USER MOD reduce.3.24.130724 H: found=0, std=0, add=766, rem=0, adj=32 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 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 180:sc= -0.0616 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.048 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 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=-0.01) 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 36 CYS SG : rot 18:sc= 0.306 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc=-0.00705 USER MOD Single : A 52 SER OG : rot -27:sc= 0.162 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.235) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.16 X(o=-0.16,f=0) USER MOD Single : A 62 ASN : amide:sc= 0.0284 K(o=0.028,f=-1.2) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= -0.0197 USER MOD Single : A 72 TYR OH : rot 165:sc= 0.0603 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 154:sc= -2.78 (180deg=-3.98!) USER MOD Single : A 80 TYR OH : rot 149:sc= 1.22 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 -152:sc= -0.914 (180deg=-1.68!) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 HIS :FLIP no HD1:sc= -1.71 F(o=-2.7!,f=-1.7) USER MOD Single : A 99 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0158) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0117 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 20:sc= 0.709 USER MOD Single : A 112 SER OG : rot 21:sc= 1.18 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.690 12.093 -6.733 1.00 0.00 N ATOM 2 CA GLY A 1 24.304 12.488 -6.565 1.00 0.00 C ATOM 3 C GLY A 1 24.148 13.671 -5.629 1.00 0.00 C ATOM 4 O GLY A 1 24.344 13.545 -4.421 1.00 0.00 O ATOM 0 H1 GLY A 1 25.744 11.281 -7.381 1.00 0.00 H new ATOM 0 H2 GLY A 1 26.232 12.888 -7.128 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.089 11.826 -5.810 1.00 0.00 H new ATOM 0 HA2 GLY A 1 23.881 12.740 -7.537 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.733 11.644 -6.177 1.00 0.00 H new ATOM 8 N SER A 2 23.795 14.823 -6.189 1.00 0.00 N ATOM 9 CA SER A 2 23.618 16.035 -5.397 1.00 0.00 C ATOM 10 C SER A 2 22.146 16.258 -5.067 1.00 0.00 C ATOM 11 O SER A 2 21.353 16.626 -5.934 1.00 0.00 O ATOM 12 CB SER A 2 24.173 17.246 -6.149 1.00 0.00 C ATOM 13 OG SER A 2 24.411 18.329 -5.267 1.00 0.00 O ATOM 0 H SER A 2 23.626 14.943 -7.188 1.00 0.00 H new ATOM 0 HA SER A 2 24.167 15.913 -4.463 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.100 16.972 -6.652 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.469 17.551 -6.923 1.00 0.00 H new ATOM 0 HG SER A 2 24.767 19.090 -5.772 1.00 0.00 H new ATOM 19 N SER A 3 21.788 16.032 -3.807 1.00 0.00 N ATOM 20 CA SER A 3 20.410 16.204 -3.361 1.00 0.00 C ATOM 21 C SER A 3 20.160 17.640 -2.912 1.00 0.00 C ATOM 22 O SER A 3 19.174 18.263 -3.304 1.00 0.00 O ATOM 23 CB SER A 3 20.097 15.238 -2.217 1.00 0.00 C ATOM 24 OG SER A 3 20.940 15.477 -1.103 1.00 0.00 O ATOM 0 H SER A 3 22.433 15.729 -3.077 1.00 0.00 H new ATOM 0 HA SER A 3 19.752 15.985 -4.202 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.054 15.348 -1.919 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.224 14.211 -2.559 1.00 0.00 H new ATOM 0 HG SER A 3 20.719 14.848 -0.385 1.00 0.00 H new ATOM 30 N GLY A 4 21.062 18.161 -2.085 1.00 0.00 N ATOM 31 CA GLY A 4 20.922 19.519 -1.594 1.00 0.00 C ATOM 32 C GLY A 4 19.892 19.633 -0.487 1.00 0.00 C ATOM 33 O GLY A 4 19.387 18.625 0.005 1.00 0.00 O ATOM 0 H GLY A 4 21.887 17.666 -1.747 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.886 19.870 -1.226 1.00 0.00 H new ATOM 0 HA3 GLY A 4 20.638 20.173 -2.419 1.00 0.00 H new ATOM 37 N SER A 5 19.582 20.864 -0.094 1.00 0.00 N ATOM 38 CA SER A 5 18.611 21.106 0.966 1.00 0.00 C ATOM 39 C SER A 5 17.448 21.952 0.455 1.00 0.00 C ATOM 40 O SER A 5 17.571 23.167 0.303 1.00 0.00 O ATOM 41 CB SER A 5 19.281 21.802 2.152 1.00 0.00 C ATOM 42 OG SER A 5 19.966 20.870 2.970 1.00 0.00 O ATOM 0 H SER A 5 19.989 21.709 -0.494 1.00 0.00 H new ATOM 0 HA SER A 5 18.220 20.143 1.293 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.981 22.554 1.788 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.529 22.325 2.743 1.00 0.00 H new ATOM 0 HG SER A 5 20.387 21.340 3.720 1.00 0.00 H new ATOM 48 N SER A 6 16.321 21.300 0.192 1.00 0.00 N ATOM 49 CA SER A 6 15.137 21.990 -0.306 1.00 0.00 C ATOM 50 C SER A 6 14.064 22.078 0.776 1.00 0.00 C ATOM 51 O SER A 6 13.574 23.161 1.093 1.00 0.00 O ATOM 52 CB SER A 6 14.579 21.270 -1.535 1.00 0.00 C ATOM 53 OG SER A 6 14.356 19.897 -1.264 1.00 0.00 O ATOM 0 H SER A 6 16.202 20.294 0.315 1.00 0.00 H new ATOM 0 HA SER A 6 15.429 23.002 -0.588 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.645 21.740 -1.843 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.276 21.371 -2.367 1.00 0.00 H new ATOM 0 HG SER A 6 13.998 19.460 -2.064 1.00 0.00 H new ATOM 59 N GLY A 7 13.704 20.929 1.338 1.00 0.00 N ATOM 60 CA GLY A 7 12.692 20.897 2.378 1.00 0.00 C ATOM 61 C GLY A 7 12.900 19.756 3.354 1.00 0.00 C ATOM 62 O GLY A 7 13.548 18.756 3.045 1.00 0.00 O ATOM 0 H GLY A 7 14.095 20.019 1.092 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.703 21.842 2.921 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.707 20.804 1.920 1.00 0.00 H new ATOM 66 N PRO A 8 12.342 19.899 4.566 1.00 0.00 N ATOM 67 CA PRO A 8 12.457 18.882 5.615 1.00 0.00 C ATOM 68 C PRO A 8 11.663 17.622 5.291 1.00 0.00 C ATOM 69 O PRO A 8 10.756 17.644 4.458 1.00 0.00 O ATOM 70 CB PRO A 8 11.875 19.578 6.848 1.00 0.00 C ATOM 71 CG PRO A 8 10.948 20.607 6.300 1.00 0.00 C ATOM 72 CD PRO A 8 11.556 21.065 5.004 1.00 0.00 C ATOM 0 HA PRO A 8 13.485 18.544 5.744 1.00 0.00 H new ATOM 0 HB2 PRO A 8 11.348 18.872 7.489 1.00 0.00 H new ATOM 0 HB3 PRO A 8 12.659 20.034 7.453 1.00 0.00 H new ATOM 0 HG2 PRO A 8 9.954 20.190 6.139 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.836 21.440 6.994 1.00 0.00 H new ATOM 0 HD2 PRO A 8 10.792 21.332 4.274 1.00 0.00 H new ATOM 0 HD3 PRO A 8 12.185 21.944 5.144 1.00 0.00 H new ATOM 80 N PHE A 9 12.008 16.523 5.954 1.00 0.00 N ATOM 81 CA PHE A 9 11.327 15.252 5.736 1.00 0.00 C ATOM 82 C PHE A 9 9.960 15.244 6.414 1.00 0.00 C ATOM 83 O PHE A 9 9.801 15.761 7.520 1.00 0.00 O ATOM 84 CB PHE A 9 12.178 14.096 6.264 1.00 0.00 C ATOM 85 CG PHE A 9 11.372 12.897 6.673 1.00 0.00 C ATOM 86 CD1 PHE A 9 10.813 12.819 7.938 1.00 0.00 C ATOM 87 CD2 PHE A 9 11.173 11.846 5.792 1.00 0.00 C ATOM 88 CE1 PHE A 9 10.071 11.716 8.317 1.00 0.00 C ATOM 89 CE2 PHE A 9 10.432 10.741 6.165 1.00 0.00 C ATOM 90 CZ PHE A 9 9.879 10.676 7.429 1.00 0.00 C ATOM 0 H PHE A 9 12.756 16.487 6.647 1.00 0.00 H new ATOM 0 HA PHE A 9 11.181 15.126 4.663 1.00 0.00 H new ATOM 0 HB2 PHE A 9 12.891 13.799 5.495 1.00 0.00 H new ATOM 0 HB3 PHE A 9 12.758 14.443 7.119 1.00 0.00 H new ATOM 0 HD1 PHE A 9 10.959 13.630 8.637 1.00 0.00 H new ATOM 0 HD2 PHE A 9 11.602 11.891 4.802 1.00 0.00 H new ATOM 0 HE1 PHE A 9 9.642 11.668 9.307 1.00 0.00 H new ATOM 0 HE2 PHE A 9 10.285 9.929 5.469 1.00 0.00 H new ATOM 0 HZ PHE A 9 9.298 9.814 7.722 1.00 0.00 H new ATOM 100 N ASP A 10 8.977 14.655 5.742 