USER MOD reduce.3.24.130724 H: found=0, std=0, add=766, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 764 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 36 CYS SG : rot -53:sc= -1.14 USER MOD Set 1.2: A 86 TYR OH : rot -90:sc= 0.089 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 -17:sc= 0.407 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 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot -5:sc= 1.04 USER MOD Single : A 23 HIS : no HD1:sc= -0.139 X(o=-0.14,f=-0.0068) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc=-0.00714 USER MOD Single : A 52 SER OG : rot -45:sc= 0.686 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -159:sc= -0.0422 (180deg=-0.29) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.0265 X(o=-0.027,f=-0.23) USER MOD Single : A 62 ASN : amide:sc= -0.768 K(o=-0.77,f=-1.8) USER MOD Single : A 63 ASN : amide:sc= -0.235 X(o=-0.24,f=-0.036) USER MOD Single : A 64 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00742) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.213 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= -0.0122 USER MOD Single : A 72 TYR OH : rot 167:sc= 0.394 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl -170:sc= -0.57 (180deg=-0.744) USER MOD Single : A 80 TYR OH : rot -21:sc= 0.69 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -162:sc=-0.00338 (180deg=-0.445) USER MOD Single : A 85 LYS NZ :NH3+ -132:sc= -0.366 (180deg=-1.22!) USER MOD Single : A 93 HIS :FLIP no HD1:sc= -1.82 F(o=-2.8!,f=-1.8) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot -8:sc= 0.653 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 35:sc= 0.951 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.014 26.036 -15.378 1.00 0.00 N ATOM 2 CA GLY A 1 14.301 26.527 -14.922 1.00 0.00 C ATOM 3 C GLY A 1 14.789 25.808 -13.680 1.00 0.00 C ATOM 4 O GLY A 1 14.718 24.582 -13.596 1.00 0.00 O ATOM 0 H1 GLY A 1 12.725 26.559 -16.229 1.00 0.00 H new ATOM 0 H2 GLY A 1 13.089 25.023 -15.603 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.305 26.173 -14.629 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.035 26.408 -15.719 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.226 27.594 -14.714 1.00 0.00 H new ATOM 8 N SER A 2 15.288 26.571 -12.713 1.00 0.00 N ATOM 9 CA SER A 2 15.795 25.999 -11.472 1.00 0.00 C ATOM 10 C SER A 2 14.668 25.354 -10.671 1.00 0.00 C ATOM 11 O SER A 2 13.496 25.679 -10.856 1.00 0.00 O ATOM 12 CB SER A 2 16.481 27.077 -10.631 1.00 0.00 C ATOM 13 OG SER A 2 15.538 28.004 -10.122 1.00 0.00 O ATOM 0 H SER A 2 15.352 27.588 -12.765 1.00 0.00 H new ATOM 0 HA SER A 2 16.523 25.229 -11.727 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.019 26.611 -9.806 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.219 27.601 -11.238 1.00 0.00 H new ATOM 0 HG SER A 2 16.001 28.682 -9.587 1.00 0.00 H new ATOM 19 N SER A 3 15.034 24.438 -9.780 1.00 0.00 N ATOM 20 CA SER A 3 14.054 23.744 -8.952 1.00 0.00 C ATOM 21 C SER A 3 14.703 23.201 -7.682 1.00 0.00 C ATOM 22 O SER A 3 15.908 22.957 -7.643 1.00 0.00 O ATOM 23 CB SER A 3 13.410 22.600 -9.738 1.00 0.00 C ATOM 24 OG SER A 3 12.870 23.064 -10.963 1.00 0.00 O ATOM 0 H SER A 3 16.001 24.159 -9.613 1.00 0.00 H new ATOM 0 HA SER A 3 13.283 24.460 -8.668 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.152 21.826 -9.934 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.622 22.142 -9.140 1.00 0.00 H new ATOM 0 HG SER A 3 12.771 24.038 -10.929 1.00 0.00 H new ATOM 30 N GLY A 4 13.893 23.016 -6.644 1.00 0.00 N ATOM 31 CA GLY A 4 14.405 22.504 -5.386 1.00 0.00 C ATOM 32 C GLY A 4 13.485 21.474 -4.762 1.00 0.00 C ATOM 33 O GLY A 4 12.315 21.753 -4.502 1.00 0.00 O ATOM 0 H GLY A 4 12.892 23.211 -6.652 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.386 22.058 -5.551 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.544 23.331 -4.690 1.00 0.00 H new ATOM 37 N SER A 5 14.014 20.278 -4.521 1.00 0.00 N ATOM 38 CA SER A 5 13.230 19.201 -3.928 1.00 0.00 C ATOM 39 C SER A 5 13.855 18.732 -2.618 1.00 0.00 C ATOM 40 O SER A 5 13.856 17.540 -2.309 1.00 0.00 O ATOM 41 CB SER A 5 13.120 18.027 -4.903 1.00 0.00 C ATOM 42 OG SER A 5 14.399 17.611 -5.348 1.00 0.00 O ATOM 0 H SER A 5 14.982 20.031 -4.727 1.00 0.00 H new ATOM 0 HA SER A 5 12.232 19.584 -3.717 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.612 17.194 -4.418 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.511 18.317 -5.759 1.00 0.00 H new ATOM 0 HG SER A 5 14.301 16.859 -5.968 1.00 0.00 H new ATOM 48 N SER A 6 14.386 19.679 -1.851 1.00 0.00 N ATOM 49 CA SER A 6 15.019 19.364 -0.575 1.00 0.00 C ATOM 50 C SER A 6 14.300 20.063 0.575 1.00 0.00 C ATOM 51 O SER A 6 13.503 20.976 0.360 1.00 0.00 O ATOM 52 CB SER A 6 16.492 19.775 -0.596 1.00 0.00 C ATOM 53 OG SER A 6 17.258 18.975 0.288 1.00 0.00 O ATOM 0 H SER A 6 14.391 20.670 -2.091 1.00 0.00 H new ATOM 0 HA SER A 6 14.953 18.287 -0.421 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.884 19.681 -1.609 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.584 20.824 -0.314 1.00 0.00 H new ATOM 0 HG SER A 6 18.196 19.257 0.255 1.00 0.00 H new ATOM 59 N GLY A 7 14.588 19.627 1.798 1.00 0.00 N ATOM 60 CA GLY A 7 13.962 20.221 2.964 1.00 0.00 C ATOM 61 C GLY A 7 13.768 19.224 4.089 1.00 0.00 C ATOM 62 O GLY A 7 14.371 18.151 4.107 1.00 0.00 O ATOM 0 H GLY A 7 15.244 18.873 2.001 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.575 21.050 3.319 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.995 20.637 2.681 1.00 0.00 H new ATOM 66 N PRO A 8 12.909 19.577 5.057 1.00 0.00 N ATOM 67 CA PRO A 8 12.619 18.720 6.210 1.00 0.00 C ATOM 68 C PRO A 8 11.824 17.478 5.822 1.00 0.00 C ATOM 69 O PRO A 8 10.938 17.536 4.969 1.00 0.00 O ATOM 70 CB PRO A 8 11.787 19.623 7.124 1.00 0.00 C ATOM 71 CG PRO A 8 11.162 20.617 6.207 1.00 0.00 C ATOM 72 CD PRO A 8 12.155 20.841 5.100 1.00 0.00 C ATOM 0 HA PRO A 8 13.529 18.342 6.676 1.00 0.00 H new ATOM 0 HB2 PRO A 8 11.031 19.052 7.663 1.00 0.00 H new ATOM 0 HB3 PRO A 8 12.411 20.112 7.872 1.00 0.00 H new ATOM 0 HG2 PRO A 8 10.216 20.244 5.813 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.945 21.548 6.730 1.00 0.00 H new ATOM 0 HD2 PRO A 8 11.659 21.046 4.151 1.00 0.00 H new ATOM 0 HD3 PRO A 8 12.806 21.690 5.310 1.00 0.00 H new ATOM 80 N PHE A 9 12.145 16.354 6.455 1.00 0.00 N ATOM 81 CA PHE A 9 11.460 15.097 6.176 1.00 0.00 C ATOM 82 C PHE A 9 10.039 15.116 6.732 1.00 0.00 C ATOM 83 O PHE A 9 9.805 15.574 7.850 1.00 0.00 O ATOM 84 CB PHE A 9 12.238 13.924 6.775 1.00 0.00 C ATOM 85 CG PHE A 9 11.391 12.711 7.032 1.00 0.00 C ATOM 86 CD1 PHE A 9 10.701 12.571 8.226 1.00 0.00 C ATOM 87 CD2 PHE A 9 11.283 11.710 6.080 1.00 0.00 C ATOM 88 CE1 PHE A 9 9.921 11.456 8.464 1.00 0.00 C ATOM 89 CE2 PHE A 9 10.504 10.593 6.313 1.00 0.00 C ATOM 90 CZ PHE A 9 9.821 10.466 7.507 1.00 0.00 C ATOM 0 H PHE A 9 12.875 16.288 7.164 1.00 0.00 H new ATOM 0 HA PHE A 9 11.406 14.974 5.094 1.00 0.00 H new ATOM 0 HB2 PHE A 9 13.049 13.654 6.099 1.00 0.00 H new ATOM 0 HB3 PHE A 9 12.696 14.243 7.712 1.00 0.00 H new ATOM 0 HD1 PHE A 9 10.774 13.342 8.979 1.00 0.00 H new ATOM 0 HD2 PHE A 9 11.814 11.804 5.144 1.00 0.00 H new ATOM 0 HE1 PHE A 9 9.389 11.359 9.399 1.00 0.00 H new ATOM 0 HE2 PHE A 9 10.429 9.820 5.562 1.00 0.00 H new ATOM 0 HZ PHE A 9 9.210 9.594 7.691 1.00 0.00 H new ATOM 100 N ASP A 10 9.095 14.617 5.942 1.00 0.00 N ATOM 101 CA ASP A 10 7.697 14.576 6.354 1.00 0.00 C ATOM 102 C ASP A 10 6.917 13.557 5.529 1.00 0.00 C ATOM 103 O ASP A 10 6.740 13.705 4.320 1.00 0.00 O ATOM 104 CB ASP A 10 7.060 15.960 6.212 1.00 0.00 C ATOM 105 CG ASP A 10 7.196 16.792 7.472 1.00 0.00 C ATOM 106 OD1 ASP A 10 6.960 16.247 8.571 1.00 0.00 O ATOM 107 OD2 ASP A 10 7.540 17.987 7.359 1.00 0.00 O ATOM 0 H ASP A 10 9.272 14.235 5.013 1.00 0.00 H new ATOM 0 HA ASP A 10 7.661 14.274 7.401 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.526 16.488 5.380 1.00 0.00 H new ATOM 0 HB3 ASP A 10 6.004 15.847 5.967 1.00 0.00 H new ATOM 112 N PRO A 11 6.440 12.496 6.197 1.00 0.00 N ATOM 113 CA PRO A 11 5.672 11.431 5.545 1.00 0.00 C ATOM 114 C PRO A 11 4.289 11.899 5.105 1.00 0.00 C ATOM 115 O PRO A 11 3.751 11.423 4.105 1.00 0.00 O ATOM 116 CB PRO A 11 5.552 10.362 6.635 1.00 0.00 C ATOM 117 CG PRO A 11 5.675 11.112 7.916 1.00 0.00 C ATOM 118 CD PRO A 11 6.612 12.254 7.639 1.00 0.00 C ATOM 0 HA PRO A 11 6.156 11.079 4.634 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.598 9.838 6.573 1.00 0.00 H new ATOM 0 HB3 PRO A 11 6.335 9.610 6.540 1.00 0.00 H new ATOM 0 HG2 PRO A 11 4.703 11.477 8.250 1.00 0.00 H new ATOM 0 HG3 PRO A 11 6.064 10.471 8.707 1.00 0.00 H new ATOM 0 HD2 PRO A 11 6.356 13.135 8.227 1.00 0.00 H new ATOM 0 HD3 PRO A 11 7.643 11.996 7.883 1.00 0.00 H new ATOM 126 N SER A 12 3.719 12.835 5.857 1.00 0.00 N ATOM 127 CA SER A 12 2.397 13.365 5.546 1.00 0.00 C ATOM 128 C SER A 12 2.375 13.989 4.154 1.00 0.00 C ATOM 129 O SER A 12 1.343 14.003 3.483 1.00 0.00 O ATOM 130 CB SER A 12 1.982 14.404 6.590 1.00 0.00 C ATOM 131 OG SER A 12 1.914 13.829 7.883 1.00 0.00 O ATOM 0 H SER A 12 4.152 13.242 6.686 1.00 0.00 H new ATOM 0 HA SER A 12 1.688 12.538 5.565 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.696 15.227 6.592 1.00 0.00 H new ATOM 0 HB3 SER A 12 1.012 14.824 6.324 1.00 0.00 H new ATOM 0 HG SER A 12 1.649 14.514 8.532 1.00 0.00 H new ATOM 137 N LYS A 13 3.523 14.504 3.726 1.00 0.00 N ATOM 138 CA LYS A 13 3.639 15.129 2.414 1.00 0.00 C ATOM 139 C LYS A 13 3.475 14.097 1.303 1.00 0.00 C ATOM 140 O LYS A 13 3.156 14.441 0.165 1.00 0.00 O ATOM 141 CB LYS A 13 4.993 15.829 2.278 1.00 0.00 C ATOM 142 CG LYS A 13 5.214 16.931 3.300 1.00 0.00 C ATOM 143 CD LYS A 13 4.548 18.229 2.872 1.00 0.00 C ATOM 144 CE LYS A 13 4.233 19.114 4.069 1.00 0.00 C ATOM 145 NZ LYS A 13 5.467 19.682 4.679 1.00 0.00 N ATOM 0 H LYS A 13 4.386 14.501 4.269 1.00 0.00 H new ATOM 0 HA LYS A 13 2.843 15.868 2.320 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.787 15.089 2.377 1.00 0.00 H new ATOM 0 HB3 LYS A 13 5.075 16.252 1.277 1.00 0.00 H new ATOM 0 HG2 LYS A 13 4.817 16.618 4.266 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.283 17.096 3.433 1.00 0.00 H new ATOM 0 HD2 LYS A 13 5.201 18.765 2.184 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.629 18.006 2.331 1.00 0.00 H new ATOM 0 HE2 LYS A 13 3.575 19.925 3.758 1.00 0.00 H new ATOM 0 HE3 LYS A 13 3.692 18.534 4.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 5.210 20.279 5.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 6.084 18.908 4.