USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 784 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 SER OG : rot -158:sc= 0.0746 USER MOD Set 1.2: A 73 THR OG1 : rot 180:sc= 0.0666 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 35:sc= 0.457 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 151:sc= 1.14 (180deg=0.702) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.392 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.305 USER MOD Single : A 29 MET CE :methyl 141:sc= -2.72 (180deg=-5.3!) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0483) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot -118:sc= -0.782! USER MOD Single : A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 130:sc= 0 USER MOD Single : A 78 TYR OH : rot -32:sc= 1.25 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.222 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 HIS : no HE2:sc= -9.44! C(o=-9.4!,f=-11!) USER MOD Single : A 92 SER OG : rot 23:sc= -1.54 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -150:sc= -0.525 (180deg=-1.79!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 12:sc= 0.453! USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 29.110 6.806 1.528 1.00 0.00 N ATOM 2 CA GLY A 1 28.627 8.044 0.944 1.00 0.00 C ATOM 3 C GLY A 1 27.141 8.245 1.160 1.00 0.00 C ATOM 4 O GLY A 1 26.356 8.190 0.213 1.00 0.00 O ATOM 0 H1 GLY A 1 30.131 6.715 1.353 1.00 0.00 H new ATOM 0 H2 GLY A 1 28.933 6.814 2.553 1.00 0.00 H new ATOM 0 H3 GLY A 1 28.612 6.001 1.097 1.00 0.00 H new ATOM 0 HA2 GLY A 1 29.171 8.883 1.378 1.00 0.00 H new ATOM 0 HA3 GLY A 1 28.839 8.045 -0.125 1.00 0.00 H new ATOM 8 N SER A 2 26.751 8.478 2.409 1.00 0.00 N ATOM 9 CA SER A 2 25.348 8.683 2.747 1.00 0.00 C ATOM 10 C SER A 2 24.883 10.072 2.320 1.00 0.00 C ATOM 11 O SER A 2 25.518 11.077 2.640 1.00 0.00 O ATOM 12 CB SER A 2 25.131 8.500 4.250 1.00 0.00 C ATOM 13 OG SER A 2 25.647 7.256 4.692 1.00 0.00 O ATOM 0 H SER A 2 27.388 8.530 3.204 1.00 0.00 H new ATOM 0 HA SER A 2 24.759 7.940 2.209 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.616 9.312 4.792 1.00 0.00 H new ATOM 0 HB3 SER A 2 24.066 8.557 4.477 1.00 0.00 H new ATOM 0 HG SER A 2 25.498 7.164 5.656 1.00 0.00 H new ATOM 19 N SER A 3 23.770 10.120 1.595 1.00 0.00 N ATOM 20 CA SER A 3 23.221 11.384 1.120 1.00 0.00 C ATOM 21 C SER A 3 23.007 12.353 2.279 1.00 0.00 C ATOM 22 O SER A 3 22.278 12.057 3.225 1.00 0.00 O ATOM 23 CB SER A 3 21.899 11.148 0.388 1.00 0.00 C ATOM 24 OG SER A 3 20.914 10.631 1.267 1.00 0.00 O ATOM 0 H SER A 3 23.231 9.298 1.324 1.00 0.00 H new ATOM 0 HA SER A 3 23.938 11.825 0.427 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.548 12.084 -0.046 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.056 10.453 -0.437 1.00 0.00 H new ATOM 0 HG SER A 3 21.036 11.018 2.159 1.00 0.00 H new ATOM 30 N GLY A 4 23.650 13.514 2.198 1.00 0.00 N ATOM 31 CA GLY A 4 23.518 14.510 3.246 1.00 0.00 C ATOM 32 C GLY A 4 22.420 15.515 2.956 1.00 0.00 C ATOM 33 O GLY A 4 21.355 15.476 3.572 1.00 0.00 O ATOM 0 H GLY A 4 24.260 13.783 1.426 1.00 0.00 H new ATOM 0 HA2 GLY A 4 23.309 14.011 4.193 1.00 0.00 H new ATOM 0 HA3 GLY A 4 24.465 15.036 3.365 1.00 0.00 H new ATOM 37 N SER A 5 22.681 16.419 2.017 1.00 0.00 N ATOM 38 CA SER A 5 21.709 17.442 1.650 1.00 0.00 C ATOM 39 C SER A 5 21.396 17.384 0.158 1.00 0.00 C ATOM 40 O SER A 5 20.237 17.266 -0.239 1.00 0.00 O ATOM 41 CB SER A 5 22.235 18.831 2.019 1.00 0.00 C ATOM 42 OG SER A 5 21.170 19.723 2.298 1.00 0.00 O ATOM 0 H SER A 5 23.557 16.464 1.497 1.00 0.00 H new ATOM 0 HA SER A 5 20.790 17.250 2.204 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.888 18.757 2.888 1.00 0.00 H new ATOM 0 HB3 SER A 5 22.838 19.224 1.200 1.00 0.00 H new ATOM 0 HG SER A 5 21.533 20.603 2.533 1.00 0.00 H new ATOM 48 N SER A 6 22.438 17.469 -0.662 1.00 0.00 N ATOM 49 CA SER A 6 22.275 17.430 -2.111 1.00 0.00 C ATOM 50 C SER A 6 21.199 16.424 -2.510 1.00 0.00 C ATOM 51 O SER A 6 20.889 15.500 -1.760 1.00 0.00 O ATOM 52 CB SER A 6 23.600 17.071 -2.785 1.00 0.00 C ATOM 53 OG SER A 6 24.388 18.227 -3.010 1.00 0.00 O ATOM 0 H SER A 6 23.404 17.565 -0.348 1.00 0.00 H new ATOM 0 HA SER A 6 21.963 18.420 -2.443 1.00 0.00 H new ATOM 0 HB2 SER A 6 24.151 16.368 -2.160 1.00 0.00 H new ATOM 0 HB3 SER A 6 23.405 16.570 -3.733 1.00 0.00 H new ATOM 0 HG SER A 6 25.230 17.970 -3.440 1.00 0.00 H new ATOM 59 N GLY A 7 20.633 16.612 -3.698 1.00 0.00 N ATOM 60 CA GLY A 7 19.598 15.715 -4.178 1.00 0.00 C ATOM 61 C GLY A 7 18.346 15.767 -3.326 1.00 0.00 C ATOM 62 O GLY A 7 18.140 14.917 -2.460 1.00 0.00 O ATOM 0 H GLY A 7 20.873 17.370 -4.337 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.345 15.974 -5.206 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.983 14.695 -4.191 1.00 0.00 H new ATOM 66 N ILE A 8 17.507 16.768 -3.572 1.00 0.00 N ATOM 67 CA ILE A 8 16.268 16.928 -2.820 1.00 0.00 C ATOM 68 C ILE A 8 15.066 17.017 -3.754 1.00 0.00 C ATOM 69 O ILE A 8 15.183 17.469 -4.892 1.00 0.00 O ATOM 70 CB ILE A 8 16.307 18.184 -1.931 1.00 0.00 C ATOM 71 CG1 ILE A 8 16.450 19.441 -2.792 1.00 0.00 C ATOM 72 CG2 ILE A 8 17.449 18.089 -0.929 1.00 0.00 C ATOM 73 CD1 ILE A 8 15.806 20.667 -2.183 1.00 0.00 C ATOM 0 H ILE A 8 17.662 17.480 -4.286 1.00 0.00 H new ATOM 0 HA ILE A 8 16.168 16.047 -2.186 1.00 0.00 H new ATOM 0 HB ILE A 8 15.369 18.249 -1.379 1.00 0.00 H new ATOM 0 HG12 ILE A 8 17.509 19.640 -2.956 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.005 19.255 -3.770 1.00 0.00 H new ATOM 0 HG21 ILE A 8 17.463 18.985 -0.308 1.00 0.00 H new ATOM 0 HG22 ILE A 8 17.307 17.212 -0.298 1.00 0.00 H new ATOM 0 HG23 ILE A 8 18.395 18.003 -1.463 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.946 21.520 -2.847 1.00 0.00 H new ATOM 0 HD12 ILE A 8 14.740 20.487 -2.044 1.00 0.00 H new ATOM 0 HD13 ILE A 8 16.267 20.879 -1.218 1.00 0.00 H new ATOM 85 N GLY A 9 13.908 16.584 -3.263 1.00 0.00 N ATOM 86 CA GLY A 9 12.700 16.625 -4.066 1.00 0.00 C ATOM 87 C GLY A 9 11.447 16.753 -3.223 1.00 0.00 C ATOM 88 O GLY A 9 11.524 16.876 -2.000 1.00 0.00 O ATOM 0 H GLY A 9 13.785 16.206 -2.324 1.00 0.00 H new ATOM 0 HA2 GLY A 9 12.756 17.465 -4.758 1.00 0.00 H new ATOM 0 HA3 GLY A 9 12.637 15.719 -4.669 1.00 0.00 H new ATOM 92 N ASP A 10 10.291 16.725 -3.876 1.00 0.00 N ATOM 93 CA ASP A 10 9.016 16.839 -3.178 1.00 0.00 C ATOM 94 C ASP A 10 8.092 15.681 -3.541 1.00 0.00 C ATOM 95 O ASP A 10 7.593 15.600 -4.662 1.00 0.00 O ATOM 96 CB ASP A 10 8.342 18.170 -3.517 1.00 0.00 C ATOM 97 CG ASP A 10 9.316 19.332 -3.505 1.00 0.00 C ATOM 98 OD1 ASP A 10 10.103 19.435 -2.542 1.00 0.00 O ATOM 99 OD2 ASP A 10 9.290 20.138 -4.459 1.00 0.00 O ATOM 0 H ASP A 10 10.210 16.624 -4.888 1.00 0.00 H new ATOM 0 HA ASP A 10 9.212 16.802 -2.106 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.878 18.099 -4.501 1.00 0.00 H new ATOM 0 HB3 ASP A 10 7.543 18.362 -2.801 1.00 0.00 H new ATOM 104 N ALA A 11 7.871 14.785 -2.584 1.00 0.00 N ATOM 105 CA ALA A 11 7.007 13.632 -2.802 1.00 0.00 C ATOM 106 C ALA A 11 5.616 14.065 -3.251 1.00 0.00 C ATOM 107 O ALA A 11 5.012 13.440 -4.123 1.00 0.00 O ATOM 108 CB ALA A 11 6.918 12.792 -1.536 1.00 0.00 C ATOM 0 H ALA A 11 8.279 14.836 -1.650 1.00 0.00 H new ATOM 0 HA ALA A 11 7.444 13.027 -3.596 1.00 0.00 H new ATOM 0 HB1 ALA A 11 6.269 11.934 -1.713 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.913 12.444 -1.260 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.508 13.396 -0.727 1.00 0.00 H new ATOM 114 N ARG A 12 5.112 15.137 -2.649 1.00 0.00 N ATOM 115 CA ARG A 12 3.790 15.652 -2.986 1.00 0.00 C ATOM 116 C ARG A 12 3.661 15.875 -4.490 1.00 0.00 C ATOM 117 O ARG A 12 2.555 16.004 -5.015 1.00 0.00 O ATOM 118 CB ARG A 12 3.525 16.962 -2.241 1.00 0.00 C ATOM 119 CG ARG A 12 3.063 16.764 -0.807 1.00 0.00 C ATOM 120 CD ARG A 12 3.082 18.071 -0.030 1.00 0.00 C ATOM 121 NE ARG A 12 2.213 18.023 1.143 1.00 0.00 N ATOM 122 CZ ARG A 12 0.886 18.038 1.076 1.00 0.00 C ATOM 123 NH1 ARG A 12 0.279 18.098 -0.102 1.00 0.00 N ATOM 124 NH2 ARG A 12 0.164 17.992 2.188 1.00 0.00 N ATOM 0 H ARG A 12 5.599 15.666 -1.925 1.00 0.00 H new ATOM 0 HA ARG A 12 3.050 14.912 -2.681 1.00 0.00 H new ATOM 0 HB2 ARG A 12 4.436 17.561 -2.241 1.00 0.00 H new ATOM 0 HB3 ARG A 12 2.769 17.531 -2.782 1.00 0.00 H new ATOM 0 HG2 ARG A 12 2.054 16.351 -0.802 1.00 0.00 H new ATOM 0 HG3 ARG A 12 3.707 16.037 -0.313 1.00 0.00 H new ATOM 0 HD2 ARG A 12 4.102 18.292 0.284 1.00 0.00 H new ATOM 0 HD3 ARG A 12 2.766 18.885 -0.682 1.00 0.00 H new ATOM 0 HE ARG A 12 2.649 17.975 2.064 1.00 0.00 H new ATOM 0 HH11 ARG A 12 0.831 18.133 -0.959 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -0.740 18.109 -0.151 1.00 0.00 H new ATOM 0 HH21 ARG A 12 0.627 17.945 3.095 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -0.855 18.004 2.136 1.00 0.00 H new ATOM 138 N ARG A 13 4.798 15.918 -5.176 1.00 0.00 N ATOM 139 CA ARG A 13 4.811 16.127 -6.619 1.00 0.00 C ATOM 140 C ARG A 13 4.973 14.802 -7.358 1.00 0.00 C ATOM 141 O ARG A 13 4.418 14.612 -8.440 1.00 0.00 O ATOM 142 CB ARG A 13 5.942 17.081 -7.007 1.00 0.00 C ATOM 143 CG ARG A 13 5.942 18.379 -6.217 1.00 0.00 C ATOM 144 CD ARG A 13 5.067 19.433 -6.878 1.00 0.00 C ATOM 145 NE ARG A 13 5.806 20.221 -7.860 1.00 0.00 N ATOM 146 CZ ARG A 13 5.229 21.052 -8.721 1.00 0.00 C ATOM 147 NH1 ARG A 13 3.911 21.203 -8.719 1.00 0.00 N ATOM 148 NH2 ARG A 13 5.969 21.735 -9.585 1.00 0.00 N ATOM 0 H ARG A 13 5.722 15.811 -4.757 1.00 0.00 H new ATOM 0 HA ARG A 13 3.857 16.569 -6.906 1.00 0.00 H new ATOM 0 HB2 ARG A 13 6.897 16.577 -6.861 1.00 0.00 H new ATOM 0 HB3 ARG A 13 5.863 17.312 -8.069 1.00 0.00 H new ATOM 0 HG2 ARG A 13 5.584 18.190 -5.205 1.00 0.00 H new ATOM 0 HG3 ARG A 13 6.962 18.753 -6.130 1.00 0.00 H new ATOM 0 HD2 ARG A 13 4.221 18.948 -7.365 1.00 0.00 H new ATOM 0 HD3 ARG A 13 4.659 20.096 -6.115 1.00 0.00 H new ATOM 0 HE ARG A 13 6.821 20.128 -7.886 1.00 0.00 H new ATOM 0 HH11 ARG A 13 3.339 20.681 -8.056 1.00 0.00 H new ATOM 0 HH12 ARG A 13 3.470 21.842 -9.381 1.00 0.00 H new ATOM 0 HH21 ARG A 13 6.983 21.622 -9.589 1.00 0.00 H new ATOM 0 HH22 ARG A 13 5.524 22.373 -10.245 1.00 0.00 H new ATOM 162 N ALA A 14 5.737 13.889 -6.767 1.00 0.00 N ATOM 163 CA ALA A 14 5.971 12.582 -7.368 1.00 0.00 C ATOM 164 C ALA A 14 4.655 11.874 -7.670 1.00 0.00 C ATOM 165 O ALA A 14 3.815 11.699 -6.788 1.00 0.00 O ATOM 166 CB ALA A 14 6.835 11.727 -6.453 1.00 0.00 C ATOM 0 H ALA A 14 6.205 14.031 -5.872 1.00 0.00 H new ATOM 0 HA ALA A 14 6.498 12.732 -8.310 1.00 0.00 H new ATOM 0 HB1 ALA A 14 7.002 10.754 -6.915 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.793 12.221 -6.291 1.00 0.00 H new ATOM 0 HB3 ALA A 14 6.330 11.593 -5.496 1.00 0.00 H new ATOM 172 N LYS A 15 4.480 11.469 -8.924 1.00 0.00 N ATOM 173 CA LYS A 15 3.266 10.779 -9.343 1.00 0.00 C ATOM 174 C LYS A 15 3.494 9.272 -9.415 1.00 0.00 C ATOM 175 O LYS A 15 4.623 8.812 -9.587 1.00 0.00 O ATOM 176 CB LYS A 15 2.804 11.300 -10.706 1.00 0.00 C ATOM 177 CG LYS A 15 2.619 12.807 -10.749 1.00 0.00 C ATOM 178 CD LYS A 15 3.899 13.515 -11.160 1.00 0.00 C ATOM 179 CE LYS A 15 3.641 14.969 -11.522 1.00 0.00 C ATOM 180 NZ LYS A 15 3.199 15.764 -10.343 1.00 0.00 N ATOM 0 H LYS A 15 5.164 11.607 -9.668 1.00 0.00 H new ATOM 0 HA LYS A 15 2.491 10.977 -8.602 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.533 11.010 -11.463 1.00 0.00 H new ATOM 0 HB3 LYS A 15 1.862 10.819 -10.970 1.00 0.00 H new ATOM 0 HG2 LYS A 15 1.823 13.057 -11.450 1.00 0.00 H new ATOM 0 HG3 LYS A 15 2.304 13.164 -9.769 1.00 0.00 H new ATOM 0 HD2 LYS A 15 4.621 13.465 -10.345 1.00 0.00 H new ATOM 0 HD3 LYS A 15 4.343 13.000 -12.012 1.00 0.00 H new ATOM 0 HE2 LYS A 15 4.549 15.407 -11.935 1.00 0.00 H new ATOM 0 HE3 LYS A 15 2.880 15.020 -12.