095 0.594 0.875 0.688 CB 1.744 17 residues pruned to eliminate duplicates Z: 60 29.832 2.133 0.494 0.420 0.864 0.458 CB 1.532 60 residues pruned to eliminate duplicates Z: 14 11.442 1.632 0.661 0.502 1.000 0.538 CB 1.168 Z: 6 2.341 1.420 0.094 0.468 0.600 0.400 O 1.160 Z: 22 29.812 2.275 0.612 0.657 0.952 0.667 CB 1.610 22 residues pruned to eliminate duplicates Z: 24 50.961 2.319 0.900 0.845 1.000 0.783 CB 1.793 24 residues pruned to eliminate duplicates Z: 65 61.117 2.435 0.799 0.598 0.922 0.719 CB 1.722 65 residues pruned to eliminate duplicates Z: 7 5.018 1.720 0.225 0.777 0.833 0.667 CB 0.913 7 residues pruned to eliminate duplicates Z: 6 11.377 1.783 0.455 0.845 1.000 0.800 C 1.458 6 residues pruned to eliminate duplicates Z: 10 8.996 1.809 0.113 0.885 0.889 0.667 CB 1.211 10 residues pruned to eliminate duplicates Z: 8 5.256 1.799 0.162 0.402 0.714 0.429 CB 1.475 8 residues pruned to eliminate duplicates Z: 30 30.892 2.025 0.746 0.723 0.966 0.793 CB 1.374 Z: 12 7.822 1.791 0.067 0.783 0.909 0.545 CB 1.059 12 residues pruned to eliminate duplicates Z: 12 16.868 2.003 0.885 0.479 0.909 0.636 CB 1.512 26 residues pruned to eliminate duplicates Z: 11 9.901 2.015 0.720 0.332 0.800 0.400 CB 1.357 11 residues pruned to eliminate duplicates Z: 59 40.566 2.230 0.526 0.580 0.966 0.638 CB 1.502 59 residues pruned to eliminate duplicates Z: 7 5.319 1.879 0.623 0.378 0.667 0.500 CB 1.216 7 residues pruned to eliminate duplicates Z: 16 8.274 1.642 0.398 0.537 0.867 0.400 CB 1.035 16 residues pruned to eliminate duplicates Z: 39 27.364 2.108 0.719 0.500 0.895 0.711 CB 1.369 39 residues pruned to eliminate duplicates Z: 34 50.722 2.385 0.769 0.685 1.000 0.667 CB 1.767 34 residues pruned to eliminate duplicates Z: 17 24.188 1.937 1.034 0.877 0.938 0.438 CB 1.189 17 residues pruned to eliminate duplicates Z: 28 14.933 1.950 0.382 0.494 0.889 0.519 CB 1.208 28 residues pruned to eliminate duplicates Z: 10 19.302 2.037 0.723 0.746 1.000 1.000 CA 1.471 10 residues pruned to eliminate duplicates Z: 6 8.978 1.705 0.813 0.802 1.000 1.000 CB 0.997 Z: 12 24.653 2.183 0.734 0.714 1.000 0.545 CA 1.618 12 residues pruned to eliminate duplicates Z: 83 97.360 2.444 1.151 0.741 0.963 0.683 CB 1.710 83 residues pruned to eliminate duplicates Z: 15 55.264 2.531 1.201 0.855 1.000 0.643 CB 1.956 15 residues pruned to eliminate duplicates Z: 14 25.955 2.579 0.534 0.537 0.923 0.692 CA 1.900 14 residues pruned to eliminate duplicates Z: 7 6.618 1.925 0.236 0.671 0.833 0.667 CB 1.164 7 residues pruned to eliminate duplicates 6 1.363 1.420 0.302 0.299 0.600 0.600 C 0.688 ? Z: 65 44.675 2.254 0.646 0.547 0.859 0.594 CB 1.673 65 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 18 11.586 1.753 0.328 0.467 0.941 0.647 CB 1.327 18 residues pruned to eliminate duplicates Z: 10 9.416 1.932 0.560 0.353 0.778 0.556 CA 1.570 10 residues pruned to eliminate duplicates Z: 13 11.452 1.872 0.748 0.348 0.833 0.333 CB 1.430 13 residues pruned to eliminate duplicates Z: 12 15.189 2.090 0.793 0.415 0.818 0.545 CB 1.633 12 residues pruned to eliminate duplicates Z: 9 11.014 1.781 0.431 0.905 1.000 1.000 CB 1.088 9 residues pruned to eliminate duplicates Z: 8 9.604 1.748 0.278 0.895 1.000 0.857 CB 1.165 8 residues pruned to eliminate duplicates Z: 9 9.235 1.797 0.211 0.907 1.000 0.875 CB 1.066 9 residues pruned to eliminate duplicates Z: 19 11.598 1.735 0.263 0.664 0.944 0.667 CB 1.134 19 residues pruned to eliminate duplicates Z: 14 10.095 1.841 0.315 0.676 0.923 0.615 CB 1.066 14 residues pruned to eliminate duplicates Z: 17 11.922 1.812 0.353 0.661 0.875 0.750 CB 1.197 16 residues pruned to eliminate duplicates Z: 11 8.255 1.633 0.207 0.808 1.000 0.700 CB 1.013 11 residues pruned to eliminate duplicates Z: 18 12.503 1.755 0.493 0.664 0.941 0.706 CB 1.056 18 residues pruned to eliminate duplicates Z: 84 69.890 2.331 0.832 0.678 0.916 0.614 CB 1.665 102 residues pruned to eliminate duplicates Z: 17 13.036 1.788 0.376 0.708 0.938 0.688 CB 1.169 Z: 7 7.522 1.778 0.307 0.830 1.000 0.833 CB 0.994 8 residues pruned to eliminate duplicates Z: 8 5.279 1.764 0.136 0.769 0.857 0.714 CB 0.916 7 residues pruned to eliminate duplicates Z: 9 5.939 1.569 0.356 0.699 0.875 0.750 CB 0.940 9 residues pruned to eliminate duplicates Z: 6 6.642 1.669 0.393 0.759 0.800 0.600 CB 1.268 6 residues pruned to eliminate duplicates Z: 18 12.896 1.756 0.468 0.721 0.941 0.647 CB 1.056 18 residues pruned to eliminate duplicates Z: 12 17.254 1.995 0.510 0.708 1.000 0.545 CB 1.430 12 residues pruned to eliminate duplicates Z: 18 13.170 2.102 0.298 0.401 0.882 0.471 CB 1.473 18 residues pruned to eliminate duplicates Z: 18 12.748 2.102 0.288 0.427 0.824 0.529 CB 1.497 18 residues pruned to eliminate duplicates Z: 13 10.234 1.959 0.217 0.537 1.000 0.583 CB 1.195 12 residues pruned to eliminate duplicates Z: 15 13.709 2.123 0.384 0.356 0.929 0.429 CA 1.569 15 residues pruned to eliminate duplicates Z: 19 15.443 1.971 0.411 0.429 0.944 0.444 CB 1.491 19 residues pruned to eliminate duplicates Z: 18 11.151 2.035 0.265 0.412 0.824 0.471 CB 1.400 18 residues pruned to eliminate duplicates Z: 17 13.752 2.153 0.254 0.448 0.938 0.500 CB 1.433 17 residues pruned to eliminate duplicates Z: 19 13.420 2.025 0.256 0.466 0.889 0.389 CB 1.448 19 residues pruned to eliminate duplicates Z: 23 13.901 1.927 0.308 0.465 0.864 0.500 CB 1.410 23 residues pruned to eliminate duplicates Z: 6 8.836 2.261 0.597 0.369 0.800 0.600 CA 1.574 8 residues pruned to eliminate duplicates Z: 6 4.964 1.711 0.459 0.298 1.000 0.400 N 1.114 6 residues pruned to eliminate duplicates Z: 16 13.802 2.137 0.366 0.506 0.867 0.533 CB 1.401 16 residues pruned to eliminate duplicates Z: 19 15.624 2.127 0.390 0.487 0.944 0.444 CB 1.337 19 residues pruned to eliminate duplicates Z: 17 13.349 2.076 0.305 0.516 0.875 0.562 CB 1.385 17 residues pruned to eliminate duplicates Z: 9 17.559 2.117 0.986 0.536 1.000 0.750 CB 1.425 9 residues pruned to eliminate duplicates Z: 31 44.584 2.468 0.932 0.596 0.967 0.633 CB 1.610 29 residues pruned to eliminate duplicates Z: 8 12.695 1.944 1.100 0.496 0.857 0.714 CB 1.377 8 residues pruned to eliminate duplicates Z: 53 49.126 2.299 0.887 0.633 0.942 0.635 CB 1.471 116 residues pruned to eliminate duplicates Z: 23 46.320 2.370 1.104 0.749 1.000 0.727 CB 1.586 23 residues pruned to eliminate duplicates Z: 23 52.708 2.551 1.042 0.697 1.000 0.818 CB 1.802 23 residues pruned to eliminate duplicates Z: 24 49.716 2.514 0.881 0.723 1.000 0.783 CB 1.793 24 residues pruned to eliminate duplicates Z: 37 56.013 2.479 0.954 0.607 0.944 0.639 CB 1.843 37 residues pruned to eliminate duplicates Z: 35 62.999 2.554 1.006 0.686 0.941 0.647 CB 1.890 35 residues pruned to eliminate duplicates Z: 36 57.872 2.536 0.927 0.648 0.943 0.743 CB 1.848 36 residues pruned to eliminate duplicates Z: 86 57.196 2.340 0.675 0.585 0.929 0.659 CB 1.569 86 residues pruned to eliminate duplicates Z: 25 48.407 2.504 1.038 0.698 1.000 0.833 CB 1.616 25 residues pruned to eliminate duplicates Z: 25 49.620 2.487 0.917 0.671 1.000 0.583 CB 1.814 25 residues pruned to eliminate duplicates Z: 24 52.573 2.452 1.138 0.675 1.000 0.609 CB 1.780 24 residues pruned to eliminate duplicates Z: 30 46.419 2.411 0.935 0.685 0.897 0.586 CB 1.738 30 residues pruned to eliminate duplicates Z: 25 45.957 2.459 1.050 0.658 0.917 0.583 CB 1.753 25 residues pruned to eliminate duplicates Z: 23 52.885 2.551 1.048 0.704 1.000 0.545 CB 1.793 23 residues pruned to eliminate duplicates Z: 35 65.618 2.558 1.111 0.624 0.971 0.647 CB 1.911 35 residues pruned to eliminate duplicates Z: 35 69.250 2.571 1.056 0.671 1.000 0.647 CB 1.919 35 residues pruned to eliminate duplicates Z: 67 60.783 2.425 0.710 0.599 0.924 0.652 CB 1.776 67 residues pruned to eliminate duplicates Z: 46 46.734 2.367 0.819 0.565 0.911 0.600 CB 1.667 46 residues pruned to eliminate duplicates Z: 