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 5.971 20.256 3.973 1.00 0.00 H new ATOM 159 N VAL A 14 3.693 12.830 1.642 1.00 0.00 N ATOM 160 CA VAL A 14 3.567 11.748 0.673 1.00 0.00 C ATOM 161 C VAL A 14 2.106 11.505 0.308 1.00 0.00 C ATOM 162 O VAL A 14 1.250 11.371 1.183 1.00 0.00 O ATOM 163 CB VAL A 14 4.174 10.439 1.212 1.00 0.00 C ATOM 164 CG1 VAL A 14 3.912 9.292 0.248 1.00 0.00 C ATOM 165 CG2 VAL A 14 5.665 10.607 1.462 1.00 0.00 C ATOM 0 H VAL A 14 3.958 12.528 2.580 1.00 0.00 H new ATOM 0 HA VAL A 14 4.115 12.055 -0.218 1.00 0.00 H new ATOM 0 HB VAL A 14 3.695 10.200 2.161 1.00 0.00 H new ATOM 0 HG11 VAL A 14 4.348 8.376 0.646 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.837 9.159 0.125 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.363 9.519 -0.718 1.00 0.00 H new ATOM 0 HG21 VAL A 14 6.078 9.673 1.843 1.00 0.00 H new ATOM 0 HG22 VAL A 14 6.163 10.870 0.529 1.00 0.00 H new ATOM 0 HG23 VAL A 14 5.824 11.399 2.194 1.00 0.00 H new ATOM 175 N VAL A 15 1.829 11.449 -0.991 1.00 0.00 N ATOM 176 CA VAL A 15 0.472 11.220 -1.473 1.00 0.00 C ATOM 177 C VAL A 15 0.374 9.903 -2.234 1.00 0.00 C ATOM 178 O VAL A 15 0.970 9.744 -3.299 1.00 0.00 O ATOM 179 CB VAL A 15 0.001 12.366 -2.388 1.00 0.00 C ATOM 180 CG1 VAL A 15 -1.386 12.074 -2.940 1.00 0.00 C ATOM 181 CG2 VAL A 15 0.018 13.689 -1.637 1.00 0.00 C ATOM 0 H VAL A 15 2.526 11.559 -1.728 1.00 0.00 H new ATOM 0 HA VAL A 15 -0.173 11.177 -0.595 1.00 0.00 H new ATOM 0 HB VAL A 15 0.691 12.443 -3.228 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -1.702 12.895 -3.584 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -1.361 11.149 -3.517 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.091 11.968 -2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -0.318 14.487 -2.299 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -0.648 13.627 -0.776 1.00 0.00 H new ATOM 0 HG23 VAL A 15 1.032 13.902 -1.297 1.00 0.00 H new ATOM 191 N ALA A 16 -0.384 8.961 -1.681 1.00 0.00 N ATOM 192 CA ALA A 16 -0.563 7.658 -2.309 1.00 0.00 C ATOM 193 C ALA A 16 -1.998 7.472 -2.789 1.00 0.00 C ATOM 194 O ALA A 16 -2.941 7.947 -2.155 1.00 0.00 O ATOM 195 CB ALA A 16 -0.180 6.549 -1.341 1.00 0.00 C ATOM 0 H ALA A 16 -0.884 9.076 -0.799 1.00 0.00 H new ATOM 0 HA ALA A 16 0.092 7.608 -3.179 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -0.319 5.581 -1.823 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.864 6.664 -1.051 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -0.811 6.606 -0.454 1.00 0.00 H new ATOM 201 N SER A 17 -2.157 6.780 -3.912 1.00 0.00 N ATOM 202 CA SER A 17 -3.478 6.536 -4.479 1.00 0.00 C ATOM 203 C SER A 17 -3.429 5.405 -5.503 1.00 0.00 C ATOM 204 O SER A 17 -2.375 4.821 -5.749 1.00 0.00 O ATOM 205 CB SER A 17 -4.019 7.808 -5.134 1.00 0.00 C ATOM 206 OG SER A 17 -4.309 8.798 -4.161 1.00 0.00 O ATOM 0 H SER A 17 -1.387 6.378 -4.448 1.00 0.00 H new ATOM 0 HA SER A 17 -4.145 6.242 -3.669 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.288 8.194 -5.844 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.921 7.574 -5.700 1.00 0.00 H new ATOM 0 HG SER A 17 -4.181 8.423 -3.265 1.00 0.00 H new ATOM 212 N GLY A 18 -4.579 5.103 -6.097 1.00 0.00 N ATOM 213 CA GLY A 18 -4.647 4.044 -7.087 1.00 0.00 C ATOM 214 C GLY A 18 -5.773 3.066 -6.814 1.00 0.00 C ATOM 215 O GLY A 18 -6.435 3.123 -5.778 1.00 0.00 O ATOM 0 H GLY A 18 -5.465 5.573 -5.910 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.783 4.483 -8.075 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.699 3.506 -7.105 1.00 0.00 H new ATOM 219 N PRO A 19 -6.004 2.145 -7.761 1.00 0.00 N ATOM 220 CA PRO A 19 -7.059 1.134 -7.641 1.00 0.00 C ATOM 221 C PRO A 19 -6.747 0.096 -6.568 1.00 0.00 C ATOM 222 O PRO A 19 -7.647 -0.412 -5.902 1.00 0.00 O ATOM 223 CB PRO A 19 -7.084 0.481 -9.025 1.00 0.00 C ATOM 224 CG PRO A 19 -5.714 0.697 -9.571 1.00 0.00 C ATOM 225 CD PRO A 19 -5.254 2.019 -9.022 1.00 0.00 C ATOM 0 HA PRO A 19 -8.012 1.572 -7.344 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.320 -0.581 -8.957 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -7.841 0.936 -9.664 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -5.042 -0.106 -9.269 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -5.726 0.710 -10.661 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -4.177 2.031 -8.852 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -5.478 2.838 -9.706 1.00 0.00 H new ATOM 233 N GLY A 20 -5.464 -0.215 -6.406 1.00 0.00 N ATOM 234 CA GLY A 20 -5.056 -1.191 -5.412 1.00 0.00 C ATOM 235 C GLY A 20 -5.511 -0.820 -4.015 1.00 0.00 C ATOM 236 O GLY A 20 -5.739 -1.692 -3.176 1.00 0.00 O ATOM 0 H GLY A 20 -4.700 0.192 -6.946 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.464 -2.167 -5.676 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -3.970 -1.285 -5.424 1.00 0.00 H new ATOM 240 N LEU A 21 -5.643 0.478 -3.762 1.00 0.00 N ATOM 241 CA LEU A 21 -6.072 0.963 -2.455 1.00 0.00 C ATOM 242 C LEU A 21 -7.594 1.032 -2.373 1.00 0.00 C ATOM 243 O LEU A 21 -8.152 1.413 -1.344 1.00 0.00 O ATOM 244 CB LEU A 21 -5.472 2.343 -2.180 1.00 0.00 C ATOM 245 CG LEU A 21 -4.076 2.356 -1.556 1.00 0.00 C ATOM 246 CD1 LEU A 21 -3.327 3.619 -1.950 1.00 0.00 C ATOM 247 CD2 LEU A 21 -4.168 2.239 -0.041 1.00 0.00 C ATOM 0 H LEU A 21 -5.459 1.213 -4.445 1.00 0.00 H new ATOM 0 HA LEU A 21 -5.717 0.262 -1.700 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.433 2.894 -3.120 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.148 2.886 -1.520 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.522 1.497 -1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.336 3.611 -1.497 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.230 3.661 -3.035 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.878 4.492 -1.601 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.165 2.250 0.386 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.740 3.078 0.355 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.664 1.305 0.222 1.00 0.00 H new ATOM 259 N GLU A 22 -8.258 0.658 -3.462 1.00 0.00 N ATOM 260 CA GLU A 22 -9.715 0.676 -3.511 1.00 0.00 C ATOM 261 C GLU A 22 -10.276 -0.743 -3.528 1.00 0.00 C ATOM 262 O GLU A 22 -11.370 -0.996 -3.021 1.00 0.00 O ATOM 263 CB GLU A 22 -10.196 1.442 -4.746 1.00 0.00 C ATOM 264 CG GLU A 22 -9.540 2.802 -4.913 1.00 0.00 C ATOM 265 CD GLU A 22 -10.396 3.769 -5.708 1.00 0.00 C ATOM 266 OE1 GLU A 22 -10.492 3.600 -6.941 1.00 0.00 O ATOM 267 OE2 GLU A 22 -10.969 4.694 -5.095 1.00 0.00 O ATOM 0 H GLU A 22 -7.811 0.339 -4.321 1.00 0.00 H new ATOM 0 HA GLU A 22 -10.078 1.181 -2.615 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -10.000 0.842 -5.634 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.276 1.574 -4.683 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -9.337 3.226 -3.930 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -8.579 2.679 -5.412 1.00 0.00 H new ATOM 274 N HIS A 23 -9.521 -1.665 -4.115 1.00 0.00 N ATOM 275 CA HIS A 23 -9.942 -3.059 -4.199 1.00 0.00 C ATOM 276 C HIS A 23 -8.819 -3.934 -4.747 1.00 0.00 C ATOM 277 O HIS A 23 -7.835 -3.432 -5.288 1.00 0.00 O ATOM 278 CB HIS A 23 -11.182 -3.187 -5.084 1.00 0.00 C ATOM 279 CG HIS A 23 -10.910 -2.938 -6.535 1.00 0.00 C ATOM 280 ND1 HIS A 23 -11.332 -3.787 -7.536 1.00 0.00 N ATOM 281 CD2 HIS A 23 -10.257 -1.926 -7.153 1.00 0.00 C ATOM 282 CE1 HIS A 23 -10.947 -3.310 -8.707 1.00 0.00 C ATOM 283 NE2 HIS A 23 -10.294 -2.180 -8.502 1.00 0.00 N ATOM 0 H HIS A 23 -8.614 -1.472 -4.540 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.186 -3.400 -3.193 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.600 -4.187 -4.967 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -11.939 -2.483 -4.739 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -9.793 -1.076 -6.674 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -11.134 -3.766 -9.668 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -9.884 -1.592 -9.228 1.00 0.00 H new ATOM 292 N GLY A 24 -8.973 -5.247 -4.603 1.00 0.00 N ATOM 293 CA GLY A 24 -7.965 -6.170 -5.088 1.00 0.00 C ATOM 294 C GLY A 24 -8.556 -7.493 -5.534 1.00 0.00 C ATOM 295 O GLY A 24 -9.704 -7.807 -5.218 1.00 0.00 O ATOM 0 H GLY A 24 -9.779 -5.687 -4.159 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.431 -5.715 -5.922 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -7.233 -6.350 -4.301 1.00 0.00 H new ATOM 299 N LYS A 25 -7.771 -8.271 -6.272 1.00 0.00 N ATOM 300 CA LYS A 25 -8.223 -9.567 -6.764 1.00 0.00 C ATOM 301 C LYS A 25 -7.107 -10.603 -6.669 1.00 0.00 C ATOM 302 O LYS A 25 -5.965 -10.336 -7.040 1.00 0.00 O ATOM 303 CB LYS A 25 -8.701 -9.448 -8.213 1.00 0.00 C ATOM 304 CG LYS A 25 -9.747 -10.480 -8.595 1.00 0.00 C ATOM 305 CD LYS A 25 -10.036 -10.456 -10.086 1.00 0.00 C ATOM 306 CE LYS A 25 -10.497 -11.816 -10.587 1.00 0.00 C ATOM 307 NZ LYS A 25 -10.832 -11.788 -12.038 1.00 0.00 N ATOM 0 H LYS A 25 -6.818 -8.026 -6.542 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.054 -9.895 -6.140 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.112 -8.451 -8.370 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.844 -9.548 -8.879 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.402 -11.473 -8.306 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.667 -10.289 -8.042 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.803 -9.710 -10.297 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.139 -10.153 -10.627 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.714 -12.553 -10.409 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.371 -12.135 -10.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.142 -12.733 -12.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.597 -11.103 -12.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.992 -11.508 -12.583 1.00 0.00 H new ATOM 321 N VAL A 26 -7.447 -11.788 -6.170 1.00 0.00 N ATOM 322 CA VAL A 26 -6.475 -12.865 -6.030 1.00 0.00 C ATOM 323 C VAL A 26 -5.759 -13.135 -7.348 1.00 0.00 C ATOM 324 O VAL A 26 -6.342 -13.685 -8.282 1.00 0.00 O ATOM 325 CB VAL A 26 -7.144 -14.165 -5.546 1.00 0.00 C ATOM 326 CG1 VAL A 26 -6.153 -15.319 -5.574 1.00 0.00 C ATOM 327 CG2 VAL A 26 -7.720 -13.980 -4.150 1.00 0.00 C ATOM 0 H VAL A 26 -8.388 -12.026 -5.856 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.748 -12.540 -5.286 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.963 -14.405 -6.224 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.644 -16.229 -5.229 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.793 -15.465 -6.593 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.311 -15.091 -4.921 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.189 -14.908 -3.824 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.920 -13.715 -3.459 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.464 -13.184 -4.166 1.00 0.00 H new ATOM 337 N GLY A 27 -4.490 -12.745 -7.417 1.00 0.00 N ATOM 338 CA GLY A 27 -3.714 -12.954 -8.626 1.00 0.00 C ATOM 339 C GLY A 27 -3.450 -11.663 -9.375 1.00 0.00 C ATOM 340 O GLY A 27 -2.442 -11.537 -10.071 1.00 0.00 O ATOM 0 H GLY A 27 -3.985 -12.288 -6.658 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.764 -13.422 -8.368 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.244 -13.648 -9.279 1.00 0.00 H new ATOM 344 N GLU A 28 -4.358 -10.702 -9.234 1.00 0.00 N ATOM 345 CA GLU A 28 -4.218 -9.415 -9.907 1.00 0.00 C ATOM 346 C GLU A 28 -3.087 -8.599 -9.288 1.00 0.00 C ATOM 347 O GLU A 28 -2.390 -9.066 -8.388 1.00 0.00 O ATOM 348 CB GLU A 28 -5.529 -8.630 -9.831 1.00 0.00 C ATOM 349 CG GLU A 28 -6.517 -8.990 -10.928 1.00 0.00 C ATOM 350 CD GLU A 28 -6.035 -8.579 -12.305 1.00 0.00 C ATOM 351 OE1 GLU A 28 -5.292 -7.579 -12.399 1.00 0.00 O ATOM 352 OE2 GLU A 28 -6.400 -9.256 -13.289 1.00 0.00 O ATOM 0 H GLU A 28 -5.197 -10.790 -8.661 1.00 0.00 H new ATOM 0 HA GLU A 28 -3.977 -9.604 -10.953 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.994 -8.808 -8.862 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -5.309 -7.564 -9.887 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.693 -10.066 -10.915 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.473 -8.508 -10.723 1.00 0.00 H new ATOM 359 N ALA A 29 -2.911 -7.376 -9.779 1.00 0.00 N ATOM 360 CA ALA A 29 -1.866 -6.494 -9.275 1.00 0.00 C ATOM 361 C ALA A 29 -2.445 -5.153 -8.835 1.00 0.00 C ATOM 362 O ALA A 29 -3.051 -4.437 -9.630 1.00 0.00 O ATOM 363 CB ALA A 29 -0.794 -6.285 -10.335 1.00 0.00 C ATOM 0 H ALA A 29 -3.479 -6.974 -10.525 1.00 0.00 H new ATOM 0 HA ALA A 29 -1.413 -6.969 -8.405 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -0.020 -5.624 -9.944 