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.494 16.754 -10.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 2.163 15.719 -10.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 3.631 15.375 -9.480 1.00 0.00 H new ATOM 194 N VAL A 16 2.414 8.508 -9.283 1.00 0.00 N ATOM 195 CA VAL A 16 2.496 7.053 -9.336 1.00 0.00 C ATOM 196 C VAL A 16 1.311 6.463 -10.091 1.00 0.00 C ATOM 197 O VAL A 16 0.160 6.627 -9.687 1.00 0.00 O ATOM 198 CB VAL A 16 2.547 6.442 -7.923 1.00 0.00 C ATOM 199 CG1 VAL A 16 3.852 6.803 -7.231 1.00 0.00 C ATOM 200 CG2 VAL A 16 1.353 6.904 -7.101 1.00 0.00 C ATOM 0 H VAL A 16 1.472 8.872 -9.139 1.00 0.00 H new ATOM 0 HA VAL A 16 3.418 6.807 -9.863 1.00 0.00 H new ATOM 0 HB VAL A 16 2.500 5.357 -8.013 1.00 0.00 H new ATOM 0 HG11 VAL A 16 3.869 6.362 -6.234 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.690 6.419 -7.812 1.00 0.00 H new ATOM 0 HG13 VAL A 16 3.933 7.887 -7.150 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.404 6.463 -6.105 1.00 0.00 H new ATOM 0 HG22 VAL A 16 1.367 7.991 -7.018 1.00 0.00 H new ATOM 0 HG23 VAL A 16 0.431 6.589 -7.590 1.00 0.00 H new ATOM 210 N TYR A 17 1.600 5.774 -11.190 1.00 0.00 N ATOM 211 CA TYR A 17 0.557 5.160 -12.003 1.00 0.00 C ATOM 212 C TYR A 17 0.996 3.789 -12.507 1.00 0.00 C ATOM 213 O TYR A 17 2.147 3.597 -12.898 1.00 0.00 O ATOM 214 CB TYR A 17 0.208 6.063 -13.188 1.00 0.00 C ATOM 215 CG TYR A 17 1.416 6.679 -13.857 1.00 0.00 C ATOM 216 CD1 TYR A 17 2.150 5.970 -14.799 1.00 0.00 C ATOM 217 CD2 TYR A 17 1.823 7.971 -13.546 1.00 0.00 C ATOM 218 CE1 TYR A 17 3.255 6.529 -15.412 1.00 0.00 C ATOM 219 CE2 TYR A 17 2.925 8.538 -14.155 1.00 0.00 C ATOM 220 CZ TYR A 17 3.638 7.813 -15.087 1.00 0.00 C ATOM 221 OH TYR A 17 4.737 8.374 -15.696 1.00 0.00 O ATOM 0 H TYR A 17 2.548 5.627 -11.538 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.327 5.032 -11.379 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -0.348 5.483 -13.924 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.452 6.859 -12.845 1.00 0.00 H new ATOM 0 HD1 TYR A 17 1.852 4.964 -15.057 1.00 0.00 H new ATOM 0 HD2 TYR A 17 1.268 8.541 -12.816 1.00 0.00 H new ATOM 0 HE1 TYR A 17 3.815 5.963 -16.142 1.00 0.00 H new ATOM 0 HE2 TYR A 17 3.227 9.544 -13.903 1.00 0.00 H new ATOM 0 HH TYR A 17 4.871 9.283 -15.356 1.00 0.00 H new ATOM 231 N GLY A 18 0.069 2.836 -12.493 1.00 0.00 N ATOM 232 CA GLY A 18 0.377 1.494 -12.950 1.00 0.00 C ATOM 233 C GLY A 18 -0.757 0.520 -12.699 1.00 0.00 C ATOM 234 O GLY A 18 -1.929 0.888 -12.780 1.00 0.00 O ATOM 0 H GLY A 18 -0.890 2.970 -12.173 1.00 0.00 H new ATOM 0 HA2 GLY A 18 0.600 1.519 -14.017 1.00 0.00 H new ATOM 0 HA3 GLY A 18 1.275 1.139 -12.445 1.00 0.00 H new ATOM 238 N ARG A 19 -0.409 -0.726 -12.394 1.00 0.00 N ATOM 239 CA ARG A 19 -1.407 -1.756 -12.132 1.00 0.00 C ATOM 240 C ARG A 19 -1.206 -2.369 -10.750 1.00 0.00 C ATOM 241 O ARG A 19 -2.144 -2.893 -10.150 1.00 0.00 O ATOM 242 CB ARG A 19 -1.336 -2.848 -13.201 1.00 0.00 C ATOM 243 CG ARG A 19 -2.488 -3.837 -13.139 1.00 0.00 C ATOM 244 CD ARG A 19 -2.135 -5.147 -13.825 1.00 0.00 C ATOM 245 NE ARG A 19 -1.980 -4.985 -15.268 1.00 0.00 N ATOM 246 CZ ARG A 19 -1.973 -5.999 -16.126 1.00 0.00 C ATOM 247 NH1 ARG A 19 -2.112 -7.243 -15.687 1.00 0.00 N ATOM 248 NH2 ARG A 19 -1.828 -5.771 -17.425 1.00 0.00 N ATOM 0 H ARG A 19 0.557 -1.047 -12.322 1.00 0.00 H new ATOM 0 HA ARG A 19 -2.391 -1.289 -12.164 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -1.322 -2.380 -14.186 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -0.397 -3.390 -13.093 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -2.749 -4.029 -12.098 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -3.368 -3.402 -13.613 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -1.210 -5.539 -13.403 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -2.914 -5.883 -13.624 1.00 0.00 H new ATOM 0 HE ARG A 19 -1.871 -4.041 -15.638 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -2.225 -7.422 -14.689 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.106 -8.020 -16.347 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -1.722 -4.816 -17.766 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -1.823 -6.551 -18.082 1.00 0.00 H new ATOM 262 N GLY A 20 0.024 -2.300 -10.250 1.00 0.00 N ATOM 263 CA GLY A 20 0.325 -2.852 -8.942 1.00 0.00 C ATOM 264 C GLY A 20 0.169 -1.832 -7.832 1.00 0.00 C ATOM 265 O GLY A 20 0.755 -1.977 -6.758 1.00 0.00 O ATOM 0 H GLY A 20 0.817 -1.872 -10.727 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.333 -3.699 -8.748 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.346 -3.235 -8.939 1.00 0.00 H new ATOM 269 N LEU A 21 -0.622 -0.796 -8.089 1.00 0.00 N ATOM 270 CA LEU A 21 -0.853 0.254 -7.103 1.00 0.00 C ATOM 271 C LEU A 21 -2.304 0.251 -6.634 1.00 0.00 C ATOM 272 O LEU A 21 -2.602 0.629 -5.502 1.00 0.00 O ATOM 273 CB LEU A 21 -0.498 1.620 -7.692 1.00 0.00 C ATOM 274 CG LEU A 21 0.951 1.799 -8.148 1.00 0.00 C ATOM 275 CD1 LEU A 21 1.089 3.043 -9.012 1.00 0.00 C ATOM 276 CD2 LEU A 21 1.882 1.876 -6.947 1.00 0.00 C ATOM 0 H LEU A 21 -1.114 -0.661 -8.972 1.00 0.00 H new ATOM 0 HA LEU A 21 -0.213 0.058 -6.243 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -1.152 1.807 -8.544 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -0.720 2.384 -6.946 1.00 0.00 H new ATOM 0 HG LEU A 21 1.233 0.933 -8.747 1.00 0.00 H new ATOM 0 HD11 LEU A 21 2.127 3.154 -9.327 1.00 0.00 H new ATOM 0 HD12 LEU A 21 0.451 2.948 -9.891 1.00 0.00 H new ATOM 0 HD13 LEU A 21 0.788 3.920 -8.438 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.909 2.003 -7.290 1.00 0.00 H new ATOM 0 HD22 LEU A 21 1.600 2.724 -6.322 1.00 0.00 H new ATOM 0 HD23 LEU A 21 1.805 0.956 -6.367 1.00 0.00 H new ATOM 288 N SER A 22 -3.204 -0.180 -7.513 1.00 0.00 N ATOM 289 CA SER A 22 -4.625 -0.231 -7.190 1.00 0.00 C ATOM 290 C SER A 22 -5.056 -1.657 -6.860 1.00 0.00 C ATOM 291 O SER A 22 -5.492 -1.942 -5.745 1.00 0.00 O ATOM 292 CB SER A 22 -5.455 0.307 -8.356 1.00 0.00 C ATOM 293 OG SER A 22 -6.754 0.678 -7.930 1.00 0.00 O ATOM 0 H SER A 22 -2.974 -0.499 -8.454 1.00 0.00 H new ATOM 0 HA SER A 22 -4.795 0.394 -6.314 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.953 1.169 -8.796 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.527 -0.452 -9.135 1.00 0.00 H new ATOM 0 HG SER A 22 -7.264 1.020 -8.694 1.00 0.00 H new ATOM 299 N GLU A 23 -4.931 -2.548 -7.838 1.00 0.00 N ATOM 300 CA GLU A 23 -5.308 -3.944 -7.653 1.00 0.00 C ATOM 301 C GLU A 23 -4.171 -4.875 -8.064 1.00 0.00 C ATOM 302 O GLU A 23 -3.093 -4.423 -8.449 1.00 0.00 O ATOM 303 CB GLU A 23 -6.565 -4.268 -8.463 1.00 0.00 C ATOM 304 CG GLU A 23 -6.385 -4.097 -9.962 1.00 0.00 C ATOM 305 CD GLU A 23 -7.655 -4.382 -10.739 1.00 0.00 C ATOM 306 OE1 GLU A 23 -8.733 -3.927 -10.302 1.00 0.00 O ATOM 307 OE2 GLU A 23 -7.570 -5.060 -11.784 1.00 0.00 O ATOM 0 H GLU A 23 -4.571 -2.328 -8.767 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.516 -4.099 -6.594 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.865 -5.295 -8.257 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -7.379 -3.625 -8.128 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -6.057 -3.079 -10.171 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -5.595 -4.764 -10.308 1.00 0.00 H new ATOM 314 N GLY A 24 -4.421 -6.178 -7.980 1.00 0.00 N ATOM 315 CA GLY A 24 -3.409 -7.152 -8.346 1.00 0.00 C ATOM 316 C GLY A 24 -3.889 -8.580 -8.172 1.00 0.00 C ATOM 317 O GLY A 24 -5.015 -8.814 -7.732 1.00 0.00 O ATOM 0 H GLY A 24 -5.306 -6.576 -7.665 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -3.116 -6.994 -9.384 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.520 -6.994 -7.736 1.00 0.00 H new ATOM 321 N ARG A 25 -3.034 -9.536 -8.519 1.00 0.00 N ATOM 322 CA ARG A 25 -3.378 -10.948 -8.401 1.00 0.00 C ATOM 323 C ARG A 25 -2.141 -11.785 -8.091 1.00 0.00 C ATOM 324 O ARG A 25 -1.014 -11.380 -8.382 1.00 0.00 O ATOM 325 CB ARG A 25 -4.033 -11.445 -9.692 1.00 0.00 C ATOM 326 CG ARG A 25 -5.546 -11.302 -9.701 1.00 0.00 C ATOM 327 CD ARG A 25 -6.185 -12.207 -10.743 1.00 0.00 C ATOM 328 NE ARG A 25 -6.273 -11.561 -12.049 1.00 0.00 N ATOM 329 CZ ARG A 25 -7.138 -10.594 -12.334 1.00 0.00 C ATOM 330 NH1 ARG A 25 -7.984 -10.163 -11.409 1.00 0.00 N ATOM 331 NH2 ARG A 25 -7.158 -10.055 -13.547 1.00 0.00 N ATOM 0 H ARG A 25 -2.098 -9.359 -8.884 1.00 0.00 H new ATOM 0 HA ARG A 25 -4.084 -11.056 -7.578 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -3.619 -10.892 -10.536 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -3.775 -12.494 -9.840 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.941 -11.545 -8.715 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -5.813 -10.265 -9.905 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.604 -13.125 -10.831 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -7.183 -12.492 -10.412 1.00 0.00 H new ATOM 0 HE ARG A 25 -5.635 -11.869 -12.783 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -7.972 -10.574 -10.476 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -8.647 -9.420 -11.631 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -6.509 -10.383 -14.262 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -7.823 -9.313 -13.764 1.00 0.00 H new ATOM 345 N THR A 26 -2.357 -12.955 -7.499 1.00 0.00 N ATOM 346 CA THR A 26 -1.261 -13.849 -7.148 1.00 0.00 C ATOM 347 C THR A 26 -0.588 -14.410 -8.395 1.00 0.00 C ATOM 348 O THR A 26 -1.227 -14.583 -9.433 1.00 0.00 O ATOM 349 CB THR A 26 -1.747 -15.018 -6.271 1.00 0.00 C ATOM 350 OG1 THR A 26 -2.723 -15.789 -6.981 1.00 0.00 O ATOM 351 CG2 THR A 26 -2.347 -14.506 -4.970 1.00 0.00 C ATOM 0 H THR A 26 -3.282 -13.306 -7.252 1.00 0.00 H new ATOM 0 HA THR A 26 -0.540 -13.257 -6.584 1.00 0.00 H new ATOM 0 HB THR A 26 -0.889 -15.647 -6.034 1.00 0.00 H new ATOM 0 HG1 THR A 26 -3.026 -16.532 -6.418 1.00 0.00 H new ATOM 0 HG21 THR A 26 -2.683 -15.350 -4.367 1.00 0.00 H new ATOM 0 HG22 THR A 26 -1.594 -13.943 -4.418 1.00 0.00 H new ATOM 0 HG23 THR A 26 -3.195 -13.857 -5.191 1.00 0.00 H new ATOM 359 N PHE A 27 0.706 -14.693 -8.287 1.00 0.00 N ATOM 360 CA PHE A 27 1.466 -15.235 -9.407 1.00 0.00 C ATOM 361 C PHE A 27 1.350 -14.331 -10.631 1.00 0.00 C ATOM 362 O PHE A 27 1.399 -14.800 -11.768 1.00 0.00 O ATOM 363 CB PHE A 27 0.976 -16.643 -9.750 1.00 0.00 C ATOM 364 CG PHE A 27 1.356 -17.676 -8.728 1.00 0.00 C ATOM 365 CD1 PHE A 27 1.056 -17.487 -7.389 1.00 0.00 C ATOM 366 CD2 PHE A 27 2.014 -18.835 -9.107 1.00 0.00 C ATOM 367 CE1 PHE A 27 1.404 -18.436 -6.446 1.00 0.00 C ATOM 368 CE2 PHE A 27 2.364 -19.787 -8.168 1.00 0.00 C ATOM 369 CZ PHE A 27 2.060 -19.587 -6.836 1.00 0.00 C ATOM 0 H PHE A 27 1.250 -14.556 -7.435 1.00 0.00 H new ATOM 0 HA PHE A 27 2.514 -15.285 -9.112 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -0.109 -16.627 -9.852 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.383 -16.935 -10.718 1.00 0.00 H new ATOM 0 HD1 PHE A 27 0.544 -16.588 -7.078 1.00 0.00 H new ATOM 0 HD2 PHE A 27 2.256 -18.996 -10.147 1.00 0.00 H new ATOM 0 HE1 PHE A 27 1.163 -18.277 -5.405 1.00 0.00 H new ATOM 0 HE2 PHE A 27 2.875 -20.687 -8.476 1.00 0.00 H new ATOM 0 HZ PHE A 27 2.335 -20.329 -6.101 1.00 0.00 H new ATOM 379 N GLU A 28 1.196 -13.033 -10.389 1.00 0.00 N ATOM 380 CA GLU A 28 1.071 -12.064 -11.471 1.00 0.00 C ATOM 381 C GLU A 28 1.978 -10.861 -11.232 1.00 0.00 C ATOM 382 O GLU A 28 1.793 -10.112 -10.273 1.00 0.00 O ATOM 383 CB GLU A 28 -0.382 -11.602 -11.607 1.00 0.00 C ATOM 384 CG GLU A 28 -1.294 -12.640 -12.240 1.00 0.00 C ATOM 385 CD GLU A 28 -0.871 -13.007 -13.649 1.00 0.00 C ATOM 386 OE1 GLU A 28 -0.777 -12.094 -14.496 1.00 0.00 O ATOM 387 OE2 GLU A 28 -0.633 -14.205 -13.905 1.00 0.00 O ATOM 0 H GLU A 28 1.155 -12.629 -9.454 1.00 0.00 H new ATOM 0 HA GLU A 28 1.378 -12.551 -12.397 