66 65.098 2.422 0.780 0.621 0.954 0.631 CB 1.751 66 residues pruned to eliminate duplicates Z: 34 57.664 2.564 0.812 0.651 0.970 0.697 CB 1.936 34 residues pruned to eliminate duplicates Z: 38 49.701 2.554 0.747 0.559 0.946 0.649 CB 1.828 38 residues pruned to eliminate duplicates Z: 55 52.221 2.350 0.712 0.581 0.981 0.648 CB 1.665 55 residues pruned to eliminate duplicates Z: 35 58.055 2.565 0.852 0.628 0.971 0.676 CB 1.915 35 residues pruned to eliminate duplicates Z: 56 61.090 2.429 0.782 0.652 0.945 0.655 CB 1.748 56 residues pruned to eliminate duplicates Z: 35 55.865 2.535 0.792 0.649 0.971 0.618 CB 1.891 35 residues pruned to eliminate duplicates Z: 12 17.657 2.273 1.079 0.334 0.909 0.545 CB 1.486 12 residues pruned to eliminate duplicates Z: 13 33.724 2.551 0.943 0.490 1.000 0.417 CB 1.984 13 residues pruned to eliminate duplicates Z: 45 39.444 2.336 0.657 0.515 0.909 0.523 CB 1.665 45 residues pruned to eliminate duplicates Z: 36 54.039 2.535 0.818 0.637 0.971 0.686 CB 1.794 36 residues pruned to eliminate duplicates Z: 68 59.568 2.388 0.746 0.579 0.940 0.642 CB 1.720 68 residues pruned to eliminate duplicates Z: 67 57.679 2.379 0.712 0.585 0.939 0.621 CB 1.711 67 residues pruned to eliminate duplicates Z: 32 32.905 2.273 0.551 0.604 0.935 0.710 CB 1.623 32 residues pruned to eliminate duplicates Z: 67 54.113 2.375 0.584 0.592 0.955 0.606 CB 1.699 67 residues pruned to eliminate duplicates Z: 19 27.527 2.292 0.350 0.795 1.000 0.833 CB 1.619 19 residues pruned to eliminate duplicates Z: 18 27.861 2.226 0.413 0.837 1.000 0.882 CB 1.607 18 residues pruned to eliminate duplicates Z: 44 35.606 2.323 0.560 0.516 0.860 0.651 CB 1.714 44 residues pruned to eliminate duplicates Z: 23 25.317 2.156 0.480 0.589 0.955 0.773 CB 1.627 23 residues pruned to eliminate duplicates Z: 23 23.049 2.159 0.392 0.648 0.955 0.682 CB 1.491 23 residues pruned to eliminate duplicates Z: 32 30.310 2.250 0.488 0.590 0.935 0.581 CB 1.595 32 residues pruned to eliminate duplicates Z: 43 37.122 2.235 0.741 0.573 0.905 0.738 CB 1.515 43 residues pruned to eliminate duplicates Z: 33 30.458 2.260 0.568 0.563 0.906 0.594 CB 1.577 33 residues pruned to eliminate duplicates Z: 59 56.778 2.386 0.795 0.626 0.931 0.655 CB 1.660 59 residues pruned to eliminate duplicates Z: 71 48.809 2.254 0.698 0.582 0.943 0.686 CB 1.495 71 residues pruned to eliminate duplicates Z: 23 26.183 2.149 0.796 0.593 0.864 0.636 CB 1.532 23 residues pruned to eliminate duplicates Z: 31 31.548 2.264 0.652 0.567 0.867 0.600 CB 1.665 31 residues pruned to eliminate duplicates Z: 22 27.691 2.217 0.616 0.624 0.952 0.762 CB 1.575 22 residues pruned to eliminate duplicates Z: 20 32.632 2.253 0.921 0.685 0.895 0.526 CB 1.632 20 residues pruned to eliminate duplicates Z: 32 39.039 2.300 0.910 0.562 0.935 0.581 CB 1.607 32 residues pruned to eliminate duplicates Z: 33 33.871 2.275 0.835 0.550 0.906 0.438 CB 1.507 33 residues pruned to eliminate duplicates Z: 42 42.813 2.340 0.786 0.524 0.927 0.537 CB 1.686 42 residues pruned to eliminate duplicates Z: 58 45.530 2.322 0.733 0.480 0.912 0.509 CB 1.675 58 residues pruned to eliminate duplicates Z: 16 10.981 2.063 0.487 0.297 0.800 0.467 CB 1.449 16 residues pruned to eliminate duplicates Z: 14 17.025 2.291 0.590 0.368 0.846 0.462 CB 1.766 14 residues pruned to eliminate duplicates Z: 56 36.658 2.249 0.611 0.533 0.927 0.600 CB 1.424 56 residues pruned to eliminate duplicates Z: 19 13.432 2.028 0.589 0.294 0.833 0.389 CB 1.484 19 residues pruned to eliminate duplicates Z: 60 32.165 2.135 0.621 0.487 0.898 0.525 CB 1.365 60 residues pruned to eliminate duplicates Z: 16 12.826 2.159 0.561 0.360 0.800 0.600 CB 1.428 16 residues pruned to eliminate duplicates Z: 52 46.553 2.279 0.770 0.589 0.922 0.627 CB 1.610 52 residues pruned to eliminate duplicates Z: 17 15.013 2.167 0.745 0.329 0.750 0.375 CB 1.596 17 residues pruned to eliminate duplicates Z: 16 15.549 2.137 0.612 0.372 0.933 0.400 CB 1.433 16 residues pruned to eliminate duplicates Z: 27 17.253 1.986 0.685 0.338 0.846 0.423 CB 1.426 27 residues pruned to eliminate duplicates Z: 40 32.384 2.128 0.826 0.592 0.872 0.590 CB 1.401 40 residues pruned to eliminate duplicates Z: 25 27.731 2.257 0.808 0.543 0.875 0.500 CB 1.520 25 residues pruned to eliminate duplicates Z: 43 40.484 2.250 0.802 0.588 0.905 0.595 CB 1.565 43 residues pruned to eliminate duplicates Z: 85 43.446 2.108 0.791 0.541 0.905 0.524 CB 1.333 85 residues pruned to eliminate duplicates Z: 26 31.037 2.119 0.888 0.642 0.920 0.560 CB 1.477 26 residues pruned to eliminate duplicates Z: 14 30.789 2.284 0.960 0.788 0.923 0.692 CB 1.604 14 residues pruned to eliminate duplicates Z: 19 17.326 2.077 0.692 0.598 0.778 0.444 CB 1.361 19 residues pruned to eliminate duplicates Z: 14 28.349 2.255 0.974 0.793 0.923 0.538 CB 1.480 14 residues pruned to eliminate duplicates Z: 26 29.239 2.192 0.803 0.636 0.960 0.480 CB 1.357 26 residues pruned to eliminate duplicates Z: 42 39.636 2.217 0.803 0.602 0.951 0.561 CB 1.478 42 residues pruned to eliminate duplicates Z: 52 39.530 2.198 0.686 0.582 0.941 0.510 CB 1.467 52 residues pruned to eliminate duplicates Z: 76 47.877 2.195 0.777 0.573 0.880 0.493 CB 1.501 76 residues pruned to eliminate duplicates Z: 57 41.208 2.242 0.773 0.529 0.911 0.554 CB 1.478 57 residues pruned to eliminate duplicates Z: 65 47.975 2.218 0.751 0.643 0.906 0.562 CB 1.491 65 residues pruned to eliminate duplicates Z: 16 9.991 1.861 0.222 0.482 1.000 0.533 CB 1.154 16 residues pruned to eliminate duplicates Z: 36 21.360 1.990 0.588 0.550 0.943 0.571 CB 1.154 36 residues pruned to eliminate duplicates Z: 30 22.582 2.164 0.613 0.513 0.828 0.621 CB 1.434 30 residues pruned to eliminate duplicates Z: 31 23.730 2.101 0.699 0.492 0.900 0.467 CB 1.359 31 residues pruned to eliminate duplicates Z: 30 24.267 2.173 0.607 0.479 0.897 0.448 CB 1.469 30 residues pruned to eliminate duplicates Z: 36 27.234 1.989 0.693 0.592 0.943 0.571 CB 1.328 36 residues pruned to eliminate duplicates Z: 29 25.962 2.199 0.656 0.511 0.929 0.536 CB 1.434 29 residues pruned to eliminate duplicates Z: 36 23.822 1.993 0.635 0.524 0.971 0.457 CB 1.243 36 residues pruned to eliminate duplicates Z: 34 23.302 2.080 0.654 0.514 0.879 0.455 CB 1.324 34 residues pruned to eliminate duplicates Z: 81 54.894 2.314 0.719 0.536 0.938 0.663 CB 1.589 81 residues pruned to eliminate duplicates Z: 36 27.449 2.034 0.728 0.544 0.943 0.629 CB 1.341 36 residues pruned to eliminate duplicates Z: 28 23.742 2.202 0.732 0.469 0.889 0.593 CB 1.390 28 residues pruned to eliminate duplicates Z: 34 24.700 2.083 0.648 0.526 0.909 0.545 CB 1.343 34 residues pruned to eliminate duplicates Z: 31 26.137 2.133 0.703 0.475 0.933 0.667 CB 1.443 31 residues pruned to eliminate duplicates Z: 36 28.209 2.022 0.719 0.562 0.971 0.657 CB 1.330 36 residues pruned to eliminate duplicates Z: 32 26.619 2.132 0.741 0.478 0.968 0.581 CB 1.360 32 residues pruned to eliminate duplicates Z: 74 51.866 2.266 0.742 0.570 0.959 0.562 CB 1.499 74 residues pruned to eliminate duplicates Z: 36 25.360 2.029 0.602 0.554 0.971 0.657 CB 1.288 36 residues pruned to eliminate duplicates Z: 30 25.753 2.162 0.616 0.494 0.966 0.586 CB 1.427 30 residues pruned to eliminate duplicates Z: 31 23.027 2.113 0.600 0.493 0.933 0.533 CB 1.341 31 residues pruned to eliminate duplicates Z: 29 26.037 2.181 0.630 0.513 0.964 0.571 CB 1.416 29 residues pruned to eliminate duplicates Z: 34 24.774 2.077 0.542 0.537 0.970 0.606 CB 1.339 34 residues pruned to eliminate duplicates Z: 31 19.211 2.134 0.483 0.456 0.900 0.600 CB 1.288 31 residues pruned to eliminate duplicates Z: 69 44.319 2.328 0.696 0.492 0.882 0.485 CB 1.555 69 residues pruned to eliminate duplicates Z: 29 26.874 2.202 0.716 0.524 0.929 0.607 CB 1.414 29 residues pruned to eliminate duplicates Z: 34 21.427 2.070 0.497 0.527 0.939 0.545 CB 1.247 34 residues