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -0.352 -7.245 -10.599 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.242 -5.835 -11.221 1.00 0.00 H new ATOM 369 N GLY A 30 -2.255 -4.821 -7.561 1.00 0.00 N ATOM 370 CA GLY A 30 -2.766 -3.568 -7.037 1.00 0.00 C ATOM 371 C GLY A 30 -1.909 -2.382 -7.433 1.00 0.00 C ATOM 372 O GLY A 30 -0.895 -2.098 -6.794 1.00 0.00 O ATOM 0 H GLY A 30 -1.756 -5.398 -6.883 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -3.783 -3.414 -7.398 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -2.819 -3.627 -5.950 1.00 0.00 H new ATOM 376 N LEU A 31 -2.314 -1.688 -8.491 1.00 0.00 N ATOM 377 CA LEU A 31 -1.575 -0.526 -8.972 1.00 0.00 C ATOM 378 C LEU A 31 -1.585 0.594 -7.937 1.00 0.00 C ATOM 379 O LEU A 31 -2.645 1.092 -7.556 1.00 0.00 O ATOM 380 CB LEU A 31 -2.174 -0.025 -10.288 1.00 0.00 C ATOM 381 CG LEU A 31 -2.124 -1.002 -11.463 1.00 0.00 C ATOM 382 CD1 LEU A 31 -2.962 -0.486 -12.622 1.00 0.00 C ATOM 383 CD2 LEU A 31 -0.686 -1.233 -11.904 1.00 0.00 C ATOM 0 H LEU A 31 -3.150 -1.910 -9.032 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.542 -0.829 -9.142 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -3.215 0.246 -10.111 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.652 0.887 -10.577 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.540 -1.955 -11.136 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.914 -1.194 -13.449 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.997 -0.373 -12.300 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.576 0.480 -12.949 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.670 -1.931 -12.741 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.243 -0.286 -12.213 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.113 -1.648 -11.075 1.00 0.00 H new ATOM 395 N LEU A 32 -0.398 0.986 -7.486 1.00 0.00 N ATOM 396 CA LEU A 32 -0.270 2.050 -6.496 1.00 0.00 C ATOM 397 C LEU A 32 0.782 3.068 -6.924 1.00 0.00 C ATOM 398 O LEU A 32 1.877 2.702 -7.351 1.00 0.00 O ATOM 399 CB LEU A 32 0.098 1.462 -5.132 1.00 0.00 C ATOM 400 CG LEU A 32 -0.855 0.402 -4.579 1.00 0.00 C ATOM 401 CD1 LEU A 32 -0.369 -0.100 -3.228 1.00 0.00 C ATOM 402 CD2 LEU A 32 -2.266 0.959 -4.468 1.00 0.00 C ATOM 0 H LEU A 32 0.489 0.583 -7.790 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.231 2.559 -6.419 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.094 1.024 -5.204 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.160 2.278 -4.412 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.873 -0.440 -5.271 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.060 -0.854 -2.850 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.623 -0.539 -3.338 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.321 0.733 -2.526 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.930 0.191 -4.073 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -2.266 1.819 -3.798 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.614 1.267 -5.454 1.00 0.00 H new ATOM 414 N SER A 33 0.443 4.348 -6.804 1.00 0.00 N ATOM 415 CA SER A 33 1.357 5.419 -7.180 1.00 0.00 C ATOM 416 C SER A 33 1.625 6.345 -5.997 1.00 0.00 C ATOM 417 O SER A 33 0.701 6.761 -5.297 1.00 0.00 O ATOM 418 CB SER A 33 0.783 6.222 -8.349 1.00 0.00 C ATOM 419 OG SER A 33 1.817 6.775 -9.144 1.00 0.00 O ATOM 0 H SER A 33 -0.458 4.668 -6.449 1.00 0.00 H new ATOM 0 HA SER A 33 2.300 4.966 -7.487 1.00 0.00 H new ATOM 0 HB2 SER A 33 0.153 5.578 -8.963 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.146 7.020 -7.968 1.00 0.00 H new ATOM 0 HG SER A 33 1.424 7.282 -9.885 1.00 0.00 H new ATOM 425 N VAL A 34 2.897 6.663 -5.779 1.00 0.00 N ATOM 426 CA VAL A 34 3.289 7.540 -4.681 1.00 0.00 C ATOM 427 C VAL A 34 3.969 8.801 -5.202 1.00 0.00 C ATOM 428 O VAL A 34 5.049 8.738 -5.790 1.00 0.00 O ATOM 429 CB VAL A 34 4.238 6.824 -3.703 1.00 0.00 C ATOM 430 CG1 VAL A 34 4.676 7.770 -2.595 1.00 0.00 C ATOM 431 CG2 VAL A 34 3.571 5.585 -3.124 1.00 0.00 C ATOM 0 H VAL A 34 3.674 6.327 -6.348 1.00 0.00 H new ATOM 0 HA VAL A 34 2.376 7.815 -4.153 1.00 0.00 H new ATOM 0 HB VAL A 34 5.126 6.508 -4.251 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.346 7.246 -1.913 1.00 0.00 H new ATOM 0 HG12 VAL A 34 5.195 8.624 -3.030 1.00 0.00 H new ATOM 0 HG13 VAL A 34 3.801 8.118 -2.047 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.256 5.091 -2.435 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.666 5.875 -2.590 1.00 0.00 H new ATOM 0 HG23 VAL A 34 3.312 4.900 -3.931 1.00 0.00 H new ATOM 441 N ASP A 35 3.331 9.945 -4.981 1.00 0.00 N ATOM 442 CA ASP A 35 3.876 11.222 -5.426 1.00 0.00 C ATOM 443 C ASP A 35 4.624 11.919 -4.293 1.00 0.00 C ATOM 444 O ASP A 35 4.015 12.395 -3.335 1.00 0.00 O ATOM 445 CB ASP A 35 2.755 12.125 -5.945 1.00 0.00 C ATOM 446 CG ASP A 35 2.386 11.821 -7.383 1.00 0.00 C ATOM 447 OD1 ASP A 35 2.161 10.634 -7.699 1.00 0.00 O ATOM 448 OD2 ASP A 35 2.322 12.770 -8.193 1.00 0.00 O ATOM 0 H ASP A 35 2.436 10.014 -4.496 1.00 0.00 H new ATOM 0 HA ASP A 35 4.580 11.027 -6.235 1.00 0.00 H new ATOM 0 HB2 ASP A 35 1.874 12.005 -5.314 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.065 13.167 -5.865 1.00 0.00 H new ATOM 453 N CYS A 36 5.946 11.972 -4.410 1.00 0.00 N ATOM 454 CA CYS A 36 6.778 12.609 -3.395 1.00 0.00 C ATOM 455 C CYS A 36 7.253 13.980 -3.863 1.00 0.00 C ATOM 456 O CYS A 36 7.990 14.092 -4.842 1.00 0.00 O ATOM 457 CB CYS A 36 7.980 11.724 -3.063 1.00 0.00 C ATOM 458 SG CYS A 36 9.370 12.614 -2.323 1.00 0.00 S ATOM 0 H CYS A 36 6.465 11.582 -5.197 1.00 0.00 H new ATOM 0 HA CYS A 36 6.175 12.742 -2.497 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.661 10.937 -2.379 1.00 0.00 H new ATOM 0 HB3 CYS A 36 8.320 11.234 -3.975 1.00 0.00 H new ATOM 0 HG CYS A 36 9.688 13.625 -3.076 1.00 0.00 H new ATOM 464 N SER A 37 6.825 15.022 -3.157 1.00 0.00 N ATOM 465 CA SER A 37 7.202 16.387 -3.503 1.00 0.00 C ATOM 466 C SER A 37 8.068 17.005 -2.410 1.00 0.00 C ATOM 467 O SER A 37 9.201 17.415 -2.659 1.00 0.00 O ATOM 468 CB SER A 37 5.953 17.243 -3.726 1.00 0.00 C ATOM 469 OG SER A 37 5.411 17.028 -5.017 1.00 0.00 O ATOM 0 H SER A 37 6.217 14.946 -2.342 1.00 0.00 H new ATOM 0 HA SER A 37 7.781 16.355 -4.426 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.205 17.004 -2.970 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.204 18.297 -3.605 1.00 0.00 H new ATOM 0 HG SER A 37 4.613 17.585 -5.134 1.00 0.00 H new ATOM 475 N GLU A 38 7.525 17.069 -1.198 1.00 0.00 N ATOM 476 CA GLU A 38 8.247 17.638 -0.067 1.00 0.00 C ATOM 477 C GLU A 38 8.388 16.617 1.058 1.00 0.00 C ATOM 478 O GLU A 38 8.504 16.979 2.229 1.00 0.00 O ATOM 479 CB GLU A 38 7.529 18.887 0.450 1.00 0.00 C ATOM 480 CG GLU A 38 7.956 20.167 -0.249 1.00 0.00 C ATOM 481 CD GLU A 38 9.297 20.679 0.239 1.00 0.00 C ATOM 482 OE1 GLU A 38 10.170 19.846 0.560 1.00 0.00 O ATOM 483 OE2 GLU A 38 9.473 21.914 0.299 1.00 0.00 O ATOM 0 H GLU A 38 6.588 16.734 -0.975 1.00 0.00 H new ATOM 0 HA GLU A 38 9.244 17.916 -0.409 1.00 0.00 H new ATOM 0 HB2 GLU A 38 6.454 18.756 0.325 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.716 18.987 1.519 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.008 19.990 -1.323 1.00 0.00 H new ATOM 0 HG3 GLU A 38 7.198 20.934 -0.089 1.00 0.00 H new ATOM 490 N ALA A 39 8.375 15.338 0.694 1.00 0.00 N ATOM 491 CA ALA A 39 8.502 14.264 1.671 1.00 0.00 C ATOM 492 C ALA A 39 9.931 14.164 2.194 1.00 0.00 C ATOM 493 O ALA A 39 10.228 13.346 3.064 1.00 0.00 O ATOM 494 CB ALA A 39 8.067 12.941 1.060 1.00 0.00 C ATOM 0 H ALA A 39 8.278 15.021 -0.271 1.00 0.00 H new ATOM 0 HA ALA A 39 7.850 14.494 2.514 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.167 12.148 1.801 1.00 0.00 H new ATOM 0 HB2 ALA A 39 7.027 13.012 0.742 1.00 0.00 H new ATOM 0 HB3 ALA A 39 8.695 12.714 0.198 1.00 0.00 H new ATOM 500 N GLY A 40 10.813 15.002 1.658 1.00 0.00 N ATOM 501 CA GLY A 40 12.200 14.991 2.082 1.00 0.00 C ATOM 502 C GLY A 40 12.866 13.649 1.851 1.00 0.00 C ATOM 503 O GLY A 40 12.445 12.861 1.004 1.00 0.00 O ATOM 0 H GLY A 40 10.591 15.689 0.937 1.00 0.00 H new ATOM 0 HA2 GLY A 40 12.748 15.763 1.542 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.255 15.243 3.141 1.00 0.00 H new ATOM 507 N PRO A 41 13.933 13.373 2.616 1.00 0.00 N ATOM 508 CA PRO A 41 14.682 12.118 2.507 1.00 0.00 C ATOM 509 C PRO A 41 13.885 10.922 3.017 1.00 0.00 C ATOM 510 O PRO A 41 12.688 11.027 3.279 1.00 0.00 O ATOM 511 CB PRO A 41 15.909 12.359 3.391 1.00 0.00 C ATOM 512 CG PRO A 41 15.471 13.389 4.374 1.00 0.00 C ATOM 513 CD PRO A 41 14.490 14.266 3.646 1.00 0.00 C ATOM 0 HA PRO A 41 14.926 11.877 1.472 1.00 0.00 H new ATOM 0 HB2 PRO A 41 16.223 11.443 3.891 1.00 0.00 H new ATOM 0 HB3 PRO A 41 16.758 12.708 2.803 1.00 0.00 H new ATOM 0 HG2 PRO A 41 15.008 12.925 5.245 1.00 0.00 H new ATOM 0 HG3 PRO A 41 16.320 13.969 4.735 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.715 14.642 4.314 1.00 0.00 H new ATOM 0 HD3 PRO A 41 14.978 15.134 3.204 1.00 0.00 H new ATOM 521 N GLY A 42 14.559 9.784 3.156 1.00 0.00 N ATOM 522 CA GLY A 42 13.897 8.584 3.635 1.00 0.00 C ATOM 523 C GLY A 42 13.470 7.668 2.505 1.00 0.00 C ATOM 524 O GLY A 42 13.149 8.129 1.411 1.00 0.00 O ATOM 0 H GLY A 42 15.551 9.672 2.946 1.00 0.00 H new ATOM 0 HA2 GLY A 42 14.569 8.044 4.303 1.00 0.00 H new ATOM 0 HA3 GLY A 42 13.022 8.865 4.222 1.00 0.00 H new ATOM 528 N ALA A 43 13.467 6.366 2.771 1.00 0.00 N ATOM 529 CA ALA A 43 13.075 5.383 1.768 1.00 0.00 C ATOM 530 C ALA A 43 11.635 4.928 1.978 1.00 0.00 C ATOM 531 O ALA A 43 11.137 4.910 3.104 1.00 0.00 O ATOM 532 CB ALA A 43 14.018 4.189 1.803 1.00 0.00 C ATOM 0 H ALA A 43 13.731 5.967 3.672 1.00 0.00 H new ATOM 0 HA ALA A 43 13.140 5.855 0.788 1.00 0.00 H new ATOM 0 HB1 ALA A 43 13.714 3.463 1.049 1.00 0.00 H new ATOM 0 HB2 ALA A 43 15.035 4.522 1.596 1.00 0.00 H new ATOM 0 HB3 ALA A 43 13.982 3.725 2.789 1.00 0.00 H new ATOM 538 N LEU A 44 10.970 4.562 0.887 1.00 0.00 N ATOM 539 CA LEU A 44 9.586 4.108 0.952 1.00 0.00 C ATOM 540 C LEU A 44 9.516 2.588 1.056 1.00 0.00 C ATOM 541 O LEU A 44 10.294 1.876 0.422 1.00 0.00 O ATOM 542 CB LEU A 44 8.814 4.582 -0.281 1.00 0.00 C ATOM 543 CG LEU A 44 7.558 3.786 -0.635 1.00 0.00 C ATOM 544 CD1 LEU A 44 6.422 4.132 0.314 1.00 0.00 C ATOM 545 CD2 LEU A 44 7.150 4.047 -2.077 1.00 0.00 C ATOM 0 H LEU A 44 11.367 4.571 -0.052 1.00 0.00 H new ATOM 0 HA LEU A 44 9.131 4.537 1.845 1.00 0.00 H new ATOM 0 HB2 LEU A 44 8.529 5.623 -0.128 1.00 0.00 H new ATOM 0 HB3 LEU A 44 9.488 4.559 -1.138 1.00 0.00 H new ATOM 0 HG LEU A 44 7.782 2.724 -0.529 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.536 3.556 0.047 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.716 3.892 1.336 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.198 5.196 0.241 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.254 3.472 -2.311 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.945 5.109 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.958 3.747 -2.744 1.00 0.00 H new ATOM 557 N GLY A 45 8.576 2.097 1.857 1.00 0.00 N ATOM 558 CA GLY A 45 8.420 0.664 2.028 1.00 0.00 C ATOM 559 C GLY A 45 6.997 0.273 2.376 1.00 0.00 C ATOM 560 O GLY A 45 6.399 0.833 3.296 1.00 0.00 O ATOM 0 H GLY A 45 7.919 2.666 2.391 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.719 0.157 1.110 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.091 0.320 2.815 1.00 0.00 H new ATOM 564 N LEU A 46 6.453 -0.690 1.641 1.00 0.00 N ATOM 565 CA LEU A 46 5.091 -1.155 1.875 1.00 0.00 C ATOM 566 C LEU A 46 5.083 -2.612 2.329 1.00 0.00 C ATOM 567 O LEU A 46 5.986 -3.379 1.998 1.00 0.00 O ATOM 568 CB