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.767 -11.346 -10.620 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -0.410 -10.692 -12.206 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.301 -13.537 -11.621 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.315 -12.258 -12.259 1.00 0.00 H new ATOM 394 N MET A 29 2.959 -10.683 -12.110 1.00 0.00 N ATOM 395 CA MET A 29 3.896 -9.571 -11.995 1.00 0.00 C ATOM 396 C MET A 29 3.168 -8.235 -12.103 1.00 0.00 C ATOM 397 O MET A 29 2.661 -7.878 -13.166 1.00 0.00 O ATOM 398 CB MET A 29 4.972 -9.668 -13.078 1.00 0.00 C ATOM 399 CG MET A 29 6.294 -9.032 -12.680 1.00 0.00 C ATOM 400 SD MET A 29 7.401 -10.191 -11.853 1.00 0.00 S ATOM 401 CE MET A 29 7.990 -9.185 -10.494 1.00 0.00 C ATOM 0 H MET A 29 3.126 -11.294 -12.909 1.00 0.00 H new ATOM 0 HA MET A 29 4.371 -9.628 -11.016 1.00 0.00 H new ATOM 0 HB2 MET A 29 5.141 -10.718 -13.318 1.00 0.00 H new ATOM 0 HB3 MET A 29 4.606 -9.188 -13.986 1.00 0.00 H new ATOM 0 HG2 MET A 29 6.785 -8.638 -13.569 1.00 0.00 H new ATOM 0 HG3 MET A 29 6.102 -8.186 -12.021 1.00 0.00 H new ATOM 0 HE1 MET A 29 8.067 -9.797 -9.595 1.00 0.00 H new ATOM 0 HE2 MET A 29 8.970 -8.777 -10.741 1.00 0.00 H new ATOM 0 HE3 MET A 29 7.291 -8.367 -10.317 1.00 0.00 H new ATOM 411 N SER A 30 3.122 -7.501 -10.996 1.00 0.00 N ATOM 412 CA SER A 30 2.452 -6.205 -10.966 1.00 0.00 C ATOM 413 C SER A 30 3.461 -5.077 -10.771 1.00 0.00 C ATOM 414 O SER A 30 3.927 -4.831 -9.658 1.00 0.00 O ATOM 415 CB SER A 30 1.410 -6.172 -9.846 1.00 0.00 C ATOM 416 OG SER A 30 0.571 -7.312 -9.897 1.00 0.00 O ATOM 0 H SER A 30 3.540 -7.781 -10.109 1.00 0.00 H new ATOM 0 HA SER A 30 1.951 -6.060 -11.923 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.912 -6.129 -8.879 1.00 0.00 H new ATOM 0 HB3 SER A 30 0.807 -5.268 -9.933 1.00 0.00 H new ATOM 0 HG SER A 30 -0.085 -7.268 -9.170 1.00 0.00 H new ATOM 422 N ASP A 31 3.794 -4.395 -11.861 1.00 0.00 N ATOM 423 CA ASP A 31 4.746 -3.292 -11.811 1.00 0.00 C ATOM 424 C ASP A 31 4.050 -1.961 -12.077 1.00 0.00 C ATOM 425 O ASP A 31 3.007 -1.913 -12.729 1.00 0.00 O ATOM 426 CB ASP A 31 5.865 -3.509 -12.832 1.00 0.00 C ATOM 427 CG ASP A 31 5.374 -4.196 -14.091 1.00 0.00 C ATOM 428 OD1 ASP A 31 5.401 -5.444 -14.135 1.00 0.00 O ATOM 429 OD2 ASP A 31 4.963 -3.487 -15.033 1.00 0.00 O ATOM 0 H ASP A 31 3.419 -4.587 -12.790 1.00 0.00 H new ATOM 0 HA ASP A 31 5.178 -3.263 -10.811 1.00 0.00 H new ATOM 0 HB2 ASP A 31 6.305 -2.547 -13.094 1.00 0.00 H new ATOM 0 HB3 ASP A 31 6.655 -4.108 -12.379 1.00 0.00 H new ATOM 434 N PHE A 32 4.634 -0.881 -11.566 1.00 0.00 N ATOM 435 CA PHE A 32 4.069 0.451 -11.746 1.00 0.00 C ATOM 436 C PHE A 32 5.163 1.469 -12.051 1.00 0.00 C ATOM 437 O PHE A 32 6.351 1.184 -11.896 1.00 0.00 O ATOM 438 CB PHE A 32 3.297 0.874 -10.494 1.00 0.00 C ATOM 439 CG PHE A 32 4.101 0.769 -9.230 1.00 0.00 C ATOM 440 CD1 PHE A 32 4.131 -0.413 -8.509 1.00 0.00 C ATOM 441 CD2 PHE A 32 4.826 1.854 -8.763 1.00 0.00 C ATOM 442 CE1 PHE A 32 4.871 -0.513 -7.345 1.00 0.00 C ATOM 443 CE2 PHE A 32 5.568 1.760 -7.600 1.00 0.00 C ATOM 444 CZ PHE A 32 5.589 0.575 -6.890 1.00 0.00 C ATOM 0 H PHE A 32 5.498 -0.903 -11.024 1.00 0.00 H new ATOM 0 HA PHE A 32 3.383 0.416 -12.593 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.959 1.903 -10.616 1.00 0.00 H new ATOM 0 HB3 PHE A 32 2.405 0.255 -10.400 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.570 -1.267 -8.860 1.00 0.00 H new ATOM 0 HD2 PHE A 32 4.811 2.783 -9.313 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.887 -1.441 -6.793 1.00 0.00 H new ATOM 0 HE2 PHE A 32 6.130 2.612 -7.247 1.00 0.00 H new ATOM 0 HZ PHE A 32 6.166 0.500 -5.980 1.00 0.00 H new ATOM 454 N ILE A 33 4.754 2.657 -12.484 1.00 0.00 N ATOM 455 CA ILE A 33 5.699 3.718 -12.810 1.00 0.00 C ATOM 456 C ILE A 33 5.806 4.728 -11.673 1.00 0.00 C ATOM 457 O ILE A 33 4.854 4.932 -10.918 1.00 0.00 O ATOM 458 CB ILE A 33 5.295 4.455 -14.100 1.00 0.00 C ATOM 459 CG1 ILE A 33 5.711 3.644 -15.329 1.00 0.00 C ATOM 460 CG2 ILE A 33 5.921 5.841 -14.137 1.00 0.00 C ATOM 461 CD1 ILE A 33 7.170 3.246 -15.325 1.00 0.00 C ATOM 0 H ILE A 33 3.775 2.909 -12.617 1.00 0.00 H new ATOM 0 HA ILE A 33 6.668 3.242 -12.962 1.00 0.00 H new ATOM 0 HB ILE A 33 4.211 4.567 -14.112 1.00 0.00 H new ATOM 0 HG12 ILE A 33 5.098 2.745 -15.385 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.504 4.227 -16.226 1.00 0.00 H new ATOM 0 HG21 ILE A 33 5.626 6.349 -15.055 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.580 6.418 -13.277 1.00 0.00 H new ATOM 0 HG23 ILE A 33 7.007 5.751 -14.105 1.00 0.00 H new ATOM 0 HD11 ILE A 33 7.394 2.674 -16.226 1.00 0.00 H new ATOM 0 HD12 ILE A 33 7.791 4.141 -15.300 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.378 2.635 -14.446 1.00 0.00 H new ATOM 473 N VAL A 34 6.970 5.359 -11.556 1.00 0.00 N ATOM 474 CA VAL A 34 7.200 6.351 -10.512 1.00 0.00 C ATOM 475 C VAL A 34 7.801 7.627 -11.090 1.00 0.00 C ATOM 476 O VAL A 34 9.010 7.715 -11.305 1.00 0.00 O ATOM 477 CB VAL A 34 8.136 5.806 -9.417 1.00 0.00 C ATOM 478 CG1 VAL A 34 8.660 6.940 -8.550 1.00 0.00 C ATOM 479 CG2 VAL A 34 7.418 4.765 -8.572 1.00 0.00 C ATOM 0 H VAL A 34 7.768 5.201 -12.171 1.00 0.00 H new ATOM 0 HA VAL A 34 6.229 6.577 -10.070 1.00 0.00 H new ATOM 0 HB VAL A 34 8.988 5.325 -9.898 1.00 0.00 H new ATOM 0 HG11 VAL A 34 9.320 6.536 -7.782 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.214 7.646 -9.169 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.823 7.453 -8.076 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.094 4.391 -7.803 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.547 5.218 -8.099 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.098 3.939 -9.207 1.00 0.00 H new ATOM 489 N ASP A 35 6.948 8.615 -11.339 1.00 0.00 N ATOM 490 CA ASP A 35 7.395 9.889 -11.891 1.00 0.00 C ATOM 491 C ASP A 35 7.999 10.771 -10.803 1.00 0.00 C ATOM 492 O ASP A 35 7.329 11.127 -9.833 1.00 0.00 O ATOM 493 CB ASP A 35 6.228 10.615 -12.564 1.00 0.00 C ATOM 494 CG ASP A 35 6.666 11.880 -13.274 1.00 0.00 C ATOM 495 OD1 ASP A 35 7.448 12.653 -12.681 1.00 0.00 O ATOM 496 OD2 ASP A 35 6.225 12.099 -14.422 1.00 0.00 O ATOM 0 H ASP A 35 5.944 8.558 -11.168 1.00 0.00 H new ATOM 0 HA ASP A 35 8.164 9.684 -12.636 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.752 9.946 -13.281 1.00 0.00 H new ATOM 0 HB3 ASP A 35 5.478 10.864 -11.814 1.00 0.00 H new ATOM 501 N THR A 36 9.271 11.119 -10.970 1.00 0.00 N ATOM 502 CA THR A 36 9.967 11.957 -10.001 1.00 0.00 C ATOM 503 C THR A 36 10.735 13.077 -10.694 1.00 0.00 C ATOM 504 O THR A 36 11.756 13.545 -10.191 1.00 0.00 O ATOM 505 CB THR A 36 10.947 11.132 -9.145 1.00 0.00 C ATOM 506 OG1 THR A 36 11.839 10.399 -9.992 1.00 0.00 O ATOM 507 CG2 THR A 36 10.194 10.169 -8.239 1.00 0.00 C ATOM 0 H THR A 36 9.840 10.834 -11.767 1.00 0.00 H new ATOM 0 HA THR A 36 9.205 12.389 -9.353 1.00 0.00 H new ATOM 0 HB THR A 36 11.520 11.819 -8.523 1.00 0.00 H new ATOM 0 HG1 THR A 36 12.460 9.878 -9.441 1.00 0.00 H new ATOM 0 HG21 THR A 36 10.906 9.597 -7.644 1.00 0.00 H new ATOM 0 HG22 THR A 36 9.537 10.732 -7.576 1.00 0.00 H new ATOM 0 HG23 THR A 36 9.599 9.487 -8.847 1.00 0.00 H new ATOM 515 N ARG A 37 10.237 13.502 -11.850 1.00 0.00 N ATOM 516 CA ARG A 37 10.877 14.567 -12.613 1.00 0.00 C ATOM 517 C ARG A 37 10.391 15.936 -12.147 1.00 0.00 C ATOM 518 O ARG A 37 11.190 16.840 -11.902 1.00 0.00 O ATOM 519 CB ARG A 37 10.595 14.395 -14.106 1.00 0.00 C ATOM 520 CG ARG A 37 10.790 12.971 -14.602 1.00 0.00 C ATOM 521 CD ARG A 37 10.346 12.820 -16.049 1.00 0.00 C ATOM 522 NE ARG A 37 8.891 12.784 -16.174 1.00 0.00 N ATOM 523 CZ ARG A 37 8.257 12.455 -17.294 1.00 0.00 C ATOM 524 NH1 ARG A 37 8.947 12.134 -18.380 1.00 0.00 N ATOM 525 NH2 ARG A 37 6.931 12.446 -17.330 1.00 0.00 N ATOM 0 H ARG A 37 9.392 13.125 -12.279 1.00 0.00 H new ATOM 0 HA ARG A 37 11.952 14.505 -12.444 1.00 0.00 H new ATOM 0 HB2 ARG A 37 9.571 14.706 -14.312 1.00 0.00 H new ATOM 0 HB3 ARG A 37 11.249 15.060 -14.670 1.00 0.00 H new ATOM 0 HG2 ARG A 37 11.840 12.694 -14.512 1.00 0.00 H new ATOM 0 HG3 ARG A 37 10.224 12.284 -13.973 1.00 0.00 H new ATOM 0 HD2 ARG A 37 10.740 13.649 -16.637 1.00 0.00 H new ATOM 0 HD3 ARG A 37 10.768 11.905 -16.464 1.00 0.00 H new ATOM 0 HE ARG A 37 8.331 13.025 -15.356 1.00 0.00 H new ATOM 0 HH11 ARG A 37 9.967 12.139 -18.356 1.00 0.00 H new ATOM 0 HH12 ARG A 37 8.458 11.882 -19.239 1.00 0.00 H new ATOM 0 HH21 ARG A 37 6.397 12.692 -16.497 1.00 0.00 H new ATOM 0 HH22 ARG A 37 6.446 12.193 -18.191 1.00 0.00 H new ATOM 539 N ASP A 38 9.076 16.082 -12.029 1.00 0.00 N ATOM 540 CA ASP A 38 8.482 17.341 -11.592 1.00 0.00 C ATOM 541 C ASP A 38 8.750 17.583 -10.110 1.00 0.00 C ATOM 542 O ASP A 38 8.711 18.719 -9.639 1.00 0.00 O ATOM 543 CB ASP A 38 6.976 17.339 -11.858 1.00 0.00 C ATOM 544 CG ASP A 38 6.646 17.553 -13.322 1.00 0.00 C ATOM 545 OD1 ASP A 38 7.486 18.133 -14.041 1.00 0.00 O ATOM 546 OD2 ASP A 38 5.547 17.140 -13.748 1.00 0.00 O ATOM 0 H ASP A 38 8.401 15.344 -12.230 1.00 0.00 H new ATOM 0 HA ASP A 38 8.942 18.148 -12.162 1.00 0.00 H new ATOM 0 HB2 ASP A 38 6.553 16.390 -11.528 1.00 0.00 H new ATOM 0 HB3 ASP A 38 6.504 18.122 -11.264 1.00 0.00 H new ATOM 551 N ALA A 39 9.019 16.506 -9.379 1.00 0.00 N ATOM 552 CA ALA A 39 9.294 16.601 -7.951 1.00 0.00 C ATOM 553 C ALA A 39 10.726 17.057 -7.696 1.00 0.00 C ATOM 554 O ALA A 39 10.959 18.059 -7.020 1.00 0.00 O ATOM 555 CB ALA A 39 9.036 15.264 -7.273 1.00 0.00 C ATOM 0 H ALA A 39 9.052 15.557 -9.753 1.00 0.00 H new ATOM 0 HA ALA A 39 8.622 17.347 -7.527 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.246 15.350 -6.207 1.00 0.00 H new ATOM 0 HB2 ALA A 39 7.994 14.979 -7.416 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.683 14.504 -7.710 1.00 0.00 H new ATOM 561 N GLY A 40 11.685 16.315 -8.242 1.00 0.00 N ATOM 562 CA GLY A 40 13.083 16.659 -8.062 1.00 0.00 C ATOM 563 C GLY A 40 13.957 15.440 -7.842 1.00 0.00 C ATOM 564 O GLY A 40 13.922 14.493 -8.628 1.00 0.00 O ATOM 0 H GLY A 40 11.518 15.482 -8.806 1.00 0.00 H new ATOM 0 HA2 GLY A 40 13.436 17.202 -8.939 1.00 0.00 H new ATOM 0 HA3 GLY A 40 13.182 17.331 -7.210 1.00 0.00 H new ATOM 568 N TYR A 41 14.744 15.463 -6.773 1.00 0.00 N ATOM 569 CA TYR A 41 15.634 14.353 -6.454 1.00 0.00 C ATOM 570 C TYR A 41 15.380 13.840 -5.040 1.00 0.00 C ATOM 571 O TYR A 41 14.656 14.460 -4.263 1.00 0.00 O ATOM 572 CB TYR A 41 17.094 14.785 -6.598 1.00 0.00 C ATOM 573 CG TYR A 41 18.039 13.639 -6.883 1.00 0.00 C ATOM 574 CD1 TYR A 41 18.298 13.233 -8.186 1.00 0.00 C ATOM 575 CD2 TYR A 41 18.672 12.961 -5.848 1.00 0.00 C ATOM 576 CE1 TYR A 41 19.160 12.187 -8.451 1.00 0.00 C ATOM 577 CE2 TYR A 41 19.537 11.915 -6.103 1.00 0.00 C ATOM 578 CZ TYR A 41 19.777 11.531 -7.406 1.00 0.00 C ATOM 579 OH TYR A 41 20.637 10.488 -7.664 1.00 0.00 O ATOM 0 H TYR A 41 14.784 16.239 -6.112 1.00 0.00 H new ATOM 0 HA TYR A 41 15.431 13.544 -7.156 1.00 0.00 H new ATOM 0 HB2 TYR A 41 17.170 15.516 -7.403 1.00 0.00 H new ATOM 0 HB3 TYR A 41 17.408 15.285 -5.682 1.00 0.00 H new ATOM 0 HD1 TYR A 41 17.817 13.744 -9.006 1.00 0.00 H new ATOM 0 HD2 TYR A 41 18.484 13.257 -4.827 1.00 0.00 H new ATOM 0 HE1 TYR A 41 19.350 11.884 -9.470 1.00 0.00 H new ATOM 0 HE2 TYR A 41 20.023 11.401 -5.287 1.00 0.00 H new ATOM 0 HH TYR A 41 20.987 10.136 -6.819 1.00 0.00 H new ATOM 589 N GLY A 42 15.984 12.701 -4.713 1.00 0.00 N ATOM 590 CA GLY A 42 15.813 12.123 -3.393 1.00 0.00 C ATOM 591 C GLY A 42 15.755 10.609 -3.427 1.00 0.00 C ATOM 592 O GLY A 42 15.178 10.023 -4.341 1.00 0.00 O ATOM 0 H GLY A 42 16.588 12.169 -5.339 1.00 0.00 H new ATOM 0 HA2 GLY A 42 16.637 12.438 -2.752 1.00 0.00 H new ATOM 0 HA3 GLY A 42 14.897 12.509 -2.947 1.00 0.00 H new ATOM 596 N GLY A 43 16.358 9.972 -2.426 1.00 0.00 N ATOM 597 CA GLY A 43 16.362 8.523 -2.365 1.00 0.00 C ATOM 