pruned to eliminate duplicates Z: 36 48.674 2.553 0.843 0.601 0.857 0.514 CB 1.852 36 residues pruned to eliminate duplicates Z: 37 48.466 2.524 0.917 0.558 0.833 0.444 CB 1.894 37 residues pruned to eliminate duplicates Z: 24 42.273 2.533 0.932 0.676 0.913 0.435 CB 1.677 24 residues pruned to eliminate duplicates Z: 9 15.710 2.574 0.507 0.356 0.875 0.375 CB 1.912 9 residues pruned to eliminate duplicates Z: 52 53.535 2.440 0.768 0.650 0.863 0.510 CB 1.751 52 residues pruned to eliminate duplicates Z: 65 58.408 2.483 0.790 0.596 0.859 0.500 CB 1.744 65 residues pruned to eliminate duplicates Z: 37 37.207 2.439 0.699 0.547 0.889 0.361 CB 1.608 37 residues pruned to eliminate duplicates Z: 68 59.212 2.471 0.773 0.583 0.910 0.657 CB 1.675 68 residues pruned to eliminate duplicates Z: 66 67.980 2.482 0.946 0.591 0.892 0.569 CB 1.794 66 residues pruned to eliminate duplicates Z: 24 51.947 2.543 1.014 0.743 1.000 0.522 CB 1.701 24 residues pruned to eliminate duplicates Z: 53 40.132 2.307 0.706 0.561 0.923 0.577 CB 1.445 53 residues pruned to eliminate duplicates Z: 36 49.596 2.511 0.767 0.586 0.943 0.486 CB 1.845 36 residues pruned to eliminate duplicates Z: 29 46.723 2.530 0.855 0.638 0.893 0.607 CB 1.852 29 residues pruned to eliminate duplicates Z: 49 52.420 2.425 0.673 0.636 0.938 0.521 CB 1.751 49 residues pruned to eliminate duplicates Z: 35 50.074 2.552 0.856 0.639 0.882 0.647 CB 1.803 35 residues pruned to eliminate duplicates Z: 27 49.423 2.508 0.966 0.654 1.000 0.692 CB 1.704 27 residues pruned to eliminate duplicates Z: 22 50.509 2.589 1.030 0.750 0.905 0.714 CB 1.855 22 residues pruned to eliminate duplicates Z: 25 48.913 2.576 0.836 0.721 0.958 0.708 CB 1.804 25 residues pruned to eliminate duplicates Z: 24 51.488 2.544 0.892 0.717 1.000 0.826 CB 1.832 24 residues pruned to eliminate duplicates Z: 28 49.186 2.551 0.897 0.674 0.926 0.593 CB 1.800 28 residues pruned to eliminate duplicates Z: 26 42.344 2.517 0.871 0.646 0.960 0.600 CB 1.635 26 residues pruned to eliminate duplicates Z: 145 99.347 2.473 0.873 0.642 0.910 0.674 CB 1.720 145 residues pruned to eliminate duplicates Z: 36 58.862 2.553 0.893 0.640 0.943 0.600 CB 1.916 36 residues pruned to eliminate duplicates Z: 69 58.033 2.461 0.731 0.579 0.882 0.647 CB 1.736 69 residues pruned to eliminate duplicates Z: 34 58.504 2.603 0.744 0.703 0.970 0.667 CB 1.923 34 residues pruned to eliminate duplicates Z: 36 52.265 2.558 0.854 0.583 0.914 0.629 CB 1.882 36 residues pruned to eliminate duplicates Z: 12 27.273 2.583 0.981 0.425 0.818 0.364 CB 2.123 12 residues pruned to eliminate duplicates Z: 29 47.144 2.523 0.696 0.640 0.964 0.571 CB 1.893 29 residues pruned to eliminate duplicates Z: 52 59.079 2.496 0.685 0.635 0.941 0.627 CB 1.841 52 residues pruned to eliminate duplicates Z: 42 31.005 2.345 0.704 0.378 0.805 0.463 CB 1.713 42 residues pruned to eliminate duplicates Z: 22 29.598 2.436 0.835 0.431 0.857 0.571 CB 1.812 22 residues pruned to eliminate duplicates Z: 35 37.771 2.514 0.558 0.566 0.824 0.676 CB 1.884 35 residues pruned to eliminate duplicates Z: 72 46.776 2.309 0.637 0.529 0.944 0.549 CB 1.512 72 residues pruned to eliminate duplicates Z: 45 41.895 2.387 0.715 0.491 0.886 0.591 CB 1.756 45 residues pruned to eliminate duplicates Z: 9 20.707 2.507 0.935 0.324 0.875 0.500 CA 2.093 9 residues pruned to eliminate duplicates Z: 43 39.741 2.375 0.879 0.467 0.857 0.595 CB 1.657 43 residues pruned to eliminate duplicates Z: 67 57.533 2.444 0.774 0.574 0.894 0.621 CB 1.700 67 residues pruned to eliminate duplicates Z: 42 35.645 2.288 0.691 0.459 0.902 0.561 CB 1.663 42 residues pruned to eliminate duplicates Z: 32 37.144 2.293 0.684 0.593 0.903 0.645 CB 1.750 32 residues pruned to eliminate duplicates Z: 19 30.000 2.245 0.571 0.714 0.944 0.778 CB 1.749 19 residues pruned to eliminate duplicates Z: 34 31.609 2.263 0.652 0.605 0.818 0.636 CB 1.629 34 residues pruned to eliminate duplicates Z: 57 47.699 2.417 0.681 0.606 0.857 0.661 CB 1.655 57 residues pruned to eliminate duplicates Z: 36 29.964 2.212 0.629 0.516 0.886 0.600 CB 1.563 36 residues pruned to eliminate duplicates Z: 65 53.379 2.430 0.767 0.556 0.875 0.609 CB 1.682 65 residues pruned to eliminate duplicates Z: 68 61.690 2.422 0.773 0.606 0.925 0.537 CB 1.715 68 residues pruned to eliminate duplicates Z: 66 63.383 2.444 0.828 0.596 0.923 0.646 CB 1.739 66 residues pruned to eliminate duplicates Z: 54 43.874 2.375 0.629 0.600 0.887 0.585 CB 1.598 54 residues pruned to eliminate duplicates Z: 41 35.964 2.274 0.989 0.458 0.850 0.450 CB 1.545 41 residues pruned to eliminate duplicates Z: 104 84.373 2.444 0.837 0.666 0.913 0.621 CB 1.740 104 residues pruned to eliminate duplicates Z: 92 72.922 2.459 0.866 0.590 0.901 0.637 CB 1.696 92 residues pruned to eliminate duplicates Z: 40 37.409 2.331 0.886 0.468 0.872 0.538 CB 1.614 40 residues pruned to eliminate duplicates Z: 35 35.473 2.306 0.913 0.569 0.853 0.618 CB 1.512 35 residues pruned to eliminate duplicates Z: 35 34.709 2.313 0.999 0.557 0.765 0.500 CB 1.593 35 residues pruned to eliminate duplicates Z: 33 37.338 2.356 0.963 0.544 0.812 0.562 CB 1.684 33 residues pruned to eliminate duplicates Z: 53 43.986 2.364 0.881 0.489 0.865 0.500 CB 1.603 53 residues pruned to eliminate duplicates Z: 54 45.420 2.411 0.666 0.580 0.887 0.642 CB 1.622 54 residues pruned to eliminate duplicates Z: 57 47.126 2.341 0.753 0.587 0.875 0.589 CB 1.613 57 residues pruned to eliminate duplicates Z: 35 30.574 2.260 0.635 0.525 0.912 0.441 CB 1.518 35 residues pruned to eliminate duplicates Z: 68 59.148 2.449 0.706 0.583 0.925 0.463 CB 1.725 68 residues pruned to eliminate duplicates Z: 63 57.012 2.391 0.801 0.577 0.903 0.581 CB 1.728 63 residues pruned to eliminate duplicates Z: 34 37.777 2.304 0.938 0.568 0.848 0.485 CB 1.624 34 residues pruned to eliminate duplicates Z: 37 33.698 2.247 0.885 0.533 0.806 0.528 CB 1.593 37 residues pruned to eliminate duplicates Z: 35 34.311 2.289 0.681 0.569 0.912 0.529 CB 1.568 35 residues pruned to eliminate duplicates Z: 103 58.675 2.282 0.706 0.555 0.951 0.598 CB 1.487 103 residues pruned to eliminate duplicates Z: 58 47.846 2.339 0.808 0.611 0.877 0.614 CB 1.538 58 residues pruned to eliminate duplicates Z: 68 60.710 2.397 0.818 0.609 0.940 0.552 CB 1.633 68 residues pruned to eliminate duplicates Z: 64 50.060 2.414 0.731 0.558 0.841 0.651 CB 1.696 64 residues pruned to eliminate duplicates Z: 55 52.426 2.379 0.903 0.611 0.889 0.611 CB 1.596 55 residues pruned to eliminate duplicates Z: 56 49.009 2.380 0.744 0.610 0.891 0.564 CB 1.611 56 residues pruned to eliminate duplicates Z: 45 36.370 2.309 0.677 0.566 0.864 0.614 CB 1.539 45 residues pruned to eliminate duplicates Z: 40 37.629 2.372 0.637 0.624 0.897 0.769 CB 1.539 40 residues pruned to eliminate duplicates Z: 138 91.534 2.451 0.816 0.596 0.920 0.701 CB 1.742 138 residues pruned to eliminate duplicates Z: 91 84.986 2.423 0.944 0.706 0.911 0.689 CB 1.730 91 residues pruned to eliminate duplicates Z: 44 43.804 2.297 0.962 0.615 0.860 0.651 CB 1.545 44 residues pruned to eliminate duplicates Z: 115 91.570 2.493 0.865 0.671 0.895 0.702 CB 1.760 115 residues pruned to eliminate duplicates Z: 88 89.176 2.469 0.847 0.735 0.966 0.713 CB 1.757 88 residues pruned to eliminate duplicates Z: 40 42.192 2.328 0.851 0.588 0.897 0.692 CB 1.607 40 residues pruned to eliminate duplicates Z: 77 93.620 2.503 1.009 0.766 0.961 0.763 CB 1.756 77 residues pruned to eliminate duplicates Z: 162 101.626 2.468 0.752 0.648 0.932 0.671 CB 1.732 162 residues pruned to eliminate duplicates Z: 138 95.048 2.489 0.790 0.616 0.934 0.679 CB 1.748 138 residues pruned to eliminate duplicates Z: 44 39.695 2.293 0.920 0.572 0.837 0.651 CB 1.532 44 residues pruned to eliminate duplicates Z: 42 42.707 2.325 0.904 0.615 0.854 0.683 CB 1.583 42 residues pruned to eliminate duplicates Z: 92 85.081 