LEU A 46 4.252 -1.000 0.606 1.00 0.00 C ATOM 569 CG LEU A 46 2.829 -1.558 0.669 1.00 0.00 C ATOM 570 CD1 LEU A 46 1.927 -0.631 1.468 1.00 0.00 C ATOM 571 CD2 LEU A 46 2.276 -1.766 -0.733 1.00 0.00 C ATOM 0 H LEU A 46 6.935 -1.164 0.877 1.00 0.00 H new ATOM 0 HA LEU A 46 4.657 -0.544 2.667 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.194 0.060 0.360 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.777 -1.490 -0.214 1.00 0.00 H new ATOM 0 HG LEU A 46 2.860 -2.524 1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.919 -1.044 1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 46 2.313 -0.533 2.483 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.901 0.350 0.993 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.263 -2.163 -0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.260 -0.813 -1.263 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.909 -2.470 -1.273 1.00 0.00 H new ATOM 583 N GLU A 47 4.056 -2.985 3.086 1.00 0.00 N ATOM 584 CA GLU A 47 3.931 -4.350 3.583 1.00 0.00 C ATOM 585 C GLU A 47 2.476 -4.810 3.549 1.00 0.00 C ATOM 586 O GLU A 47 1.662 -4.391 4.372 1.00 0.00 O ATOM 587 CB GLU A 47 4.475 -4.449 5.010 1.00 0.00 C ATOM 588 CG GLU A 47 4.648 -5.878 5.498 1.00 0.00 C ATOM 589 CD GLU A 47 5.562 -5.976 6.703 1.00 0.00 C ATOM 590 OE1 GLU A 47 6.793 -5.865 6.526 1.00 0.00 O ATOM 591 OE2 GLU A 47 5.046 -6.164 7.825 1.00 0.00 O ATOM 0 H GLU A 47 3.299 -2.362 3.368 1.00 0.00 H new ATOM 0 HA GLU A 47 4.516 -5.001 2.933 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.437 -3.938 5.059 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.800 -3.923 5.685 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.672 -6.292 5.752 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.052 -6.488 4.690 1.00 0.00 H new ATOM 598 N ALA A 48 2.157 -5.674 2.591 1.00 0.00 N ATOM 599 CA ALA A 48 0.802 -6.192 2.450 1.00 0.00 C ATOM 600 C ALA A 48 0.675 -7.575 3.079 1.00 0.00 C ATOM 601 O ALA A 48 1.456 -8.479 2.778 1.00 0.00 O ATOM 602 CB ALA A 48 0.405 -6.239 0.982 1.00 0.00 C ATOM 0 H ALA A 48 2.819 -6.030 1.901 1.00 0.00 H new ATOM 0 HA ALA A 48 0.125 -5.519 2.976 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -0.609 -6.628 0.892 1.00 0.00 H new ATOM 0 HB2 ALA A 48 0.447 -5.234 0.561 1.00 0.00 H new ATOM 0 HB3 ALA A 48 1.092 -6.889 0.440 1.00 0.00 H new ATOM 608 N VAL A 49 -0.313 -7.734 3.954 1.00 0.00 N ATOM 609 CA VAL A 49 -0.542 -9.008 4.625 1.00 0.00 C ATOM 610 C VAL A 49 -2.030 -9.249 4.853 1.00 0.00 C ATOM 611 O VAL A 49 -2.797 -8.310 5.062 1.00 0.00 O ATOM 612 CB VAL A 49 0.190 -9.068 5.979 1.00 0.00 C ATOM 613 CG1 VAL A 49 -0.353 -10.207 6.829 1.00 0.00 C ATOM 614 CG2 VAL A 49 1.689 -9.217 5.769 1.00 0.00 C ATOM 0 H VAL A 49 -0.968 -6.996 4.215 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.147 -9.786 3.972 1.00 0.00 H new ATOM 0 HB VAL A 49 0.012 -8.133 6.510 1.00 0.00 H new ATOM 0 HG11 VAL A 49 0.176 -10.234 7.782 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -1.417 -10.052 7.009 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -0.208 -11.152 6.306 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.190 -9.258 6.736 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.890 -10.136 5.218 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.063 -8.365 5.202 1.00 0.00 H new ATOM 624 N SER A 50 -2.432 -10.516 4.810 1.00 0.00 N ATOM 625 CA SER A 50 -3.829 -10.881 5.008 1.00 0.00 C ATOM 626 C SER A 50 -4.127 -11.109 6.487 1.00 0.00 C ATOM 627 O SER A 50 -3.223 -11.373 7.280 1.00 0.00 O ATOM 628 CB SER A 50 -4.167 -12.141 4.208 1.00 0.00 C ATOM 629 OG SER A 50 -5.543 -12.461 4.318 1.00 0.00 O ATOM 0 H SER A 50 -1.810 -11.306 4.640 1.00 0.00 H new ATOM 0 HA SER A 50 -4.448 -10.057 4.654 1.00 0.00 H new ATOM 0 HB2 SER A 50 -3.908 -11.990 3.160 1.00 0.00 H new ATOM 0 HB3 SER A 50 -3.566 -12.976 4.568 1.00 0.00 H new ATOM 0 HG SER A 50 -5.734 -13.269 3.797 1.00 0.00 H new ATOM 635 N ASP A 51 -5.400 -11.005 6.850 1.00 0.00 N ATOM 636 CA ASP A 51 -5.819 -11.200 8.233 1.00 0.00 C ATOM 637 C ASP A 51 -5.305 -12.531 8.774 1.00 0.00 C ATOM 638 O ASP A 51 -5.281 -12.752 9.985 1.00 0.00 O ATOM 639 CB ASP A 51 -7.344 -11.148 8.339 1.00 0.00 C ATOM 640 CG ASP A 51 -8.029 -11.771 7.139 1.00 0.00 C ATOM 641 OD1 ASP A 51 -7.870 -12.992 6.932 1.00 0.00 O ATOM 642 OD2 ASP A 51 -8.726 -11.037 6.407 1.00 0.00 O ATOM 0 H ASP A 51 -6.160 -10.787 6.206 1.00 0.00 H new ATOM 0 HA ASP A 51 -5.393 -10.395 8.832 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -7.660 -11.667 9.244 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -7.663 -10.111 8.438 1.00 0.00 H new ATOM 647 N SER A 52 -4.895 -13.413 7.868 1.00 0.00 N ATOM 648 CA SER A 52 -4.386 -14.724 8.254 1.00 0.00 C ATOM 649 C SER A 52 -2.863 -14.710 8.345 1.00 0.00 C ATOM 650 O SER A 52 -2.213 -15.746 8.211 1.00 0.00 O ATOM 651 CB SER A 52 -4.839 -15.786 7.250 1.00 0.00 C ATOM 652 OG SER A 52 -4.512 -17.088 7.703 1.00 0.00 O ATOM 0 H SER A 52 -4.905 -13.244 6.862 1.00 0.00 H new ATOM 0 HA SER A 52 -4.789 -14.968 9.237 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.916 -15.710 7.097 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.366 -15.604 6.285 1.00 0.00 H new ATOM 0 HG SER A 52 -3.593 -17.095 8.043 1.00 0.00 H new ATOM 658 N GLY A 53 -2.301 -13.527 8.573 1.00 0.00 N ATOM 659 CA GLY A 53 -0.859 -13.399 8.678 1.00 0.00 C ATOM 660 C GLY A 53 -0.140 -13.931 7.454 1.00 0.00 C ATOM 661 O GLY A 53 0.808 -14.709 7.571 1.00 0.00 O ATOM 0 H GLY A 53 -2.818 -12.655 8.687 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -0.600 -12.350 8.821 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -0.513 -13.936 9.561 1.00 0.00 H new ATOM 665 N THR A 54 -0.590 -13.513 6.276 1.00 0.00 N ATOM 666 CA THR A 54 0.015 -13.954 5.025 1.00 0.00 C ATOM 667 C THR A 54 0.449 -12.766 4.175 1.00 0.00 C ATOM 668 O THR A 54 -0.369 -12.136 3.506 1.00 0.00 O ATOM 669 CB THR A 54 -0.956 -14.827 4.209 1.00 0.00 C ATOM 670 OG1 THR A 54 -1.587 -15.788 5.063 1.00 0.00 O ATOM 671 CG2 THR A 54 -0.225 -15.544 3.084 1.00 0.00 C ATOM 0 H THR A 54 -1.372 -12.869 6.161 1.00 0.00 H new ATOM 0 HA THR A 54 0.891 -14.547 5.289 1.00 0.00 H new ATOM 0 HB THR A 54 -1.714 -14.177 3.772 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.204 -16.338 4.537 1.00 0.00 H new ATOM 0 HG21 THR A 54 -0.932 -16.154 2.522 1.00 0.00 H new ATOM 0 HG22 THR A 54 0.229 -14.809 2.419 1.00 0.00 H new ATOM 0 HG23 THR A 54 0.552 -16.183 3.504 1.00 0.00 H new ATOM 679 N LYS A 55 1.743 -12.465 4.205 1.00 0.00 N ATOM 680 CA LYS A 55 2.288 -11.353 3.435 1.00 0.00 C ATOM 681 C LYS A 55 2.237 -11.650 1.940 1.00 0.00 C ATOM 682 O LYS A 55 2.465 -12.781 1.514 1.00 0.00 O ATOM 683 CB LYS A 55 3.731 -11.070 3.861 1.00 0.00 C ATOM 684 CG LYS A 55 4.638 -12.285 3.781 1.00 0.00 C ATOM 685 CD LYS A 55 5.305 -12.395 2.421 1.00 0.00 C ATOM 686 CE LYS A 55 6.663 -13.074 2.519 1.00 0.00 C ATOM 687 NZ LYS A 55 7.664 -12.215 3.209 1.00 0.00 N ATOM 0 H LYS A 55 2.434 -12.976 4.755 1.00 0.00 H new ATOM 0 HA LYS A 55 1.677 -10.472 3.633 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.139 -10.280 3.230 1.00 0.00 H new ATOM 0 HB3 LYS A 55 3.732 -10.693 4.884 1.00 0.00 H new ATOM 0 HG2 LYS A 55 5.401 -12.222 4.557 1.00 0.00 H new ATOM 0 HG3 LYS A 55 4.058 -13.187 3.976 1.00 0.00 H new ATOM 0 HD2 LYS A 55 4.663 -12.959 1.744 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.425 -11.400 1.992 1.00 0.00 H new ATOM 0 HE2 LYS A 55 6.560 -14.016 3.058 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.021 -13.317 1.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 8.623 -12.527 2.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 7.532 -11.226 2.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 7.537 -12.292 4.238 1.00 0.00 H new ATOM 701 N ALA A 56 1.938 -10.625 1.148 1.00 0.00 N ATOM 702 CA ALA A 56 1.861 -10.776 -0.300 1.00 0.00 C ATOM 703 C ALA A 56 3.139 -10.285 -0.972 1.00 0.00 C ATOM 704 O ALA A 56 4.012 -9.711 -0.321 1.00 0.00 O ATOM 705 CB ALA A 56 0.655 -10.027 -0.845 1.00 0.00 C ATOM 0 H ALA A 56 1.745 -9.682 1.485 1.00 0.00 H new ATOM 0 HA ALA A 56 1.748 -11.837 -0.524 1.00 0.00 H new ATOM 0 HB1 ALA A 56 0.610 -10.148 -1.927 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -0.255 -10.427 -0.397 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.744 -8.968 -0.602 1.00 0.00 H new ATOM 711 N GLU A 57 3.242 -10.515 -2.277 1.00 0.00 N ATOM 712 CA GLU A 57 4.415 -10.097 -3.036 1.00 0.00 C ATOM 713 C GLU A 57 4.297 -8.635 -3.458 1.00 0.00 C ATOM 714 O GLU A 57 3.436 -8.277 -4.262 1.00 0.00 O ATOM 715 CB GLU A 57 4.595 -10.983 -4.270 1.00 0.00 C ATOM 716 CG GLU A 57 5.546 -10.403 -5.302 1.00 0.00 C ATOM 717 CD GLU A 57 6.238 -11.473 -6.124 1.00 0.00 C ATOM 718 OE1 GLU A 57 5.534 -12.231 -6.825 1.00 0.00 O ATOM 719 OE2 GLU A 57 7.483 -11.554 -6.067 1.00 0.00 O ATOM 0 H GLU A 57 2.528 -10.988 -2.831 1.00 0.00 H new ATOM 0 HA GLU A 57 5.289 -10.202 -2.393 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.965 -11.959 -3.955 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.623 -11.146 -4.735 1.00 0.00 H new ATOM 0 HG2 GLU A 57 4.994 -9.740 -5.967 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.297 -9.795 -4.797 1.00 0.00 H new ATOM 726 N VAL A 58 5.168 -7.794 -2.910 1.00 0.00 N ATOM 727 CA VAL A 58 5.163 -6.372 -3.230 1.00 0.00 C ATOM 728 C VAL A 58 6.427 -5.973 -3.984 1.00 0.00 C ATOM 729 O VAL A 58 7.485 -6.577 -3.806 1.00 0.00 O ATOM 730 CB VAL A 58 5.044 -5.511 -1.958 1.00 0.00 C ATOM 731 CG1 VAL A 58 5.029 -4.032 -2.314 1.00 0.00 C ATOM 732 CG2 VAL A 58 3.798 -5.892 -1.172 1.00 0.00 C ATOM 0 H VAL A 58 5.886 -8.073 -2.242 1.00 0.00 H new ATOM 0 HA VAL A 58 4.294 -6.194 -3.864 1.00 0.00 H new ATOM 0 HB VAL A 58 5.914 -5.700 -1.329 1.00 0.00 H new ATOM 0 HG11 VAL A 58 4.944 -3.439 -1.403 1.00 0.00 H new ATOM 0 HG12 VAL A 58 5.953 -3.773 -2.831 1.00 0.00 H new ATOM 0 HG13 VAL A 58 4.179 -3.823 -2.963 1.00 0.00 H new ATOM 0 HG21 VAL A 58 3.730 -5.274 -0.277 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.915 -5.733 -1.791 1.00 0.00 H new ATOM 0 HG23 VAL A 58 3.856 -6.942 -0.885 1.00 0.00 H new ATOM 742 N SER A 59 6.310 -4.952 -4.826 1.00 0.00 N ATOM 743 CA SER A 59 7.442 -4.474 -5.610 1.00 0.00 C ATOM 744 C SER A 59 7.395 -2.956 -5.764 1.00 0.00 C ATOM 745 O SER A 59 6.328 -2.375 -5.962 1.00 0.00 O ATOM 746 CB SER A 59 7.451 -5.137 -6.989 1.00 0.00 C ATOM 747 OG SER A 59 8.594 -4.751 -7.733 1.00 0.00 O ATOM 0 H SER A 59 5.442 -4.440 -4.983 1.00 0.00 H new ATOM 0 HA SER A 59 8.357 -4.740 -5.080 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.436 -6.221 -6.875 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.548 -4.862 -7.534 1.00 0.00 H new ATOM 0 HG SER A 59 8.577 -5.189 -8.609 1.00 0.00 H new ATOM 753 N ILE A 60 8.559 -2.322 -5.670 1.00 0.00 N ATOM 754 CA ILE A 60 8.651 -0.873 -5.799 1.00 0.00 C ATOM 755 C ILE A 60 9.518 -0.482 -6.991 1.00 0.00 C ATOM 756 O ILE A 60 10.618 -1.003 -7.168 1.00 0.00 O ATOM 757 CB ILE A 60 9.230 -0.230 -4.525 1.00 0.00 C ATOM 758 CG1 ILE A 60 8.367 -0.584 -3.312 1.00 0.00 C ATOM 759 CG2 ILE A 60 9.328 1.279 -4.691 1.00 0.00 C ATOM 760 CD1 ILE A 60 9.102 -0.472 -1.994 1.00 0.00 C ATOM 0 H ILE A 60 9.451 -2.789 -5.505 1.00 0.00 H new ATOM 0 HA ILE A 60 7.637 -0.505 -5.953 1.00 0.00 H new ATOM 0 HB ILE A 60 10.233 -0.623 -4.360 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.497 0.073 -3.291 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.995 -1.602 -3.426 1.00 0.00 H new ATOM 0 HG21 ILE A 60 9.739 1.719 -3.782 1.00 0.00 H new ATOM 0 HG22 ILE A 60 9.980 1.511 -5.533 1.00 0.00 H