598 C GLY A 43 14.969 7.944 -2.212 1.00 0.00 C ATOM 599 O GLY A 43 14.290 8.201 -1.218 1.00 0.00 O ATOM 0 H GLY A 43 16.843 10.435 -1.657 1.00 0.00 H new ATOM 0 HA2 GLY A 43 16.819 8.126 -3.271 1.00 0.00 H new ATOM 0 HA3 GLY A 43 16.980 8.200 -1.528 1.00 0.00 H new ATOM 603 N ILE A 44 14.543 7.164 -3.200 1.00 0.00 N ATOM 604 CA ILE A 44 13.222 6.549 -3.170 1.00 0.00 C ATOM 605 C ILE A 44 13.245 5.233 -2.400 1.00 0.00 C ATOM 606 O ILE A 44 14.124 4.397 -2.607 1.00 0.00 O ATOM 607 CB ILE A 44 12.690 6.290 -4.592 1.00 0.00 C ATOM 608 CG1 ILE A 44 12.641 7.596 -5.388 1.00 0.00 C ATOM 609 CG2 ILE A 44 11.312 5.647 -4.533 1.00 0.00 C ATOM 610 CD1 ILE A 44 12.592 7.389 -6.886 1.00 0.00 C ATOM 0 H ILE A 44 15.093 6.943 -4.030 1.00 0.00 H new ATOM 0 HA ILE A 44 12.559 7.251 -2.664 1.00 0.00 H new ATOM 0 HB ILE A 44 13.369 5.603 -5.098 1.00 0.00 H new ATOM 0 HG12 ILE A 44 11.766 8.168 -5.079 1.00 0.00 H new ATOM 0 HG13 ILE A 44 13.517 8.196 -5.141 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.949 5.470 -5.546 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.376 4.699 -4.000 1.00 0.00 H new ATOM 0 HG23 ILE A 44 10.623 6.311 -4.012 1.00 0.00 H new ATOM 0 HD11 ILE A 44 12.559 8.357 -7.386 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.480 6.845 -7.207 1.00 0.00 H new ATOM 0 HD13 ILE A 44 11.702 6.816 -7.145 1.00 0.00 H new ATOM 622 N SER A 45 12.271 5.056 -1.513 1.00 0.00 N ATOM 623 CA SER A 45 12.180 3.842 -0.710 1.00 0.00 C ATOM 624 C SER A 45 10.913 3.061 -1.047 1.00 0.00 C ATOM 625 O SER A 45 9.799 3.545 -0.842 1.00 0.00 O ATOM 626 CB SER A 45 12.199 4.188 0.780 1.00 0.00 C ATOM 627 OG SER A 45 12.700 3.108 1.548 1.00 0.00 O ATOM 0 H SER A 45 11.534 5.738 -1.332 1.00 0.00 H new ATOM 0 HA SER A 45 13.043 3.217 -0.941 1.00 0.00 H new ATOM 0 HB2 SER A 45 12.816 5.072 0.943 1.00 0.00 H new ATOM 0 HB3 SER A 45 11.191 4.437 1.112 1.00 0.00 H new ATOM 0 HG SER A 45 12.704 3.355 2.496 1.00 0.00 H new ATOM 633 N LEU A 46 11.092 1.851 -1.565 1.00 0.00 N ATOM 634 CA LEU A 46 9.964 1.002 -1.931 1.00 0.00 C ATOM 635 C LEU A 46 10.048 -0.348 -1.226 1.00 0.00 C ATOM 636 O LEU A 46 11.079 -1.018 -1.266 1.00 0.00 O ATOM 637 CB LEU A 46 9.926 0.796 -3.447 1.00 0.00 C ATOM 638 CG LEU A 46 9.763 2.061 -4.291 1.00 0.00 C ATOM 639 CD1 LEU A 46 10.440 1.891 -5.642 1.00 0.00 C ATOM 640 CD2 LEU A 46 8.289 2.397 -4.470 1.00 0.00 C ATOM 0 H LEU A 46 12.007 1.436 -1.741 1.00 0.00 H new ATOM 0 HA LEU A 46 9.048 1.501 -1.615 1.00 0.00 H new ATOM 0 HB2 LEU A 46 10.847 0.297 -3.749 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.105 0.118 -3.681 1.00 0.00 H new ATOM 0 HG LEU A 46 10.243 2.888 -3.768 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.314 2.801 -6.229 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.503 1.698 -5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 46 9.989 1.052 -6.172 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.192 3.300 -5.073 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.786 1.570 -4.971 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.832 2.562 -3.494 1.00 0.00 H new ATOM 652 N ALA A 47 8.954 -0.742 -0.582 1.00 0.00 N ATOM 653 CA ALA A 47 8.902 -2.013 0.129 1.00 0.00 C ATOM 654 C ALA A 47 7.461 -2.460 0.352 1.00 0.00 C ATOM 655 O ALA A 47 6.718 -1.836 1.109 1.00 0.00 O ATOM 656 CB ALA A 47 9.635 -1.906 1.458 1.00 0.00 C ATOM 0 H ALA A 47 8.092 -0.199 -0.538 1.00 0.00 H new ATOM 0 HA ALA A 47 9.397 -2.765 -0.486 1.00 0.00 H new ATOM 0 HB1 ALA A 47 9.588 -2.863 1.978 1.00 0.00 H new ATOM 0 HB2 ALA A 47 10.677 -1.642 1.278 1.00 0.00 H new ATOM 0 HB3 ALA A 47 9.166 -1.137 2.071 1.00 0.00 H new ATOM 662 N VAL A 48 7.072 -3.543 -0.313 1.00 0.00 N ATOM 663 CA VAL A 48 5.720 -4.073 -0.187 1.00 0.00 C ATOM 664 C VAL A 48 5.588 -4.954 1.050 1.00 0.00 C ATOM 665 O VAL A 48 6.335 -5.916 1.221 1.00 0.00 O ATOM 666 CB VAL A 48 5.319 -4.889 -1.431 1.00 0.00 C ATOM 667 CG1 VAL A 48 3.914 -5.449 -1.271 1.00 0.00 C ATOM 668 CG2 VAL A 48 5.422 -4.034 -2.685 1.00 0.00 C ATOM 0 H VAL A 48 7.674 -4.071 -0.945 1.00 0.00 H new ATOM 0 HA VAL A 48 5.052 -3.217 -0.092 1.00 0.00 H new ATOM 0 HB VAL A 48 6.009 -5.727 -1.533 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.648 -6.022 -2.159 1.00 0.00 H new ATOM 0 HG12 VAL A 48 3.878 -6.098 -0.396 1.00 0.00 H new ATOM 0 HG13 VAL A 48 3.208 -4.629 -1.143 1.00 0.00 H new ATOM 0 HG21 VAL A 48 5.135 -4.626 -3.554 1.00 0.00 H new ATOM 0 HG22 VAL A 48 4.757 -3.175 -2.596 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.448 -3.687 -2.805 1.00 0.00 H new ATOM 678 N GLU A 49 4.631 -4.618 1.910 1.00 0.00 N ATOM 679 CA GLU A 49 4.402 -5.379 3.132 1.00 0.00 C ATOM 680 C GLU A 49 3.028 -6.042 3.110 1.00 0.00 C ATOM 681 O GLU A 49 2.013 -5.402 3.383 1.00 0.00 O ATOM 682 CB GLU A 49 4.521 -4.469 4.356 1.00 0.00 C ATOM 683 CG GLU A 49 5.956 -4.148 4.738 1.00 0.00 C ATOM 684 CD GLU A 49 6.576 -5.212 5.623 1.00 0.00 C ATOM 685 OE1 GLU A 49 6.437 -6.409 5.296 1.00 0.00 O ATOM 686 OE2 GLU A 49 7.200 -4.847 6.642 1.00 0.00 O ATOM 0 H GLU A 49 4.003 -3.825 1.783 1.00 0.00 H new ATOM 0 HA GLU A 49 5.162 -6.158 3.192 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.989 -3.538 4.159 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.027 -4.946 5.202 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.554 -4.040 3.833 1.00 0.00 H new ATOM 0 HG3 GLU A 49 5.985 -3.189 5.255 1.00 0.00 H new ATOM 693 N GLY A 50 3.004 -7.331 2.782 1.00 0.00 N ATOM 694 CA GLY A 50 1.750 -8.060 2.729 1.00 0.00 C ATOM 695 C GLY A 50 1.806 -9.365 3.497 1.00 0.00 C ATOM 696 O GLY A 50 2.664 -9.569 4.356 1.00 0.00 O ATOM 0 H GLY A 50 3.830 -7.883 2.552 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.953 -7.437 3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 50 1.496 -8.265 1.689 1.00 0.00 H new ATOM 700 N PRO A 51 0.873 -10.278 3.189 1.00 0.00 N ATOM 701 CA PRO A 51 0.798 -11.586 3.846 1.00 0.00 C ATOM 702 C PRO A 51 1.957 -12.498 3.458 1.00 0.00 C ATOM 703 O PRO A 51 2.034 -13.643 3.901 1.00 0.00 O ATOM 704 CB PRO A 51 -0.528 -12.162 3.340 1.00 0.00 C ATOM 705 CG PRO A 51 -0.761 -11.483 2.035 1.00 0.00 C ATOM 706 CD PRO A 51 -0.181 -10.103 2.175 1.00 0.00 C ATOM 0 HA PRO A 51 0.855 -11.500 4.931 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -0.469 -13.244 3.219 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -1.339 -11.963 4.040 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -0.281 -12.027 1.221 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -1.825 -11.437 1.804 1.00 0.00 H new ATOM 0 HD2 PRO A 51 0.226 -9.740 1.231 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -0.932 -9.382 2.497 1.00 0.00 H new ATOM 714 N SER A 52 2.857 -11.981 2.628 1.00 0.00 N ATOM 715 CA SER A 52 4.011 -12.750 2.177 1.00 0.00 C ATOM 716 C SER A 52 5.145 -11.825 1.745 1.00 0.00 C ATOM 717 O SER A 52 4.981 -10.606 1.690 1.00 0.00 O ATOM 718 CB SER A 52 3.618 -13.668 1.018 1.00 0.00 C ATOM 719 OG SER A 52 4.421 -14.835 0.997 1.00 0.00 O ATOM 0 H SER A 52 2.809 -11.033 2.254 1.00 0.00 H new ATOM 0 HA SER A 52 4.359 -13.359 3.012 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.568 -13.947 1.111 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.724 -13.133 0.074 1.00 0.00 H new ATOM 0 HG SER A 52 4.408 -15.225 0.098 1.00 0.00 H new ATOM 725 N LYS A 53 6.296 -12.414 1.440 1.00 0.00 N ATOM 726 CA LYS A 53 7.459 -11.646 1.012 1.00 0.00 C ATOM 727 C LYS A 53 7.542 -11.587 -0.510 1.00 0.00 C ATOM 728 O LYS A 53 7.464 -12.613 -1.186 1.00 0.00 O ATOM 729 CB LYS A 53 8.740 -12.261 1.579 1.00 0.00 C ATOM 730 CG LYS A 53 9.945 -11.339 1.502 1.00 0.00 C ATOM 731 CD LYS A 53 11.245 -12.123 1.446 1.00 0.00 C ATOM 732 CE LYS A 53 12.454 -11.200 1.470 1.00 0.00 C ATOM 733 NZ LYS A 53 12.532 -10.355 0.246 1.00 0.00 N ATOM 0 H LYS A 53 6.448 -13.422 1.481 1.00 0.00 H new ATOM 0 HA LYS A 53 7.352 -10.630 1.393 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.570 -12.537 2.620 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.962 -13.181 1.037 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.863 -10.705 0.619 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.955 -10.678 2.369 1.00 0.00 H new ATOM 0 HD2 LYS A 53 11.294 -12.810 2.291 1.00 0.00 H new ATOM 0 HD3 LYS A 53 11.267 -12.729 0.541 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.404 -10.560 2.351 1.00 0.00 H new ATOM 0 HE3 LYS A 53 13.363 -11.795 1.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.429 -9.828 0.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.485 -10.961 -0.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 11.737 -9.685 0.235 1.00 0.00 H new ATOM 747 N VAL A 54 7.702 -10.380 -1.044 1.00 0.00 N ATOM 748 CA VAL A 54 7.799 -10.188 -2.486 1.00 0.00 C ATOM 749 C VAL A 54 9.106 -9.501 -2.862 1.00 0.00 C ATOM 750 O VAL A 54 9.485 -8.493 -2.265 1.00 0.00 O ATOM 751 CB VAL A 54 6.620 -9.353 -3.021 1.00 0.00 C ATOM 752 CG1 VAL A 54 5.438 -10.250 -3.353 1.00 0.00 C ATOM 753 CG2 VAL A 54 6.223 -8.285 -2.012 1.00 0.00 C ATOM 0 H VAL A 54 7.767 -9.520 -0.499 1.00 0.00 H new ATOM 0 HA VAL A 54 7.769 -11.178 -2.940 1.00 0.00 H new ATOM 0 HB VAL A 54 6.936 -8.855 -3.938 1.00 0.00 H new ATOM 0 HG11 VAL A 54 4.615 -9.643 -3.729 1.00 0.00 H new ATOM 0 HG12 VAL A 54 5.732 -10.973 -4.113 1.00 0.00 H new ATOM 0 HG13 VAL A 54 5.118 -10.778 -2.455 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.389 -7.704 -2.406 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.925 -8.760 -1.077 1.00 0.00 H new ATOM 0 HG23 VAL A 54 7.070 -7.624 -1.829 1.00 0.00 H new ATOM 763 N ASP A 55 9.792 -10.052 -3.858 1.00 0.00 N ATOM 764 CA ASP A 55 11.058 -9.491 -4.316 1.00 0.00 C ATOM 765 C ASP A 55 10.828 -8.210 -5.112 1.00 0.00 C ATOM 766 O ASP A 55 10.327 -8.247 -6.236 1.00 0.00 O ATOM 767 CB ASP A 55 11.811 -10.510 -5.174 1.00 0.00 C ATOM 768 CG ASP A 55 12.125 -11.785 -4.416 1.00 0.00 C ATOM 769 OD1 ASP A 55 12.508 -11.692 -3.230 1.00 0.00 O ATOM 770 OD2 ASP A 55 11.987 -12.875 -5.007 1.00 0.00 O ATOM 0 H ASP A 55 9.493 -10.886 -4.363 1.00 0.00 H new ATOM 0 HA ASP A 55 11.659 -9.250 -3.439 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.215 -10.751 -6.054 1.00 0.00 H new ATOM 0 HB3 ASP A 55 12.740 -10.065 -5.531 1.00 0.00 H new ATOM 775 N ILE A 56 11.197 -7.078 -4.520 1.00 0.00 N ATOM 776 CA ILE A 56 11.031 -5.786 -5.174 1.00 0.00 C ATOM 777 C ILE A 56 12.167 -5.516 -6.154 1.00 0.00 C ATOM 778 O ILE A 56 13.329 -5.423 -5.761 1.00 0.00 O ATOM 779 CB ILE A 56 10.970 -4.640 -4.147 1.00 0.00 C ATOM 780 CG1 ILE A 56 9.814 -4.861 -3.170 1.00 0.00 C ATOM 781 CG2 ILE A 56 10.823 -3.301 -4.855 1.00 0.00 C ATOM 782 CD1 ILE A 56 8.463 -4.488 -3.738 1.00 0.00 C ATOM 0 H ILE A 56 11.612 -7.030 -3.590 1.00 0.00 H new ATOM 0 HA ILE A 56 10.087 -5.826 -5.718 1.00 0.00 H new ATOM 0 HB ILE A 56 11.902 -4.630 -3.581 1.00 0.00 H new ATOM 0 HG12 ILE A 56 9.797 -5.909 -2.871 1.00 0.00 H new ATOM 0 HG13 ILE A 56 9.994 -4.276 -2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 56 10.781 -2.501 -4.116 1.00 0.00 H new ATOM 0 HG22 ILE A 56 11.677 -3.142 -5.514 1.00 0.00 H new ATOM 0 HG23 ILE A 56 9.905 -3.299 -5.443 1.00 0.00 H new ATOM 0 HD11 ILE A 56 7.691 -4.671 -2.991 1.00 0.00 H new ATOM 0 HD12 ILE A 56 8.462 -3.433 -4.011 1.00 0.00 H new ATOM 0 HD13 ILE A 56 8.261 -5.091 -4.623 1.00 0.00 H new ATOM 794 N GLN A 57 11.821 -5.389 -7.431 1.00 0.00 N ATOM 795 CA GLN A 57 12.812 -5.128 -8.468 1.00 0.00 C ATOM 796 C GLN A 57 12.661 -3.716 -9.023 1.00 0.00 C ATOM 797 O GLN A 57 11.564 -3.295 -9.390 1.00 0.00 O ATOM 798 CB GLN A 57 12.679 -6.150 -9.599 1.00 0.00 C ATOM 799 CG GLN A 57 13.425 -7.448 -9.337 1.00 0.00 C ATOM 800 CD GLN A 57 13.359 -8.406 -10.510 1.00 0.00 C ATOM 801 OE1 GLN A 57 14.384 -8.774 -11.085 1.00 0.00 O ATOM 802 NE2 GLN A 57 12.149 -8.817 -10.873 1.00 0.00 N