2.487 0.879 0.699 0.901 0.703 CB 1.766 92 residues pruned to eliminate duplicates Z: 39 45.692 2.384 0.840 0.664 0.895 0.658 CB 1.623 39 residues pruned to eliminate duplicates Z: 26 48.246 2.503 1.015 0.758 0.920 0.760 CB 1.653 26 residues pruned to eliminate duplicates Z: 78 83.625 2.471 0.906 0.758 0.935 0.779 CB 1.721 78 residues pruned to eliminate duplicates Z: 72 89.558 2.488 1.033 0.781 0.944 0.718 CB 1.738 72 residues pruned to eliminate duplicates Z: 40 50.166 2.391 0.907 0.666 0.949 0.667 CB 1.593 40 residues pruned to eliminate duplicates Z: 39 43.115 2.377 0.751 0.645 0.921 0.632 CB 1.593 39 residues pruned to eliminate duplicates Z: 58 46.050 2.221 0.948 0.523 0.965 0.596 CB 1.428 88 residues pruned to eliminate duplicates Z: 145 87.081 2.430 0.770 0.576 0.896 0.653 CB 1.749 145 residues pruned to eliminate duplicates Z: 83 89.482 2.474 0.965 0.722 0.939 0.707 CB 1.772 83 residues pruned to eliminate duplicates Z: 51 74.996 2.456 0.935 0.789 0.980 0.780 CB 1.766 51 residues pruned to eliminate duplicates Z: 98 82.586 2.444 0.917 0.663 0.887 0.701 CB 1.736 98 residues pruned to eliminate duplicates Z: 140 100.003 2.474 0.852 0.631 0.935 0.655 CB 1.750 140 residues pruned to eliminate duplicates Z: 80 89.047 2.482 1.010 0.741 0.949 0.734 CB 1.704 80 residues pruned to eliminate duplicates Z: 52 78.505 2.441 1.009 0.783 0.961 0.765 CB 1.819 52 residues pruned to eliminate duplicates Z: 100 90.881 2.444 0.931 0.697 0.949 0.707 CB 1.703 100 residues pruned to eliminate duplicates Z: 130 89.720 2.440 0.908 0.616 0.899 0.659 CB 1.691 130 residues pruned to eliminate duplicates Z: 175 111.028 2.468 0.882 0.625 0.925 0.678 CB 1.741 175 residues pruned to eliminate duplicates Z: 109 86.823 2.405 0.978 0.639 0.926 0.685 CB 1.665 109 residues pruned to eliminate duplicates Z: 85 80.122 2.485 0.831 0.681 0.905 0.667 CB 1.798 85 residues pruned to eliminate duplicates Z: 103 88.495 2.416 0.953 0.671 0.931 0.618 CB 1.703 103 residues pruned to eliminate duplicates Z: 151 99.771 2.450 0.913 0.595 0.927 0.640 CB 1.714 151 residues pruned to eliminate duplicates Z: 164 105.897 2.493 0.807 0.647 0.914 0.712 CB 1.758 164 residues pruned to eliminate duplicates Z: 84 85.036 2.497 0.937 0.674 0.904 0.699 CB 1.818 84 residues pruned to eliminate duplicates Z: 162 117.148 2.495 0.901 0.666 0.957 0.714 CB 1.745 162 residues pruned to eliminate duplicates Z: 88 87.060 2.450 1.051 0.689 0.943 0.655 CB 1.657 88 residues pruned to eliminate duplicates Z: 90 84.689 2.427 1.030 0.696 0.899 0.697 CB 1.694 90 residues pruned to eliminate duplicates Z: 175 115.457 2.474 0.896 0.650 0.931 0.661 CB 1.743 175 residues pruned to eliminate duplicates Z: 89 80.983 2.438 0.931 0.688 0.920 0.614 CB 1.678 89 residues pruned to eliminate duplicates Z: 97 88.471 2.491 0.942 0.675 0.927 0.688 CB 1.714 97 residues pruned to eliminate duplicates Z: 177 111.164 2.468 0.809 0.640 0.955 0.682 CB 1.725 177 residues pruned to eliminate duplicates Z: 73 88.223 2.520 0.991 0.773 0.931 0.722 CB 1.749 73 residues pruned to eliminate duplicates Z: 93 83.176 2.421 0.956 0.683 0.924 0.685 CB 1.677 93 residues pruned to eliminate duplicates Z: 87 94.282 2.479 1.034 0.718 0.953 0.709 CB 1.737 87 residues pruned to eliminate duplicates Z: 69 83.411 2.503 1.003 0.696 0.941 0.676 CB 1.792 69 residues pruned to eliminate duplicates Z: 98 90.319 2.465 0.965 0.675 0.928 0.629 CB 1.737 98 residues pruned to eliminate duplicates Z: 178 107.200 2.461 0.803 0.624 0.938 0.655 CB 1.723 178 residues pruned to eliminate duplicates Z: 91 89.498 2.445 0.923 0.721 0.956 0.733 CB 1.719 91 residues pruned to eliminate duplicates Z: 137 102.368 2.504 0.902 0.624 0.926 0.654 CB 1.769 137 residues pruned to eliminate duplicates Z: 175 113.643 2.474 0.873 0.639 0.943 0.644 CB 1.733 175 residues pruned to eliminate duplicates Z: 99 84.707 2.462 0.886 0.660 0.918 0.694 CB 1.730 99 residues pruned to eliminate duplicates Z: 117 93.865 2.478 0.939 0.651 0.922 0.647 CB 1.709 117 residues pruned to eliminate duplicates Z: 28 48.380 2.357 0.988 0.765 0.963 0.704 CB 1.631 28 residues pruned to eliminate duplicates Z: 178 107.089 2.449 0.840 0.622 0.938 0.650 CB 1.698 178 residues pruned to eliminate duplicates Z: 86 88.544 2.460 1.008 0.722 0.941 0.682 CB 1.691 86 residues pruned to eliminate duplicates Z: 103 95.955 2.439 1.079 0.672 0.941 0.706 CB 1.698 103 residues pruned to eliminate duplicates Z: 127 89.715 2.444 0.924 0.649 0.865 0.619 CB 1.710 127 residues pruned to eliminate duplicates Z: 99 90.470 2.454 0.988 0.679 0.929 0.704 CB 1.712 99 residues pruned to eliminate duplicates Z: 106 86.577 2.416 0.973 0.650 0.933 0.610 CB 1.652 106 residues pruned to eliminate duplicates Z: 152 100.271 2.474 0.866 0.596 0.934 0.596 CB 1.728 152 residues pruned to eliminate duplicates Z: 97 89.540 2.488 0.991 0.696 0.906 0.635 CB 1.702 97 residues pruned to eliminate duplicates Z: 179 110.747 2.457 0.852 0.635 0.933 0.663 CB 1.723 179 residues pruned to eliminate duplicates Z: 101 91.662 2.471 0.963 0.682 0.920 0.630 CB 1.738 101 residues pruned to eliminate duplicates Z: 85 69.995 2.470 0.816 0.556 0.929 0.583 CB 1.737 85 residues pruned to eliminate duplicates Z: 163 113.258 2.492 0.870 0.652 0.957 0.685 CB 1.732 163 residues pruned to eliminate duplicates Z: 68 61.424 2.417 0.887 0.623 0.881 0.567 CB 1.664 68 residues pruned to eliminate duplicates Z: 126 92.214 2.462 0.886 0.642 0.912 0.640 CB 1.704 126 residues pruned to eliminate duplicates Z: 118 77.568 2.381 0.958 0.614 0.846 0.538 CB 1.632 118 residues pruned to eliminate duplicates Z: 110 85.211 2.438 0.924 0.658 0.872 0.624 CB 1.724 110 residues pruned to eliminate duplicates Z: 161 88.932 2.321 0.906 0.625 0.919 0.606 CB 1.538 161 residues pruned to eliminate duplicates Z: 163 115.647 2.482 0.875 0.664 0.957 0.716 CB 1.754 163 residues pruned to eliminate duplicates Z: 149 97.567 2.462 0.834 0.605 0.926 0.676 CB 1.736 149 residues pruned to eliminate duplicates Z: 86 62.713 2.427 0.770 0.520 0.941 0.647 CB 1.649 86 residues pruned to eliminate duplicates Z: 151 97.130 2.425 0.923 0.581 0.920 0.593 CB 1.710 151 residues pruned to eliminate duplicates Z: 175 109.694 2.471 0.819 0.639 0.943 0.644 CB 1.724 175 residues pruned to eliminate duplicates Z: 174 112.192 2.473 0.883 0.641 0.942 0.671 CB 1.703 174 residues pruned to eliminate duplicates Z: 137 103.114 2.498 0.923 0.620 0.934 0.647 CB 1.760 137 residues pruned to eliminate duplicates Z: 148 99.412 2.458 0.889 0.619 0.925 0.653 CB 1.706 148 residues pruned to eliminate duplicates Z: 55 41.562 2.397 0.639 0.453 0.889 0.593 CB 1.700 55 residues pruned to eliminate duplicates Z: 72 57.521 2.420 0.727 0.534 0.915 0.577 CB 1.725 72 residues pruned to eliminate duplicates Z: 27 40.829 2.464 0.853 0.569 0.923 0.615 CB 1.776 27 residues pruned to eliminate duplicates Z: 165 110.757 2.483 0.863 0.645 0.939 0.695 CB 1.738 165 residues pruned to eliminate duplicates Z: 73 67.263 2.473 0.756 0.597 0.931 0.681 CB 1.789 73 residues pruned to eliminate duplicates Z: 75 64.962 2.439 0.805 0.579 0.905 0.662 CB 1.755 75 residues pruned to eliminate duplicates Z: 77 71.185 2.478 0.837 0.596 0.934 0.658 CB 1.752 77 residues pruned to eliminate duplicates Z: 75 65.776 2.490 0.687 0.606 0.932 0.676 CB 1.766 75 residues pruned to eliminate duplicates Z: 50 53.515 2.505 0.741 0.526 0.959 0.714 CB 1.782 50 residues pruned to eliminate duplicates Z: 114 91.809 2.469 1.004 0.621 0.912 0.566 CB 1.708 114 residues pruned to eliminate duplicates Z: 41 46.064 2.497 0.710 0.487 0.975 0.650 CB 1.773 41 residues pruned to eliminate duplicates Z: 173 108.999 2.438 0.940 0.628 0.930 0.651 CB 1.674 173 residues pruned to eliminate duplicates Z: 51 49.463 2.440 0.777 0.519 0.920 0.700 CB 1.721 51 residues pruned to eliminate duplicates Z: 163 112.508 2.493 0.871 0.660 0.938 0.679 CB 1.741 163 residues