new ATOM 0 HG23 ILE A 60 8.336 1.690 -4.876 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.429 -0.737 -1.179 1.00 0.00 H new ATOM 0 HD12 ILE A 60 9.956 -1.149 -1.995 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.451 0.552 -1.858 1.00 0.00 H new ATOM 772 N GLN A 61 9.014 0.441 -7.804 1.00 0.00 N ATOM 773 CA GLN A 61 9.743 0.903 -8.979 1.00 0.00 C ATOM 774 C GLN A 61 9.794 2.427 -9.024 1.00 0.00 C ATOM 775 O GLN A 61 8.760 3.093 -9.001 1.00 0.00 O ATOM 776 CB GLN A 61 9.091 0.365 -10.255 1.00 0.00 C ATOM 777 CG GLN A 61 10.065 0.191 -11.409 1.00 0.00 C ATOM 778 CD GLN A 61 9.380 0.226 -12.761 1.00 0.00 C ATOM 779 OE1 GLN A 61 8.593 1.128 -13.048 1.00 0.00 O ATOM 780 NE2 GLN A 61 9.676 -0.759 -13.600 1.00 0.00 N ATOM 0 H GLN A 61 8.105 0.883 -7.671 1.00 0.00 H new ATOM 0 HA GLN A 61 10.763 0.525 -8.914 1.00 0.00 H new ATOM 0 HB2 GLN A 61 8.623 -0.595 -10.037 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.296 1.045 -10.561 1.00 0.00 H new ATOM 0 HG2 GLN A 61 10.817 0.979 -11.367 1.00 0.00 H new ATOM 0 HG3 GLN A 61 10.590 -0.758 -11.296 1.00 0.00 H new ATOM 0 HE21 GLN A 61 10.334 -1.486 -13.321 1.00 0.00 H new ATOM 0 HE22 GLN A 61 9.245 -0.788 -14.524 1.00 0.00 H new ATOM 789 N ASN A 62 11.005 2.972 -9.087 1.00 0.00 N ATOM 790 CA ASN A 62 11.191 4.417 -9.134 1.00 0.00 C ATOM 791 C ASN A 62 10.860 4.964 -10.519 1.00 0.00 C ATOM 792 O ASN A 62 10.917 4.240 -11.513 1.00 0.00 O ATOM 793 CB ASN A 62 12.630 4.780 -8.760 1.00 0.00 C ATOM 794 CG ASN A 62 12.998 6.190 -9.179 1.00 0.00 C ATOM 795 OD1 ASN A 62 13.331 6.438 -10.338 1.00 0.00 O ATOM 796 ND2 ASN A 62 12.939 7.122 -8.235 1.00 0.00 N ATOM 0 H ASN A 62 11.872 2.434 -9.107 1.00 0.00 H new ATOM 0 HA ASN A 62 10.510 4.869 -8.413 1.00 0.00 H new ATOM 0 HB2 ASN A 62 12.759 4.679 -7.682 1.00 0.00 H new ATOM 0 HB3 ASN A 62 13.314 4.074 -9.231 1.00 0.00 H new ATOM 0 HD21 ASN A 62 13.175 8.089 -8.458 1.00 0.00 H new ATOM 0 HD22 ASN A 62 12.658 6.871 -7.287 1.00 0.00 H new ATOM 803 N ASN A 63 10.516 6.246 -10.577 1.00 0.00 N ATOM 804 CA ASN A 63 10.176 6.891 -11.840 1.00 0.00 C ATOM 805 C ASN A 63 10.835 8.263 -11.946 1.00 0.00 C ATOM 806 O ASN A 63 11.066 8.932 -10.938 1.00 0.00 O ATOM 807 CB ASN A 63 8.659 7.029 -11.974 1.00 0.00 C ATOM 808 CG ASN A 63 7.950 5.689 -11.933 1.00 0.00 C ATOM 809 OD1 ASN A 63 8.020 4.908 -12.882 1.00 0.00 O ATOM 810 ND2 ASN A 63 7.262 5.417 -10.830 1.00 0.00 N ATOM 0 H ASN A 63 10.465 6.859 -9.764 1.00 0.00 H new ATOM 0 HA ASN A 63 10.550 6.265 -12.651 1.00 0.00 H new ATOM 0 HB2 ASN A 63 8.282 7.661 -11.170 1.00 0.00 H new ATOM 0 HB3 ASN A 63 8.424 7.533 -12.912 1.00 0.00 H new ATOM 0 HD21 ASN A 63 6.764 4.531 -10.745 1.00 0.00 H new ATOM 0 HD22 ASN A 63 7.232 6.094 -10.068 1.00 0.00 H new ATOM 817 N LYS A 64 11.134 8.677 -13.172 1.00 0.00 N ATOM 818 CA LYS A 64 11.764 9.970 -13.411 1.00 0.00 C ATOM 819 C LYS A 64 10.941 11.098 -12.797 1.00 0.00 C ATOM 820 O LYS A 64 11.445 12.201 -12.582 1.00 0.00 O ATOM 821 CB LYS A 64 11.934 10.208 -14.914 1.00 0.00 C ATOM 822 CG LYS A 64 12.707 9.108 -15.620 1.00 0.00 C ATOM 823 CD LYS A 64 14.197 9.206 -15.340 1.00 0.00 C ATOM 824 CE LYS A 64 14.907 7.893 -15.633 1.00 0.00 C ATOM 825 NZ LYS A 64 14.695 6.894 -14.548 1.00 0.00 N ATOM 0 H LYS A 64 10.950 8.135 -14.017 1.00 0.00 H new ATOM 0 HA LYS A 64 12.746 9.961 -12.937 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.949 10.300 -15.372 1.00 0.00 H new ATOM 0 HB3 LYS A 64 12.447 11.157 -15.067 1.00 0.00 H new ATOM 0 HG2 LYS A 64 12.338 8.136 -15.294 1.00 0.00 H new ATOM 0 HG3 LYS A 64 12.533 9.171 -16.694 1.00 0.00 H new ATOM 0 HD2 LYS A 64 14.631 9.999 -15.949 1.00 0.00 H new ATOM 0 HD3 LYS A 64 14.355 9.481 -14.297 1.00 0.00 H new ATOM 0 HE2 LYS A 64 14.544 7.487 -16.577 1.00 0.00 H new ATOM 0 HE3 LYS A 64 15.975 8.076 -15.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 15.249 6.038 -14.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 15.002 7.297 -13.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 13.686 6.649 -14.494 1.00 0.00 H new ATOM 839 N ASP A 65 9.675 10.814 -12.515 1.00 0.00 N ATOM 840 CA ASP A 65 8.783 11.804 -11.923 1.00 0.00 C ATOM 841 C ASP A 65 8.841 11.745 -10.399 1.00 0.00 C ATOM 842 O ASP A 65 7.874 12.083 -9.718 1.00 0.00 O ATOM 843 CB ASP A 65 7.347 11.580 -12.400 1.00 0.00 C ATOM 844 CG ASP A 65 7.256 11.418 -13.905 1.00 0.00 C ATOM 845 OD1 ASP A 65 7.540 10.308 -14.401 1.00 0.00 O ATOM 846 OD2 ASP A 65 6.901 12.402 -14.586 1.00 0.00 O ATOM 0 H ASP A 65 9.243 9.906 -12.687 1.00 0.00 H new ATOM 0 HA ASP A 65 9.113 12.792 -12.244 1.00 0.00 H new ATOM 0 HB2 ASP A 65 6.941 10.691 -11.917 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.729 12.422 -12.090 1.00 0.00 H new ATOM 851 N GLY A 66 9.982 11.312 -9.871 1.00 0.00 N ATOM 852 CA GLY A 66 10.144 11.216 -8.433 1.00 0.00 C ATOM 853 C GLY A 66 9.032 10.421 -7.776 1.00 0.00 C ATOM 854 O GLY A 66 8.848 10.483 -6.560 1.00 0.00 O ATOM 0 H GLY A 66 10.797 11.026 -10.414 1.00 0.00 H new ATOM 0 HA2 GLY A 66 11.102 10.748 -8.209 1.00 0.00 H new ATOM 0 HA3 GLY A 66 10.171 12.218 -8.006 1.00 0.00 H new ATOM 858 N THR A 67 8.287 9.671 -8.582 1.00 0.00 N ATOM 859 CA THR A 67 7.186 8.863 -8.074 1.00 0.00 C ATOM 860 C THR A 67 7.584 7.396 -7.967 1.00 0.00 C ATOM 861 O THR A 67 8.562 6.962 -8.576 1.00 0.00 O ATOM 862 CB THR A 67 5.940 8.982 -8.972 1.00 0.00 C ATOM 863 OG1 THR A 67 6.320 8.894 -10.350 1.00 0.00 O ATOM 864 CG2 THR A 67 5.216 10.296 -8.723 1.00 0.00 C ATOM 0 H THR A 67 8.427 9.607 -9.590 1.00 0.00 H new ATOM 0 HA THR A 67 6.946 9.244 -7.081 1.00 0.00 H new ATOM 0 HB THR A 67 5.264 8.162 -8.728 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.523 8.969 -10.915 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.340 10.357 -9.369 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.903 10.347 -7.680 1.00 0.00 H new ATOM 0 HG23 THR A 67 5.886 11.128 -8.941 1.00 0.00 H new ATOM 872 N TYR A 68 6.820 6.635 -7.191 1.00 0.00 N ATOM 873 CA TYR A 68 7.095 5.216 -7.003 1.00 0.00 C ATOM 874 C TYR A 68 5.875 4.373 -7.362 1.00 0.00 C ATOM 875 O TYR A 68 4.769 4.628 -6.887 1.00 0.00 O ATOM 876 CB TYR A 68 7.511 4.942 -5.557 1.00 0.00 C ATOM 877 CG TYR A 68 8.819 5.595 -5.169 1.00 0.00 C ATOM 878 CD1 TYR A 68 8.861 6.922 -4.760 1.00 0.00 C ATOM 879 CD2 TYR A 68 10.012 4.884 -5.211 1.00 0.00 C ATOM 880 CE1 TYR A 68 10.053 7.522 -4.406 1.00 0.00 C ATOM 881 CE2 TYR A 68 11.209 5.476 -4.857 1.00 0.00 C ATOM 882 CZ TYR A 68 11.224 6.795 -4.455 1.00 0.00 C ATOM 883 OH TYR A 68 12.414 7.390 -4.101 1.00 0.00 O ATOM 0 H TYR A 68 6.005 6.978 -6.682 1.00 0.00 H new ATOM 0 HA TYR A 68 7.914 4.940 -7.667 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.726 5.295 -4.889 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.594 3.865 -5.410 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.946 7.494 -4.718 1.00 0.00 H new ATOM 0 HD2 TYR A 68 10.003 3.851 -5.526 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.068 8.555 -4.092 1.00 0.00 H new ATOM 0 HE2 TYR A 68 12.128 4.909 -4.895 1.00 0.00 H new ATOM 0 HH TYR A 68 13.143 6.741 -4.190 1.00 0.00 H new ATOM 893 N ALA A 69 6.086 3.366 -8.203 1.00 0.00 N ATOM 894 CA ALA A 69 5.006 2.483 -8.624 1.00 0.00 C ATOM 895 C ALA A 69 4.975 1.213 -7.780 1.00 0.00 C ATOM 896 O ALA A 69 5.686 0.249 -8.064 1.00 0.00 O ATOM 897 CB ALA A 69 5.152 2.135 -10.098 1.00 0.00 C ATOM 0 H ALA A 69 6.996 3.142 -8.606 1.00 0.00 H new ATOM 0 HA ALA A 69 4.063 3.009 -8.478 1.00 0.00 H new ATOM 0 HB1 ALA A 69 4.338 1.475 -10.398 1.00 0.00 H new ATOM 0 HB2 ALA A 69 5.117 3.048 -10.693 1.00 0.00 H new ATOM 0 HB3 ALA A 69 6.106 1.633 -10.261 1.00 0.00 H new ATOM 903 N VAL A 70 4.146 1.219 -6.741 1.00 0.00 N ATOM 904 CA VAL A 70 4.021 0.067 -5.856 1.00 0.00 C ATOM 905 C VAL A 70 2.925 -0.878 -6.334 1.00 0.00 C ATOM 906 O VAL A 70 1.887 -0.441 -6.834 1.00 0.00 O ATOM 907 CB VAL A 70 3.716 0.501 -4.410 1.00 0.00 C ATOM 908 CG1 VAL A 70 3.277 -0.693 -3.576 1.00 0.00 C ATOM 909 CG2 VAL A 70 4.928 1.178 -3.790 1.00 0.00 C ATOM 0 H VAL A 70 3.551 2.009 -6.491 1.00 0.00 H new ATOM 0 HA VAL A 70 4.979 -0.453 -5.877 1.00 0.00 H new ATOM 0 HB VAL A 70 2.898 1.221 -4.430 1.00 0.00 H new ATOM 0 HG11 VAL A 70 3.066 -0.367 -2.557 1.00 0.00 H new ATOM 0 HG12 VAL A 70 2.378 -1.130 -4.011 1.00 0.00 H new ATOM 0 HG13 VAL A 70 4.072 -1.438 -3.561 1.00 0.00 H new ATOM 0 HG21 VAL A 70 4.694 1.478 -2.768 1.00 0.00 H new ATOM 0 HG22 VAL A 70 5.768 0.483 -3.781 1.00 0.00 H new ATOM 0 HG23 VAL A 70 5.192 2.059 -4.375 1.00 0.00 H new ATOM 919 N THR A 71 3.160 -2.177 -6.177 1.00 0.00 N ATOM 920 CA THR A 71 2.193 -3.185 -6.593 1.00 0.00 C ATOM 921 C THR A 71 2.157 -4.351 -5.612 1.00 0.00 C ATOM 922 O THR A 71 3.154 -4.652 -4.954 1.00 0.00 O ATOM 923 CB THR A 71 2.512 -3.723 -8.000 1.00 0.00 C ATOM 924 OG1 THR A 71 3.151 -2.706 -8.780 1.00 0.00 O ATOM 925 CG2 THR A 71 1.245 -4.186 -8.703 1.00 0.00 C ATOM 0 H THR A 71 4.012 -2.556 -5.764 1.00 0.00 H new ATOM 0 HA THR A 71 1.218 -2.698 -6.611 1.00 0.00 H new ATOM 0 HB THR A 71 3.183 -4.576 -7.895 1.00 0.00 H new ATOM 0 HG1 THR A 71 3.352 -3.056 -9.673 1.00 0.00 H new ATOM 0 HG21 THR A 71 1.496 -4.562 -9.695 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.776 -4.980 -8.122 1.00 0.00 H new ATOM 0 HG23 THR A 71 0.554 -3.348 -8.796 1.00 0.00 H new ATOM 933 N TYR A 72 1.005 -5.005 -5.519 1.00 0.00 N ATOM 934 CA TYR A 72 0.839 -6.137 -4.616 1.00 0.00 C ATOM 935 C TYR A 72 -0.064 -7.200 -5.234 1.00 0.00 C ATOM 936 O TYR A 72 -1.151 -6.897 -5.726 1.00 0.00 O ATOM 937 CB TYR A 72 0.257 -5.671 -3.280 1.00 0.00 C ATOM 938 CG TYR A 72 -1.231 -5.409 -3.327 1.00 0.00 C ATOM 939 CD1 TYR A 72 -2.144 -6.450 -3.208 1.00 0.00 C ATOM 940 CD2 TYR A 72 -1.725 -4.121 -3.490 1.00 0.00 C ATOM 941 CE1 TYR A 72 -3.504 -6.215 -3.251 1.00 0.00 C ATOM 942 CE2 TYR A 72 -3.084 -3.876 -3.532 1.00 0.00 C ATOM 943 CZ TYR A 72 -3.969 -4.927 -3.413 1.00 0.00 C ATOM 944 OH TYR A 72 -5.324 -4.688 -3.455 1.00 0.00 O ATOM 0 H TYR A 72 0.172 -4.770 -6.058 1.00 0.00 H new ATOM 0 HA TYR A 72 1.821 -6.577 -4.443 1.00 0.00 H new ATOM 0 HB2 TYR A 72 0.461 -6.426 -2.521 1.00 0.00 H new ATOM 0 HB3 TYR A 72 0.768 -4.760 -2.968 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -1.784 -7.460 -3.080 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -1.034 -3.296 -3.586 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -4.200 -7.036 -3.158 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -3.451 -2.868 -3.657 1.00 0.00 H new ATOM 0 HH TYR A 72 -5.489 -3.726 -3.366 1.00 0.00 H new ATOM 954 N VAL A 73 0.394 -8.447 -5.205 1.00 0.00 N ATOM 955 CA VAL A 73 -0.372 -9.556 -5.760 1.00 0.00 C ATOM 956 C VAL A 73 -0.860 -10.492 -4.660 1.00 0.00 C ATOM 957 O VAL A 73 -0.112 -11.316 -4.134 1.00 0.00 O ATOM 958 CB VAL A 73 0.462 -10.363 -6.773 1.00 0.00 C ATOM 959 CG1 VAL A 73 -0.298 -11.600 -7.226 1.00 0.00 C ATOM 960 CG2 VAL A 73 0.840 -9.494 -7.963 1.00 0.00 C ATOM 0 H VAL A 73 1.292 -8.715 -4.803 1.00 0.00 H new ATOM 0 HA VAL A 73 -1.231 -9.122 -6.272 1.00 0.00 H new ATOM 0 HB VAL A 73 1.380 -10.689 -6.284 1.00 0.00 H new ATOM 0 HG11 VAL A 73 0.307 -12.157 -7.941 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -0.513 -12.231 -6.364 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.233 -11.300 -7.698 1.00 0.00 H new ATOM 0 HG21 VAL A 73 1.429 -10.080 -8.669 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.065 -9.136 -8.454 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.427 -8.642 -7.620 1.00 0.00 H new ATOM 970 N PRO A 74 -2.147 -10.366 -4.303 1.00 0.00 N ATOM 971 CA PRO A 74 -2.765 -11.193 -3.263 1.00 0.00 C ATOM 972 