1.00 0.00 N ATOM 101 CA ASP A 10 7.623 14.579 6.278 1.00 0.00 C ATOM 102 C ASP A 10 6.795 13.548 5.518 1.00 0.00 C ATOM 103 O ASP A 10 6.550 13.675 4.318 1.00 0.00 O ATOM 104 CB ASP A 10 6.946 15.948 6.208 1.00 0.00 C ATOM 105 CG ASP A 10 5.902 16.134 7.291 1.00 0.00 C ATOM 106 OD1 ASP A 10 6.268 16.078 8.484 1.00 0.00 O ATOM 107 OD2 ASP A 10 4.718 16.334 6.947 1.00 0.00 O ATOM 0 H ASP A 10 9.092 14.223 4.825 1.00 0.00 H new ATOM 0 HA ASP A 10 7.688 14.268 7.321 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.701 16.729 6.298 1.00 0.00 H new ATOM 0 HB3 ASP A 10 6.477 16.069 5.231 1.00 0.00 H new ATOM 112 N PRO A 11 6.354 12.500 6.231 1.00 0.00 N ATOM 113 CA PRO A 11 5.547 11.427 5.643 1.00 0.00 C ATOM 114 C PRO A 11 4.143 11.892 5.275 1.00 0.00 C ATOM 115 O PRO A 11 3.497 11.316 4.399 1.00 0.00 O ATOM 116 CB PRO A 11 5.488 10.378 6.757 1.00 0.00 C ATOM 117 CG PRO A 11 5.685 11.150 8.016 1.00 0.00 C ATOM 118 CD PRO A 11 6.609 12.284 7.665 1.00 0.00 C ATOM 0 HA PRO A 11 5.976 11.057 4.712 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.531 9.856 6.759 1.00 0.00 H new ATOM 0 HB3 PRO A 11 6.263 9.622 6.631 1.00 0.00 H new ATOM 0 HG2 PRO A 11 4.735 11.524 8.397 1.00 0.00 H new ATOM 0 HG3 PRO A 11 6.116 10.522 8.796 1.00 0.00 H new ATOM 0 HD2 PRO A 11 6.390 13.177 8.251 1.00 0.00 H new ATOM 0 HD3 PRO A 11 7.651 12.026 7.854 1.00 0.00 H new ATOM 126 N SER A 12 3.675 12.939 5.948 1.00 0.00 N ATOM 127 CA SER A 12 2.345 13.479 5.693 1.00 0.00 C ATOM 128 C SER A 12 2.289 14.163 4.331 1.00 0.00 C ATOM 129 O SER A 12 1.215 14.338 3.754 1.00 0.00 O ATOM 130 CB SER A 12 1.956 14.472 6.791 1.00 0.00 C ATOM 131 OG SER A 12 1.338 13.811 7.881 1.00 0.00 O ATOM 0 H SER A 12 4.197 13.430 6.674 1.00 0.00 H new ATOM 0 HA SER A 12 1.637 12.651 5.694 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.844 15.001 7.138 1.00 0.00 H new ATOM 0 HB3 SER A 12 1.277 15.221 6.384 1.00 0.00 H new ATOM 0 HG SER A 12 1.101 14.467 8.569 1.00 0.00 H new ATOM 137 N LYS A 13 3.453 14.548 3.820 1.00 0.00 N ATOM 138 CA LYS A 13 3.540 15.211 2.524 1.00 0.00 C ATOM 139 C LYS A 13 3.438 14.199 1.387 1.00 0.00 C ATOM 140 O LYS A 13 3.295 14.572 0.223 1.00 0.00 O ATOM 141 CB LYS A 13 4.853 15.989 2.413 1.00 0.00 C ATOM 142 CG LYS A 13 5.043 17.022 3.510 1.00 0.00 C ATOM 143 CD LYS A 13 4.245 18.285 3.230 1.00 0.00 C ATOM 144 CE LYS A 13 3.934 19.043 4.511 1.00 0.00 C ATOM 145 NZ LYS A 13 2.711 19.882 4.377 1.00 0.00 N ATOM 0 H LYS A 13 4.351 14.412 4.284 1.00 0.00 H new ATOM 0 HA LYS A 13 2.705 15.907 2.443 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.685 15.286 2.440 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.889 16.489 1.445 1.00 0.00 H new ATOM 0 HG2 LYS A 13 4.734 16.600 4.466 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.101 17.271 3.598 1.00 0.00 H new ATOM 0 HD2 LYS A 13 4.806 18.928 2.552 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.315 18.024 2.725 1.00 0.00 H new ATOM 0 HE2 LYS A 13 3.800 18.335 5.329 1.00 0.00 H new ATOM 0 HE3 LYS A 13 4.782 19.676 4.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.533 20.382 5.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 2.847 20.575 3.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 1.897 19.275 4.152 1.00 0.00 H new ATOM 159 N VAL A 14 3.511 12.918 1.733 1.00 0.00 N ATOM 160 CA VAL A 14 3.424 11.852 0.741 1.00 0.00 C ATOM 161 C VAL A 14 1.974 11.560 0.374 1.00 0.00 C ATOM 162 O VAL A 14 1.125 11.381 1.248 1.00 0.00 O ATOM 163 CB VAL A 14 4.085 10.557 1.250 1.00 0.00 C ATOM 164 CG1 VAL A 14 3.919 9.438 0.233 1.00 0.00 C ATOM 165 CG2 VAL A 14 5.556 10.795 1.557 1.00 0.00 C ATOM 0 H VAL A 14 3.630 12.593 2.692 1.00 0.00 H new ATOM 0 HA VAL A 14 3.956 12.199 -0.145 1.00 0.00 H new ATOM 0 HB VAL A 14 3.589 10.254 2.172 1.00 0.00 H new ATOM 0 HG11 VAL A 14 4.392 8.531 0.609 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.858 9.252 0.067 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.388 9.728 -0.707 1.00 0.00 H new ATOM 0 HG21 VAL A 14 6.007 9.870 1.915 1.00 0.00 H new ATOM 0 HG22 VAL A 14 6.068 11.122 0.652 1.00 0.00 H new ATOM 0 HG23 VAL A 14 5.648 11.564 2.324 1.00 0.00 H new ATOM 175 N VAL A 15 1.696 11.512 -0.925 1.00 0.00 N ATOM 176 CA VAL A 15 0.348 11.240 -1.408 1.00 0.00 C ATOM 177 C VAL A 15 0.280 9.891 -2.117 1.00 0.00 C ATOM 178 O VAL A 15 0.907 9.693 -3.157 1.00 0.00 O ATOM 179 CB VAL A 15 -0.135 12.339 -2.373 1.00 0.00 C ATOM 180 CG1 VAL A 15 -1.485 11.970 -2.970 1.00 0.00 C ATOM 181 CG2 VAL A 15 -0.207 13.680 -1.659 1.00 0.00 C ATOM 0 H VAL A 15 2.387 11.658 -1.661 1.00 0.00 H new ATOM 0 HA VAL A 15 -0.304 11.222 -0.534 1.00 0.00 H new ATOM 0 HB VAL A 15 0.584 12.425 -3.188 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -1.810 12.758 -3.649 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -1.396 11.032 -3.518 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.217 11.855 -2.171 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -0.550 14.445 -2.355 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -0.904 13.611 -0.824 1.00 0.00 H new ATOM 0 HG23 VAL A 15 0.782 13.947 -1.285 1.00 0.00 H new ATOM 191 N ALA A 16 -0.486 8.967 -1.546 1.00 0.00 N ATOM 192 CA ALA A 16 -0.637 7.638 -2.125 1.00 0.00 C ATOM 193 C ALA A 16 -2.082 7.382 -2.542 1.00 0.00 C ATOM 194 O ALA A 16 -3.016 7.696 -1.805 1.00 0.00 O ATOM 195 CB ALA A 16 -0.176 6.577 -1.136 1.00 0.00 C ATOM 0 H ALA A 16 -1.011 9.114 -0.684 1.00 0.00 H new ATOM 0 HA ALA A 16 -0.013 7.584 -3.017 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -0.294 5.589 -1.581 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.873 6.741 -0.889 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -0.776 6.640 -0.228 1.00 0.00 H new ATOM 201 N SER A 17 -2.257 6.811 -3.730 1.00 0.00 N ATOM 202 CA SER A 17 -3.588 6.518 -4.247 1.00 0.00 C ATOM 203 C SER A 17 -3.536 5.391 -5.275 1.00 0.00 C ATOM 204 O SER A 17 -2.463 4.888 -5.606 1.00 0.00 O ATOM 205 CB SER A 17 -4.201 7.770 -4.878 1.00 0.00 C ATOM 206 OG SER A 17 -3.440 8.204 -5.992 1.00 0.00 O ATOM 0 H SER A 17 -1.494 6.543 -4.352 1.00 0.00 H new ATOM 0 HA SER A 17 -4.212 6.198 -3.413 1.00 0.00 H new ATOM 0 HB2 SER A 17 -5.223 7.560 -5.192 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.253 8.567 -4.136 1.00 0.00 H new ATOM 0 HG SER A 17 -3.853 9.004 -6.379 1.00 0.00 H new ATOM 212 N GLY A 18 -4.704 5.000 -5.775 1.00 0.00 N ATOM 213 CA GLY A 18 -4.770 3.935 -6.759 1.00 0.00 C ATOM 214 C GLY A 18 -5.902 2.964 -6.487 1.00 0.00 C ATOM 215 O GLY A 18 -6.536 2.996 -5.433 1.00 0.00 O ATOM 0 H GLY A 18 -5.605 5.401 -5.517 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.898 4.368 -7.751 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.824 3.393 -6.767 1.00 0.00 H new ATOM 219 N PRO A 19 -6.171 2.076 -7.457 1.00 0.00 N ATOM 220 CA PRO A 19 -7.236 1.076 -7.341 1.00 0.00 C ATOM 221 C PRO A 19 -6.911 0.000 -6.310 1.00 0.00 C ATOM 222 O PRO A 19 -7.807 -0.560 -5.680 1.00 0.00 O ATOM 223 CB PRO A 19 -7.306 0.469 -8.744 1.00 0.00 C ATOM 224 CG PRO A 19 -5.948 0.684 -9.318 1.00 0.00 C ATOM 225 CD PRO A 19 -5.455 1.981 -8.740 1.00 0.00 C ATOM 