ATOM 0 H GLN A 57 10.863 -5.463 -7.772 1.00 0.00 H new ATOM 0 HA GLN A 57 13.802 -5.219 -8.020 1.00 0.00 H new ATOM 0 HB2 GLN A 57 11.623 -6.372 -9.754 1.00 0.00 H new ATOM 0 HB3 GLN A 57 13.051 -5.707 -10.523 1.00 0.00 H new ATOM 0 HG2 GLN A 57 14.468 -7.224 -9.114 1.00 0.00 H new ATOM 0 HG3 GLN A 57 13.007 -7.931 -8.454 1.00 0.00 H new ATOM 0 HE21 GLN A 57 11.326 -8.487 -10.369 1.00 0.00 H new ATOM 0 HE22 GLN A 57 12.043 -9.462 -11.656 1.00 0.00 H new ATOM 811 N THR A 58 13.771 -2.986 -9.081 1.00 0.00 N ATOM 812 CA THR A 58 13.762 -1.620 -9.589 1.00 0.00 C ATOM 813 C THR A 58 14.694 -1.473 -10.787 1.00 0.00 C ATOM 814 O THR A 58 15.619 -2.264 -10.966 1.00 0.00 O ATOM 815 CB THR A 58 14.180 -0.613 -8.501 1.00 0.00 C ATOM 816 OG1 THR A 58 15.475 -0.952 -7.992 1.00 0.00 O ATOM 817 CG2 THR A 58 13.171 -0.596 -7.363 1.00 0.00 C ATOM 0 H THR A 58 14.688 -3.319 -8.782 1.00 0.00 H new ATOM 0 HA THR A 58 12.739 -1.405 -9.899 1.00 0.00 H new ATOM 0 HB THR A 58 14.214 0.380 -8.950 1.00 0.00 H new ATOM 0 HG1 THR A 58 15.735 -0.306 -7.302 1.00 0.00 H new ATOM 0 HG21 THR A 58 13.487 0.122 -6.607 1.00 0.00 H new ATOM 0 HG22 THR A 58 12.192 -0.310 -7.749 1.00 0.00 H new ATOM 0 HG23 THR A 58 13.109 -1.589 -6.917 1.00 0.00 H new ATOM 825 N GLU A 59 14.443 -0.455 -11.604 1.00 0.00 N ATOM 826 CA GLU A 59 15.261 -0.205 -12.785 1.00 0.00 C ATOM 827 C GLU A 59 15.098 1.235 -13.265 1.00 0.00 C ATOM 828 O GLU A 59 13.988 1.765 -13.305 1.00 0.00 O ATOM 829 CB GLU A 59 14.884 -1.174 -13.908 1.00 0.00 C ATOM 830 CG GLU A 59 15.661 -0.947 -15.194 1.00 0.00 C ATOM 831 CD GLU A 59 17.036 -1.584 -15.165 1.00 0.00 C ATOM 832 OE1 GLU A 59 17.884 -1.132 -14.367 1.00 0.00 O ATOM 833 OE2 GLU A 59 17.265 -2.536 -15.941 1.00 0.00 O ATOM 0 H GLU A 59 13.681 0.209 -11.470 1.00 0.00 H new ATOM 0 HA GLU A 59 16.305 -0.363 -12.513 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.053 -2.195 -13.567 1.00 0.00 H new ATOM 0 HB3 GLU A 59 13.818 -1.079 -14.116 1.00 0.00 H new ATOM 0 HG2 GLU A 59 15.095 -1.352 -16.033 1.00 0.00 H new ATOM 0 HG3 GLU A 59 15.765 0.124 -15.367 1.00 0.00 H new ATOM 840 N ASP A 60 16.212 1.861 -13.628 1.00 0.00 N ATOM 841 CA ASP A 60 16.194 3.238 -14.106 1.00 0.00 C ATOM 842 C ASP A 60 15.851 3.294 -15.591 1.00 0.00 C ATOM 843 O ASP A 60 16.553 2.719 -16.423 1.00 0.00 O ATOM 844 CB ASP A 60 17.548 3.904 -13.858 1.00 0.00 C ATOM 845 CG ASP A 60 17.840 5.011 -14.852 1.00 0.00 C ATOM 846 OD1 ASP A 60 17.282 6.117 -14.690 1.00 0.00 O ATOM 847 OD2 ASP A 60 18.627 4.772 -15.791 1.00 0.00 O ATOM 0 H ASP A 60 17.139 1.436 -13.600 1.00 0.00 H new ATOM 0 HA ASP A 60 15.425 3.778 -13.553 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.569 4.312 -12.848 1.00 0.00 H new ATOM 0 HB3 ASP A 60 18.335 3.152 -13.914 1.00 0.00 H new ATOM 852 N LEU A 61 14.766 3.988 -15.916 1.00 0.00 N ATOM 853 CA LEU A 61 14.328 4.118 -17.302 1.00 0.00 C ATOM 854 C LEU A 61 15.021 5.293 -17.984 1.00 0.00 C ATOM 855 O LEU A 61 15.852 5.971 -17.380 1.00 0.00 O ATOM 856 CB LEU A 61 12.810 4.301 -17.362 1.00 0.00 C ATOM 857 CG LEU A 61 11.971 3.083 -16.977 1.00 0.00 C ATOM 858 CD1 LEU A 61 10.498 3.453 -16.896 1.00 0.00 C ATOM 859 CD2 LEU A 61 12.184 1.952 -17.973 1.00 0.00 C ATOM 0 H LEU A 61 14.173 4.469 -15.239 1.00 0.00 H new ATOM 0 HA LEU A 61 14.599 3.204 -17.831 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.538 5.127 -16.705 1.00 0.00 H new ATOM 0 HB3 LEU A 61 12.540 4.597 -18.376 1.00 0.00 H new ATOM 0 HG LEU A 61 12.293 2.740 -15.994 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.916 2.573 -16.621 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.359 4.230 -16.144 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.162 3.822 -17.865 1.00 0.00 H new ATOM 0 HD21 LEU A 61 11.579 1.093 -17.683 1.00 0.00 H new ATOM 0 HD22 LEU A 61 11.890 2.284 -18.969 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.236 1.668 -17.982 1.00 0.00 H new ATOM 871 N GLU A 62 14.671 5.529 -19.245 1.00 0.00 N ATOM 872 CA GLU A 62 15.259 6.623 -20.008 1.00 0.00 C ATOM 873 C GLU A 62 14.535 7.936 -19.724 1.00 0.00 C ATOM 874 O GLU A 62 15.148 9.003 -19.697 1.00 0.00 O ATOM 875 CB GLU A 62 15.210 6.314 -21.506 1.00 0.00 C ATOM 876 CG GLU A 62 16.312 5.378 -21.971 1.00 0.00 C ATOM 877 CD GLU A 62 16.510 5.411 -23.474 1.00 0.00 C ATOM 878 OE1 GLU A 62 15.538 5.128 -24.206 1.00 0.00 O ATOM 879 OE2 GLU A 62 17.636 5.718 -23.918 1.00 0.00 O ATOM 0 H GLU A 62 13.984 4.977 -19.759 1.00 0.00 H new ATOM 0 HA GLU A 62 16.299 6.728 -19.700 1.00 0.00 H new ATOM 0 HB2 GLU A 62 14.243 5.871 -21.745 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.279 7.248 -22.063 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.246 5.650 -21.479 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.074 4.360 -21.662 1.00 0.00 H new ATOM 886 N ASP A 63 13.226 7.848 -19.514 1.00 0.00 N ATOM 887 CA ASP A 63 12.416 9.028 -19.231 1.00 0.00 C ATOM 888 C ASP A 63 12.819 9.658 -17.902 1.00 0.00 C ATOM 889 O ASP A 63 12.554 10.834 -17.654 1.00 0.00 O ATOM 890 CB ASP A 63 10.932 8.660 -19.206 1.00 0.00 C ATOM 891 CG ASP A 63 10.631 7.531 -18.241 1.00 0.00 C ATOM 892 OD1 ASP A 63 11.545 6.724 -17.968 1.00 0.00 O ATOM 893 OD2 ASP A 63 9.483 7.454 -17.757 1.00 0.00 O ATOM 0 H ASP A 63 12.703 6.972 -19.534 1.00 0.00 H new ATOM 0 HA ASP A 63 12.589 9.755 -20.024 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.348 9.537 -18.928 1.00 0.00 H new ATOM 0 HB3 ASP A 63 10.615 8.371 -20.208 1.00 0.00 H new ATOM 898 N GLY A 64 13.462 8.867 -17.048 1.00 0.00 N ATOM 899 CA GLY A 64 13.890 9.364 -15.753 1.00 0.00 C ATOM 900 C GLY A 64 12.964 8.935 -14.633 1.00 0.00 C ATOM 901 O GLY A 64 12.834 9.629 -13.623 1.00 0.00 O ATOM 0 H GLY A 64 13.694 7.891 -17.230 1.00 0.00 H new ATOM 0 HA2 GLY A 64 14.898 9.005 -15.545 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.939 10.452 -15.783 1.00 0.00 H new ATOM 905 N THR A 65 12.315 7.788 -14.809 1.00 0.00 N ATOM 906 CA THR A 65 11.394 7.269 -13.806 1.00 0.00 C ATOM 907 C THR A 65 11.830 5.892 -13.319 1.00 0.00 C ATOM 908 O THR A 65 12.748 5.288 -13.876 1.00 0.00 O ATOM 909 CB THR A 65 9.959 7.175 -14.356 1.00 0.00 C ATOM 910 OG1 THR A 65 9.871 6.118 -15.318 1.00 0.00 O ATOM 911 CG2 THR A 65 9.539 8.489 -14.999 1.00 0.00 C ATOM 0 H THR A 65 12.411 7.201 -15.638 1.00 0.00 H new ATOM 0 HA THR A 65 11.410 7.969 -12.971 1.00 0.00 H new ATOM 0 HB THR A 65 9.287 6.965 -13.524 1.00 0.00 H new ATOM 0 HG1 THR A 65 9.622 6.489 -16.190 1.00 0.00 H new ATOM 0 HG21 THR A 65 8.522 8.399 -15.380 1.00 0.00 H new ATOM 0 HG22 THR A 65 9.579 9.286 -14.257 1.00 0.00 H new ATOM 0 HG23 THR A 65 10.215 8.724 -15.821 1.00 0.00 H new ATOM 919 N CYS A 66 11.167 5.400 -12.278 1.00 0.00 N ATOM 920 CA CYS A 66 11.488 4.093 -11.716 1.00 0.00 C ATOM 921 C CYS A 66 10.293 3.150 -11.818 1.00 0.00 C ATOM 922 O CYS A 66 9.193 3.473 -11.369 1.00 0.00 O ATOM 923 CB CYS A 66 11.918 4.234 -10.255 1.00 0.00 C ATOM 924 SG CYS A 66 13.692 4.500 -10.030 1.00 0.00 S ATOM 0 H CYS A 66 10.404 5.886 -11.806 1.00 0.00 H new ATOM 0 HA CYS A 66 12.312 3.670 -12.290 1.00 0.00 H new ATOM 0 HB2 CYS A 66 11.377 5.067 -9.807 1.00 0.00 H new ATOM 0 HB3 CYS A 66 11.625 3.335 -9.713 1.00 0.00 H new ATOM 0 HG CYS A 66 13.957 4.609 -8.762 1.00 0.00 H new ATOM 930 N LYS A 67 10.516 1.983 -12.412 1.00 0.00 N ATOM 931 CA LYS A 67 9.459 0.992 -12.575 1.00 0.00 C ATOM 932 C LYS A 67 9.663 -0.182 -11.622 1.00 0.00 C ATOM 933 O LYS A 67 10.522 -1.035 -11.847 1.00 0.00 O ATOM 934 CB LYS A 67 9.421 0.489 -14.020 1.00 0.00 C ATOM 935 CG LYS A 67 8.201 -0.358 -14.337 1.00 0.00 C ATOM 936 CD LYS A 67 8.103 -0.660 -15.823 1.00 0.00 C ATOM 937 CE LYS A 67 9.023 -1.805 -16.220 1.00 0.00 C ATOM 938 NZ LYS A 67 8.346 -3.126 -16.105 1.00 0.00 N ATOM 0 H LYS A 67 11.420 1.700 -12.789 1.00 0.00 H new ATOM 0 HA LYS A 67 8.508 1.469 -12.338 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.444 1.345 -14.695 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.320 -0.096 -14.216 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.250 -1.292 -13.777 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.301 0.162 -14.010 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.074 -0.914 -16.077 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.362 0.231 -16.395 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.363 -1.659 -17.245 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.910 -1.795 -15.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.006 -3.880 -16.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.044 -3.277 -15.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.514 -3.145 -16.729 1.00 0.00 H new ATOM 952 N VAL A 68 8.868 -0.219 -10.558 1.00 0.00 N ATOM 953 CA VAL A 68 8.959 -1.290 -9.572 1.00 0.00 C ATOM 954 C VAL A 68 8.289 -2.562 -10.079 1.00 0.00 C ATOM 955 O VAL A 68 7.297 -2.507 -10.806 1.00 0.00 O ATOM 956 CB VAL A 68 8.312 -0.880 -8.236 1.00 0.00 C ATOM 957 CG1 VAL A 68 8.554 -1.944 -7.177 1.00 0.00 C ATOM 958 CG2 VAL A 68 8.845 0.470 -7.779 1.00 0.00 C ATOM 0 H VAL A 68 8.153 0.480 -10.356 1.00 0.00 H new ATOM 0 HA VAL A 68 10.020 -1.481 -9.410 1.00 0.00 H new ATOM 0 HB VAL A 68 7.236 -0.789 -8.386 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.090 -1.637 -6.240 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.120 -2.889 -7.505 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.626 -2.070 -7.026 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.377 0.745 -6.833 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.925 0.408 -7.645 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.615 1.225 -8.530 1.00 0.00 H new ATOM 968 N SER A 69 8.837 -3.709 -9.690 1.00 0.00 N ATOM 969 CA SER A 69 8.295 -4.996 -10.107 1.00 0.00 C ATOM 970 C SER A 69 8.315 -5.994 -8.954 1.00 0.00 C ATOM 971 O SER A 69 9.359 -6.240 -8.348 1.00 0.00 O ATOM 972 CB SER A 69 9.092 -5.550 -11.290 1.00 0.00 C ATOM 973 OG SER A 69 9.430 -4.521 -12.203 1.00 0.00 O ATOM 0 H SER A 69 9.657 -3.773 -9.086 1.00 0.00 H new ATOM 0 HA SER A 69 7.260 -4.844 -10.414 1.00 0.00 H new ATOM 0 HB2 SER A 69 10.000 -6.031 -10.927 1.00 0.00 H new ATOM 0 HB3 SER A 69 8.507 -6.316 -11.800 1.00 0.00 H new ATOM 0 HG SER A 69 9.940 -4.900 -12.949 1.00 0.00 H new ATOM 979 N TYR A 70 7.154 -6.567 -8.655 1.00 0.00 N ATOM 980 CA TYR A 70 7.037 -7.537 -7.572 1.00 0.00 C ATOM 981 C TYR A 70 6.137 -8.700 -7.978 1.00 0.00 C ATOM 982 O TYR A 70 5.188 -8.528 -8.743 1.00 0.00 O ATOM 983 CB TYR A 70 6.484 -6.864 -6.315 1.00 0.00 C ATOM 984 CG TYR A 70 5.002 -6.572 -6.386 1.00 0.00 C ATOM 985 CD1 TYR A 70 4.536 -5.372 -6.910 1.00 0.00 C ATOM 986 CD2 TYR A 70 4.069 -7.494 -5.928 1.00 0.00 C ATOM 987 CE1 TYR A 70 3.183 -5.100 -6.977 1.00 0.00 C ATOM 988 CE2 TYR A 70 2.715 -7.231 -5.993 1.00 0.00 C ATOM 989 CZ TYR A 70 2.276 -6.033 -6.517 1.00 0.00 C ATOM 990 OH TYR A 70 0.928 -5.767 -6.582 1.00 0.00 O ATOM 0 H TYR A 70 6.281 -6.377 -9.147 1.00 0.00 H new ATOM 0 HA TYR A 70 8.032 -7.928 -7.359 1.00 0.00 H new ATOM 0 HB2 TYR A 70 6.679 -7.504 -5.455 1.00 0.00 H new ATOM 0 HB3 TYR A 70 7.022 -5.931 -6.146 1.00 0.00 H new ATOM 0 HD1 TYR A 70 5.243 -4.640 -7.271 1.00 0.00 H new ATOM 0 HD2 TYR A 70 4.408 -8.432 -5.514 1.00 0.00 H new ATOM 0 HE1 TYR A 70 2.837 -4.163 -7.387 1.00 0.00 H new ATOM 0 HE2 TYR A 70 2.003 -7.960 -5.635 1.00 0.00 H new ATOM 0 HH TYR A 70 0.465 -6.524 -6.998 1.00 0.00 H new ATOM 1000 N PHE A 71 6.442 -9.885 -7.459 1.00 0.00 N ATOM 1001 CA PHE A 71 5.662 -11.078 -7.767 1.00 0.00 C ATOM 1002 C PHE A 71 5.069 -11.682 -6.497 1.00 0.00 C ATOM 1003 O PHE A 71 5.736 -12.401 -5.752 1.00 0.00 O ATOM 1004 CB PHE A 71 6.534 -12.114 -8.479 1.00 0.00 C ATOM 1005 CG PHE A 71 5.745 -13.144 -9.234 1.00 0.00 C ATOM 1006 CD1 PHE A 71 5.103 -12.815 -10.417 1.00 0.00 C ATOM 1007 CD2 PHE A 71 5.646 -14.443 -8.762 1.00 