C PRO A 74 -2.927 -12.646 -3.698 1.00 0.00 C ATOM 973 O PRO A 74 -3.449 -12.927 -4.778 1.00 0.00 O ATOM 974 CB PRO A 74 -4.134 -10.540 -3.058 1.00 0.00 C ATOM 975 CG PRO A 74 -4.427 -9.858 -4.349 1.00 0.00 C ATOM 976 CD PRO A 74 -3.098 -9.405 -4.888 1.00 0.00 C ATOM 0 HA PRO A 74 -2.157 -11.233 -2.359 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -4.895 -11.283 -2.822 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -4.114 -9.830 -2.231 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -4.920 -10.536 -5.046 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -5.097 -9.011 -4.200 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -3.076 -9.431 -5.977 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -2.871 -8.382 -4.589 1.00 0.00 H new ATOM 984 N LEU A 75 -2.478 -13.565 -2.851 1.00 0.00 N ATOM 985 CA LEU A 75 -2.573 -14.990 -3.148 1.00 0.00 C ATOM 986 C LEU A 75 -3.952 -15.531 -2.781 1.00 0.00 C ATOM 987 O LEU A 75 -4.592 -16.220 -3.576 1.00 0.00 O ATOM 988 CB LEU A 75 -1.492 -15.763 -2.390 1.00 0.00 C ATOM 989 CG LEU A 75 -0.051 -15.514 -2.839 1.00 0.00 C ATOM 990 CD1 LEU A 75 0.929 -16.100 -1.834 1.00 0.00 C ATOM 991 CD2 LEU A 75 0.186 -16.102 -4.222 1.00 0.00 C ATOM 0 H LEU A 75 -2.045 -13.349 -1.953 1.00 0.00 H new ATOM 0 HA LEU A 75 -2.423 -15.124 -4.219 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.570 -15.514 -1.332 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.702 -16.829 -2.484 1.00 0.00 H new ATOM 0 HG LEU A 75 0.113 -14.438 -2.891 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.949 -15.914 -2.169 1.00 0.00 H new ATOM 0 HD12 LEU A 75 0.776 -15.633 -0.861 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.765 -17.174 -1.750 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.216 -15.915 -4.525 1.00 0.00 H new ATOM 0 HD22 LEU A 75 0.004 -17.176 -4.197 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.492 -15.636 -4.937 1.00 0.00 H new ATOM 1003 N THR A 76 -4.404 -15.214 -1.572 1.00 0.00 N ATOM 1004 CA THR A 76 -5.707 -15.666 -1.100 1.00 0.00 C ATOM 1005 C THR A 76 -6.657 -14.492 -0.896 1.00 0.00 C ATOM 1006 O THR A 76 -6.271 -13.458 -0.352 1.00 0.00 O ATOM 1007 CB THR A 76 -5.585 -16.449 0.220 1.00 0.00 C ATOM 1008 OG1 THR A 76 -6.855 -17.004 0.580 1.00 0.00 O ATOM 1009 CG2 THR A 76 -5.085 -15.548 1.339 1.00 0.00 C ATOM 0 H THR A 76 -3.887 -14.646 -0.901 1.00 0.00 H new ATOM 0 HA THR A 76 -6.110 -16.325 -1.869 1.00 0.00 H new ATOM 0 HB THR A 76 -4.865 -17.254 0.074 1.00 0.00 H new ATOM 0 HG1 THR A 76 -6.768 -17.502 1.420 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.007 -16.123 2.262 1.00 0.00 H new ATOM 0 HG22 THR A 76 -4.105 -15.150 1.075 1.00 0.00 H new ATOM 0 HG23 THR A 76 -5.784 -14.724 1.483 1.00 0.00 H new ATOM 1017 N ALA A 77 -7.900 -14.658 -1.335 1.00 0.00 N ATOM 1018 CA ALA A 77 -8.905 -13.612 -1.198 1.00 0.00 C ATOM 1019 C ALA A 77 -9.187 -13.311 0.270 1.00 0.00 C ATOM 1020 O ALA A 77 -8.847 -14.099 1.152 1.00 0.00 O ATOM 1021 CB ALA A 77 -10.187 -14.015 -1.912 1.00 0.00 C ATOM 0 H ALA A 77 -8.235 -15.508 -1.789 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.515 -12.705 -1.659 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -10.929 -13.224 -1.801 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.980 -14.173 -2.970 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -10.572 -14.937 -1.476 1.00 0.00 H new ATOM 1027 N GLY A 78 -9.811 -12.165 0.526 1.00 0.00 N ATOM 1028 CA GLY A 78 -10.127 -11.781 1.889 1.00 0.00 C ATOM 1029 C GLY A 78 -9.687 -10.366 2.209 1.00 0.00 C ATOM 1030 O GLY A 78 -9.284 -9.618 1.319 1.00 0.00 O ATOM 0 H GLY A 78 -10.103 -11.496 -0.186 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -11.202 -11.869 2.048 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -9.645 -12.473 2.579 1.00 0.00 H new ATOM 1034 N MET A 79 -9.767 -9.997 3.484 1.00 0.00 N ATOM 1035 CA MET A 79 -9.374 -8.662 3.918 1.00 0.00 C ATOM 1036 C MET A 79 -7.857 -8.550 4.027 1.00 0.00 C ATOM 1037 O MET A 79 -7.202 -9.406 4.622 1.00 0.00 O ATOM 1038 CB MET A 79 -10.019 -8.331 5.266 1.00 0.00 C ATOM 1039 CG MET A 79 -11.530 -8.183 5.196 1.00 0.00 C ATOM 1040 SD MET A 79 -12.059 -7.056 3.892 1.00 0.00 S ATOM 1041 CE MET A 79 -11.070 -5.612 4.271 1.00 0.00 C ATOM 0 H MET A 79 -10.100 -10.604 4.233 1.00 0.00 H new ATOM 0 HA MET A 79 -9.721 -7.948 3.171 1.00 0.00 H new ATOM 0 HB2 MET A 79 -9.772 -9.116 5.980 1.00 0.00 H new ATOM 0 HB3 MET A 79 -9.589 -7.405 5.648 1.00 0.00 H new ATOM 0 HG2 MET A 79 -11.979 -9.162 5.029 1.00 0.00 H new ATOM 0 HG3 MET A 79 -11.900 -7.822 6.155 1.00 0.00 H new ATOM 0 HE1 MET A 79 -11.409 -4.770 3.667 1.00 0.00 H new ATOM 0 HE2 MET A 79 -11.175 -5.366 5.328 1.00 0.00 H new ATOM 0 HE3 MET A 79 -10.023 -5.819 4.049 1.00 0.00 H new ATOM 1051 N TYR A 80 -7.303 -7.490 3.447 1.00 0.00 N ATOM 1052 CA TYR A 80 -5.863 -7.268 3.476 1.00 0.00 C ATOM 1053 C TYR A 80 -5.521 -6.012 4.271 1.00 0.00 C ATOM 1054 O TYR A 80 -6.353 -5.118 4.431 1.00 0.00 O ATOM 1055 CB TYR A 80 -5.315 -7.150 2.053 1.00 0.00 C ATOM 1056 CG TYR A 80 -4.886 -8.471 1.457 1.00 0.00 C ATOM 1057 CD1 TYR A 80 -5.796 -9.286 0.796 1.00 0.00 C ATOM 1058 CD2 TYR A 80 -3.569 -8.905 1.555 1.00 0.00 C ATOM 1059 CE1 TYR A 80 -5.408 -10.495 0.251 1.00 0.00 C ATOM 1060 CE2 TYR A 80 -3.172 -10.111 1.012 1.00 0.00 C ATOM 1061 CZ TYR A 80 -4.095 -10.903 0.361 1.00 0.00 C ATOM 1062 OH TYR A 80 -3.705 -12.106 -0.182 1.00 0.00 O ATOM 0 H TYR A 80 -7.830 -6.771 2.951 1.00 0.00 H new ATOM 0 HA TYR A 80 -5.399 -8.124 3.967 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.078 -6.704 1.415 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -4.464 -6.469 2.056 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -6.825 -8.969 0.706 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -2.844 -8.288 2.065 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -6.129 -11.117 -0.258 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -2.144 -10.432 1.097 1.00 0.00 H new ATOM 0 HH TYR A 80 -4.489 -12.682 -0.298 1.00 0.00 H new ATOM 1072 N THR A 81 -4.289 -5.950 4.768 1.00 0.00 N ATOM 1073 CA THR A 81 -3.835 -4.805 5.547 1.00 0.00 C ATOM 1074 C THR A 81 -2.584 -4.185 4.935 1.00 0.00 C ATOM 1075 O THR A 81 -1.477 -4.697 5.110 1.00 0.00 O ATOM 1076 CB THR A 81 -3.539 -5.199 7.006 1.00 0.00 C ATOM 1077 OG1 THR A 81 -4.684 -5.838 7.583 1.00 0.00 O ATOM 1078 CG2 THR A 81 -3.164 -3.978 7.831 1.00 0.00 C ATOM 0 H THR A 81 -3.588 -6.680 4.644 1.00 0.00 H new ATOM 0 HA THR A 81 -4.643 -4.074 5.534 1.00 0.00 H new ATOM 0 HB THR A 81 -2.697 -5.892 7.008 1.00 0.00 H new ATOM 0 HG1 THR A 81 -4.487 -6.087 8.510 1.00 0.00 H new ATOM 0 HG21 THR A 81 -2.959 -4.281 8.858 1.00 0.00 H new ATOM 0 HG22 THR A 81 -2.275 -3.511 7.407 1.00 0.00 H new ATOM 0 HG23 THR A 81 -3.988 -3.265 7.821 1.00 0.00 H new ATOM 1086 N LEU A 82 -2.765 -3.082 4.219 1.00 0.00 N ATOM 1087 CA LEU A 82 -1.649 -2.391 3.582 1.00 0.00 C ATOM 1088 C LEU A 82 -0.922 -1.495 4.579 1.00 0.00 C ATOM 1089 O LEU A 82 -1.537 -0.658 5.242 1.00 0.00 O ATOM 1090 CB LEU A 82 -2.148 -1.558 2.399 1.00 0.00 C ATOM 1091 CG LEU A 82 -3.267 -2.180 1.565 1.00 0.00 C ATOM 1092 CD1 LEU A 82 -3.947 -1.122 0.710 1.00 0.00 C ATOM 1093 CD2 LEU A 82 -2.723 -3.303 0.693 1.00 0.00 C ATOM 0 H LEU A 82 -3.674 -2.646 4.064 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.948 -3.143 3.220 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -2.496 -0.597 2.778 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -1.303 -1.354 1.742 1.00 0.00 H new ATOM 0 HG LEU A 82 -4.008 -2.601 2.244 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.741 -1.584 0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -4.372 -0.352 1.354 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.216 -0.671 0.039 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.534 -3.734 0.106 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.961 -2.906 0.022 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.283 -4.074 1.325 1.00 0.00 H new ATOM 1105 N THR A 83 0.391 -1.674 4.680 1.00 0.00 N ATOM 1106 CA THR A 83 1.203 -0.882 5.595 1.00 0.00 C ATOM 1107 C THR A 83 2.338 -0.181 4.858 1.00 0.00 C ATOM 1108 O THR A 83 3.337 -0.804 4.501 1.00 0.00 O ATOM 1109 CB THR A 83 1.796 -1.753 6.718 1.00 0.00 C ATOM 1110 OG1 THR A 83 0.767 -2.549 7.317 1.00 0.00 O ATOM 1111 CG2 THR A 83 2.459 -0.890 7.780 1.00 0.00 C ATOM 0 H THR A 83 0.915 -2.361 4.139 1.00 0.00 H new ATOM 0 HA THR A 83 0.543 -0.134 6.035 1.00 0.00 H new ATOM 0 HB THR A 83 2.551 -2.406 6.280 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.153 -3.101 8.029 1.00 0.00 H new ATOM 0 HG21 THR A 83 2.870 -1.528 8.562 1.00 0.00 H new ATOM 0 HG22 THR A 83 3.262 -0.308 7.327 1.00 0.00 H new ATOM 0 HG23 THR A 83 1.721 -0.215 8.213 1.00 0.00 H new ATOM 1119 N MET A 84 2.177 1.119 4.633 1.00 0.00 N ATOM 1120 CA MET A 84 3.191 1.905 3.939 1.00 0.00 C ATOM 1121 C MET A 84 3.857 2.894 4.890 1.00 0.00 C ATOM 1122 O MET A 84 3.199 3.766 5.457 1.00 0.00 O ATOM 1123 CB MET A 84 2.567 2.655 2.760 1.00 0.00 C ATOM 1124 CG MET A 84 3.586 3.357 1.879 1.00 0.00 C ATOM 1125 SD MET A 84 2.830 4.186 0.467 1.00 0.00 S ATOM 1126 CE MET A 84 2.670 2.820 -0.681 1.00 0.00 C ATOM 0 H MET A 84 1.355 1.650 4.921 1.00 0.00 H new ATOM 0 HA MET A 84 3.952 1.220 3.564 1.00 0.00 H new ATOM 0 HB2 MET A 84 1.997 1.951 2.153 1.00 0.00 H new ATOM 0 HB3 MET A 84 1.860 3.392 3.142 1.00 0.00 H new ATOM 0 HG2 MET A 84 4.133 4.088 2.474 1.00 0.00 H new ATOM 0 HG3 MET A 84 4.314 2.629 1.521 1.00 0.00 H new ATOM 0 HE1 MET A 84 2.525 3.207 -1.690 1.00 0.00 H new ATOM 0 HE2 MET A 84 3.574 2.212 -0.652 1.00 0.00 H new ATOM 0 HE3 MET A 84 1.813 2.208 -0.401 1.00 0.00 H new ATOM 1136 N LYS A 85 5.168 2.753 5.060 1.00 0.00 N ATOM 1137 CA LYS A 85 5.924 3.633 5.942 1.00 0.00 C ATOM 1138 C LYS A 85 7.040 4.340 5.178 1.00 0.00 C ATOM 1139 O LYS A 85 7.909 3.695 4.592 1.00 0.00 O ATOM 1140 CB LYS A 85 6.515 2.837 7.107 1.00 0.00 C ATOM 1141 CG LYS A 85 5.620 2.799 8.334 1.00 0.00 C ATOM 1142 CD LYS A 85 6.384 2.351 9.568 1.00 0.00 C ATOM 1143 CE LYS A 85 6.307 0.844 9.755 1.00 0.00 C ATOM 1144 NZ LYS A 85 4.898 0.365 9.823 1.00 0.00 N ATOM 0 H LYS A 85 5.728 2.037 4.598 1.00 0.00 H new ATOM 0 HA LYS A 85 5.241 4.387 6.335 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.709 1.816 6.777 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.476 3.271 7.382 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.196 3.788 8.507 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.785 2.121 8.156 1.00 0.00 H new ATOM 0 HD2 LYS A 85 7.427 2.655 9.482 1.00 0.00 H new ATOM 0 HD3 LYS A 85 5.979 2.849 10.449 1.00 0.00 H new ATOM 0 HE2 LYS A 85 6.820 0.349 8.930 1.00 0.00 H new ATOM 0 HE3 LYS A 85 6.830 0.564 10.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 4.787 -0.273 10.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 4.260 1.179 9.