0 HA PRO A 19 -8.175 1.517 -7.005 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.556 -0.591 -8.705 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -8.072 0.955 -9.348 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -5.280 -0.138 -9.059 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -5.987 0.732 -10.406 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -4.374 1.973 -8.598 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -5.684 2.824 -9.392 1.00 0.00 H new ATOM 233 N GLY A 20 -5.623 -0.284 -6.143 1.00 0.00 N ATOM 234 CA GLY A 20 -5.203 -1.292 -5.187 1.00 0.00 C ATOM 235 C GLY A 20 -5.603 -0.946 -3.767 1.00 0.00 C ATOM 236 O GLY A 20 -5.868 -1.834 -2.955 1.00 0.00 O ATOM 0 H GLY A 20 -4.863 0.166 -6.653 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.640 -2.252 -5.461 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.120 -1.408 -5.238 1.00 0.00 H new ATOM 240 N LEU A 21 -5.646 0.347 -3.464 1.00 0.00 N ATOM 241 CA LEU A 21 -6.015 0.808 -2.130 1.00 0.00 C ATOM 242 C LEU A 21 -7.531 0.839 -1.966 1.00 0.00 C ATOM 243 O LEU A 21 -8.042 1.214 -0.911 1.00 0.00 O ATOM 244 CB LEU A 21 -5.434 2.199 -1.872 1.00 0.00 C ATOM 245 CG LEU A 21 -4.021 2.238 -1.290 1.00 0.00 C ATOM 246 CD1 LEU A 21 -3.306 3.514 -1.708 1.00 0.00 C ATOM 247 CD2 LEU A 21 -4.065 2.123 0.227 1.00 0.00 C ATOM 0 H LEU A 21 -5.430 1.094 -4.124 1.00 0.00 H new ATOM 0 HA LEU A 21 -5.603 0.108 -1.403 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.434 2.751 -2.812 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.101 2.729 -1.192 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.464 1.388 -1.683 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.302 3.524 -1.284 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.241 3.555 -2.795 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.862 4.378 -1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.050 2.153 0.624 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.640 2.953 0.638 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.537 1.181 0.507 1.00 0.00 H new ATOM 259 N GLU A 22 -8.244 0.441 -3.015 1.00 0.00 N ATOM 260 CA GLU A 22 -9.702 0.422 -2.984 1.00 0.00 C ATOM 261 C GLU A 22 -10.229 -1.009 -3.036 1.00 0.00 C ATOM 262 O GLU A 22 -11.229 -1.338 -2.397 1.00 0.00 O ATOM 263 CB GLU A 22 -10.269 1.229 -4.154 1.00 0.00 C ATOM 264 CG GLU A 22 -9.625 2.596 -4.320 1.00 0.00 C ATOM 265 CD GLU A 22 -10.481 3.549 -5.131 1.00 0.00 C ATOM 266 OE1 GLU A 22 -11.545 3.966 -4.626 1.00 0.00 O ATOM 267 OE2 GLU A 22 -10.088 3.877 -6.270 1.00 0.00 O ATOM 0 H GLU A 22 -7.836 0.128 -3.896 1.00 0.00 H new ATOM 0 HA GLU A 22 -10.026 0.876 -2.048 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -10.137 0.660 -5.074 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.342 1.357 -4.010 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -9.439 3.028 -3.337 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -8.656 2.481 -4.806 1.00 0.00 H new ATOM 274 N HIS A 23 -9.549 -1.856 -3.803 1.00 0.00 N ATOM 275 CA HIS A 23 -9.948 -3.252 -3.939 1.00 0.00 C ATOM 276 C HIS A 23 -8.870 -4.058 -4.657 1.00 0.00 C ATOM 277 O HIS A 23 -7.942 -3.494 -5.237 1.00 0.00 O ATOM 278 CB HIS A 23 -11.270 -3.355 -4.701 1.00 0.00 C ATOM 279 CG HIS A 23 -11.136 -3.099 -6.170 1.00 0.00 C ATOM 280 ND1 HIS A 23 -11.496 -4.021 -7.131 1.00 0.00 N ATOM 281 CD2 HIS A 23 -10.679 -2.017 -6.843 1.00 0.00 C ATOM 282 CE1 HIS A 23 -11.265 -3.517 -8.330 1.00 0.00 C ATOM 283 NE2 HIS A 23 -10.770 -2.301 -8.183 1.00 0.00 N ATOM 0 H HIS A 23 -8.720 -1.600 -4.339 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.080 -3.665 -2.939 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.690 -4.350 -4.551 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -11.979 -2.643 -4.280 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -10.311 -1.100 -6.407 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -11.449 -4.015 -9.271 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -10.499 -1.675 -8.942 1.00 0.00 H new ATOM 292 N GLY A 24 -8.998 -5.381 -4.614 1.00 0.00 N ATOM 293 CA GLY A 24 -8.027 -6.242 -5.264 1.00 0.00 C ATOM 294 C GLY A 24 -8.603 -7.597 -5.623 1.00 0.00 C ATOM 295 O GLY A 24 -9.690 -7.958 -5.171 1.00 0.00 O ATOM 0 H GLY A 24 -9.757 -5.872 -4.141 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.662 -5.755 -6.168 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -7.169 -6.378 -4.606 1.00 0.00 H new ATOM 299 N LYS A 25 -7.875 -8.350 -6.440 1.00 0.00 N ATOM 300 CA LYS A 25 -8.318 -9.674 -6.861 1.00 0.00 C ATOM 301 C LYS A 25 -7.190 -10.692 -6.733 1.00 0.00 C ATOM 302 O LYS A 25 -6.050 -10.421 -7.111 1.00 0.00 O ATOM 303 CB LYS A 25 -8.820 -9.631 -8.306 1.00 0.00 C ATOM 304 CG LYS A 25 -9.785 -10.752 -8.649 1.00 0.00 C ATOM 305 CD LYS A 25 -10.081 -10.797 -10.138 1.00 0.00 C ATOM 306 CE LYS A 25 -11.370 -11.552 -10.428 1.00 0.00 C ATOM 307 NZ LYS A 25 -11.469 -11.950 -11.860 1.00 0.00 N ATOM 0 H LYS A 25 -6.974 -8.066 -6.824 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.135 -9.981 -6.208 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.311 -8.674 -8.483 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.965 -9.680 -8.980 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.363 -11.706 -8.332 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.714 -10.615 -8.096 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.158 -9.781 -10.526 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.253 -11.275 -10.660 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.419 -12.441 -9.800 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.224 -10.928 -10.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.361 -12.462 -12.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.447 -11.100 -12.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.668 -12.567 -12.105 1.00 0.00 H new ATOM 321 N VAL A 26 -7.515 -11.866 -6.201 1.00 0.00 N ATOM 322 CA VAL A 26 -6.529 -12.926 -6.027 1.00 0.00 C ATOM 323 C VAL A 26 -5.773 -13.192 -7.324 1.00 0.00 C ATOM 324 O VAL A 26 -6.334 -13.718 -8.284 1.00 0.00 O ATOM 325 CB VAL A 26 -7.189 -14.234 -5.552 1.00 0.00 C ATOM 326 CG1 VAL A 26 -6.172 -15.364 -5.518 1.00 0.00 C ATOM 327 CG2 VAL A 26 -7.830 -14.042 -4.186 1.00 0.00 C ATOM 0 H VAL A 26 -8.454 -12.107 -5.883 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.828 -12.584 -5.265 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.972 -14.503 -6.261 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.657 -16.280 -5.180 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.764 -15.517 -6.517 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.365 -15.106 -4.832 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.291 -14.976 -3.866 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.068 -13.748 -3.464 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.591 -13.264 -4.247 1.00 0.00 H new ATOM 337 N GLY A 27 -4.495 -12.825 -7.344 1.00 0.00 N ATOM 338 CA GLY A 27 -3.683 -13.033 -8.528 1.00 0.00 C ATOM 339 C GLY A 27 -3.419 -11.745 -9.283 1.00 0.00 C ATOM 340 O GLY A 27 -2.417 -11.627 -9.988 1.00 0.00 