pruned to eliminate duplicates Z: 136 106.398 2.507 0.930 0.640 0.956 0.681 CB 1.737 136 residues pruned to eliminate duplicates Z: 64 43.631 2.401 0.745 0.437 0.889 0.587 CB 1.575 64 residues pruned to eliminate duplicates Z: 77 64.902 2.443 0.734 0.593 0.934 0.697 CB 1.720 77 residues pruned to eliminate duplicates Z: 75 66.875 2.444 0.856 0.576 0.932 0.662 CB 1.709 75 residues pruned to eliminate duplicates Z: 118 90.182 2.436 1.010 0.636 0.889 0.615 CB 1.685 118 residues pruned to eliminate duplicates Z: 79 66.369 2.426 0.790 0.597 0.923 0.731 CB 1.709 79 residues pruned to eliminate duplicates Z: 42 50.758 2.485 0.828 0.485 0.976 0.610 CB 1.817 42 residues pruned to eliminate duplicates Z: 76 77.416 2.499 0.862 0.625 0.960 0.680 CB 1.778 76 residues pruned to eliminate duplicates Z: 52 51.069 2.463 0.819 0.495 0.922 0.608 CB 1.740 52 residues pruned to eliminate duplicates Z: 42 45.915 2.474 0.740 0.503 0.927 0.732 CB 1.793 42 residues pruned to eliminate duplicates Z: 76 70.791 2.459 0.841 0.595 0.960 0.693 CB 1.718 76 residues pruned to eliminate duplicates Z: 77 66.268 2.447 0.710 0.616 0.947 0.750 CB 1.717 77 residues pruned to eliminate duplicates Z: 50 53.012 2.485 0.800 0.530 0.918 0.653 CB 1.790 50 residues pruned to eliminate duplicates Z: 33 30.020 2.272 0.696 0.503 0.906 0.625 CB 1.515 33 residues pruned to eliminate duplicates Z: 31 26.905 2.274 0.560 0.376 0.900 0.533 CB 1.756 31 residues pruned to eliminate duplicates Z: 76 77.820 2.466 0.848 0.637 0.973 0.693 CB 1.782 76 residues pruned to eliminate duplicates Z: 41 46.518 2.477 0.748 0.498 0.950 0.750 CB 1.792 41 residues pruned to eliminate duplicates Z: 49 53.684 2.431 0.813 0.569 0.938 0.688 CB 1.755 49 residues pruned to eliminate duplicates Z: 66 55.118 2.358 0.806 0.569 0.892 0.708 CB 1.683 66 residues pruned to eliminate duplicates Z: 74 68.661 2.430 0.881 0.593 0.945 0.671 CB 1.702 74 residues pruned to eliminate duplicates Z: 156 105.518 2.446 0.934 0.641 0.910 0.684 CB 1.726 156 residues pruned to eliminate duplicates Z: 26 33.258 2.437 0.794 0.397 0.960 0.560 CB 1.767 26 residues pruned to eliminate duplicates Z: 52 55.608 2.383 0.791 0.615 0.941 0.725 CB 1.739 52 residues pruned to eliminate duplicates Z: 75 79.636 2.517 0.829 0.653 0.973 0.689 CB 1.792 75 residues pruned to eliminate duplicates Z: 25 30.247 2.392 0.748 0.420 0.958 0.625 CB 1.675 25 residues pruned to eliminate duplicates Z: 137 102.808 2.496 0.946 0.636 0.912 0.713 CB 1.751 137 residues pruned to eliminate duplicates Z: 73 68.570 2.460 0.798 0.586 0.958 0.681 CB 1.755 73 residues pruned to eliminate duplicates Z: 65 59.757 2.433 0.827 0.567 0.953 0.703 CB 1.651 65 residues pruned to eliminate duplicates Z: 15 20.413 2.354 0.637 0.336 0.929 0.714 CA 1.825 15 residues pruned to eliminate duplicates Z: 51 52.035 2.463 0.753 0.522 0.940 0.680 CB 1.774 51 residues pruned to eliminate duplicates Z: 74 70.221 2.460 0.910 0.601 0.904 0.699 CB 1.757 74 residues pruned to eliminate duplicates Z: 50 58.663 2.490 0.848 0.559 0.959 0.673 CB 1.792 50 residues pruned to eliminate duplicates Z: 76 78.453 2.476 0.888 0.650 0.973 0.707 CB 1.730 76 residues pruned to eliminate duplicates Z: 67 72.821 2.484 0.761 0.636 1.000 0.667 CB 1.804 67 residues pruned to eliminate duplicates Z: 67 70.585 2.464 0.785 0.641 0.985 0.667 CB 1.758 67 residues pruned to eliminate duplicates Z: 52 58.189 2.445 0.724 0.627 0.980 0.706 CB 1.749 52 residues pruned to eliminate duplicates Z: 76 78.972 2.491 0.870 0.638 0.973 0.693 CB 1.768 76 residues pruned to eliminate duplicates Z: 68 73.424 2.465 0.903 0.623 0.955 0.776 CB 1.782 68 residues pruned to eliminate duplicates Z: 33 43.443 2.386 0.829 0.705 0.906 0.656 CB 1.612 33 residues pruned to eliminate duplicates Z: 33 39.737 2.380 0.804 0.693 0.875 0.656 CB 1.568 33 residues pruned to eliminate duplicates Z: 67 71.936 2.486 0.812 0.646 0.970 0.667 CB 1.768 67 residues pruned to eliminate duplicates Z: 111 79.405 2.413 0.800 0.634 0.936 0.655 CB 1.642 111 residues pruned to eliminate duplicates Z: 68 70.514 2.462 0.776 0.630 1.000 0.701 CB 1.743 68 residues pruned to eliminate duplicates Z: 76 70.353 2.439 0.838 0.627 0.960 0.667 CB 1.674 76 residues pruned to eliminate duplicates Z: 32 49.616 2.380 0.943 0.747 1.000 0.516 CB 1.545 32 residues pruned to eliminate duplicates Z: 76 75.762 2.482 0.806 0.631 0.973 0.653 CB 1.773 76 residues pruned to eliminate duplicates Z: 31 51.206 2.385 1.028 0.729 0.933 0.600 CB 1.685 30 residues pruned to eliminate duplicates Z: 25 55.638 2.423 1.145 0.917 0.958 0.625 CB 1.609 27 residues pruned to eliminate duplicates Z: 26 51.153 2.303 1.164 0.877 0.920 0.440 CB 1.620 26 residues pruned to eliminate duplicates Z: 31 47.144 2.404 0.908 0.732 0.933 0.533 CB 1.632 29 residues pruned to eliminate duplicates Z: 25 58.468 2.431 1.136 0.934 0.958 0.708 CB 1.673 25 residues pruned to eliminate duplicates Z: 78 66.391 2.414 0.835 0.589 0.935 0.662 CB 1.677 78 residues pruned to eliminate duplicates Z: 77 75.438 2.470 0.884 0.626 0.961 0.592 CB 1.719 77 residues pruned to eliminate duplicates Z: 29 55.221 2.488 1.079 0.788 0.929 0.536 CB 1.687 29 residues pruned to eliminate duplicates Z: 76 73.701 2.476 0.812 0.643 0.960 0.520 CB 1.729 76 residues pruned to eliminate duplicates Z: 174 118.326 2.476 0.940 0.659 0.942 0.671 CB 1.714 174 residues pruned to eliminate duplicates Z: 32 49.551 2.339 1.073 0.718 0.968 0.355 CB 1.557 32 residues pruned to eliminate duplicates Z: 24 58.761 2.464 1.260 0.948 0.957 0.391 CB 1.588 24 residues pruned to eliminate duplicates Z: 31 20.799 1.995 0.602 0.592 0.867 0.667 CB 1.256 31 residues pruned to eliminate duplicates Z: 82 39.518 2.164 0.522 0.567 0.938 0.642 CB 1.332 82 residues pruned to eliminate duplicates Z: 40 22.339 1.888 0.541 0.587 0.949 0.513 CB 1.193 43 residues pruned to eliminate duplicates Z: 14 22.769 1.932 0.662 0.930 1.000 0.692 CB 1.376 14 residues pruned to eliminate duplicates Z: 42 22.090 1.909 0.685 0.551 0.878 0.561 CB 1.162 42 residues pruned to eliminate duplicates Z: 16 21.360 1.895 0.718 0.808 0.933 0.667 CB 1.388 16 residues pruned to eliminate duplicates Z: 27 16.849 1.771 0.556 0.673 0.885 0.500 CB 1.156 27 residues pruned to eliminate duplicates Z: 22 18.741 1.739 0.797 0.687 0.905 0.571 CB 1.219 22 residues pruned to eliminate duplicates Z: 39 23.227 1.909 0.710 0.588 0.921 0.526 CB 1.152 39 residues pruned to eliminate duplicates Z: 31 25.481 1.964 0.759 0.609 0.967 0.567 CB 1.257 31 residues pruned to eliminate duplicates Z: 56 26.293 1.906 0.565 0.542 0.927 0.582 CB 1.230 56 residues pruned to eliminate duplicates Z: 42 22.442 1.863 0.746 0.554 0.951 0.488 CB 1.075 42 residues pruned to eliminate duplicates Z: 17 18.327 1.831 0.765 0.712 0.938 0.188 CB 1.247 17 residues pruned to eliminate duplicates Z: 31 19.622 2.019 0.610 0.503 0.833 0.233 CB 1.318 31 residues pruned to eliminate duplicates Z: 30 17.931 1.749 0.727 0.514 0.897 0.241 CB 1.213 30 residues pruned to eliminate duplicates Z: 67 36.372 2.216 0.579 0.495 0.909 0.621 CB 1.414 67 residues pruned to eliminate duplicates Z: 65 30.267 2.193 0.511 0.438 0.906 0.547 CB 1.343 65 residues pruned to eliminate duplicates Z: 14 10.166 2.044 0.652 0.376 0.846 0.615 CB 1.126 14 residues pruned to eliminate duplicates Z: 17 10.986 2.120 0.497 0.322 0.812 0.375 CB 1.296 17 residues pruned to eliminate duplicates Z: 28 19.555 1.945 0.594 0.521 0.926 0.556 CB 1.284 28 residues pruned to eliminate duplicates Z: 13 13.345 2.032 0.621 0.443 0.917 0.500 CB 1.352 13 residues pruned to eliminate duplicates Z: 16 7.750 1.929 0.576 0.320 0.733 0.333 CB 1.095 16 residues pruned to eliminate duplicates Z: 48 33.610 2.201 0.754 0.499 0.894 0.596 CB 1.422 48 residues pruned to eliminate duplicates Z: 18 10.121 2.067 0.478 0.293 0.824 0.353 CB 1.230 18 residues pruned to eliminate duplicates Z: 12 10.742 