0.00 C ATOM 1008 CE1 PHE A 71 4.375 -13.761 -11.113 1.00 0.00 C ATOM 1009 CE2 PHE A 71 4.920 -15.394 -9.454 1.00 0.00 C ATOM 1010 CZ PHE A 71 4.285 -15.053 -10.632 1.00 0.00 C ATOM 0 H PHE A 71 7.224 -10.045 -6.823 1.00 0.00 H new ATOM 0 HA PHE A 71 4.844 -10.787 -8.427 1.00 0.00 H new ATOM 0 HB2 PHE A 71 7.202 -11.601 -9.171 1.00 0.00 H new ATOM 0 HB3 PHE A 71 7.162 -12.616 -7.743 1.00 0.00 H new ATOM 0 HD1 PHE A 71 5.172 -11.807 -10.800 1.00 0.00 H new ATOM 0 HD2 PHE A 71 6.142 -14.716 -7.842 1.00 0.00 H new ATOM 0 HE1 PHE A 71 3.877 -13.491 -12.032 1.00 0.00 H new ATOM 0 HE2 PHE A 71 4.849 -16.402 -9.074 1.00 0.00 H new ATOM 0 HZ PHE A 71 3.719 -15.795 -11.176 1.00 0.00 H new ATOM 1020 N PRO A 72 3.786 -11.384 -6.244 1.00 0.00 N ATOM 1021 CA PRO A 72 3.075 -11.887 -5.065 1.00 0.00 C ATOM 1022 C PRO A 72 2.813 -13.387 -5.143 1.00 0.00 C ATOM 1023 O PRO A 72 2.767 -13.965 -6.229 1.00 0.00 O ATOM 1024 CB PRO A 72 1.755 -11.112 -5.090 1.00 0.00 C ATOM 1025 CG PRO A 72 1.556 -10.749 -6.521 1.00 0.00 C ATOM 1026 CD PRO A 72 2.932 -10.533 -7.089 1.00 0.00 C ATOM 0 HA PRO A 72 3.651 -11.746 -4.150 1.00 0.00 H new ATOM 0 HB2 PRO A 72 0.931 -11.721 -4.718 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.805 -10.224 -4.460 1.00 0.00 H new ATOM 0 HG2 PRO A 72 1.033 -11.542 -7.056 1.00 0.00 H new ATOM 0 HG3 PRO A 72 0.949 -9.848 -6.614 1.00 0.00 H new ATOM 0 HD2 PRO A 72 2.985 -10.826 -8.138 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.229 -9.486 -7.035 1.00 0.00 H new ATOM 1034 N THR A 73 2.641 -14.014 -3.983 1.00 0.00 N ATOM 1035 CA THR A 73 2.385 -15.447 -3.919 1.00 0.00 C ATOM 1036 C THR A 73 1.151 -15.748 -3.075 1.00 0.00 C ATOM 1037 O THR A 73 0.424 -16.705 -3.340 1.00 0.00 O ATOM 1038 CB THR A 73 3.590 -16.209 -3.336 1.00 0.00 C ATOM 1039 OG1 THR A 73 3.956 -15.650 -2.070 1.00 0.00 O ATOM 1040 CG2 THR A 73 4.778 -16.149 -4.285 1.00 0.00 C ATOM 0 H THR A 73 2.675 -13.551 -3.075 1.00 0.00 H new ATOM 0 HA THR A 73 2.214 -15.783 -4.942 1.00 0.00 H new ATOM 0 HB THR A 73 3.303 -17.252 -3.203 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.722 -16.141 -1.705 1.00 0.00 H new ATOM 0 HG21 THR A 73 5.617 -16.694 -3.852 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.505 -16.601 -5.239 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.064 -15.109 -4.445 1.00 0.00 H new ATOM 1048 N VAL A 74 0.921 -14.925 -2.057 1.00 0.00 N ATOM 1049 CA VAL A 74 -0.226 -15.102 -1.175 1.00 0.00 C ATOM 1050 C VAL A 74 -1.207 -13.943 -1.310 1.00 0.00 C ATOM 1051 O VAL A 74 -0.846 -12.773 -1.185 1.00 0.00 O ATOM 1052 CB VAL A 74 0.212 -15.221 0.297 1.00 0.00 C ATOM 1053 CG1 VAL A 74 -0.994 -15.445 1.196 1.00 0.00 C ATOM 1054 CG2 VAL A 74 1.226 -16.342 0.462 1.00 0.00 C ATOM 0 H VAL A 74 1.514 -14.129 -1.823 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.718 -16.027 -1.476 1.00 0.00 H new ATOM 0 HB VAL A 74 0.687 -14.286 0.593 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.665 -15.527 2.232 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.682 -14.605 1.099 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.501 -16.364 0.903 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.524 -16.412 1.508 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.779 -17.286 0.148 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.102 -16.133 -0.152 1.00 0.00 H new ATOM 1064 N PRO A 75 -2.481 -14.274 -1.571 1.00 0.00 N ATOM 1065 CA PRO A 75 -3.542 -13.275 -1.728 1.00 0.00 C ATOM 1066 C PRO A 75 -3.887 -12.585 -0.412 1.00 0.00 C ATOM 1067 O PRO A 75 -3.948 -13.224 0.637 1.00 0.00 O ATOM 1068 CB PRO A 75 -4.732 -14.097 -2.229 1.00 0.00 C ATOM 1069 CG PRO A 75 -4.477 -15.476 -1.729 1.00 0.00 C ATOM 1070 CD PRO A 75 -2.983 -15.649 -1.732 1.00 0.00 C ATOM 0 HA PRO A 75 -3.248 -12.471 -2.402 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -5.674 -13.705 -1.845 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -4.798 -14.076 -3.317 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.883 -15.609 -0.726 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.957 -16.217 -2.368 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -2.652 -16.296 -0.920 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -2.632 -16.099 -2.661 1.00 0.00 H new ATOM 1078 N GLY A 76 -4.114 -11.276 -0.477 1.00 0.00 N ATOM 1079 CA GLY A 76 -4.452 -10.522 0.716 1.00 0.00 C ATOM 1080 C GLY A 76 -4.271 -9.029 0.528 1.00 0.00 C ATOM 1081 O GLY A 76 -4.623 -8.480 -0.516 1.00 0.00 O ATOM 0 H GLY A 76 -4.070 -10.725 -1.334 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.486 -10.728 0.991 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -3.829 -10.859 1.544 1.00 0.00 H new ATOM 1085 N VAL A 77 -3.723 -8.368 1.543 1.00 0.00 N ATOM 1086 CA VAL A 77 -3.497 -6.929 1.485 1.00 0.00 C ATOM 1087 C VAL A 77 -2.008 -6.604 1.522 1.00 0.00 C ATOM 1088 O VAL A 77 -1.320 -6.907 2.497 1.00 0.00 O ATOM 1089 CB VAL A 77 -4.198 -6.204 2.649 1.00 0.00 C ATOM 1090 CG1 VAL A 77 -3.764 -4.747 2.710 1.00 0.00 C ATOM 1091 CG2 VAL A 77 -5.709 -6.312 2.511 1.00 0.00 C ATOM 0 H VAL A 77 -3.427 -8.806 2.415 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.918 -6.580 0.542 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.905 -6.685 3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.270 -4.251 3.539 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.686 -4.695 2.859 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.025 -4.250 1.776 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.188 -5.794 3.342 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.022 -5.857 1.571 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.001 -7.362 2.521 1.00 0.00 H new ATOM 1101 N TYR A 78 -1.516 -5.986 0.454 1.00 0.00 N ATOM 1102 CA TYR A 78 -0.107 -5.622 0.363 1.00 0.00 C ATOM 1103 C TYR A 78 0.074 -4.112 0.486 1.00 0.00 C ATOM 1104 O TYR A 78 -0.435 -3.346 -0.334 1.00 0.00 O ATOM 1105 CB TYR A 78 0.483 -6.112 -0.960 1.00 0.00 C ATOM 1106 CG TYR A 78 0.763 -7.598 -0.985 1.00 0.00 C ATOM 1107 CD1 TYR A 78 -0.217 -8.503 -1.374 1.00 0.00 C ATOM 1108 CD2 TYR A 78 2.007 -8.097 -0.619 1.00 0.00 C ATOM 1109 CE1 TYR A 78 0.034 -9.861 -1.398 1.00 0.00 C ATOM 1110 CE2 TYR A 78 2.267 -9.453 -0.641 1.00 0.00 C ATOM 1111 CZ TYR A 78 1.277 -10.331 -1.031 1.00 0.00 C ATOM 1112 OH TYR A 78 1.532 -11.683 -1.053 1.00 0.00 O ATOM 0 H TYR A 78 -2.072 -5.727 -0.361 1.00 0.00 H new ATOM 0 HA TYR A 78 0.421 -6.101 1.188 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.206 -5.867 -1.768 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.410 -5.573 -1.157 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -1.192 -8.138 -1.663 1.00 0.00 H new ATOM 0 HD2 TYR A 78 2.784 -7.413 -0.312 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.739 -10.551 -1.703 1.00 0.00 H new ATOM 0 HE2 TYR A 78 3.240 -9.824 -0.354 1.00 0.00 H new ATOM 0 HH TYR A 78 0.711 -12.174 -0.841 1.00 0.00 H new ATOM 1122 N ILE A 79 0.802 -3.692 1.514 1.00 0.00 N ATOM 1123 CA ILE A 79 1.053 -2.275 1.744 1.00 0.00 C ATOM 1124 C ILE A 79 2.314 -1.815 1.021 1.00 0.00 C ATOM 1125 O ILE A 79 3.428 -2.171 1.405 1.00 0.00 O ATOM 1126 CB ILE A 79 1.194 -1.964 3.246 1.00 0.00 C ATOM 1127 CG1 ILE A 79 -0.110 -2.283 3.980 1.00 0.00 C ATOM 1128 CG2 ILE A 79 1.580 -0.507 3.451 1.00 0.00 C ATOM 1129 CD1 ILE A 79 -1.347 -1.811 3.247 1.00 0.00 C ATOM 0 H ILE A 79 1.229 -4.313 2.201 1.00 0.00 H new ATOM 0 HA ILE A 79 0.193 -1.735 1.349 1.00 0.00 H new ATOM 0 HB ILE A 79 1.984 -2.591 3.659 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.177 -3.360 4.133 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -0.084 -1.822 4.967 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.676 -0.303 4.517 1.00 0.00 H new ATOM 0 HG22 ILE A 79 2.531 -0.310 2.957 1.00 0.00 H new ATOM 0 HG23 ILE A 79 0.810 0.137 3.026 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.234 -2.071 3.825 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.302 -0.730 3.117 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.397 -2.292 2.270 1.00 0.00 H new ATOM 1141 N VAL A 80 2.131 -1.020 -0.029 1.00 0.00 N ATOM 1142 CA VAL A 80 3.255 -0.509 -0.805 1.00 0.00 C ATOM 1143 C VAL A 80 3.762 0.811 -0.234 1.00 0.00 C ATOM 1144 O VAL A 80 3.190 1.870 -0.489 1.00 0.00 O ATOM 1145 CB VAL A 80 2.868 -0.301 -2.282 1.00 0.00 C ATOM 1146 CG1 VAL A 80 3.982 0.416 -3.030 1.00 0.00 C ATOM 1147 CG2 VAL A 80 2.545 -1.634 -2.940 1.00 0.00 C ATOM 0 H VAL A 80 1.216 -0.716 -0.361 1.00 0.00 H new ATOM 0 HA VAL A 80 4.047 -1.256 -0.745 1.00 0.00 H new ATOM 0 HB VAL A 80 1.976 0.324 -2.322 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.691 0.554 -4.071 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.161 1.388 -2.571 1.00 0.00 H new ATOM 0 HG13 VAL A 80 4.893 -0.180 -2.984 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.274 -1.469 -3.983 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.418 -2.285 -2.891 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.712 -2.105 -2.418 1.00 0.00 H new ATOM 1157 N SER A 81 4.840 0.738 0.541 1.00 0.00 N ATOM 1158 CA SER A 81 5.423 1.927 1.152 1.00 0.00 C ATOM 1159 C SER A 81 6.239 2.717 0.133 1.00 0.00 C ATOM 1160 O SER A 81 7.404 2.409 -0.121 1.00 0.00 O ATOM 1161 CB SER A 81 6.308 1.535 2.337 1.00 0.00 C ATOM 1162 OG SER A 81 5.539 1.380 3.517 1.00 0.00 O ATOM 0 H SER A 81 5.327 -0.131 0.760 1.00 0.00 H new ATOM 0 HA SER A 81 4.609 2.559 1.508 1.00 0.00 H new ATOM 0 HB2 SER A 81 6.829 0.604 2.114 1.00 0.00 H new ATOM 0 HB3 SER A 81 7.071 2.298 2.494 1.00 0.00 H new ATOM 0 HG SER A 81 6.127 1.128 4.260 1.00 0.00 H new ATOM 1168 N THR A 82 5.618 3.738 -0.449 1.00 0.00 N ATOM 1169 CA THR A 82 6.284 4.573 -1.441 1.00 0.00 C ATOM 1170 C THR A 82 6.766 5.881 -0.825 1.00 0.00 C ATOM 1171 O THR A 82 5.965 6.754 -0.490 1.00 0.00 O ATOM 1172 CB THR A 82 5.352 4.889 -2.626 1.00 0.00 C ATOM 1173 OG1 THR A 82 4.599 3.724 -2.982 1.00 0.00 O ATOM 1174 CG2 THR A 82 6.150 5.370 -3.829 1.00 0.00 C ATOM 0 H THR A 82 4.654 4.007 -0.250 1.00 0.00 H new ATOM 0 HA THR A 82 7.143 4.008 -1.804 1.00 0.00 H new ATOM 0 HB THR A 82 4.670 5.683 -2.321 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.008 3.934 -3.735 1.00 0.00 H new ATOM 0 HG21 THR A 82 5.471 5.587 -4.653 1.00 0.00 H new ATOM 0 HG22 THR A 82 6.699 6.274 -3.564 1.00 0.00 H new ATOM 0 HG23 THR A 82 6.853 4.594 -4.133 1.00 0.00 H new ATOM 1182 N LYS A 83 8.080 6.012 -0.678 1.00 0.00 N ATOM 1183 CA LYS A 83 8.670 7.215 -0.104 1.00 0.00 C ATOM 1184 C LYS A 83 9.660 7.852 -1.074 1.00 0.00 C ATOM 1185 O LYS A 83 10.271 7.165 -1.893 1.00 0.00 O ATOM 1186 CB LYS A 83 9.373 6.884 1.215 1.00 0.00 C ATOM 1187 CG LYS A 83 8.438 6.854 2.412 1.00 0.00 C ATOM 1188 CD LYS A 83 9.205 6.931 3.721 1.00 0.00 C ATOM 1189 CE LYS A 83 9.624 5.551 4.204 1.00 0.00 C ATOM 1190 NZ LYS A 83 10.819 5.613 5.090 1.00 0.00 N ATOM 0 H LYS A 83 8.757 5.299 -0.949 1.00 0.00 H new ATOM 0 HA LYS A 83 7.867 7.927 0.088 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.863 5.915 1.123 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.156 7.621 1.395 1.00 0.00 H new ATOM 0 HG2 LYS A 83 7.739 7.688 2.349 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.846 5.939 2.389 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.089 7.555 3.590 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.586 7.410 4.479 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.797 5.088 4.742 1.00 0.00 H new ATOM 0 HE3 LYS A 83 9.841 4.916 3.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.073 4.653 5.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.616 6.032 4.