O ATOM 0 H GLY A 27 -4.008 -12.388 -6.562 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.733 -13.483 -8.239 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.183 -13.742 -9.188 1.00 0.00 H new ATOM 344 N GLU A 28 -4.320 -10.779 -9.136 1.00 0.00 N ATOM 345 CA GLU A 28 -4.180 -9.495 -9.812 1.00 0.00 C ATOM 346 C GLU A 28 -3.078 -8.658 -9.168 1.00 0.00 C ATOM 347 O GLU A 28 -2.399 -9.110 -8.247 1.00 0.00 O ATOM 348 CB GLU A 28 -5.504 -8.729 -9.779 1.00 0.00 C ATOM 349 CG GLU A 28 -6.422 -9.049 -10.947 1.00 0.00 C ATOM 350 CD GLU A 28 -6.051 -8.291 -12.206 1.00 0.00 C ATOM 351 OE1 GLU A 28 -4.933 -8.503 -12.720 1.00 0.00 O ATOM 352 OE2 GLU A 28 -6.880 -7.484 -12.678 1.00 0.00 O ATOM 0 H GLU A 28 -5.154 -10.861 -8.555 1.00 0.00 H new ATOM 0 HA GLU A 28 -3.906 -9.687 -10.849 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.022 -8.956 -8.848 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -5.295 -7.659 -9.775 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.387 -10.120 -11.149 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.449 -8.809 -10.673 1.00 0.00 H new ATOM 359 N ALA A 29 -2.908 -7.435 -9.660 1.00 0.00 N ATOM 360 CA ALA A 29 -1.891 -6.534 -9.132 1.00 0.00 C ATOM 361 C ALA A 29 -2.497 -5.189 -8.745 1.00 0.00 C ATOM 362 O ALA A 29 -3.048 -4.481 -9.586 1.00 0.00 O ATOM 363 CB ALA A 29 -0.778 -6.340 -10.150 1.00 0.00 C ATOM 0 H ALA A 29 -3.461 -7.046 -10.423 1.00 0.00 H new ATOM 0 HA ALA A 29 -1.471 -6.986 -8.233 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -0.026 -5.665 -9.742 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -0.318 -7.303 -10.374 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.191 -5.913 -11.064 1.00 0.00 H new ATOM 369 N GLY A 30 -2.392 -4.844 -7.465 1.00 0.00 N ATOM 370 CA GLY A 30 -2.935 -3.585 -6.989 1.00 0.00 C ATOM 371 C GLY A 30 -2.086 -2.397 -7.395 1.00 0.00 C ATOM 372 O GLY A 30 -1.025 -2.157 -6.817 1.00 0.00 O ATOM 0 H GLY A 30 -1.941 -5.414 -6.749 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -3.944 -3.457 -7.380 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -3.016 -3.615 -5.902 1.00 0.00 H new ATOM 376 N LEU A 31 -2.550 -1.653 -8.392 1.00 0.00 N ATOM 377 CA LEU A 31 -1.825 -0.484 -8.877 1.00 0.00 C ATOM 378 C LEU A 31 -1.793 0.614 -7.818 1.00 0.00 C ATOM 379 O LEU A 31 -2.834 1.034 -7.312 1.00 0.00 O ATOM 380 CB LEU A 31 -2.471 0.047 -10.158 1.00 0.00 C ATOM 381 CG LEU A 31 -2.495 -0.916 -11.346 1.00 0.00 C ATOM 382 CD1 LEU A 31 -3.204 -0.283 -12.532 1.00 0.00 C ATOM 383 CD2 LEU A 31 -1.080 -1.329 -11.726 1.00 0.00 C ATOM 0 H LEU A 31 -3.426 -1.838 -8.881 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.800 -0.787 -9.093 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -3.497 0.338 -9.931 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.943 0.952 -10.460 1.00 0.00 H new ATOM 0 HG LEU A 31 -3.047 -1.809 -11.054 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.211 -0.983 -13.368 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.229 -0.038 -12.255 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.681 0.627 -12.825 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.116 -2.014 -12.573 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.504 -0.445 -11.999 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.606 -1.824 -10.879 1.00 0.00 H new ATOM 395 N LEU A 32 -0.591 1.076 -7.489 1.00 0.00 N ATOM 396 CA LEU A 32 -0.423 2.127 -6.492 1.00 0.00 C ATOM 397 C LEU A 32 0.624 3.141 -6.941 1.00 0.00 C ATOM 398 O LEU A 32 1.709 2.771 -7.389 1.00 0.00 O ATOM 399 CB LEU A 32 -0.018 1.521 -5.147 1.00 0.00 C ATOM 400 CG LEU A 32 -0.947 0.442 -4.589 1.00 0.00 C ATOM 401 CD1 LEU A 32 -0.428 -0.073 -3.256 1.00 0.00 C ATOM 402 CD2 LEU A 32 -2.362 0.982 -4.440 1.00 0.00 C ATOM 0 H LEU A 32 0.281 0.739 -7.898 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.377 2.643 -6.379 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.980 1.095 -5.249 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.052 2.326 -4.415 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.969 -0.390 -5.292 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.102 -0.840 -2.875 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.566 -0.499 -3.393 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.375 0.750 -2.544 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.010 0.201 -4.042 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -2.357 1.832 -3.758 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.734 1.300 -5.414 1.00 0.00 H new ATOM 414 N SER A 33 0.292 4.422 -6.817 1.00 0.00 N ATOM 415 CA SER A 33 1.203 5.490 -7.211 1.00 0.00 C ATOM 416 C SER A 33 1.424 6.468 -6.062 1.00 0.00 C ATOM 417 O SER A 33 0.472 7.007 -5.497 1.00 0.00 O ATOM 418 CB SER A 33 0.652 6.234 -8.430 1.00 0.00 C ATOM 419 OG SER A 33 1.025 5.587 -9.634 1.00 0.00 O ATOM 0 H SER A 33 -0.602 4.746 -6.447 1.00 0.00 H new ATOM 0 HA SER A 33 2.161 5.040 -7.470 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.435 6.290 -8.365 1.00 0.00 H new ATOM 0 HB3 SER A 33 1.024 7.258 -8.434 1.00 0.00 H new ATOM 0 HG SER A 33 0.659 6.081 -10.398 1.00 0.00 H new ATOM 425 N VAL A 34 2.689 6.692 -5.719 1.00 0.00 N ATOM 426 CA VAL A 34 3.038 7.605 -4.637 1.00 0.00 C ATOM 427 C VAL A 34 3.767 8.834 -5.169 1.00 0.00 C ATOM 428 O VAL A 34 4.917 8.748 -5.600 1.00 0.00 O ATOM 429 CB VAL A 34 3.922 6.914 -3.582 1.00 0.00 C ATOM 430 CG1 VAL A 34 4.331 7.900 -2.499 1.00 0.00 C ATOM 431 CG2 VAL A 34 3.198 5.719 -2.981 1.00 0.00 C ATOM 0 H VAL A 34 3.489 6.253 -6.175 1.00 0.00 H new ATOM 0 HA VAL A 34 2.103 7.914 -4.170 1.00 0.00 H new ATOM 0 HB VAL A 34 4.827 6.553 -4.071 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.955 7.394 -1.763 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.892 8.721 -2.947 1.00 0.00 H new ATOM 0 HG13 VAL A 34 3.440 8.294 -2.010 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.837 5.243 -2.238 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.276 6.054 -2.506 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.962 5.003 -3.768 1.00 0.00 H new ATOM 441 N ASP A 35 3.091 9.977 -5.135 1.00 0.00 N ATOM 442 CA ASP A 35 3.675 11.225 -5.613 1.00 0.00 C ATOM 443 C ASP A 35 4.384 11.961 -4.480 1.00 0.00 C ATOM 444 O ASP A 35 3.760 12.348 -3.492 1.00 0.00 O ATOM 445 CB ASP A 35 2.593 12.119 -6.221 1.00 0.00 C ATOM 446 CG ASP A 35 2.345 11.813 -7.685 1.00 0.00 C ATOM 447 OD1 ASP A 35 1.941 10.673 -7.992 1.00 0.00 O ATOM 448 OD2 ASP A 35 2.555 12.715 -8.523 1.00 0.00 O ATOM 0 H ASP A 35 2.138 10.065 -4.782 1.00 0.00 H new ATOM 0 HA ASP A 35 4.410 10.984 -6.381 1.00 0.00 H new ATOM 0 HB2 ASP A 35 1.665 11.991 -5.664 1.00 0.00 H new ATOM 0 HB3 ASP A 35 2.887 13.163 -6.116 1.00 0.00 H new ATOM 453 N CYS A 36 5.690 12.150 -4.631 1.00 0.00 N ATOM 454 CA CYS A 36 6.485 12.838 -3.620 1.00 0.00 C ATOM 455 C CYS A 36 6.800 14.266 -4.055 1.00 0.00 C ATOM 456 O CYS A 36 7.237 14.500 -5.182 1.00 0.00 O ATOM 457 CB CYS A 36 7.783 12.075 -3.355 1.00 0.00 C ATOM 458 SG CYS A 36 8.965 12.131 -4.723 1.00 0.00 S ATOM 0 H CYS A 36 6.221 11.837 -5.444 1.00 0.00 H new ATOM 0 HA