2.192 0.493 0.268 0.909 0.545 CB 1.418 12 residues pruned to eliminate duplicates Z: 18 9.525 2.034 0.523 0.238 0.824 0.353 CB 1.227 18 residues pruned to eliminate duplicates Z: 18 13.210 2.060 0.600 0.272 0.882 0.471 CB 1.427 18 residues pruned to eliminate duplicates Z: 68 33.933 2.192 0.588 0.483 0.881 0.612 CB 1.375 68 residues pruned to eliminate duplicates Z: 67 33.938 2.187 0.555 0.508 0.939 0.591 CB 1.297 67 residues pruned to eliminate duplicates Z: 65 41.871 2.286 0.633 0.533 0.938 0.656 CB 1.448 65 residues pruned to eliminate duplicates Z: 55 36.060 2.236 0.584 0.491 0.944 0.704 CB 1.481 55 residues pruned to eliminate duplicates Z: 40 34.684 2.330 0.662 0.590 0.897 0.744 CB 1.467 40 residues pruned to eliminate duplicates Z: 55 37.034 2.314 0.623 0.528 0.907 0.667 CB 1.439 55 residues pruned to eliminate duplicates Z: 38 38.747 2.329 0.706 0.618 0.973 0.757 CB 1.473 38 residues pruned to eliminate duplicates Z: 151 83.061 2.372 0.665 0.628 0.933 0.680 CB 1.632 151 residues pruned to eliminate duplicates Z: 56 35.843 2.248 0.669 0.491 0.909 0.527 CB 1.429 56 residues pruned to eliminate duplicates Z: 35 35.459 2.325 0.787 0.635 0.941 0.676 CB 1.370 35 residues pruned to eliminate duplicates Z: 32 34.791 2.319 0.646 0.684 0.968 0.710 CB 1.428 32 residues pruned to eliminate duplicates Z: 51 36.978 2.294 0.651 0.577 0.920 0.620 CB 1.393 51 residues pruned to eliminate duplicates Z: 34 40.130 2.308 0.840 0.674 1.000 0.727 CB 1.401 34 residues pruned to eliminate duplicates Z: 49 42.790 2.307 0.778 0.601 0.958 0.583 CB 1.428 49 residues pruned to eliminate duplicates Z: 41 34.347 2.278 0.799 0.591 0.875 0.700 CB 1.388 41 residues pruned to eliminate duplicates Z: 55 40.441 2.227 0.846 0.497 0.963 0.611 CB 1.394 55 residues pruned to eliminate duplicates Z: 51 39.287 2.290 0.746 0.574 0.940 0.660 CB 1.376 51 residues pruned to eliminate duplicates Z: 216 91.847 2.353 0.710 0.563 0.912 0.642 CB 1.607 216 residues pruned to eliminate duplicates Z: 39 45.504 2.308 0.978 0.627 1.000 0.711 CB 1.435 39 residues pruned to eliminate duplicates Z: 48 42.286 2.307 0.792 0.607 0.936 0.681 CB 1.440 48 residues pruned to eliminate duplicates Z: 50 39.120 2.282 0.754 0.587 0.918 0.653 CB 1.399 50 residues pruned to eliminate duplicates Z: 50 40.772 2.309 0.736 0.567 0.939 0.633 CB 1.451 50 residues pruned to eliminate duplicates Z: 37 44.758 2.334 0.975 0.625 0.972 0.750 CB 1.480 37 residues pruned to eliminate duplicates Z: 37 39.761 2.309 0.911 0.582 0.972 0.722 CB 1.428 37 residues pruned to eliminate duplicates Z: 55 39.131 2.310 0.656 0.547 0.926 0.667 CB 1.435 55 residues pruned to eliminate duplicates Z: 91 61.779 2.373 0.677 0.595 0.933 0.744 CB 1.601 91 residues pruned to eliminate duplicates Z: 38 39.423 2.307 0.770 0.623 0.946 0.811 CB 1.494 38 residues pruned to eliminate duplicates Z: 53 36.123 2.253 0.616 0.557 0.904 0.635 CB 1.439 53 residues pruned to eliminate duplicates Z: 50 41.506 2.282 0.781 0.578 0.939 0.592 CB 1.442 50 residues pruned to eliminate duplicates Z: 31 43.745 2.348 0.909 0.676 1.000 0.767 CB 1.515 31 residues pruned to eliminate duplicates Z: 50 37.552 2.261 0.688 0.550 0.980 0.633 CB 1.366 50 residues pruned to eliminate duplicates Z: 55 36.325 2.251 0.711 0.467 0.926 0.593 CB 1.433 55 residues pruned to eliminate duplicates Z: 142 91.210 2.398 0.766 0.655 0.929 0.667 CB 1.690 142 residues pruned to eliminate duplicates Z: 71 44.888 2.303 0.682 0.496 0.929 0.643 CB 1.497 71 residues pruned to eliminate duplicates Z: 45 36.636 2.297 0.721 0.555 0.955 0.682 CB 1.387 45 residues pruned to eliminate duplicates Z: 56 39.570 2.297 0.720 0.523 0.909 0.564 CB 1.453 56 residues pruned to eliminate duplicates Z: 51 38.144 2.276 0.675 0.559 0.920 0.620 CB 1.453 51 residues pruned to eliminate duplicates Z: 49 36.299 2.306 0.675 0.565 0.917 0.708 CB 1.389 49 residues pruned to eliminate duplicates Z: 22 14.708 2.198 0.329 0.389 0.905 0.571 CB 1.366 22 residues pruned to eliminate duplicates Z: 64 45.414 2.309 0.656 0.542 0.952 0.651 CB 1.508 64 residues pruned to eliminate duplicates Z: 67 36.282 2.262 0.626 0.472 0.909 0.545 CB 1.374 67 residues pruned to eliminate duplicates Z: 140 86.683 2.369 0.791 0.641 0.928 0.676 CB 1.636 140 residues pruned to eliminate duplicates Z: 67 40.348 2.247 0.730 0.500 0.909 0.636 CB 1.406 67 residues pruned to eliminate duplicates Z: 109 64.003 2.334 0.743 0.534 0.944 0.657 CB 1.550 109 residues pruned to eliminate duplicates Z: 30 16.449 2.159 0.444 0.368 0.828 0.448 CB 1.365 30 residues pruned to eliminate duplicates Z: 56 38.708 2.298 0.695 0.512 0.927 0.527 CB 1.428 56 residues pruned to eliminate duplicates Z: 16 14.042 2.045 0.433 0.551 0.867 0.600 CB 1.358 16 residues pruned to eliminate duplicates Z: 47 40.574 2.321 0.686 0.612 0.935 0.674 CB 1.471 47 residues pruned to eliminate duplicates Z: 50 39.395 2.302 0.730 0.554 0.939 0.612 CB 1.428 50 residues pruned to eliminate duplicates Z: 50 39.527 2.282 0.656 0.576 0.959 0.653 CB 1.448 50 residues pruned to eliminate duplicates Z: 51 39.282 2.290 0.742 0.566 0.940 0.560 CB 1.391 51 residues pruned to eliminate duplicates Z: 25 16.658 2.270 0.387 0.422 0.917 0.417 CB 1.278 25 residues pruned to eliminate duplicates Z: 91 54.664 2.313 0.641 0.577 0.867 0.667 CB 1.626 91 residues pruned to eliminate duplicates Z: 141 85.592 2.373 0.745 0.648 0.929 0.664 CB 1.639 141 residues pruned to eliminate duplicates Z: 43 49.978 2.407 0.694 0.614 0.952 0.738 CB 1.783 43 residues pruned to eliminate duplicates Z: 137 91.770 2.412 0.816 0.650 0.956 0.654 CB 1.634 137 residues pruned to eliminate duplicates Z: 44 25.337 2.203 0.633 0.399 0.860 0.512 CB 1.387 44 residues pruned to eliminate duplicates Z: 15 22.238 2.297 0.454 0.524 1.000 0.643 CB 1.737 15 residues pruned to eliminate duplicates Z: 88 84.665 2.428 0.868 0.724 0.931 0.701 CB 1.757 88 residues pruned to eliminate duplicates Z: 91 88.974 2.450 0.814 0.709 0.956 0.744 CB 1.827 91 residues pruned to eliminate duplicates Z: 26 18.588 2.136 0.436 0.354 0.880 0.440 CB 1.613 26 residues pruned to eliminate duplicates Z: 14 25.364 2.318 0.622 0.588 0.923 0.692 CB 1.863 14 residues pruned to eliminate duplicates Z: 45 55.489 2.443 0.957 0.597 0.864 0.750 CB 1.846 45 residues pruned to eliminate duplicates Z: 44 50.896 2.405 0.761 0.611 0.953 0.767 CB 1.730 44 residues pruned to eliminate duplicates Z: 88 88.887 2.485 0.807 0.738 0.943 0.782 CB 1.818 88 residues pruned to eliminate duplicates Z: 90 90.973 2.465 0.844 0.723 0.933 0.798 CB 1.860 90 residues pruned to eliminate duplicates Z: 75 82.495 2.432 0.816 0.771 0.973 0.770 CB 1.755 75 residues pruned to eliminate duplicates Z: 143 90.059 2.415 0.745 0.645 0.923 0.669 CB 1.697 143 residues pruned to eliminate duplicates Z: 88 91.991 2.507 0.810 0.728 0.954 0.736 CB 1.856 88 residues pruned to eliminate duplicates Z: 135 88.549 2.369 0.793 0.663 0.940 0.731 CB 1.647 135 residues pruned to eliminate duplicates Z: 134 91.611 2.396 0.845 0.664 0.932 0.707 CB 1.656 134 residues pruned to eliminate duplicates Z: 29 43.152 2.498 0.924 0.664 0.893 0.714 CB 1.632 29 residues pruned to eliminate duplicates Z: 75 85.374 2.503 0.852 0.752 0.932 0.770 CB 1.833 75 residues pruned to eliminate duplicates Z: 29 45.019 2.509 0.852 0.687 0.929 0.750 CB 1.660 29 residues pruned to eliminate duplicates Z: 90 96.146 2.476 0.911 0.715 0.955 0.708 CB 1.857 90 residues pruned to eliminate duplicates Z: 88 53.409 2.258 0.727 0.553 0.943 0.644 CB 1.480 117 residues pruned to eliminate duplicates Z: 94 64.335 2.361 0.772 0.597 0.935 0.624 CB 1.554 94 residues pruned to eliminate duplicates Z: 88 89.854 2.487 0.817 0.739 0.954 0.747 CB 1.804 88 residues pruned to eliminate duplicates Z: 43 49.117 2.366 0.820 0.609 0.976 0.738 CB 1.626 43 residues pruned to eliminate duplicates Z: 75 87.350 2.502 0.876 0.751 0.932 0.730 CB 1.856 