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 10.604 6.198 5.923 1.00 0.00 H new ATOM 1204 N PHE A 84 9.815 9.168 -0.975 1.00 0.00 N ATOM 1205 CA PHE A 84 10.732 9.897 -1.843 1.00 0.00 C ATOM 1206 C PHE A 84 11.356 11.078 -1.106 1.00 0.00 C ATOM 1207 O PHE A 84 10.701 12.092 -0.869 1.00 0.00 O ATOM 1208 CB PHE A 84 10.000 10.391 -3.093 1.00 0.00 C ATOM 1209 CG PHE A 84 10.811 11.343 -3.926 1.00 0.00 C ATOM 1210 CD1 PHE A 84 12.004 10.937 -4.500 1.00 0.00 C ATOM 1211 CD2 PHE A 84 10.379 12.643 -4.134 1.00 0.00 C ATOM 1212 CE1 PHE A 84 12.753 11.811 -5.267 1.00 0.00 C ATOM 1213 CE2 PHE A 84 11.122 13.520 -4.900 1.00 0.00 C ATOM 1214 CZ PHE A 84 12.311 13.104 -5.466 1.00 0.00 C ATOM 0 H PHE A 84 9.317 9.751 -0.302 1.00 0.00 H new ATOM 0 HA PHE A 84 11.529 9.216 -2.142 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.721 9.533 -3.704 1.00 0.00 H new ATOM 0 HB3 PHE A 84 9.074 10.882 -2.792 1.00 0.00 H new ATOM 0 HD1 PHE A 84 12.354 9.927 -4.347 1.00 0.00 H new ATOM 0 HD2 PHE A 84 9.451 12.974 -3.692 1.00 0.00 H new ATOM 0 HE1 PHE A 84 13.682 11.483 -5.709 1.00 0.00 H new ATOM 0 HE2 PHE A 84 10.773 14.530 -5.056 1.00 0.00 H new ATOM 0 HZ PHE A 84 12.894 13.789 -6.063 1.00 0.00 H new ATOM 1224 N ALA A 85 12.628 10.938 -0.746 1.00 0.00 N ATOM 1225 CA ALA A 85 13.342 11.992 -0.037 1.00 0.00 C ATOM 1226 C ALA A 85 12.795 12.173 1.375 1.00 0.00 C ATOM 1227 O ALA A 85 12.645 13.297 1.854 1.00 0.00 O ATOM 1228 CB ALA A 85 13.255 13.300 -0.810 1.00 0.00 C ATOM 0 H ALA A 85 13.185 10.104 -0.934 1.00 0.00 H new ATOM 0 HA ALA A 85 14.388 11.698 0.042 1.00 0.00 H new ATOM 0 HB1 ALA A 85 13.793 14.079 -0.269 1.00 0.00 H new ATOM 0 HB2 ALA A 85 13.700 13.170 -1.796 1.00 0.00 H new ATOM 0 HB3 ALA A 85 12.210 13.589 -0.919 1.00 0.00 H new ATOM 1234 N ASP A 86 12.497 11.060 2.035 1.00 0.00 N ATOM 1235 CA ASP A 86 11.966 11.095 3.393 1.00 0.00 C ATOM 1236 C ASP A 86 10.565 11.700 3.414 1.00 0.00 C ATOM 1237 O ASP A 86 10.214 12.444 4.328 1.00 0.00 O ATOM 1238 CB ASP A 86 12.895 11.897 4.306 1.00 0.00 C ATOM 1239 CG ASP A 86 14.358 11.692 3.967 1.00 0.00 C ATOM 1240 OD1 ASP A 86 14.906 10.627 4.323 1.00 0.00 O ATOM 1241 OD2 ASP A 86 14.955 12.595 3.346 1.00 0.00 O ATOM 0 H ASP A 86 12.614 10.122 1.652 1.00 0.00 H new ATOM 0 HA ASP A 86 11.905 10.070 3.759 1.00 0.00 H new ATOM 0 HB2 ASP A 86 12.652 12.957 4.227 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.721 11.607 5.342 1.00 0.00 H new ATOM 1246 N GLU A 87 9.771 11.375 2.398 1.00 0.00 N ATOM 1247 CA GLU A 87 8.410 11.888 2.300 1.00 0.00 C ATOM 1248 C GLU A 87 7.515 10.914 1.540 1.00 0.00 C ATOM 1249 O GLU A 87 7.780 10.581 0.384 1.00 0.00 O ATOM 1250 CB GLU A 87 8.404 13.251 1.604 1.00 0.00 C ATOM 1251 CG GLU A 87 8.849 14.394 2.502 1.00 0.00 C ATOM 1252 CD GLU A 87 8.781 15.741 1.808 1.00 0.00 C ATOM 1253 OE1 GLU A 87 7.678 16.130 1.373 1.00 0.00 O ATOM 1254 OE2 GLU A 87 9.833 16.406 1.701 1.00 0.00 O ATOM 0 H GLU A 87 10.047 10.760 1.633 1.00 0.00 H new ATOM 0 HA GLU A 87 8.019 12.002 3.311 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.058 13.208 0.733 1.00 0.00 H new ATOM 0 HB3 GLU A 87 7.399 13.458 1.237 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.222 14.416 3.393 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.871 14.212 2.836 1.00 0.00 H new ATOM 1261 N HIS A 88 6.453 10.459 2.197 1.00 0.00 N ATOM 1262 CA HIS A 88 5.518 9.522 1.585 1.00 0.00 C ATOM 1263 C HIS A 88 4.627 10.230 0.568 1.00 0.00 C ATOM 1264 O HIS A 88 4.066 11.289 0.850 1.00 0.00 O ATOM 1265 CB HIS A 88 4.656 8.854 2.657 1.00 0.00 C ATOM 1266 CG HIS A 88 5.257 7.600 3.212 1.00 0.00 C ATOM 1267 ND1 HIS A 88 4.871 6.338 2.810 1.00 0.00 N ATOM 1268 CD2 HIS A 88 6.223 7.417 4.143 1.00 0.00 C ATOM 1269 CE1 HIS A 88 5.572 5.434 3.471 1.00 0.00 C ATOM 1270 NE2 HIS A 88 6.400 6.063 4.286 1.00 0.00 N ATOM 0 H HIS A 88 6.218 10.724 3.154 1.00 0.00 H new ATOM 0 HA HIS A 88 6.096 8.757 1.066 1.00 0.00 H new ATOM 0 HB2 HIS A 88 4.492 9.560 3.471 1.00 0.00 H new ATOM 0 HB3 HIS A 88 3.679 8.622 2.234 1.00 0.00 H new ATOM 0 HD1 HIS A 88 4.156 6.135 2.112 1.00 0.00 H new ATOM 0 HD2 HIS A 88 6.755 8.192 4.674 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.483 4.363 3.363 1.00 0.00 H new ATOM 1279 N VAL A 89 4.503 9.639 -0.616 1.00 0.00 N ATOM 1280 CA VAL A 89 3.681 10.213 -1.675 1.00 0.00 C ATOM 1281 C VAL A 89 2.333 10.676 -1.134 1.00 0.00 C ATOM 1282 O VAL A 89 1.853 10.202 -0.104 1.00 0.00 O ATOM 1283 CB VAL A 89 3.445 9.202 -2.812 1.00 0.00 C ATOM 1284 CG1 VAL A 89 4.655 9.140 -3.732 1.00 0.00 C ATOM 1285 CG2 VAL A 89 3.125 7.827 -2.245 1.00 0.00 C ATOM 0 H VAL A 89 4.961 8.763 -0.866 1.00 0.00 H new ATOM 0 HA VAL A 89 4.226 11.071 -2.069 1.00 0.00 H new ATOM 0 HB VAL A 89 2.589 9.536 -3.399 1.00 0.00 H new ATOM 0 HG11 VAL A 89 4.469 8.420 -4.529 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.833 10.124 -4.166 1.00 0.00 H new ATOM 0 HG13 VAL A 89 5.531 8.831 -3.161 1.00 0.00 H new ATOM 0 HG21 VAL A 89 2.961 7.125 -3.063 1.00 0.00 H new ATOM 0 HG22 VAL A 89 3.959 7.483 -1.633 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.225 7.886 -1.632 1.00 0.00 H new ATOM 1295 N PRO A 90 1.705 11.625 -1.843 1.00 0.00 N ATOM 1296 CA PRO A 90 0.402 12.173 -1.454 1.00 0.00 C ATOM 1297 C PRO A 90 -0.726 11.162 -1.624 1.00 0.00 C ATOM 1298 O PRO A 90 -1.466 11.202 -2.606 1.00 0.00 O ATOM 1299 CB PRO A 90 0.213 13.352 -2.412 1.00 0.00 C ATOM 1300 CG PRO A 90 1.038 13.009 -3.603 1.00 0.00 C ATOM 1301 CD PRO A 90 2.218 12.236 -3.081 1.00 0.00 C ATOM 0 HA PRO A 90 0.375 12.453 -0.401 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -0.836 13.480 -2.680 1.00 0.00 H new ATOM 0 HB3 PRO A 90 0.542 14.287 -1.959 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.466 12.414 -4.316 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.361 13.909 -4.126 1.00 0.00 H new ATOM 0 HD2 PRO A 90 2.551 11.481 -3.794 1.00 0.00 H new ATOM 0 HD3 PRO A 90 3.070 12.887 -2.885 1.00 0.00 H new ATOM 1309 N GLY A 91 -0.853 10.256 -0.659 1.00 0.00 N ATOM 1310 CA GLY A 91 -1.894 9.247 -0.722 1.00 0.00 C ATOM 1311 C GLY A 91 -1.463 7.930 -0.107 1.00 0.00 C ATOM 1312 O GLY A 91 -2.274 7.018 0.054 1.00 0.00 O ATOM 0 H GLY A 91 -0.254 10.203 0.165 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -2.782 9.612 -0.206 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.175 9.084 -1.762 1.00 0.00 H new ATOM 1316 N SER A 92 -0.183 7.830 0.236 1.00 0.00 N ATOM 1317 CA SER A 92 0.356 6.612 0.831 1.00 0.00 C ATOM 1318 C SER A 92 -0.108 6.464 2.277 1.00 0.00 C ATOM 1319 O SER A 92 -0.544 7.421 2.918 1.00 0.00 O ATOM 1320 CB SER A 92 1.884 6.624 0.772 1.00 0.00 C ATOM 1321 OG SER A 92 2.354 5.982 -0.401 1.00 0.00 O ATOM 0 H SER A 92 0.500 8.577 0.112 1.00 0.00 H new ATOM 0 HA SER A 92 -0.015 5.761 0.259 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.244 7.653 0.797 1.00 0.00 H new ATOM 0 HB3 SER A 92 2.289 6.123 1.652 1.00 0.00 H new ATOM 0 HG SER A 92 1.652 5.995 -1.085 1.00 0.00 H new ATOM 1327 N PRO A 93 -0.011 5.234 2.805 1.00 0.00 N ATOM 1328 CA PRO A 93 0.505 4.088 2.052 1.00 0.00 C ATOM 1329 C PRO A 93 -0.445 3.645 0.945 1.00 0.00 C ATOM 1330 O PRO A 93 -1.592 4.090 0.883 1.00 0.00 O ATOM 1331 CB PRO A 93 0.635 2.994 3.115 1.00 0.00 C ATOM 1332 CG PRO A 93 -0.356 3.366 4.163 1.00 0.00 C ATOM 1333 CD PRO A 93 -0.400 4.869 4.178 1.00 0.00 C ATOM 0 HA PRO A 93 1.441 4.322 1.545 1.00 0.00 H new ATOM 0 HB2 PRO A 93 0.421 2.010 2.699 1.00 0.00 H new ATOM 0 HB3 PRO A 93 1.646 2.955 3.522 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -1.338 2.949 3.937 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.060 2.975 5.136 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -1.395 5.240 4.426 1.00 0.00 H new ATOM 0 HD3 PRO A 93 0.288 5.284 4.915 1.00 0.00 H new ATOM 1341 N PHE A 94 0.037 2.766 0.073 1.00 0.00 N ATOM 1342 CA PHE A 94 -0.770 2.263 -1.032 1.00 0.00 C ATOM 1343 C PHE A 94 -1.271 0.852 -0.741 1.00 0.00 C ATOM 1344 O PHE A 94 -0.508 -0.114 -0.789 1.00 0.00 O ATOM 1345 CB PHE A 94 0.041 2.271 -2.329 1.00 0.00 C ATOM 1346 CG PHE A 94 -0.041 3.570 -3.079 1.00 0.00 C ATOM 1347 CD1 PHE A 94 0.278 4.766 -2.457 1.00 0.00 C ATOM 1348 CD2 PHE A 94 -0.438 3.594 -4.407 1.00 0.00 C ATOM 1349 CE1 PHE A 94 0.204 5.963 -3.145 1.00 0.00 C ATOM 1350 CE2 PHE A 94 -0.513 4.788 -5.100 1.00 0.00 C ATOM 1351 CZ PHE A 94 -0.193 5.974 -4.468 1.00 0.00 C ATOM 0 H PHE A 94 0.983 2.387 0.110 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.633 2.919 -1.147 1.00 0.00 H new ATOM 0 HB2 PHE A 94 1.085 2.060 -2.097 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -0.311 1.466 -2.973 1.00 0.00 H new ATOM 0 HD1 PHE A 94 0.588 4.763 -1.422 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.691 2.670 -4.906 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.456 6.888 -2.649 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.822 4.793 -6.135 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.253 6.908 -5.007 1.00 0.00 H new ATOM 1361 N THR A 95 -2.561 0.738 -0.439 1.00 0.00 N ATOM 1362 CA THR A 95 -3.165 -0.553 -0.138 1.00 0.00 C ATOM 1363 C THR A 95 -3.565 -1.284 -1.415 1.00 0.00 C ATOM 1364 O THR A 95 -4.541 -0.919 -2.072 1.00 0.00 O ATOM 1365 CB THR A 95 -4.406 -0.398 0.761 1.00 0.00 C ATOM 1366 OG1 THR A 95 -4.098 0.442 1.879 1.00 0.00 O ATOM 1367 CG2 THR A 95 -4.889 -1.753 1.256 1.00 0.00 C ATOM 0 H THR A 95 -3.208 1.526 -0.397 1.00 0.00 H new ATOM 0 HA THR A 95 -2.413 -1.137 0.392 1.00 0.00 H new ATOM 0 HB THR A 95 -5.200 0.059 0.171 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.892 0.537 2.445 1.00 0.00 H new ATOM 0 HG21 THR A 95 -5.766 -1.618 1.889 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.150 -2.380 0.403 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.097 -2.234 1.831 1.00 0.00 H new ATOM 1375 N VAL A 96 -2.806 -2.318 -1.762 1.00 0.00 N ATOM 1376 CA VAL A 96 -3.083 -3.102 -2.960 1.00 0.00 C ATOM 1377 C VAL A 96 -3.677 -4.460 -2.604 1.00 0.00 C ATOM 1378 O VAL A 96 -2.968 -5.362 -2.158 1.00 0.00 O ATOM 1379 CB VAL A 96 -1.809 -3.315 -3.799 1.00 0.00 C ATOM 1380 CG1 VAL A 96 -2.112 -4.160 -5.027 1.00 0.00 C ATOM 1381 CG2 VAL A 96 -1.204 -1.977 -4.197 1.00 0.00 C ATOM 0 H VAL A 96 -1.994 -2.633 -1.231 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.806 -2.536 -3.548 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.080 -3.851 -3.191 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -1.200 -4.299 -5.607 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.495 -5.131 -4.715 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.858 -3.656 -5.641 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -0.305 -2.146 -4.789 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.926 -1.412 -4.787 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.947 -1.413 -3.300 1.00 0.00 H new ATOM 1391 N LYS A 97 -4.983 -4.599 -2.805 1.00 0.00 N ATOM 1392 CA LYS A 97 -5.674 -5.848 -2.507 1.00 0.00 C ATOM 1393 C LYS A 97 -5.419 -6.885 -3.596 1.00 0.00 C ATOM 1394 O LYS A 97 -5.851 -6.719 -4.737 1.00 0.00 O ATOM 1395 CB LYS A 97 -7.178 -5.601 -2.366 1.00 0.00 C ATOM 1396 CG LYS A 97 -7.607 -5.254 -0.950 1.00 0.00 C ATOM 1397 CD LYS A 97 -7.045 -3.913 -0.510 1.00 0.00 C ATOM 1398 CE LYS A 97 -7.945 -2.764 -0.937 1.00 0.00 C ATOM 1399 NZ LYS A 97 -7.688 -2.352 -2.345 1.00 0.00 N ATOM 0 H LYS A 97 -5.584 -3.862 -3.173 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.285 -6.233 -1.565 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.469 -4.790 -3.034 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.716 -6.491 -2.692 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.695 -5.229 -0.894 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.270 -6.033 -0.266 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -6.931 -3.903 0.574 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -6.051 -3.776 -0.937 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -8.988 -3.061 -0.830 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -7.786 -1.913 -0.