CYS A 36 5.902 12.878 -2.700 1.00 0.00 H new ATOM 0 HB2 CYS A 36 8.257 12.484 -2.463 1.00 0.00 H new ATOM 0 HB3 CYS A 36 7.542 11.034 -3.139 1.00 0.00 H new ATOM 0 HG CYS A 36 8.658 13.110 -5.522 1.00 0.00 H new ATOM 464 N SER A 37 6.573 15.217 -3.155 1.00 0.00 N ATOM 465 CA SER A 37 6.828 16.623 -3.447 1.00 0.00 C ATOM 466 C SER A 37 7.771 17.231 -2.413 1.00 0.00 C ATOM 467 O SER A 37 8.898 17.606 -2.732 1.00 0.00 O ATOM 468 CB SER A 37 5.513 17.405 -3.477 1.00 0.00 C ATOM 469 OG SER A 37 5.603 18.519 -4.349 1.00 0.00 O ATOM 0 H SER A 37 6.213 15.040 -2.217 1.00 0.00 H new ATOM 0 HA SER A 37 7.303 16.685 -4.426 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.704 16.750 -3.800 1.00 0.00 H new ATOM 0 HB3 SER A 37 5.265 17.745 -2.471 1.00 0.00 H new ATOM 0 HG SER A 37 4.750 19.002 -4.352 1.00 0.00 H new ATOM 475 N GLU A 38 7.299 17.324 -1.174 1.00 0.00 N ATOM 476 CA GLU A 38 8.100 17.887 -0.093 1.00 0.00 C ATOM 477 C GLU A 38 8.311 16.863 1.018 1.00 0.00 C ATOM 478 O GLU A 38 8.670 17.215 2.141 1.00 0.00 O ATOM 479 CB GLU A 38 7.425 19.138 0.473 1.00 0.00 C ATOM 480 CG GLU A 38 7.709 20.398 -0.327 1.00 0.00 C ATOM 481 CD GLU A 38 9.127 20.902 -0.138 1.00 0.00 C ATOM 482 OE1 GLU A 38 9.714 20.631 0.931 1.00 0.00 O ATOM 483 OE2 GLU A 38 9.648 21.566 -1.057 1.00 0.00 O ATOM 0 H GLU A 38 6.367 17.017 -0.894 1.00 0.00 H new ATOM 0 HA GLU A 38 9.073 18.161 -0.501 1.00 0.00 H new ATOM 0 HB2 GLU A 38 6.348 18.975 0.508 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.758 19.287 1.500 1.00 0.00 H new ATOM 0 HG2 GLU A 38 7.536 20.199 -1.385 1.00 0.00 H new ATOM 0 HG3 GLU A 38 7.008 21.178 -0.031 1.00 0.00 H new ATOM 490 N ALA A 39 8.085 15.593 0.696 1.00 0.00 N ATOM 491 CA ALA A 39 8.251 14.517 1.665 1.00 0.00 C ATOM 492 C ALA A 39 9.706 14.396 2.105 1.00 0.00 C ATOM 493 O ALA A 39 10.018 13.688 3.062 1.00 0.00 O ATOM 494 CB ALA A 39 7.762 13.200 1.081 1.00 0.00 C ATOM 0 H ALA A 39 7.786 15.285 -0.229 1.00 0.00 H new ATOM 0 HA ALA A 39 7.651 14.756 2.543 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.892 12.406 1.816 1.00 0.00 H new ATOM 0 HB2 ALA A 39 6.707 13.286 0.823 1.00 0.00 H new ATOM 0 HB3 ALA A 39 8.337 12.964 0.185 1.00 0.00 H new ATOM 500 N GLY A 40 10.593 15.091 1.400 1.00 0.00 N ATOM 501 CA GLY A 40 12.005 15.046 1.733 1.00 0.00 C ATOM 502 C GLY A 40 12.623 13.689 1.459 1.00 0.00 C ATOM 503 O GLY A 40 12.115 12.902 0.659 1.00 0.00 O ATOM 0 H GLY A 40 10.359 15.685 0.604 1.00 0.00 H new ATOM 0 HA2 GLY A 40 12.535 15.806 1.158 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.135 15.295 2.786 1.00 0.00 H new ATOM 507 N PRO A 41 13.746 13.399 2.132 1.00 0.00 N ATOM 508 CA PRO A 41 14.458 12.127 1.972 1.00 0.00 C ATOM 509 C PRO A 41 13.685 10.952 2.561 1.00 0.00 C ATOM 510 O PRO A 41 12.527 11.091 2.950 1.00 0.00 O ATOM 511 CB PRO A 41 15.761 12.351 2.744 1.00 0.00 C ATOM 512 CG PRO A 41 15.429 13.398 3.751 1.00 0.00 C ATOM 513 CD PRO A 41 14.407 14.289 3.101 1.00 0.00 C ATOM 0 HA PRO A 41 14.606 11.872 0.923 1.00 0.00 H new ATOM 0 HB2 PRO A 41 16.100 11.433 3.224 1.00 0.00 H new ATOM 0 HB3 PRO A 41 16.562 12.679 2.082 1.00 0.00 H new ATOM 0 HG2 PRO A 41 15.033 12.951 4.663 1.00 0.00 H new ATOM 0 HG3 PRO A 41 16.317 13.964 4.033 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.700 14.687 3.829 1.00 0.00 H new ATOM 0 HD3 PRO A 41 14.873 15.143 2.609 1.00 0.00 H new ATOM 521 N GLY A 42 14.336 9.794 2.624 1.00 0.00 N ATOM 522 CA GLY A 42 13.694 8.611 3.167 1.00 0.00 C ATOM 523 C GLY A 42 13.407 7.568 2.105 1.00 0.00 C ATOM 524 O GLY A 42 13.368 7.878 0.915 1.00 0.00 O ATOM 0 H GLY A 42 15.296 9.654 2.309 1.00 0.00 H new ATOM 0 HA2 GLY A 42 14.332 8.176 3.936 1.00 0.00 H new ATOM 0 HA3 GLY A 42 12.761 8.898 3.652 1.00 0.00 H new ATOM 528 N ALA A 43 13.206 6.327 2.536 1.00 0.00 N ATOM 529 CA ALA A 43 12.921 5.235 1.614 1.00 0.00 C ATOM 530 C ALA A 43 11.480 4.757 1.757 1.00 0.00 C ATOM 531 O ALA A 43 10.957 4.655 2.867 1.00 0.00 O ATOM 532 CB ALA A 43 13.887 4.082 1.846 1.00 0.00 C ATOM 0 H ALA A 43 13.235 6.053 3.518 1.00 0.00 H new ATOM 0 HA ALA A 43 13.054 5.607 0.598 1.00 0.00 H new ATOM 0 HB1 ALA A 43 13.662 3.273 1.150 1.00 0.00 H new ATOM 0 HB2 ALA A 43 14.909 4.426 1.685 1.00 0.00 H new ATOM 0 HB3 ALA A 43 13.783 3.720 2.869 1.00 0.00 H new ATOM 538 N LEU A 44 10.843 4.466 0.628 1.00 0.00 N ATOM 539 CA LEU A 44 9.461 3.999 0.628 1.00 0.00 C ATOM 540 C LEU A 44 9.400 2.479 0.738 1.00 0.00 C ATOM 541 O LEU A 44 10.151 1.768 0.073 1.00 0.00 O ATOM 542 CB LEU A 44 8.747 4.459 -0.644 1.00 0.00 C ATOM 543 CG LEU A 44 7.355 3.871 -0.882 1.00 0.00 C ATOM 544 CD1 LEU A 44 6.425 4.215 0.271 1.00 0.00 C ATOM 545 CD2 LEU A 44 6.783 4.374 -2.200 1.00 0.00 C ATOM 0 H LEU A 44 11.261 4.545 -0.299 1.00 0.00 H new ATOM 0 HA LEU A 44 8.958 4.428 1.495 1.00 0.00 H new ATOM 0 HB2 LEU A 44 8.661 5.545 -0.616 1.00 0.00 H new ATOM 0 HB3 LEU A 44 9.375 4.211 -1.499 1.00 0.00 H new ATOM 0 HG LEU A 44 7.444 2.786 -0.937 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.440 3.788 0.084 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.827 3.806 1.198 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.340 5.298 0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.792 3.946 -2.354 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.708 5.461 -2.173 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.438 4.076 -3.018 1.00 0.00 H new ATOM 557 N GLY A 45 8.497 1.987 1.581 1.00 0.00 N ATOM 558 CA GLY A 45 8.352 0.555 1.761 1.00 0.00 C ATOM 559 C GLY A 45 6.938 0.157 2.135 1.00 0.00 C ATOM 560 O GLY A 45 6.384 0.655 3.116 1.00 0.00 O ATOM 0 H GLY A 45 7.863 2.555 2.143 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.638 0.046 0.841 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.038 0.218 2.538 1.00 0.00 H new ATOM 564 N LEU A 46 6.351 -0.741 1.352 1.00 0.00 N ATOM 565 CA LEU A 46 4.991 -1.205 1.605 1.00 0.00 C ATOM 566 C LEU A 46 4.985 -2.670 2.030 1.00 0.00 C ATOM 567 O LEU A 46 5.921 -3.413 1.738 1.00 0.00 O ATOM 568 CB LEU A 46 4.128 -1.021 0.355 1.00 0.00 C ATOM 569 CG LEU A 46 2.678 -1.495 0.466 1.00 0.00 C ATOM 570 CD1 LEU A 46 1.878 -0.561 1.360 1.00 0.00 C ATOM 571 CD2 LEU A 46 2.042 -1.591 -0.914 1.00 0.00 C ATOM 0 H LEU A 46 6.795 -1.163 0.536 1.00 0.00 H new ATOM 0 HA LEU A 46 4.575 -0.609 2.417 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.125 0.037 0.093 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.601 -1.553 -0.471 1.00 0.00 H new ATOM 0 HG LEU A 46 2.673 -2.488 0.917 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.849 -0.914 1.427 1.00 0.00 H new ATOM 0 HD12 LEU A 46 2.321 -0.543 2.356 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.890 0.444 0.939 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.011 -1.930 -0.816 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.059 -0.611 -1.391 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.601 -2.301 -1.524 1.00 0.00 H new ATOM 583 N GLU A 47 3.924 -3.077 2.718 1.00 0.00 N ATOM 584 CA GLU A 47 3.797 -4.454 3.182 1.00 0.00 C ATOM 585 C GLU A 47 2.339 -4.904 3.154 1.00 0.00 C ATOM 586 O GLU A 47 1.523 -4.453 3.957 