75 residues pruned to eliminate duplicates Z: 89 93.304 2.487 0.874 0.733 0.966 0.761 CB 1.791 89 residues pruned to eliminate duplicates Z: 73 91.367 2.508 0.925 0.779 0.944 0.708 CB 1.847 73 residues pruned to eliminate duplicates Z: 195 80.391 2.289 0.638 0.579 0.907 0.680 CB 1.573 195 residues pruned to eliminate duplicates Z: 90 90.767 2.468 0.834 0.718 0.955 0.719 CB 1.827 90 residues pruned to eliminate duplicates Z: 73 94.492 2.520 0.909 0.770 0.986 0.792 CB 1.850 73 residues pruned to eliminate duplicates Z: 139 89.610 2.422 0.809 0.657 0.899 0.717 CB 1.675 139 residues pruned to eliminate duplicates Z: 150 89.823 2.373 0.810 0.625 0.933 0.678 CB 1.632 150 residues pruned to eliminate duplicates Z: 163 84.437 2.355 0.762 0.594 0.907 0.642 CB 1.610 163 residues pruned to eliminate duplicates Z: 31 50.669 2.450 1.082 0.654 0.933 0.567 CB 1.684 31 residues pruned to eliminate duplicates Z: 30 48.015 2.524 1.034 0.648 0.862 0.759 CB 1.755 30 residues pruned to eliminate duplicates Z: 91 90.310 2.448 0.893 0.711 0.956 0.644 CB 1.775 91 residues pruned to eliminate duplicates Z: 75 91.376 2.508 0.970 0.748 0.932 0.770 CB 1.848 75 residues pruned to eliminate duplicates Z: 140 78.054 2.359 0.717 0.601 0.914 0.676 CB 1.624 140 residues pruned to eliminate duplicates Z: 88 93.462 2.492 0.851 0.745 0.954 0.724 CB 1.829 88 residues pruned to eliminate duplicates Z: 102 83.787 2.438 0.826 0.668 0.911 0.663 CB 1.761 102 residues pruned to eliminate duplicates Z: 114 84.680 2.414 0.796 0.648 0.947 0.646 CB 1.690 114 residues pruned to eliminate duplicates Z: 75 89.615 2.491 0.942 0.763 0.932 0.757 CB 1.829 75 residues pruned to eliminate duplicates Z: 91 87.817 2.451 0.851 0.724 0.944 0.667 CB 1.765 91 residues pruned to eliminate duplicates Z: 75 89.308 2.494 0.909 0.761 0.946 0.770 CB 1.828 75 residues pruned to eliminate duplicates Z: 73 92.844 2.503 0.916 0.787 0.986 0.736 CB 1.798 73 residues pruned to eliminate duplicates Z: 89 95.849 2.484 0.894 0.728 0.966 0.705 CB 1.831 89 residues pruned to eliminate duplicates Z: 73 94.095 2.522 0.973 0.770 0.944 0.667 CB 1.858 73 residues pruned to eliminate duplicates Z: 91 90.184 2.448 0.924 0.721 0.922 0.689 CB 1.792 91 residues pruned to eliminate duplicates Z: 103 81.199 2.413 0.831 0.645 0.931 0.667 CB 1.707 103 residues pruned to eliminate duplicates Z: 131 90.172 2.411 0.782 0.661 0.938 0.677 CB 1.690 131 residues pruned to eliminate duplicates Z: 75 87.332 2.504 0.887 0.758 0.932 0.757 CB 1.832 75 residues pruned to eliminate duplicates Z: 73 95.576 2.502 0.975 0.780 0.972 0.722 CB 1.833 73 residues pruned to eliminate duplicates Z: 87 93.311 2.503 0.918 0.723 0.942 0.686 CB 1.819 87 residues pruned to eliminate duplicates Z: 89 92.211 2.486 0.872 0.730 0.932 0.727 CB 1.843 89 residues pruned to eliminate duplicates Z: 87 100.368 2.502 0.965 0.733 0.965 0.698 CB 1.850 87 residues pruned to eliminate duplicates Z: 88 96.438 2.495 0.922 0.728 0.954 0.747 CB 1.840 88 residues pruned to eliminate duplicates Z: 102 82.140 2.431 0.816 0.654 0.921 0.683 CB 1.743 102 residues pruned to eliminate duplicates Z: 101 86.218 2.452 0.726 0.705 0.940 0.690 CB 1.800 101 residues pruned to eliminate duplicates Z: 112 84.383 2.442 0.749 0.668 0.937 0.640 CB 1.713 112 residues pruned to eliminate duplicates Z: 84 86.007 2.428 0.854 0.682 0.964 0.639 CB 1.840 84 residues pruned to eliminate duplicates Z: 134 95.413 2.430 0.806 0.681 0.947 0.692 CB 1.685 134 residues pruned to eliminate duplicates Z: 102 83.358 2.437 0.785 0.672 0.931 0.693 CB 1.748 102 residues pruned to eliminate duplicates Z: 143 94.965 2.386 0.834 0.668 0.944 0.662 CB 1.652 143 residues pruned to eliminate duplicates Z: 105 77.360 2.410 0.744 0.643 0.913 0.663 CB 1.728 105 residues pruned to eliminate duplicates Z: 50 69.310 2.433 0.788 0.781 0.959 0.755 CB 1.853 50 residues pruned to eliminate duplicates Z: 89 99.817 2.486 0.894 0.731 0.977 0.727 CB 1.879 89 residues pruned to eliminate duplicates Z: 99 72.974 2.380 0.787 0.647 0.898 0.663 CB 1.683 99 residues pruned to eliminate duplicates Z: 92 89.421 2.448 0.868 0.705 0.934 0.714 CB 1.822 92 residues pruned to eliminate duplicates Z: 88 94.645 2.496 0.881 0.734 0.954 0.713 CB 1.836 88 residues pruned to eliminate duplicates Z: 88 93.412 2.486 0.870 0.738 0.966 0.621 CB 1.803 88 residues pruned to eliminate duplicates Z: 75 88.283 2.507 0.953 0.753 0.919 0.730 CB 1.820 75 residues pruned to eliminate duplicates Z: 89 94.601 2.475 0.907 0.726 0.955 0.670 CB 1.826 89 residues pruned to eliminate duplicates Z: 88 95.813 2.494 0.904 0.719 0.954 0.690 CB 1.860 88 residues pruned to eliminate duplicates Z: 90 93.622 2.471 0.933 0.721 0.933 0.719 CB 1.824 90 residues pruned to eliminate duplicates Z: 73 94.455 2.518 0.898 0.777 0.972 0.708 CB 1.875 73 residues pruned to eliminate duplicates Z: 76 86.732 2.482 0.877 0.740 0.960 0.680 CB 1.806 76 residues pruned to eliminate duplicates Z: 193 91.158 2.362 0.752 0.579 0.922 0.641 CB 1.598 193 residues pruned to eliminate duplicates Z: 89 94.214 2.476 0.893 0.727 0.955 0.682 CB 1.830 89 residues pruned to eliminate duplicates Z: 75 94.277 2.486 0.987 0.758 0.959 0.703 CB 1.838 75 residues pruned to eliminate duplicates Z: 73 95.797 2.519 0.975 0.778 0.958 0.722 CB 1.852 73 residues pruned to eliminate duplicates Z: 102 85.073 2.426 0.857 0.661 0.921 0.604 CB 1.758 102 residues pruned to eliminate duplicates Z: 89 97.206 2.477 0.967 0.717 0.955 0.693 CB 1.831 89 residues pruned to eliminate duplicates Z: 100 83.622 2.407 0.817 0.681 0.929 0.657 CB 1.752 100 residues pruned to eliminate duplicates Z: 108 77.599 2.393 0.813 0.620 0.916 0.589 CB 1.686 108 residues pruned to eliminate duplicates Z: 104 83.067 2.395 0.890 0.641 0.913 0.621 CB 1.737 104 residues pruned to eliminate duplicates Z: 154 84.550 2.361 0.750 0.584 0.922 0.614 CB 1.656 154 residues pruned to eliminate duplicates Z: 161 84.304 2.355 0.699 0.629 0.906 0.656 CB 1.628 161 residues pruned to eliminate duplicates Z: 102 80.163 2.427 0.819 0.665 0.891 0.614 CB 1.740 102 residues pruned to eliminate duplicates Z: 47 26.711 2.266 0.487 0.421 0.870 0.522 CB 1.458 47 residues pruned to eliminate duplicates Z: 61 28.431 2.261 0.376 0.413 0.883 0.533 CB 1.462 61 residues pruned to eliminate duplicates Z: 82 44.570 2.255 0.518 0.533 0.926 0.593 CB 1.512 82 residues pruned to eliminate duplicates Z: 62 59.899 2.370 0.782 0.668 0.902 0.590 CB 1.725 62 residues pruned to eliminate duplicates Z: 104 81.541 2.412 0.815 0.648 0.922 0.544 CB 1.733 104 residues pruned to eliminate duplicates Z: 13 5.434 2.101 0.239 0.226 0.667 0.417 CB 1.245 13 residues pruned to eliminate duplicates Z: 12 5.659 2.143 0.343 0.141 0.727 0.455 CB 1.272 12 residues pruned to eliminate duplicates Z: 105 74.383 2.369 0.796 0.631 0.904 0.519 CB 1.677 105 residues pruned to eliminate duplicates Z: 10 7.099 2.256 0.387 0.287 0.667 0.556 CB 1.441 10 residues pruned to eliminate duplicates Z: 87 83.200 2.447 0.922 0.696 0.919 0.593 CB 1.737 87 residues pruned to eliminate duplicates Z: 12 7.418 2.041 0.313 0.246 0.818 0.545 CB 1.366 12 residues pruned to eliminate duplicates Z: 97 77.066 2.407 0.820 0.655 0.917 0.625 CB 1.696 97 residues pruned to eliminate duplicates Z: 49 33.917 2.302 0.540 0.503 0.896 0.604 CB 1.536 49 residues pruned to eliminate duplicates Z: 51 33.017 2.274 0.505 0.487 0.900 0.660 CB 1.537 51 residues pruned to eliminate duplicates Z: 18 14.039 2.194 0.588 0.395 0.765 0.471 CB 1.427 18 residues pruned to eliminate duplicates Z: 61 31.610 2.208 0.505 0.463 0.900 0.633 CB 1.417 61 residues pruned to eliminate duplicates Z: 37 31.015 2.273 0.591 0.587 0.889 0.667 CB 1.480 37 residues pruned to eliminate duplicates Z: 140 90.073 2.379 0.813 0.629 0.935 0.612 CB 1.678 140 residues pruned to eliminate duplicates Z: 50 35.224 2.295 0.515 0.517 0.918 0.673 CB 1.550 50 