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -7.892 -1.338 -2.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -6.692 -2.532 -2.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.301 -2.898 -2.984 1.00 0.00 H new ATOM 1413 N ILE A 98 -4.715 -7.953 -3.236 1.00 0.00 N ATOM 1414 CA ILE A 98 -4.405 -9.017 -4.183 1.00 0.00 C ATOM 1415 C ILE A 98 -5.414 -10.156 -4.079 1.00 0.00 C ATOM 1416 O ILE A 98 -5.681 -10.665 -2.991 1.00 0.00 O ATOM 1417 CB ILE A 98 -2.989 -9.578 -3.954 1.00 0.00 C ATOM 1418 CG1 ILE A 98 -1.941 -8.487 -4.183 1.00 0.00 C ATOM 1419 CG2 ILE A 98 -2.735 -10.764 -4.873 1.00 0.00 C ATOM 1420 CD1 ILE A 98 -1.961 -7.913 -5.582 1.00 0.00 C ATOM 0 H ILE A 98 -4.349 -8.104 -2.296 1.00 0.00 H new ATOM 0 HA ILE A 98 -4.457 -8.579 -5.180 1.00 0.00 H new ATOM 0 HB ILE A 98 -2.912 -9.919 -2.922 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.104 -7.682 -3.467 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -0.951 -8.897 -3.982 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -1.730 -11.150 -4.700 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -3.465 -11.547 -4.667 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -2.827 -10.446 -5.911 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -1.192 -7.146 -5.671 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -1.767 -8.707 -6.304 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -2.938 -7.472 -5.781 1.00 0.00 H new ATOM 1432 N SER A 99 -5.970 -10.551 -5.220 1.00 0.00 N ATOM 1433 CA SER A 99 -6.951 -11.629 -5.258 1.00 0.00 C ATOM 1434 C SER A 99 -6.303 -12.939 -5.699 1.00 0.00 C ATOM 1435 O SER A 99 -5.581 -12.983 -6.694 1.00 0.00 O ATOM 1436 CB SER A 99 -8.098 -11.270 -6.206 1.00 0.00 C ATOM 1437 OG SER A 99 -8.697 -10.040 -5.838 1.00 0.00 O ATOM 0 H SER A 99 -5.758 -10.141 -6.130 1.00 0.00 H new ATOM 0 HA SER A 99 -7.348 -11.761 -4.252 1.00 0.00 H new ATOM 0 HB2 SER A 99 -7.723 -11.204 -7.227 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.847 -12.062 -6.192 1.00 0.00 H new ATOM 0 HG SER A 99 -9.425 -9.832 -6.460 1.00 0.00 H new ATOM 1443 N GLY A 100 -6.568 -14.004 -4.949 1.00 0.00 N ATOM 1444 CA GLY A 100 -6.003 -15.300 -5.276 1.00 0.00 C ATOM 1445 C GLY A 100 -7.055 -16.292 -5.733 1.00 0.00 C ATOM 1446 O GLY A 100 -7.749 -16.892 -4.913 1.00 0.00 O ATOM 0 H GLY A 100 -7.164 -13.993 -4.121 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -5.256 -15.180 -6.061 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -5.487 -15.699 -4.403 1.00 0.00 H new ATOM 1450 N GLU A 101 -7.173 -16.463 -7.046 1.00 0.00 N ATOM 1451 CA GLU A 101 -8.150 -17.387 -7.610 1.00 0.00 C ATOM 1452 C GLU A 101 -7.698 -17.888 -8.979 1.00 0.00 C ATOM 1453 O GLU A 101 -6.690 -17.432 -9.517 1.00 0.00 O ATOM 1454 CB GLU A 101 -9.517 -16.709 -7.729 1.00 0.00 C ATOM 1455 CG GLU A 101 -10.148 -16.373 -6.389 1.00 0.00 C ATOM 1456 CD GLU A 101 -11.635 -16.094 -6.498 1.00 0.00 C ATOM 1457 OE1 GLU A 101 -12.330 -16.852 -7.207 1.00 0.00 O ATOM 1458 OE2 GLU A 101 -12.103 -15.119 -5.875 1.00 0.00 O ATOM 0 H GLU A 101 -6.605 -15.974 -7.738 1.00 0.00 H new ATOM 0 HA GLU A 101 -8.233 -18.242 -6.939 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -9.410 -15.793 -8.310 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.190 -17.362 -8.284 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -9.987 -17.201 -5.698 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -9.649 -15.502 -5.965 1.00 0.00 H new ATOM 1465 N GLY A 102 -8.452 -18.831 -9.536 1.00 0.00 N ATOM 1466 CA GLY A 102 -8.113 -19.380 -10.836 1.00 0.00 C ATOM 1467 C GLY A 102 -7.697 -18.310 -11.826 1.00 0.00 C ATOM 1468 O GLY A 102 -8.479 -17.415 -12.148 1.00 0.00 O ATOM 0 H GLY A 102 -9.291 -19.224 -9.110 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.303 -20.101 -10.723 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -8.971 -19.924 -11.232 1.00 0.00 H new ATOM 1472 N ARG A 103 -6.463 -18.402 -12.311 1.00 0.00 N ATOM 1473 CA ARG A 103 -5.944 -17.433 -13.268 1.00 0.00 C ATOM 1474 C ARG A 103 -6.469 -17.720 -14.671 1.00 0.00 C ATOM 1475 O ARG A 103 -6.547 -18.874 -15.092 1.00 0.00 O ATOM 1476 CB ARG A 103 -4.414 -17.455 -13.270 1.00 0.00 C ATOM 1477 CG ARG A 103 -3.791 -16.531 -12.236 1.00 0.00 C ATOM 1478 CD ARG A 103 -3.797 -17.159 -10.851 1.00 0.00 C ATOM 1479 NE ARG A 103 -2.622 -17.995 -10.624 1.00 0.00 N ATOM 1480 CZ ARG A 103 -2.274 -18.466 -9.432 1.00 0.00 C ATOM 1481 NH1 ARG A 103 -3.008 -18.185 -8.365 1.00 0.00 N ATOM 1482 NH2 ARG A 103 -1.190 -19.221 -9.306 1.00 0.00 N ATOM 0 H ARG A 103 -5.804 -19.138 -12.057 1.00 0.00 H new ATOM 0 HA ARG A 103 -6.286 -16.443 -12.966 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -4.073 -18.474 -13.087 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -4.056 -17.173 -14.260 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -2.767 -16.297 -12.526 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -4.339 -15.589 -12.212 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -3.834 -16.373 -10.097 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -4.698 -17.760 -10.729 1.00 0.00 H new ATOM 0 HE ARG A 103 -2.036 -18.230 -11.425 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -3.842 -17.606 -8.458 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -2.739 -18.548 -7.451 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -0.623 -19.440 -10.125 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -0.924 -19.582 -8.390 1.00 0.00 H new ATOM 1496 N VAL A 104 -6.828 -16.662 -15.392 1.00 0.00 N ATOM 1497 CA VAL A 104 -7.345 -16.800 -16.748 1.00 0.00 C ATOM 1498 C VAL A 104 -6.518 -17.796 -17.553 1.00 0.00 C ATOM 1499 O VAL A 104 -5.396 -17.500 -17.964 1.00 0.00 O ATOM 1500 CB VAL A 104 -7.357 -15.447 -17.484 1.00 0.00 C ATOM 1501 CG1 VAL A 104 -7.864 -15.618 -18.908 1.00 0.00 C ATOM 1502 CG2 VAL A 104 -8.204 -14.436 -16.726 1.00 0.00 C ATOM 0 H VAL A 104 -6.770 -15.700 -15.059 1.00 0.00 H new ATOM 0 HA VAL A 104 -8.367 -17.168 -16.661 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.336 -15.069 -17.530 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.865 -14.652 -19.412 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.213 -16.307 -19.446 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -8.878 -16.018 -18.888 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.201 -13.486 -17.260 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -9.227 -14.805 -16.647 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.792 -14.292 -15.727 1.00 0.00 H new ATOM 1512 N LYS A 105 -7.080 -18.980 -17.775 1.00 0.00 N ATOM 1513 CA LYS A 105 -6.397 -20.021 -18.532 1.00 0.00 C ATOM 1514 C LYS A 105 -6.995 -20.161 -19.928 1.00 0.00 C ATOM 1515 O LYS A 105 -8.209 -20.052 -20.107 1.00 0.00 O ATOM 1516 CB LYS A 105 -6.483 -21.358 -17.793 1.00 0.00 C ATOM 1517 CG LYS A 105 -7.876 -21.966 -17.796 1.00 0.00 C ATOM 1518 CD LYS A 105 -7.920 -23.262 -17.003 1.00 0.00 C ATOM 1519 CE LYS A 105 -7.335 -24.420 -17.796 1.00 0.00 C ATOM 1520 NZ LYS A 105 -8.300 -24.951 -18.797 1.00 0.00 N ATOM 0 H LYS A 105 -8.007 -19.242 -17.441 1.00 0.00 H new ATOM 0 HA LYS A 105 -5.350 -19.734 -18.632 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -5.787 -22.062 -18.250 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -6.160 -21.215 -16.762 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -8.585 -21.255 -17.373 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -8.189 -22.156 -18.823 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -7.365 -23.140 -16.073 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -8.951 -23.489 -16.732 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -6.429 -24.091 -18.305 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -7.045 -25.218 -17.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -7.863 -25.739 -19.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -9.155 -25.289 -18.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -8.558 -24.197 -19.465 1.00 0.00 H new ATOM 1534 N SER A 106 -6.137 -20.403 -20.914 1.00 0.00 N ATOM 1535 CA SER A 106 -6.582 -20.555 -22.294 1.00 0.00 C ATOM 1536 C SER A 106 -6.786 -22.027 -22.640 1.00 0.00 C ATOM 1537 O SER A 106 -6.092 -22.901 -22.121 1.00 0.00 O ATOM 1538 CB SER A 106 -5.565 -19.931 -23.251 1.00 0.00 C ATOM 1539 OG SER A 106 -6.159 -19.631 -24.502 1.00 0.00 O ATOM 0 H SER A 106 -5.130 -20.498 -20.783 1.00 0.00 H new ATOM 0 HA SER A 106 -7.536 -20.039 -22.401 1.00 0.00 H new ATOM 0 HB2 SER A 106 -5.158 -19.021 -22.811 1.00 0.00 H new ATOM 0 HB3 SER A 106 -4.730 -20.616 -23.396 1.00 0.00 H new ATOM 0 HG SER A 106 -5.489 -19.232 -25.095 1.00 0.00 H new ATOM 1545 N GLY A 107 -7.744 -22.294 -23.523 1.00 0.00 N ATOM 1546 CA GLY A 107 -8.024 -23.660 -23.924 1.00 0.00 C ATOM 1547 C GLY A 107 -9.383 -23.806 -24.579 1.00 0.00 C ATOM 1548 O GLY A 107 -10.333 -24.309 -23.981 1.00 0.00 O ATOM 0 H GLY A 107 -8.331 -21.588 -23.968 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.253 -23.997 -24.616 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.974 -24.309 -23.050 1.00 0.00 H new ATOM 1552 N PRO A 108 -9.488 -23.356 -25.838 1.00 0.00 N ATOM 1553 CA PRO A 108 -10.737 -23.426 -26.603 1.00 0.00 C ATOM 1554 C PRO A 108 -11.106 -24.857 -26.979 1.00 0.00 C ATOM 1555 O PRO A 108 -10.314 -25.781 -26.795 1.00 0.00 O ATOM 1556 CB PRO A 108 -10.432 -22.605 -27.858 1.00 0.00 C ATOM 1557 CG PRO A 108 -8.951 -22.680 -28.009 1.00 0.00 C ATOM 1558 CD PRO A 108 -8.395 -22.744 -26.613 1.00 0.00 C ATOM 0 HA PRO A 108 -11.587 -23.054 -26.031 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -10.940 -23.013 -28.731 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -10.767 -21.574 -27.748 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -8.662 -23.559 -28.585 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -8.568 -21.809 -28.542 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -7.486 -23.345 -26.570 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -8.141 -21.753 -26.236 1.00 0.00 H new ATOM 1566 N SER A 109 -12.313 -25.032 -27.508 1.00 0.00 N ATOM 1567 CA SER A 109 -12.788 -26.352 -27.908 1.00 0.00 C ATOM 1568 C SER A 109 -13.444 -26.299 -29.284 1.00 0.00 C ATOM 1569 O SER A 109 -14.350 -25.500 -29.522 1.00 0.00 O ATOM 1570 CB SER A 109 -13.781 -26.893 -26.877 1.00 0.00 C ATOM 1571 OG SER A 109 -15.047 -26.271 -27.014 1.00 0.00 O ATOM 0 H SER A 109 -12.979 -24.277 -27.670 1.00 0.00 H new ATOM 0 HA SER A 109 -11.929 -27.021 -27.960 1.00 0.00 H new ATOM 0 HB2 SER A 109 -13.887 -27.971 -27.000 1.00 0.00 H new ATOM 0 HB3 SER A 109 -13.395 -26.723 -25.872 1.00 0.00 H new ATOM 0 HG SER A 109 -15.073 -25.764 -27.852 1.00 0.00 H new ATOM 1577 N SER A 110 -12.979 -27.157 -30.187 1.00 0.00 N ATOM 1578 CA SER A 110 -13.517 -27.206 -31.542 1.00 0.00 C ATOM 1579 C SER A 110 -13.110 -25.967 -32.333 1.00 0.00 C ATOM 1580 O SER A 110 -13.915 -25.392 -33.065 1.00 0.00 O ATOM 1581 CB SER A 110 -15.042 -27.323 -31.504 1.00 0.00 C ATOM 1582 OG SER A 110 -15.534 -27.956 -32.672 1.00 0.00 O ATOM 0 H SER A 110 -12.232 -27.827 -30.005 1.00 0.00 H new ATOM 0 HA SER A 110 -13.105 -28.084 -32.039 1.00 0.00 H new ATOM 0 HB2 SER A 110 -15.344 -27.891 -30.624 1.00 0.00 H new ATOM 0 HB3 SER A 110 -15.484 -26.331 -31.411 1.00 0.00 H new ATOM 0 HG SER A 110 -16.511 -28.020 -32.623 1.00 0.00 H new ATOM 1588 N GLY A 111 -11.853 -25.561 -32.181 1.00 0.00 N ATOM 1589 CA GLY A 111 -11.360 -24.393 -32.887 1.00 0.00 C ATOM 1590 C GLY A 111 -9.885 -24.147 -32.642 1.00 0.00 C ATOM 1591 O GLY A 111 -9.368 -24.451 -31.567 1.00 0.00 O ATOM 0 H GLY A 111 -11.167 -26.020 -31.581 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -11.531 -24.519 -33.956 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -11.928 -23.517 -32.574 1.00 0.00 H new TER 1595 GLY A 111