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.662 -0.146 8.948 1.00 0.00 H new ATOM 1158 N TYR A 86 7.010 5.668 5.190 1.00 0.00 N ATOM 1159 CA TYR A 86 8.018 6.462 4.498 1.00 0.00 C ATOM 1160 C TYR A 86 9.077 6.968 5.472 1.00 0.00 C ATOM 1161 O TYR A 86 8.806 7.829 6.308 1.00 0.00 O ATOM 1162 CB TYR A 86 7.363 7.643 3.780 1.00 0.00 C ATOM 1163 CG TYR A 86 8.212 8.227 2.674 1.00 0.00 C ATOM 1164 CD1 TYR A 86 9.127 9.240 2.935 1.00 0.00 C ATOM 1165 CD2 TYR A 86 8.100 7.766 1.368 1.00 0.00 C ATOM 1166 CE1 TYR A 86 9.905 9.777 1.928 1.00 0.00 C ATOM 1167 CE2 TYR A 86 8.875 8.296 0.355 1.00 0.00 C ATOM 1168 CZ TYR A 86 9.776 9.301 0.640 1.00 0.00 C ATOM 1169 OH TYR A 86 10.549 9.833 -0.367 1.00 0.00 O ATOM 0 H TYR A 86 6.298 6.217 5.672 1.00 0.00 H new ATOM 0 HA TYR A 86 8.504 5.822 3.762 1.00 0.00 H new ATOM 0 HB2 TYR A 86 6.410 7.320 3.362 1.00 0.00 H new ATOM 0 HB3 TYR A 86 7.143 8.424 4.508 1.00 0.00 H new ATOM 0 HD1 TYR A 86 9.232 9.614 3.943 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.395 6.980 1.141 1.00 0.00 H new ATOM 0 HE1 TYR A 86 10.610 10.565 2.148 1.00 0.00 H new ATOM 0 HE2 TYR A 86 8.776 7.926 -0.655 1.00 0.00 H new ATOM 0 HH TYR A 86 10.077 10.587 -0.778 1.00 0.00 H new ATOM 1179 N GLY A 87 10.285 6.425 5.358 1.00 0.00 N ATOM 1180 CA GLY A 87 11.368 6.833 6.234 1.00 0.00 C ATOM 1181 C GLY A 87 11.158 6.380 7.665 1.00 0.00 C ATOM 1182 O GLY A 87 11.660 7.001 8.600 1.00 0.00 O ATOM 0 H GLY A 87 10.533 5.710 4.675 1.00 0.00 H new ATOM 0 HA2 GLY A 87 12.307 6.424 5.861 1.00 0.00 H new ATOM 0 HA3 GLY A 87 11.461 7.919 6.210 1.00 0.00 H new ATOM 1186 N GLY A 88 10.412 5.292 7.836 1.00 0.00 N ATOM 1187 CA GLY A 88 10.149 4.776 9.166 1.00 0.00 C ATOM 1188 C GLY A 88 8.854 5.306 9.748 1.00 0.00 C ATOM 1189 O GLY A 88 8.388 4.826 10.781 1.00 0.00 O ATOM 0 H GLY A 88 9.986 4.760 7.077 1.00 0.00 H new ATOM 0 HA2 GLY A 88 10.108 3.687 9.128 1.00 0.00 H new ATOM 0 HA3 GLY A 88 10.975 5.041 9.825 1.00 0.00 H new ATOM 1193 N GLU A 89 8.271 6.300 9.085 1.00 0.00 N ATOM 1194 CA GLU A 89 7.023 6.897 9.545 1.00 0.00 C ATOM 1195 C GLU A 89 5.865 6.509 8.630 1.00 0.00 C ATOM 1196 O GLU A 89 5.993 6.527 7.405 1.00 0.00 O ATOM 1197 CB GLU A 89 7.152 8.420 9.605 1.00 0.00 C ATOM 1198 CG GLU A 89 8.368 8.898 10.382 1.00 0.00 C ATOM 1199 CD GLU A 89 8.142 10.239 11.052 1.00 0.00 C ATOM 1200 OE1 GLU A 89 6.978 10.687 11.106 1.00 0.00 O ATOM 1201 OE2 GLU A 89 9.130 10.840 11.523 1.00 0.00 O ATOM 0 H GLU A 89 8.643 6.709 8.228 1.00 0.00 H new ATOM 0 HA GLU A 89 6.816 6.518 10.546 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.203 8.812 8.589 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.253 8.835 10.062 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.625 8.157 11.139 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.220 8.973 9.706 1.00 0.00 H new ATOM 1208 N LEU A 90 4.734 6.159 9.233 1.00 0.00 N ATOM 1209 CA LEU A 90 3.552 5.766 8.474 1.00 0.00 C ATOM 1210 C LEU A 90 2.956 6.961 7.737 1.00 0.00 C ATOM 1211 O LEU A 90 3.121 8.107 8.156 1.00 0.00 O ATOM 1212 CB LEU A 90 2.505 5.152 9.405 1.00 0.00 C ATOM 1213 CG LEU A 90 2.586 3.638 9.600 1.00 0.00 C ATOM 1214 CD1 LEU A 90 1.756 3.209 10.801 1.00 0.00 C ATOM 1215 CD2 LEU A 90 2.125 2.912 8.345 1.00 0.00 C ATOM 0 H LEU A 90 4.611 6.139 10.245 1.00 0.00 H new ATOM 0 HA LEU A 90 3.854 5.022 7.737 1.00 0.00 H new ATOM 0 HB2 LEU A 90 2.592 5.629 10.381 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.516 5.396 9.018 1.00 0.00 H new ATOM 0 HG LEU A 90 3.626 3.371 9.788 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.826 2.128 10.924 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.132 3.701 11.698 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.715 3.490 10.643 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.190 1.835 8.503 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.093 3.185 8.125 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.762 3.195 7.507 1.00 0.00 H new ATOM 1227 N VAL A 91 2.261 6.686 6.638 1.00 0.00 N ATOM 1228 CA VAL A 91 1.638 7.738 5.844 1.00 0.00 C ATOM 1229 C VAL A 91 0.172 7.916 6.223 1.00 0.00 C ATOM 1230 O VAL A 91 -0.451 7.041 6.824 1.00 0.00 O ATOM 1231 CB VAL A 91 1.734 7.436 4.337 1.00 0.00 C ATOM 1232 CG1 VAL A 91 2.972 8.087 3.739 1.00 0.00 C ATOM 1233 CG2 VAL A 91 1.741 5.934 4.095 1.00 0.00 C ATOM 0 H VAL A 91 2.115 5.743 6.277 1.00 0.00 H new ATOM 0 HA VAL A 91 2.181 8.659 6.057 1.00 0.00 H new ATOM 0 HB VAL A 91 0.858 7.857 3.843 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.023 7.862 2.674 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.920 9.167 3.880 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.862 7.699 4.234 1.00 0.00 H new ATOM 0 HG21 VAL A 91 1.809 5.738 3.025 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.597 5.488 4.601 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.821 5.498 4.486 1.00 0.00 H new ATOM 1243 N PRO A 92 -0.395 9.078 5.864 1.00 0.00 N ATOM 1244 CA PRO A 92 -1.795 9.399 6.156 1.00 0.00 C ATOM 1245 C PRO A 92 -2.766 8.558 5.333 1.00 0.00 C ATOM 1246 O PRO A 92 -3.980 8.755 5.395 1.00 0.00 O ATOM 1247 CB PRO A 92 -1.908 10.876 5.771 1.00 0.00 C ATOM 1248 CG PRO A 92 -0.837 11.086 4.757 1.00 0.00 C ATOM 1249 CD PRO A 92 0.288 10.167 5.146 1.00 0.00 C ATOM 0 HA PRO A 92 -2.052 9.195 7.195 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -2.892 11.104 5.361 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -1.766 11.523 6.637 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -1.199 10.857 3.754 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -0.507 12.125 4.748 1.00 0.00 H new ATOM 0 HD2 PRO A 92 0.826 9.798 4.273 1.00 0.00 H new ATOM 0 HD3 PRO A 92 1.018 10.671 5.780 1.00 0.00 H new ATOM 1257 N HIS A 93 -2.223 7.621 4.563 1.00 0.00 N ATOM 1258 CA HIS A 93 -3.043 6.749 3.728 1.00 0.00 C ATOM 1259 C HIS A 93 -2.893 5.291 4.154 1.00 0.00 C ATOM 1260 O HIS A 93 -3.381 4.384 3.480 1.00 0.00 O ATOM 1261 CB HIS A 93 -2.655 6.905 2.257 1.00 0.00 C ATOM 1262 CG HIS A 93 -2.587 8.330 1.804 1.00 0.00 C ATOM 1263 ND1 HIS A 93 -1.685 9.303 2.072 1.00 0.00 N flip ATOM 1264 CD2 HIS A 93 -3.528 8.901 0.972 1.00 0.00 C flip ATOM 1265 CE1 HIS A 93 -2.091 10.431 1.403 1.00 0.00 C flip ATOM 1266 NE2 HIS A 93 -3.206 10.162 0.747 1.00 0.00 N flip ATOM 0 H HIS A 93 -1.220 7.446 4.499 1.00 0.00 H new ATOM 0 HA HIS A 93 -4.086 7.041 3.854 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.686 6.434 2.093 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -3.378 6.370 1.640 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.393 8.396 0.568 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -1.582 11.383 1.412 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -3.729 10.817 0.166 1.00 0.00 H new ATOM 1275 N PHE A 94 -2.215 5.075 5.277 1.00 0.00 N ATOM 1276 CA PHE A 94 -2.000 3.727 5.792 1.00 0.00 C ATOM 1277 C PHE A 94 -1.941 3.731 7.316 1.00 0.00 C ATOM 1278 O PHE A 94 -1.571 4.722 7.946 1.00 0.00 O ATOM 1279 CB PHE A 94 -0.707 3.141 5.221 1.00 0.00 C ATOM 1280 CG PHE A 94 -0.717 3.011 3.725 1.00 0.00 C ATOM 1281 CD1 PHE A 94 -0.575 4.129 2.918 1.00 0.00 C ATOM 1282 CD2 PHE A 94 -0.868 1.771 3.125 1.00 0.00 C ATOM 1283 CE1 PHE A 94 -0.584 4.012 1.541 1.00 0.00 C ATOM 1284 CE2 PHE A 94 -0.878 1.648 1.748 1.00 0.00 C ATOM 1285 CZ PHE A 94 -0.735 2.770 0.955 1.00 0.00 C ATOM 0 H PHE A 94 -1.806 5.815 5.847 1.00 0.00 H new ATOM 0 HA PHE A 94 -2.840 3.107 5.480 1.00 0.00 H new ATOM 0 HB2 PHE A 94 0.131 3.773 5.517 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -0.537 2.159 5.662 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.456 5.102 3.370 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.979 0.890 3.740 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -0.473 4.891 0.923 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.997 0.676 1.293 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.741 2.677 -0.121 1.00 0.00 H new ATOM 1295 N PRO A 95 -2.314 2.596 7.925 1.00 0.00 N ATOM 1296 CA PRO A 95 -2.756 1.409 7.186 1.00 0.00 C ATOM 1297 C PRO A 95 -4.112 1.613 6.520 1.00 0.00 C ATOM 1298 O PRO A 95 -4.913 2.437 6.961 1.00 0.00 O ATOM 1299 CB PRO A 95 -2.848 0.331 8.268 1.00 0.00 C ATOM 1300 CG PRO A 95 -3.075 1.083 9.534 1.00 0.00 C ATOM 1301 CD PRO A 95 -2.333 2.382 9.382 1.00 0.00 C ATOM 0 HA PRO A 95 -2.075 1.158 6.373 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -3.665 -0.362 8.068 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -1.933 -0.260 8.317 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -4.138 1.258 9.699 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -2.707 0.522 10.393 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -2.838 3.196 9.901 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.325 2.319 9.792 1.00 0.00 H new ATOM 1309 N ALA A 96 -4.364 0.857 5.456 1.00 0.00 N ATOM 1310 CA ALA A 96 -5.625 0.954 4.732 1.00 0.00 C ATOM 1311 C ALA A 96 -6.114 -0.423 4.295 1.00 0.00 C ATOM 1312 O ALA A 96 -5.532 -1.045 3.406 1.00 0.00 O ATOM 1313 CB ALA A 96 -5.472 1.869 3.526 1.00 0.00 C ATOM 0 H ALA A 96 -3.711 0.171 5.077 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.370 1.379 5.404 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.422 1.932 2.994 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -5.176 2.864 3.859 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.709 1.468 2.859 1.00 0.00 H new ATOM 1319 N ARG A 97 -7.184 -0.893 4.926 1.00 0.00 N ATOM 1320 CA ARG A 97 -7.750 -2.198 4.603 1.00 0.00 C ATOM 1321 C ARG A 97 -8.439 -2.170 3.242 1.00 0.00 C ATOM 1322 O ARG A 97 -9.027 -1.161 2.853 1.00 0.00 O ATOM 1323 CB ARG A 97 -8.745 -2.627 5.682 1.00 0.00 C ATOM 1324 CG ARG A 97 -9.859 -1.621 5.919 1.00 0.00 C ATOM 1325 CD ARG A 97 -11.055 -1.893 5.020 1.00 0.00 C ATOM 1326 NE ARG A 97 -12.306 -1.435 5.620 1.00 0.00 N ATOM 1327 CZ ARG A 97 -12.867 -2.010 6.678 1.00 0.00 C ATOM 1328 NH1 ARG A 97 -12.291 -3.059 7.250 1.00 0.00 N ATOM 1329 NH2 ARG A 97 -14.006 -1.536 7.166 1.00 0.00 N ATOM 0 H ARG A 97 -7.677 -0.390 5.664 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.934 -2.920 4.563 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -9.185 -3.583 5.399 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.207 -2.788 6.617 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -10.170 -1.660 6.963 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.486 -0.613 5.735 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.909 -1.395 4.062 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -11.120 -2.962 4.817 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.774 -0.630 5.204 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.415 -3.426 6.878 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.724 -3.499 8.062 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -14.452 -0.729 6.729 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -14.436 -1.978 7.978 1.00 0.00 H new ATOM 1343 N VAL A 98 -8.363 -3.285 2.522 1.00 0.00 N ATOM 1344 CA VAL A 98 -8.980 -3.389 1.205 1.00 0.00 C ATOM 1345 C VAL A 98 -9.548 -4.784 0.973 1.00 0.00 C ATOM 1346 O VAL A 98 -8.822 -5.778 1.018 1.00 0.00 O ATOM 1347 CB VAL A 98 -7.972 -3.063 0.087 1.00 0.00 C ATOM 1348 CG1 VAL A 98 -8.600 -3.292 -1.280 1.00 0.00 C ATOM 1349 CG2 VAL A 98 -7.472 -1.633 0.220 1.00 0.00 C ATOM 0 H VAL A 98 -7.880 -4.129 2.829 1.00 0.00 H new ATOM 0 HA VAL A 98 -9.791 -2.661 1.176 1.00 0.00 H new ATOM 0 HB VAL A 98 -7.117 -3.732 0.185 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -7.874 -3.057 -2.058 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -8.904 -4.335 -1.371 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -9.473 -2.649 -1.392 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -6.761 -1.420 -0.578 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -8.314 -0.945 0.148 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -6.982 -1.507 1.185 1.00 0.00 H new ATOM 1359 N LYS A 99 -10.851 -4.852 0.724 1.00 0.00 N ATOM 1360 CA LYS A 99 -11.518 -6.126 0.482 1.00 0.00 C ATOM 1361 C LYS A 99 -11.119 -6.701 -0.873 1.00 0.00 C ATOM 1362 O LYS A 99 -11.359 -6.089 -1.914 1.00 0.00 O ATOM 1363 CB LYS A 99 -13.037 -5.949 0.545 1.00 0.00 C ATOM 1364 CG LYS A 99 -13.804 -7.260 0.520 1.00 0.00 C ATOM 1365 CD LYS A 99 -15.280 -7.038 0.240 1.00 0.00 C ATOM 1366 CE LYS A 99 -16.063 -6.810 1.524 1.00 0.00 C ATOM 1367 NZ LYS A 99 -17.435 -6.298 1.254 1.00 0.00 N ATOM 0 H LYS A 99 -11.467 -4.040 0.684 1.00 0.00 H new ATOM 0 HA LYS A 99 -11.206 -6.824 1.259 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -13.294 -5.405 1.454 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -13.358 -5.334 -0.296 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -13.383 -7.914 -0.243 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -13.687 -7.769 1.477 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -15.401 -6.178 -0.419 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -15.686 -7.902 -0.286 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -16.127 -7.745 2.081 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -15.528 -6.100 2.