1.00 0.00 O ATOM 587 CB GLU A 47 4.358 -4.592 4.598 1.00 0.00 C ATOM 588 CG GLU A 47 4.357 -6.021 5.116 1.00 0.00 C ATOM 589 CD GLU A 47 4.616 -6.101 6.608 1.00 0.00 C ATOM 590 OE1 GLU A 47 5.685 -5.633 7.051 1.00 0.00 O ATOM 591 OE2 GLU A 47 3.748 -6.631 7.333 1.00 0.00 O ATOM 0 H GLU A 47 3.140 -2.474 2.967 1.00 0.00 H new ATOM 0 HA GLU A 47 4.370 -5.092 2.509 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.378 -4.209 4.615 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.773 -3.969 5.274 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.396 -6.484 4.893 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.118 -6.596 4.588 1.00 0.00 H new ATOM 598 N ALA A 48 2.020 -5.798 2.223 1.00 0.00 N ATOM 599 CA ALA A 48 0.662 -6.311 2.091 1.00 0.00 C ATOM 600 C ALA A 48 0.508 -7.649 2.807 1.00 0.00 C ATOM 601 O ALA A 48 1.155 -8.633 2.450 1.00 0.00 O ATOM 602 CB ALA A 48 0.291 -6.451 0.622 1.00 0.00 C ATOM 0 H ALA A 48 2.683 -6.181 1.550 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.016 -5.598 2.560 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -0.726 -6.835 0.538 1.00 0.00 H new ATOM 0 HB2 ALA A 48 0.352 -5.477 0.137 1.00 0.00 H new ATOM 0 HB3 ALA A 48 0.981 -7.142 0.137 1.00 0.00 H new ATOM 608 N VAL A 49 -0.351 -7.677 3.821 1.00 0.00 N ATOM 609 CA VAL A 49 -0.589 -8.894 4.588 1.00 0.00 C ATOM 610 C VAL A 49 -2.082 -9.150 4.762 1.00 0.00 C ATOM 611 O VAL A 49 -2.829 -8.264 5.179 1.00 0.00 O ATOM 612 CB VAL A 49 0.074 -8.822 5.976 1.00 0.00 C ATOM 613 CG1 VAL A 49 -0.413 -9.960 6.860 1.00 0.00 C ATOM 614 CG2 VAL A 49 1.589 -8.849 5.844 1.00 0.00 C ATOM 0 H VAL A 49 -0.894 -6.871 4.130 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.145 -9.715 4.025 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.210 -7.881 6.447 1.00 0.00 H new ATOM 0 HG11 VAL A 49 0.066 -9.893 7.837 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -1.494 -9.890 6.981 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -0.161 -10.914 6.397 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.041 -8.797 6.834 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.895 -9.773 5.353 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.918 -7.996 5.250 1.00 0.00 H new ATOM 624 N SER A 50 -2.510 -10.366 4.442 1.00 0.00 N ATOM 625 CA SER A 50 -3.915 -10.739 4.560 1.00 0.00 C ATOM 626 C SER A 50 -4.328 -10.843 6.025 1.00 0.00 C ATOM 627 O SER A 50 -3.482 -10.930 6.915 1.00 0.00 O ATOM 628 CB SER A 50 -4.174 -12.069 3.850 1.00 0.00 C ATOM 629 OG SER A 50 -5.562 -12.337 3.760 1.00 0.00 O ATOM 0 H SER A 50 -1.904 -11.111 4.099 1.00 0.00 H new ATOM 0 HA SER A 50 -4.513 -9.960 4.086 1.00 0.00 H new ATOM 0 HB2 SER A 50 -3.740 -12.042 2.850 1.00 0.00 H new ATOM 0 HB3 SER A 50 -3.679 -12.876 4.390 1.00 0.00 H new ATOM 0 HG SER A 50 -5.701 -13.192 3.301 1.00 0.00 H new ATOM 635 N ASP A 51 -5.634 -10.832 6.267 1.00 0.00 N ATOM 636 CA ASP A 51 -6.161 -10.927 7.624 1.00 0.00 C ATOM 637 C ASP A 51 -5.522 -12.090 8.375 1.00 0.00 C ATOM 638 O ASP A 51 -5.075 -11.937 9.512 1.00 0.00 O ATOM 639 CB ASP A 51 -7.681 -11.096 7.593 1.00 0.00 C ATOM 640 CG ASP A 51 -8.109 -12.339 6.837 1.00 0.00 C ATOM 641 OD1 ASP A 51 -7.554 -12.591 5.747 1.00 0.00 O ATOM 642 OD2 ASP A 51 -9.000 -13.059 7.335 1.00 0.00 O ATOM 0 H ASP A 51 -6.347 -10.758 5.542 1.00 0.00 H new ATOM 0 HA ASP A 51 -5.917 -10.003 8.148 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -8.059 -11.147 8.614 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.132 -10.219 7.129 1.00 0.00 H new ATOM 647 N SER A 52 -5.483 -13.253 7.733 1.00 0.00 N ATOM 648 CA SER A 52 -4.903 -14.444 8.342 1.00 0.00 C ATOM 649 C SER A 52 -3.395 -14.288 8.513 1.00 0.00 C ATOM 650 O SER A 52 -2.761 -15.043 9.248 1.00 0.00 O ATOM 651 CB SER A 52 -5.207 -15.678 7.490 1.00 0.00 C ATOM 652 OG SER A 52 -4.537 -16.822 7.992 1.00 0.00 O ATOM 0 H SER A 52 -5.846 -13.396 6.791 1.00 0.00 H new ATOM 0 HA SER A 52 -5.351 -14.573 9.327 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.282 -15.859 7.477 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.901 -15.497 6.460 1.00 0.00 H new ATOM 0 HG SER A 52 -3.728 -16.544 8.471 1.00 0.00 H new ATOM 658 N GLY A 53 -2.827 -13.301 7.826 1.00 0.00 N ATOM 659 CA GLY A 53 -1.399 -13.063 7.914 1.00 0.00 C ATOM 660 C GLY A 53 -0.636 -13.677 6.757 1.00 0.00 C ATOM 661 O GLY A 53 0.236 -14.523 6.957 1.00 0.00 O ATOM 0 H GLY A 53 -3.331 -12.663 7.210 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -1.214 -11.989 7.938 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -1.023 -13.473 8.851 1.00 0.00 H new ATOM 665 N THR A 54 -0.965 -13.252 5.541 1.00 0.00 N ATOM 666 CA THR A 54 -0.308 -13.767 4.347 1.00 0.00 C ATOM 667 C THR A 54 0.443 -12.662 3.612 1.00 0.00 C ATOM 668 O THR A 54 -0.167 -11.766 3.027 1.00 0.00 O ATOM 669 CB THR A 54 -1.320 -14.414 3.383 1.00 0.00 C ATOM 670 OG1 THR A 54 -2.114 -15.379 4.081 1.00 0.00 O ATOM 671 CG2 THR A 54 -0.606 -15.083 2.218 1.00 0.00 C ATOM 0 H THR A 54 -1.683 -12.552 5.358 1.00 0.00 H new ATOM 0 HA THR A 54 0.401 -14.525 4.679 1.00 0.00 H new ATOM 0 HB THR A 54 -1.966 -13.629 2.990 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.756 -15.784 3.461 1.00 0.00 H new ATOM 0 HG21 THR A 54 -1.341 -15.533 1.551 1.00 0.00 H new ATOM 0 HG22 THR A 54 -0.027 -14.339 1.671 1.00 0.00 H new ATOM 0 HG23 THR A 54 0.062 -15.857 2.597 1.00 0.00 H new ATOM 679 N LYS A 55 1.769 -12.731 3.645 1.00 0.00 N ATOM 680 CA LYS A 55 2.604 -11.738 2.980 1.00 0.00 C ATOM 681 C LYS A 55 2.460 -11.832 1.464 1.00 0.00 C ATOM 682 O LYS A 55 2.866 -12.820 0.853 1.00 0.00 O ATOM 683 CB LYS A 55 4.070 -11.926 3.376 1.00 0.00 C ATOM 684 CG LYS A 55 4.311 -11.838 4.873 1.00 0.00 C ATOM 685 CD LYS A 55 5.636 -12.473 5.262 1.00 0.00 C ATOM 686 CE LYS A 55 6.793 -11.501 5.085 1.00 0.00 C ATOM 687 NZ LYS A 55 7.385 -11.586 3.721 1.00 0.00 N ATOM 0 H LYS A 55 2.289 -13.465 4.126 1.00 0.00 H new ATOM 0 HA LYS A 55 2.272 -10.750 3.298 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.413 -12.897 3.018 1.00 0.00 H new ATOM 0 HB3 LYS A 55 4.673 -11.169 2.874 1.00 0.00 H new ATOM 0 HG2 LYS A 55 4.302 -10.793 5.183 1.00 0.00 H new ATOM 0 HG3 LYS A 55 3.499 -12.335 5.403 1.00 0.00 H new ATOM 0 HD2 LYS A 55 5.592 -12.803 6.300 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.808 -13.360 4.653 1.00 0.00 H new ATOM 0 HE2 LYS A 55 6.444 -10.484 5.267 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.562 -11.712 5.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 8.400 -11.802 3.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 6.910 -12.338 3.