residues pruned to eliminate duplicates Z: 48 38.069 2.317 0.616 0.535 0.957 0.638 CB 1.496 48 residues pruned to eliminate duplicates Z: 50 32.675 2.304 0.440 0.519 0.918 0.571 CB 1.504 50 residues pruned to eliminate duplicates Z: 50 33.817 2.284 0.485 0.505 0.918 0.653 CB 1.543 50 residues pruned to eliminate duplicates Z: 31 29.312 2.188 0.640 0.621 0.933 0.633 CB 1.425 31 residues pruned to eliminate duplicates Z: 61 41.679 2.247 0.548 0.594 0.950 0.750 CB 1.488 61 residues pruned to eliminate duplicates Z: 41 33.981 2.334 0.551 0.501 0.925 0.650 CB 1.603 41 residues pruned to eliminate duplicates Z: 63 47.539 2.284 0.587 0.620 0.968 0.758 CB 1.538 63 residues pruned to eliminate duplicates Z: 36 31.918 2.285 0.578 0.603 0.971 0.714 CB 1.397 36 residues pruned to eliminate duplicates Z: 49 34.844 2.269 0.651 0.485 0.938 0.688 CB 1.453 49 residues pruned to eliminate duplicates Z: 37 31.215 2.247 0.633 0.564 0.917 0.722 CB 1.454 37 residues pruned to eliminate duplicates Z: 26 30.054 2.357 0.635 0.576 0.920 0.720 CB 1.574 26 residues pruned to eliminate duplicates Z: 70 48.823 2.254 0.675 0.590 0.942 0.638 CB 1.517 70 residues pruned to eliminate duplicates Z: 51 32.442 2.289 0.542 0.489 0.900 0.580 CB 1.460 51 residues pruned to eliminate duplicates Z: 62 47.363 2.318 0.480 0.645 0.967 0.689 CB 1.597 62 residues pruned to eliminate duplicates Z: 63 45.943 2.277 0.635 0.617 0.903 0.694 CB 1.554 63 residues pruned to eliminate duplicates Z: 70 46.761 2.228 0.676 0.586 0.957 0.681 CB 1.451 70 residues pruned to eliminate duplicates Z: 71 51.783 2.293 0.617 0.658 0.943 0.671 CB 1.528 71 residues pruned to eliminate duplicates Z: 48 36.383 2.320 0.559 0.555 0.936 0.702 CB 1.485 48 residues pruned to eliminate duplicates Z: 60 45.486 2.272 0.608 0.611 0.949 0.695 CB 1.536 60 residues pruned to eliminate duplicates Z: 42 32.235 2.292 0.551 0.531 0.927 0.732 CB 1.482 42 residues pruned to eliminate duplicates Z: 30 21.273 2.211 0.495 0.407 0.862 0.655 CB 1.529 Z: 6 19.811 2.404 0.878 0.823 1.000 0.600 CB 1.484 6 residues pruned to eliminate duplicates Z: 30 27.858 2.259 0.476 0.589 0.931 0.759 CB 1.531 60 residues pruned to eliminate duplicates Z: 42 33.322 2.302 0.588 0.487 0.951 0.659 CB 1.516 42 residues pruned to eliminate duplicates Z: 64 52.058 2.295 0.649 0.658 0.968 0.762 CB 1.546 64 residues pruned to eliminate duplicates Z: 41 35.986 2.318 0.665 0.526 0.950 0.750 CB 1.513 41 residues pruned to eliminate duplicates Z: 36 38.205 2.308 0.712 0.651 0.943 0.743 CB 1.505 36 residues pruned to eliminate duplicates Z: 42 34.626 2.287 0.588 0.520 0.951 0.683 CB 1.534 42 residues pruned to eliminate duplicates Z: 72 49.277 2.248 0.677 0.632 0.915 0.761 CB 1.498 72 residues pruned to eliminate duplicates Z: 50 33.882 2.226 0.594 0.544 0.939 0.694 CB 1.392 50 residues pruned to eliminate duplicates Z: 45 35.647 2.240 0.586 0.592 0.909 0.682 CB 1.524 Z: 6 7.320 1.657 0.751 0.406 1.000 0.600 C 1.246 6 residues pruned to eliminate duplicates Z: 36 39.583 2.246 0.667 0.698 0.943 0.771 CB 1.582 36 residues pruned to eliminate duplicates Z: 7 5.518 1.574 1.019 0.405 0.833 0.667 N 0.939 7 residues pruned to eliminate duplicates Z: 63 48.277 2.259 0.686 0.639 0.935 0.710 CB 1.511 108 residues pruned to eliminate duplicates Z: 30 22.529 2.230 0.473 0.426 0.897 0.759 CB 1.533 Z: 6 9.696 1.973 0.127 0.656 1.000 0.200 CA 1.688 6 residues pruned to eliminate duplicates Z: 8 6.618 1.753 0.358 0.448 0.857 0.143 CA 1.293 6 residues pruned to eliminate duplicates Z: 27 32.826 2.179 0.506 0.807 0.962 0.731 CB 1.561 7 residues pruned to eliminate duplicates Z: 23 37.761 2.207 0.782 0.889 1.000 0.818 CB 1.473 23 residues pruned to eliminate duplicates Z: 26 34.223 2.123 0.709 0.784 0.920 0.880 CB 1.597 27 residues pruned to eliminate duplicates Z: 25 34.227 2.062 0.726 0.902 0.958 0.833 CB 1.461 23 residues pruned to eliminate duplicates Z: 25 34.985 2.057 0.887 0.915 0.958 0.875 CB 1.356 25 residues pruned to eliminate duplicates Z: 22 43.104 2.285 0.884 0.904 1.000 0.714 CB 1.556 24 residues pruned to eliminate duplicates Z: 23 30.269 2.074 0.616 0.888 0.955 0.773 CB 1.453 23 residues pruned to eliminate duplicates Z: 64 48.343 2.262 0.605 0.662 0.984 0.683 CB 1.468 115 residues pruned to eliminate duplicates Z: 22 40.951 2.257 0.874 0.877 1.000 0.619 CB 1.534 Z: 22 32.571 2.158 0.746 0.889 0.905 0.619 CB 1.501 22 residues pruned to eliminate duplicates Z: 24 41.731 2.237 0.858 0.863 1.000 0.478 CB 1.536 22 residues pruned to eliminate duplicates Z: 23 38.245 2.183 1.000 0.916 0.955 0.545 CB 1.382 21 residues pruned to eliminate duplicates Z: 23 41.679 2.182 1.088 0.908 0.909 0.636 CB 1.524 24 residues pruned to eliminate duplicates Z: 21 46.632 2.232 1.049 0.909 1.000 0.450 CB 1.618 23 residues pruned to eliminate duplicates Z: 23 37.609 2.101 1.120 0.867 0.909 0.591 CB 1.448 23 residues pruned to eliminate duplicates Z: 22 43.216 2.253 1.087 0.895 0.952 0.429 CB 1.510 22 residues pruned to eliminate duplicates Z: 71 54.944 2.268 0.748 0.629 0.957 0.643 CB 1.532 94 residues pruned to eliminate duplicates Z: 21 47.171 2.301 1.056 0.900 1.000 0.600 CB 1.593 Z: 22 38.361 2.175 1.001 0.897 0.905 0.619 CB 1.521 21 residues pruned to eliminate duplicates Z: 23 40.352 2.185 1.078 0.937 0.955 0.409 CB 1.381 21 residues pruned to eliminate duplicates Z: 25 41.712 2.089 1.190 0.912 0.958 0.625 CB 1.375 25 residues pruned to eliminate duplicates Z: 23 46.772 2.194 1.181 0.932 1.000 0.591 CB 1.455 23 residues pruned to eliminate duplicates Z: 26 41.361 2.179 1.018 0.823 1.000 0.640 CB 1.422 26 residues pruned to eliminate duplicates Z: 75 54.225 2.254 0.797 0.643 0.919 0.514 CB 1.482 99 residues pruned to eliminate duplicates Z: 66 54.287 2.269 0.781 0.631 0.969 0.692 CB 1.521 66 residues pruned to eliminate duplicates 653 residues left after pruning, divided into chains as follows: A: 12 B: 7 C: 8 D: 13 E: 7 F: 12 G: 17 H: 420 I: 157 CC for partial structure against native data = 36.71 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 2 used as input for final density modification = 0.300, Contrast = 0.573, Connect. = 0.783 for dens.mod. cycle 1 = 0.300, Contrast = 0.651, Connect. = 0.805 for dens.mod. cycle 2 = 0.300, Contrast = 0.779, Connect. = 0.830 for dens.mod. cycle 3 = 0.300, Contrast = 0.791, Connect. = 0.831 for dens.mod. cycle 4 = 0.300, Contrast = 0.804, Connect. = 0.833 for dens.mod. cycle 5 = 0.300, Contrast = 0.809, Connect. = 0.834 for dens.mod. cycle 6 = 0.300, Contrast = 0.815, Connect. = 0.836 for dens.mod. cycle 7 = 0.300, Contrast = 0.817, Connect. = 0.837 for dens.mod. cycle 8 = 0.300, Contrast = 0.819, Connect. = 0.838 for dens.mod. cycle 9 = 0.300, Contrast = 0.819, Connect. = 0.838 for dens.mod. cycle 10 Estimated mean FOM and mapCC as a function of resolution d inf - 3.97 - 3.14 - 2.74 - 2.49 - 2.31 - 2.17 - 2.06 - 1.97 - 1.90 - 1.83 0.743 0.762 0.759 0.746 0.710 0.683 0.660 0.612 0.575 0.559 0.885 0.899 0.902 0.882 0.840 0.810 0.783 0.734 0.688 0.668 N 9430 9548 9536 9408 9543 9764 9656 9531 8497 9250 Estimated mean FOM = 0.682 Pseudo-free CC = 70.87 % Best trace (cycle 2 with CC 44.28%) was saved as ./1vp4-1.8-parrot-noncs/1vp4-1.8-parrot-noncs.pdb ============================================================================== CPU times required in seconds ----------------------------- 2.2 - Setup, data input and phasing 16.8 - FFTs and peak-searches 69.1 - Sphere of influence 1.0 - Rest of density modification 0.0 - Alpha-helix search 1808.5 - Tripeptide search 24315.1 - Chain tracing 0.0 - NCS analysis 120.0 - B-value refinement for trace 0.8 - Rest of tracing 0.0 - Comparison with known structure ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE finished at 06:30:44 Total time: 26333.62 secs + ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ TimeTaking 441.79 Used memory is bytes: 83555072