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -17.936 -6.156 2.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -17.374 -5.393 0.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -17.955 -6.987 0.674 1.00 0.00 H new ATOM 1381 N VAL A 100 -10.509 -7.882 -0.853 1.00 0.00 N ATOM 1382 CA VAL A 100 -10.079 -8.541 -2.080 1.00 0.00 C ATOM 1383 C VAL A 100 -11.063 -9.630 -2.493 1.00 0.00 C ATOM 1384 O VAL A 100 -11.499 -10.431 -1.667 1.00 0.00 O ATOM 1385 CB VAL A 100 -8.679 -9.162 -1.923 1.00 0.00 C ATOM 1386 CG1 VAL A 100 -8.274 -9.897 -3.192 1.00 0.00 C ATOM 1387 CG2 VAL A 100 -7.658 -8.092 -1.568 1.00 0.00 C ATOM 0 H VAL A 100 -10.302 -8.402 -0.000 1.00 0.00 H new ATOM 0 HA VAL A 100 -10.043 -7.775 -2.855 1.00 0.00 H new ATOM 0 HB VAL A 100 -8.712 -9.885 -1.108 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -7.282 -10.329 -3.061 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.992 -10.692 -3.397 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.258 -9.198 -4.028 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.674 -8.549 -1.461 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.626 -7.343 -2.359 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.941 -7.616 -0.629 1.00 0.00 H new ATOM 1397 N GLU A 101 -11.407 -9.653 -3.777 1.00 0.00 N ATOM 1398 CA GLU A 101 -12.340 -10.645 -4.299 1.00 0.00 C ATOM 1399 C GLU A 101 -11.594 -11.850 -4.864 1.00 0.00 C ATOM 1400 O GLU A 101 -10.441 -11.756 -5.286 1.00 0.00 O ATOM 1401 CB GLU A 101 -13.224 -10.025 -5.383 1.00 0.00 C ATOM 1402 CG GLU A 101 -14.382 -9.209 -4.832 1.00 0.00 C ATOM 1403 CD GLU A 101 -15.338 -8.748 -5.914 1.00 0.00 C ATOM 1404 OE1 GLU A 101 -15.792 -9.599 -6.707 1.00 0.00 O ATOM 1405 OE2 GLU A 101 -15.632 -7.535 -5.969 1.00 0.00 O ATOM 0 H GLU A 101 -11.054 -8.997 -4.474 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.969 -10.983 -3.476 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -12.611 -9.386 -6.019 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -13.619 -10.820 -6.016 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -14.927 -9.806 -4.101 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -13.990 -8.340 -4.304 1.00 0.00 H new ATOM 1412 N PRO A 102 -12.265 -13.011 -4.873 1.00 0.00 N ATOM 1413 CA PRO A 102 -11.686 -14.257 -5.383 1.00 0.00 C ATOM 1414 C PRO A 102 -11.508 -14.236 -6.897 1.00 0.00 C ATOM 1415 O PRO A 102 -12.253 -13.565 -7.610 1.00 0.00 O ATOM 1416 CB PRO A 102 -12.714 -15.317 -4.980 1.00 0.00 C ATOM 1417 CG PRO A 102 -14.001 -14.574 -4.869 1.00 0.00 C ATOM 1418 CD PRO A 102 -13.643 -13.196 -4.386 1.00 0.00 C ATOM 0 HA PRO A 102 -10.689 -14.437 -4.982 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -12.778 -16.110 -5.725 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -12.446 -15.789 -4.034 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -14.511 -14.530 -5.832 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -14.678 -15.068 -4.172 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -14.317 -12.441 -4.790 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -13.698 -13.124 -3.300 1.00 0.00 H new ATOM 1426 N ALA A 103 -10.516 -14.976 -7.382 1.00 0.00 N ATOM 1427 CA ALA A 103 -10.242 -15.044 -8.812 1.00 0.00 C ATOM 1428 C ALA A 103 -11.084 -16.125 -9.481 1.00 0.00 C ATOM 1429 O ALA A 103 -10.590 -16.881 -10.318 1.00 0.00 O ATOM 1430 CB ALA A 103 -8.762 -15.300 -9.054 1.00 0.00 C ATOM 0 H ALA A 103 -9.889 -15.537 -6.805 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.511 -14.085 -9.255 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -8.572 -15.348 -10.126 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.177 -14.491 -8.618 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -8.476 -16.245 -8.592 1.00 0.00 H new ATOM 1436 N VAL A 104 -12.358 -16.193 -9.107 1.00 0.00 N ATOM 1437 CA VAL A 104 -13.269 -17.181 -9.672 1.00 0.00 C ATOM 1438 C VAL A 104 -13.634 -16.833 -11.111 1.00 0.00 C ATOM 1439 O VAL A 104 -14.153 -15.752 -11.386 1.00 0.00 O ATOM 1440 CB VAL A 104 -14.559 -17.295 -8.839 1.00 0.00 C ATOM 1441 CG1 VAL A 104 -14.250 -17.807 -7.441 1.00 0.00 C ATOM 1442 CG2 VAL A 104 -15.274 -15.954 -8.779 1.00 0.00 C ATOM 0 H VAL A 104 -12.782 -15.575 -8.415 1.00 0.00 H new ATOM 0 HA VAL A 104 -12.748 -18.139 -9.655 1.00 0.00 H new ATOM 0 HB VAL A 104 -15.221 -18.013 -9.324 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -15.174 -17.881 -6.868 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -13.785 -18.791 -7.508 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -13.568 -17.117 -6.943 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -16.184 -16.053 -8.186 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -14.620 -15.213 -8.319 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -15.532 -15.634 -9.788 1.00 0.00 H new ATOM 1452 N ASP A 105 -13.359 -17.757 -12.025 1.00 0.00 N ATOM 1453 CA ASP A 105 -13.660 -17.549 -13.437 1.00 0.00 C ATOM 1454 C ASP A 105 -13.977 -18.873 -14.125 1.00 0.00 C ATOM 1455 O ASP A 105 -13.932 -19.936 -13.504 1.00 0.00 O ATOM 1456 CB ASP A 105 -12.484 -16.865 -14.135 1.00 0.00 C ATOM 1457 CG ASP A 105 -12.919 -16.058 -15.343 1.00 0.00 C ATOM 1458 OD1 ASP A 105 -14.014 -15.458 -15.293 1.00 0.00 O ATOM 1459 OD2 ASP A 105 -12.163 -16.024 -16.336 1.00 0.00 O ATOM 0 H ASP A 105 -12.928 -18.657 -11.814 1.00 0.00 H new ATOM 0 HA ASP A 105 -14.537 -16.905 -13.506 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.976 -16.210 -13.427 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -11.761 -17.619 -14.446 1.00 0.00 H new ATOM 1464 N THR A 106 -14.299 -18.802 -15.413 1.00 0.00 N ATOM 1465 CA THR A 106 -14.626 -19.994 -16.186 1.00 0.00 C ATOM 1466 C THR A 106 -13.399 -20.531 -16.914 1.00 0.00 C ATOM 1467 O THR A 106 -12.600 -19.765 -17.452 1.00 0.00 O ATOM 1468 CB THR A 106 -15.736 -19.709 -17.216 1.00 0.00 C ATOM 1469 OG1 THR A 106 -16.905 -19.216 -16.552 1.00 0.00 O ATOM 1470 CG2 THR A 106 -16.083 -20.966 -17.999 1.00 0.00 C ATOM 0 H THR A 106 -14.340 -17.931 -15.943 1.00 0.00 H new ATOM 0 HA THR A 106 -14.981 -20.742 -15.478 1.00 0.00 H new ATOM 0 HB THR A 106 -15.370 -18.955 -17.913 1.00 0.00 H new ATOM 0 HG1 THR A 106 -17.605 -19.036 -17.213 1.00 0.00 H new ATOM 0 HG21 THR A 106 -16.869 -20.740 -18.720 1.00 0.00 H new ATOM 0 HG22 THR A 106 -15.198 -21.322 -18.526 1.00 0.00 H new ATOM 0 HG23 THR A 106 -16.431 -21.738 -17.313 1.00 0.00 H new ATOM 1478 N SER A 107 -13.255 -21.852 -16.927 1.00 0.00 N ATOM 1479 CA SER A 107 -12.123 -22.492 -17.587 1.00 0.00 C ATOM 1480 C SER A 107 -10.826 -21.750 -17.280 1.00 0.00 C ATOM 1481 O SER A 107 -9.990 -21.548 -18.160 1.00 0.00 O ATOM 1482 CB SER A 107 -12.349 -22.542 -19.099 1.00 0.00 C ATOM 1483 OG SER A 107 -12.253 -21.250 -19.673 1.00 0.00 O ATOM 0 H SER A 107 -13.908 -22.500 -16.488 1.00 0.00 H new ATOM 0 HA SER A 107 -12.039 -23.510 -17.205 1.00 0.00 H new ATOM 0 HB2 SER A 107 -11.613 -23.203 -19.558 1.00 0.00 H new ATOM 0 HB3 SER A 107 -13.332 -22.964 -19.309 1.00 0.00 H new ATOM 0 HG SER A 107 -12.186 -20.580 -18.961 1.00 0.00 H new ATOM 1489 N SER A 108 -10.666 -21.346 -16.023 1.00 0.00 N ATOM 1490 CA SER A 108 -9.472 -20.622 -15.599 1.00 0.00 C ATOM 1491 C SER A 108 -8.255 -21.542 -15.587 1.00 0.00 C ATOM 1492 O SER A 108 -8.367 -22.734 -15.305 1.00 0.00 O ATOM 1493 CB SER A 108 -9.683 -20.019 -14.209 1.00 0.00 C ATOM 1494 OG SER A 108 -8.610 -19.163 -13.857 1.00 0.00 O ATOM 0 H SER A 108 -11.347 -21.507 -15.281 1.00 0.00 H new ATOM 0 HA SER A 108 -9.291 -19.818 -16.313 1.00 0.00 H new ATOM 0 HB2 SER A 108 -10.619 -19.461 -14.189 1.00 0.00 H new ATOM 0 HB3 SER A 108 -9.772 -20.817 -13.472 1.00 0.00 H new ATOM 0 HG SER A 108 -8.769 -18.789 -12.965 1.00 0.00 H new ATOM 1500 N GLY A 109 -7.092 -20.978 -15.896 1.00 0.00 N ATOM 1501 CA GLY A 109 -5.870 -21.761 -15.916 1.00 0.00 C ATOM 1502 C GLY A 109 -4.812 -21.162 -16.822 1.00 0.00 C ATOM 1503 O GLY A 109 -4.939 -20.034 -17.299 1.00 0.00 O ATOM 0 H GLY A 109 -6.974 -19.993 -16.133 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -5.475 -21.838 -14.903 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -6.097 -22.774 -16.248 1.00 0.00 H new ATOM 1507 N PRO A 110 -3.737 -21.925 -17.069 1.00 0.00 N ATOM 1508 CA PRO A 110 -2.632 -21.483 -17.924 1.00 0.00 C ATOM 1509 C PRO A 110 -3.032 -21.401 -19.393 1.00 0.00 C ATOM 1510 O PRO A 110 -2.972 -22.392 -20.119 1.00 0.00 O ATOM 1511 CB PRO A 110 -1.570 -22.567 -17.719 1.00 0.00 C ATOM 1512 CG PRO A 110 -2.338 -23.779 -17.318 1.00 0.00 C ATOM 1513 CD PRO A 110 -3.519 -23.280 -16.533 1.00 0.00 C ATOM 0 HA PRO A 110 -2.293 -20.480 -17.666 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -1.002 -22.743 -18.633 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.854 -22.279 -16.949 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -2.661 -24.343 -18.193 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.724 -24.449 -16.716 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.394 -23.914 -16.676 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.311 -23.260 -15.463 1.00 0.00 H new ATOM 1521 N SER A 111 -3.441 -20.212 -19.824 1.00 0.00 N ATOM 1522 CA SER A 111 -3.855 -20.000 -21.206 1.00 0.00 C ATOM 1523 C SER A 111 -2.644 -19.942 -22.132 1.00 0.00 C ATOM 1524 O SER A 111 -1.551 -19.556 -21.720 1.00 0.00 O ATOM 1525 CB SER A 111 -4.665 -18.708 -21.326 1.00 0.00 C ATOM 1526 OG SER A 111 -5.362 -18.656 -22.559 1.00 0.00 O ATOM 0 H SER A 111 -3.495 -19.380 -19.236 1.00 0.00 H new ATOM 0 HA SER A 111 -4.480 -20.841 -21.505 1.00 0.00 H new ATOM 0 HB2 SER A 111 -5.374 -18.642 -20.501 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.999 -17.849 -21.244 1.00 0.00 H new ATOM 0 HG SER A 111 -5.873 -17.822 -22.611 1.00 0.00 H new ATOM 1532 N SER A 112 -2.849 -20.330 -23.387 1.00 0.00 N ATOM 1533 CA SER A 112 -1.774 -20.327 -24.373 1.00 0.00 C ATOM 1534 C SER A 112 -1.290 -18.906 -24.644 1.00 0.00 C ATOM 1535 O SER A 112 -1.982 -18.113 -25.282 1.00 0.00 O ATOM 1536 CB SER A 112 -2.246 -20.974 -25.676 1.00 0.00 C ATOM 1537 OG SER A 112 -3.306 -20.234 -26.258 1.00 0.00 O ATOM 0 H SER A 112 -3.749 -20.650 -23.745 1.00 0.00 H new ATOM 0 HA SER A 112 -0.943 -20.905 -23.969 1.00 0.00 H new ATOM 0 HB2 SER A 112 -1.414 -21.036 -26.377 1.00 0.00 H new ATOM 0 HB3 SER A 112 -2.575 -21.995 -25.481 1.00 0.00 H new ATOM 0 HG SER A 112 -3.167 -19.278 -26.093 1.00 0.00 H new ATOM 1543 N GLY A 113 -0.095 -18.590 -24.153 1.00 0.00 N ATOM 1544 CA GLY A 113 0.462 -17.265 -24.352 1.00 0.00 C ATOM 1545 C GLY A 113 1.972 -17.245 -24.215 1.00 0.00 C ATOM 1546 O GLY A 113 2.693 -17.354 -25.207 1.00 0.00 O ATOM 0 H GLY A 113 0.497 -19.228 -23.621 1.00 0.00 H new ATOM 0 HA2 GLY A 113 0.185 -16.903 -25.342 1.00 0.00 H new ATOM 0 HA3 GLY A 113 0.025 -16.578 -23.627 1.00 0.00 H new TER 1550 GLY A 113