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 7.260 -10.677 3.231 1.00 0.00 H new ATOM 701 N ALA A 56 1.881 -10.797 0.864 1.00 0.00 N ATOM 702 CA ALA A 56 1.687 -10.763 -0.580 1.00 0.00 C ATOM 703 C ALA A 56 2.924 -10.219 -1.287 1.00 0.00 C ATOM 704 O ALA A 56 3.724 -9.500 -0.691 1.00 0.00 O ATOM 705 CB ALA A 56 0.466 -9.925 -0.929 1.00 0.00 C ATOM 0 H ALA A 56 1.538 -9.972 1.356 1.00 0.00 H new ATOM 0 HA ALA A 56 1.523 -11.784 -0.924 1.00 0.00 H new ATOM 0 HB1 ALA A 56 0.333 -9.908 -2.011 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -0.418 -10.358 -0.461 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.607 -8.907 -0.565 1.00 0.00 H new ATOM 711 N GLU A 57 3.073 -10.569 -2.561 1.00 0.00 N ATOM 712 CA GLU A 57 4.214 -10.116 -3.348 1.00 0.00 C ATOM 713 C GLU A 57 4.096 -8.630 -3.674 1.00 0.00 C ATOM 714 O GLU A 57 3.195 -8.213 -4.402 1.00 0.00 O ATOM 715 CB GLU A 57 4.323 -10.926 -4.642 1.00 0.00 C ATOM 716 CG GLU A 57 5.748 -11.074 -5.149 1.00 0.00 C ATOM 717 CD GLU A 57 5.808 -11.482 -6.608 1.00 0.00 C ATOM 718 OE1 GLU A 57 5.146 -10.821 -7.436 1.00 0.00 O ATOM 719 OE2 GLU A 57 6.518 -12.460 -6.923 1.00 0.00 O ATOM 0 H GLU A 57 2.419 -11.164 -3.069 1.00 0.00 H new ATOM 0 HA GLU A 57 5.115 -10.269 -2.754 1.00 0.00 H new ATOM 0 HB2 GLU A 57 3.900 -11.917 -4.477 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.720 -10.446 -5.413 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.276 -10.130 -5.018 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.269 -11.818 -4.546 1.00 0.00 H new ATOM 726 N VAL A 58 5.011 -7.836 -3.128 1.00 0.00 N ATOM 727 CA VAL A 58 5.011 -6.397 -3.360 1.00 0.00 C ATOM 728 C VAL A 58 6.278 -5.956 -4.084 1.00 0.00 C ATOM 729 O VAL A 58 7.371 -6.446 -3.798 1.00 0.00 O ATOM 730 CB VAL A 58 4.889 -5.615 -2.039 1.00 0.00 C ATOM 731 CG1 VAL A 58 4.889 -4.117 -2.302 1.00 0.00 C ATOM 732 CG2 VAL A 58 3.635 -6.033 -1.286 1.00 0.00 C ATOM 0 H VAL A 58 5.762 -8.165 -2.522 1.00 0.00 H new ATOM 0 HA VAL A 58 4.145 -6.178 -3.984 1.00 0.00 H new ATOM 0 HB VAL A 58 5.753 -5.850 -1.418 1.00 0.00 H new ATOM 0 HG11 VAL A 58 4.802 -3.582 -1.357 1.00 0.00 H new ATOM 0 HG12 VAL A 58 5.819 -3.834 -2.795 1.00 0.00 H new ATOM 0 HG13 VAL A 58 4.046 -3.860 -2.943 1.00 0.00 H new ATOM 0 HG21 VAL A 58 3.565 -5.470 -0.355 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.757 -5.830 -1.900 1.00 0.00 H new ATOM 0 HG23 VAL A 58 3.683 -7.099 -1.063 1.00 0.00 H new ATOM 742 N SER A 59 6.125 -5.028 -5.023 1.00 0.00 N ATOM 743 CA SER A 59 7.257 -4.523 -5.791 1.00 0.00 C ATOM 744 C SER A 59 7.174 -3.007 -5.948 1.00 0.00 C ATOM 745 O SER A 59 6.113 -2.461 -6.249 1.00 0.00 O ATOM 746 CB SER A 59 7.304 -5.187 -7.168 1.00 0.00 C ATOM 747 OG SER A 59 8.390 -4.697 -7.934 1.00 0.00 O ATOM 0 H SER A 59 5.228 -4.610 -5.270 1.00 0.00 H new ATOM 0 HA SER A 59 8.170 -4.766 -5.247 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.395 -6.267 -7.051 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.369 -5.001 -7.697 1.00 0.00 H new ATOM 0 HG SER A 59 8.399 -5.138 -8.809 1.00 0.00 H new ATOM 753 N ILE A 60 8.302 -2.335 -5.740 1.00 0.00 N ATOM 754 CA ILE A 60 8.358 -0.883 -5.860 1.00 0.00 C ATOM 755 C ILE A 60 9.318 -0.459 -6.965 1.00 0.00 C ATOM 756 O ILE A 60 10.485 -0.851 -6.971 1.00 0.00 O ATOM 757 CB ILE A 60 8.793 -0.226 -4.537 1.00 0.00 C ATOM 758 CG1 ILE A 60 7.947 -0.754 -3.377 1.00 0.00 C ATOM 759 CG2 ILE A 60 8.681 1.288 -4.635 1.00 0.00 C ATOM 760 CD1 ILE A 60 8.633 -0.652 -2.032 1.00 0.00 C ATOM 0 H ILE A 60 9.188 -2.772 -5.488 1.00 0.00 H new ATOM 0 HA ILE A 60 7.351 -0.548 -6.109 1.00 0.00 H new ATOM 0 HB ILE A 60 9.835 -0.482 -4.347 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.009 -0.200 -3.340 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.694 -1.797 -3.568 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.992 1.738 -3.692 1.00 0.00 H new ATOM 0 HG22 ILE A 60 9.323 1.649 -5.438 1.00 0.00 H new ATOM 0 HG23 ILE A 60 7.648 1.564 -4.845 1.00 0.00 H new ATOM 0 HD11 ILE A 60 7.975 -1.045 -1.257 1.00 0.00 H new ATOM 0 HD12 ILE A 60 9.557 -1.230 -2.050 1.00 0.00 H new ATOM 0 HD13 ILE A 60 8.862 0.392 -1.819 1.00 0.00 H new ATOM 772 N GLN A 61 8.820 0.345 -7.899 1.00 0.00 N ATOM 773 CA GLN A 61 9.635 0.823 -9.009 1.00 0.00 C ATOM 774 C GLN A 61 10.047 2.276 -8.796 1.00 0.00 C ATOM 775 O GLN A 61 9.200 3.160 -8.674 1.00 0.00 O ATOM 776 CB GLN A 61 8.870 0.686 -10.327 1.00 0.00 C ATOM 777 CG GLN A 61 9.770 0.461 -11.531 1.00 0.00 C ATOM 778 CD GLN A 61 8.991 0.337 -12.826 1.00 0.00 C ATOM 779 OE1 GLN A 61 9.178 -0.611 -13.589 1.00 0.00 O ATOM 780 NE2 GLN A 61 8.110 1.298 -13.082 1.00 0.00 N ATOM 0 H GLN A 61 7.856 0.679 -7.909 1.00 0.00 H new ATOM 0 HA GLN A 61 10.536 0.212 -9.054 1.00 0.00 H new ATOM 0 HB2 GLN A 61 8.170 -0.146 -10.247 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.278 1.587 -10.489 1.00 0.00 H new ATOM 0 HG2 GLN A 61 10.475 1.289 -11.613 1.00 0.00 H new ATOM 0 HG3 GLN A 61 10.358 -0.444 -11.377 1.00 0.00 H new ATOM 0 HE21 GLN A 61 7.987 2.066 -12.422 1.00 0.00 H new ATOM 0 HE22 GLN A 61 7.557 1.268 -13.939 1.00 0.00 H new ATOM 789 N ASN A 62 11.354 2.515 -8.752 1.00 0.00 N ATOM 790 CA ASN A 62 11.878 3.861 -8.552 1.00 0.00 C ATOM 791 C ASN A 62 11.985 4.606 -9.879 1.00 0.00 C ATOM 792 O ASN A 62 12.559 4.098 -10.842 1.00 0.00 O ATOM 793 CB ASN A 62 13.249 3.802 -7.875 1.00 0.00 C ATOM 794 CG ASN A 62 13.295 2.786 -6.750 1.00 0.00 C ATOM 795 OD1 ASN A 62 13.359 1.581 -6.989 1.00 0.00 O ATOM 796 ND2 ASN A 62 13.261 3.272 -5.514 1.00 0.00 N ATOM 0 H ASN A 62 12.069 1.794 -8.852 1.00 0.00 H new ATOM 0 HA ASN A 62 11.185 4.402 -7.907 1.00 0.00 H new ATOM 0 HB2 ASN A 62 14.007 3.553 -8.617 1.00 0.00 H new ATOM 0 HB3 ASN A 62 13.500 4.787 -7.482 1.00 0.00 H new ATOM 0 HD21 ASN A 62 13.288 2.638 -4.716 1.00 0.00 H new ATOM 0 HD22 ASN A 62 13.208 4.279 -5.363 1.00 0.00 H new ATOM 803 N ASN A 63 11.430 5.812 -9.921 1.00 0.00 N ATOM 804 CA ASN A 63 11.463 6.627 -11.130 1.00 0.00 C ATOM 805 C ASN A 63 12.300 7.885 -10.915 1.00 0.00 C ATOM 806 O ASN A 63 12.449 8.361 -9.789 1.00 0.00 O ATOM 807 CB ASN A 63 10.043 7.011 -11.551 1.00 0.00 C ATOM 808 CG ASN A 63 9.310 5.867 -12.224 1.00 0.00 C ATOM 809 OD1 ASN A 63 9.649 5.470 -13.339 1.00 0.00 O ATOM 810 ND2 ASN A 63 8.300 5.332 -11.549 1.00 0.00 N ATOM 0 H ASN A 63 10.952 6.247 -9.132 1.00 0.00 H new ATOM 0 HA ASN A 63 11.922 6.037 -11.923 1.00 0.00 H new ATOM 0 HB2 ASN A 63 9.481 7.333 -10.674 1.00 0.00 H new ATOM 0 HB3 ASN A 63 10.086 7.861 -12.231 1.00 0.00 H new ATOM 0 HD21 ASN A 63 7.770 4.560 -11.952 1.00 0.00 H new ATOM 0 HD22 ASN A 63 8.054 5.693 -10.627 1.00 0.00 H new ATOM 817 N LYS A 64 12.843 8.421 -12.003 1.00 0.00 N ATOM 818 CA LYS A 64 13.663 9.624 -11.936 1.00 0.00 C ATOM 819 C LYS A 64 12.826 10.869 -12.212 1.00 0.00 C ATOM 820 O LYS A 64 13.313 11.842 -12.788 1.00 0.00 O ATOM 821 CB LYS A 64 14.814 9.538 -12.941 1.00 0.00 C ATOM 822 CG LYS A 64 15.887 8.536 -12.552 1.00 0.00 C ATOM 823 CD LYS A 64 17.079 8.602 -13.492 1.00 0.00 C ATOM 824 CE LYS A 64 18.141 7.580 -13.118 1.00 0.00 C ATOM 825 NZ LYS A 64 19.487 7.968 -13.623 1.00 0.00 N ATOM 0 H LYS A 64 12.729 8.040 -12.942 1.00 0.00 H new ATOM 0 HA LYS A 64 14.073 9.699 -10.929 1.00 0.00 H new ATOM 0 HB2 LYS A 64 14.413 9.267 -13.918 1.00 0.00 H new ATOM 0 HB3 LYS A 64 15.269 10.523 -13.045 1.00 0.00 H new ATOM 0 HG2 LYS A 64 16.216 8.732 -11.531 1.00 0.00 H new ATOM 0 HG3 LYS A 64 15.468 7.530 -12.564 1.00 0.00 H new ATOM 0 HD2 LYS A 64 16.747 8.426 -14.515 1.00 0.00 H new ATOM 0 HD3 LYS A 64 17.510 9.603 -13.465 1.00 0.00 H new ATOM 0 HE2 LYS A 64 18.177 7.474 -12.034 1.00 0.00 H new ATOM 0 HE3 LYS A 64 17.867 6.607 -13.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 20.183 7.246 -13.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 19.460 8.045 -14.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 19.760 8.885 -13.215 1.00 0.00 H new ATOM 839 N ASP A 65 11.564 10.832 -11.797 1.00 0.00 N ATOM 840 CA ASP A 65 10.660 11.958 -11.997 1.00 0.00 C ATOM 841 C ASP A 65 10.162 12.500 -10.660 1.00 0.00 C ATOM 842 O ASP A 65 10.078 13.711 -10.462 1.00 0.00 O ATOM 843 CB ASP A 65 9.473 11.539 -12.865 1.00 0.00 C ATOM 844 CG ASP A 65 9.824 11.486 -14.339 1.00 0.00 C ATOM 845 OD1 ASP A 65 10.882 10.916 -14.678 1.00 0.00 O ATOM 846 OD2 ASP A 65 9.040 12.015 -15.154 1.00 0.00 O ATOM 0 H ASP A 65 11.144 10.034 -11.320 1.00 0.00 H new ATOM 0 HA ASP A 65 11.212 12.748 -12.506 1.00 0.00 H new ATOM 0 HB2 ASP A 65 9.119 10.560 -12.543 1.00 0.00 H new ATOM 0 HB3 ASP A 65 8.652 12.240 -12.715 1.00 0.00 H new ATOM 851 N GLY A 66 9.833 11.593 -9.746 1.00 0.00 N ATOM 852 CA GLY A 66 9.346 11.998 -8.440 1.00 0.00 C ATOM 853 C GLY A 66 8.134 11.202 -8.000 1.00 0.00 C ATOM 854 O GLY A 66 7.275 11.711 -7.278 1.00 0.00 O ATOM 0 H GLY A 66 9.895 10.585 -9.886 1.00 0.00 H new ATOM 0 HA2 GLY A 66 10.142 11.877 -7.705 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.092 13.058 -8.463 1.00 0.00 H new ATOM 858 N THR A 67 8.060 9.949 -8.437 1.00 0.00 N ATOM 859 CA THR A 67 6.943 9.081 -8.086 1.00 0.00 C ATOM 860 C THR A 67 7.398 7.635 -7.930 1.00 0.00 C ATOM 861 O THR A 67 8.506 7.276 -8.328 1.00 0.00 O ATOM 862 CB THR A 67 5.828 9.145 -9.147 1.00 0.00 C ATOM 863 OG1 THR A 67 6.328 8.695 -10.411 1.00 0.00 O ATOM 864 CG2 THR A 67 5.291 10.562 -9.283 1.00 0.00 C ATOM 0 H THR A 67 8.761 9.512 -9.035 1.00 0.00 H new ATOM 0 HA THR A 67 6.551 9.440 -7.134 1.00 0.00 H new ATOM 0 HB THR A 67 5.014 8.494 -8.827 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.613 8.737 -11.080 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.505 10.582 -10.038 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.884 10.890 -8.327 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.099 11.230 -9.582 1.00 0.00 H new ATOM 872 N TYR A 68 6.536 6.808 -7.348 1.00 0.00 N ATOM 873 CA TYR A 68 6.850 5.400 -7.137 1.00 0.00 C ATOM 874 C TYR A 68 5.691 4.511 -7.577 1.00 0.00 C ATOM 875 O TYR A 68 4.530 4.799 -7.289 1.00 0.00 O ATOM 876 CB TYR A 68 7.175 5.143 -5.665 1.00 0.00 C ATOM 877 CG TYR A 68 8.412 5.866 -5.182 1.00 0.00 C ATOM 878 CD1 TYR A 68 8.378 7.223 -4.888 1.00 0.00 C ATOM 879 CD2 TYR A 68 9.616 5.191 -5.019 1.00 0.00 C ATOM 880 CE1 TYR A 68 9.506 7.888 -4.448 1.00 0.00 C ATOM 881 CE2 TYR A 68 10.749 5.847 -4.578 1.00 0.00 C ATOM 882 CZ TYR A 68 10.689 7.196 -4.294 1.00 0.00 C ATOM 883 OH TYR A 68 11.814 7.854 -3.854 1.00 0.00 O ATOM 0 H TYR A 68 5.614 7.089 -7.014 1.00 0.00 H new ATOM 0 HA TYR A 68 7.722 5.154 -7.743 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.325 5.449 -5.055 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.308 4.072 -5.513 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.453 7.768 -5.005 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.667 4.135 -5.241 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.462 8.944 -4.226 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.676 5.307 -4.456 1.00 0.00 H new ATOM 0 HH TYR A 68 12.562 7.223 -3.799 1.00 0.00 H new ATOM 893 N ALA A 69 6.016 3.429 -8.276 1.00 0.00 N ATOM 894 CA ALA A 69 5.004 2.495 -8.754 1.00 0.00 C ATOM 895 C ALA A 69 4.983 1.227 -7.907 1.00 0.00 C ATOM 896 O ALA A 69 5.774 0.310 -8.126 1.00 0.00 O ATOM 897 CB ALA A 69 5.249 2.152 -10.216 1.00 0.00 C ATOM 0 H ALA A 69 6.973 3.177 -8.524 1.00 0.00 H new ATOM 0 HA ALA A 69 4.030 2.977 -8.664 1.00 0.00 H new ATOM 0 HB1 ALA A 69 4.485 1.454 -10.559 1.00 0.00 H new ATOM 0 HB2 ALA A 69 5.205 3.061 -10.815 1.00 0.00 H new ATOM 0 HB3 ALA A 69 6.233 1.695 -10.323 1.00 0.00 H new ATOM 903 N VAL A 70 4.073 1.183 -6.939 1.00 0.00 N ATOM 904 CA VAL A 70 3.950 0.026 -6.059 1.00 0.00 C ATOM 905 C VAL A 70 2.830 -0.899 -6.522 1.00 0.00 C ATOM 906 O VAL A 70 1.778 -0.443 -6.973 1.00 0.00 O ATOM 907 CB VAL A 70 3.679 0.454 -4.604 1.00 0.00 C ATOM 908 CG1 VAL A 70 3.229 -0.737 -3.772 1.00 0.00 C ATOM 909 CG2 VAL A 70 4.916 1.100 -4.000 1.00 0.00 C ATOM 0 H VAL A 70 3.411 1.934 -6.744 1.00 0.00 H new ATOM 0 HA VAL A 70 4.900 -0.507 -6.102 1.00 0.00 H new ATOM 0 HB VAL A 70 2.876 1.191 -4.604 1.00 0.00 H new ATOM 0 HG11 VAL A 70 3.042 -0.415 -2.747 1.00 0.00 H new ATOM 0 HG12 VAL A 70 2.314 -1.151 -4.195 1.00 0.00 H new ATOM 0 HG13 VAL A 70 4.008 -1.499 -3.777 1.00 0.00 H new ATOM 0 HG21 VAL A 70 4.707 1.396 -2.972 1.00 0.00 H new ATOM 0 HG22 VAL A 70 5.741 0.388 -4.012 1.00 0.00 H new ATOM 0 HG23 VAL A 70 5.188 1.980 -4.583 1.00 0.00 H new ATOM 919 N THR A 71 3.061 -2.203 -6.407 1.00 0.00 N ATOM 920 CA THR A 71 2.073 -3.194 -6.814 1.00 0.00 C ATOM 921 C THR A 71 2.086 -4.399 -5.881 1.00 0.00 C ATOM 922 O THR A 71 3.148 -4.864 -5.467 1.00 0.00 O ATOM 923 CB THR A 71 2.320 -3.673 -8.257 1.00 0.00 C ATOM 924 OG1 THR A 71 2.879 -2.611 -9.037 1.00 0.00 O ATOM 925 CG2 THR A 71 1.025 -4.152 -8.896 1.00 0.00 C ATOM 0 H THR A 71 3.925 -2.598 -6.035 1.00 0.00 H new ATOM 0 HA THR A 71 1.098 -2.709 -6.762 1.00 0.00 H new ATOM 0 HB THR A 71 3.021 -4.507 -8.225 1.00 0.00 H new ATOM 0 HG1 THR A 71 3.034 -2.924 -9.952 1.00 0.00 H new ATOM 0 HG21 THR A 71 1.223 -4.485 -9.915 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.618 -4.980 -8.316 1.00 0.00 H new ATOM 0 HG23 THR A 71 0.305 -3.334 -8.916 1.00 0.00 H new ATOM 933 N TYR A 72 0.900 -4.900 -5.554 1.00 0.00 N ATOM 934 CA TYR A 72 0.775 -6.051 -4.667 1.00 0.00 C ATOM 935 C TYR A 72 -0.105 -7.128 -5.294 1.00 0.00 C ATOM 936 O TYR A 72 -1.206 -6.849 -5.768 1.00 0.00 O ATOM 937 CB TYR A 72 0.194 -5.622 -3.319 1.00 0.00 C ATOM 938 CG TYR A 72 -1.309 -5.458 -3.332 1.00 0.00 C ATOM 939 CD1 TYR A 72 -2.149 -6.558 -3.216 1.00 0.00 C ATOM 940 CD2 TYR A 72 -1.889 -4.201 -3.460 1.00 0.00 C ATOM 941 CE1 TYR A 72 -3.523 -6.412 -3.229 1.00 0.00 C ATOM 942 CE2 TYR A 72 -3.261 -4.046 -3.472 1.00 0.00 C ATOM 943 CZ TYR A 72 -4.074 -5.154 -3.357 1.00 0.00 C ATOM 944 OH TYR A 72 -5.442 -5.005 -3.368 1.00 0.00 O ATOM 0 H TYR A 72 0.012 -4.527 -5.890 1.00 0.00 H new ATOM 0 HA TYR A 72 1.770 -6.467 -4.510 1.00 0.00 H new ATOM 0 HB2 TYR A 72 0.464 -6.361 -2.565 1.00 0.00 H new ATOM 0 HB3 TYR A 72 0.651 -4.679 -3.019 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -1.721 -7.544 -3.114 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -1.256 -3.331 -3.552 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -4.162 -7.278 -3.139 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -3.695 -3.062 -3.571 1.00 0.00 H new ATOM 0 HH TYR A 72 -5.669 -4.062 -3.230 1.00 0.00 H new ATOM 954 N VAL A 73 0.389 -8.363 -5.291 1.00 0.00 N ATOM 955 CA VAL A 73 -0.352 -9.484 -5.857 1.00 0.00 C ATOM 956 C VAL A 73 -0.829 -10.434 -4.765 1.00 0.00 C ATOM 957 O VAL A 73 -0.078 -11.272 -4.265 1.00 0.00 O ATOM 958 CB VAL A 73 0.505 -10.269 -6.868 1.00 0.00 C ATOM 959 CG1 VAL A 73 -0.239 -11.504 -7.352 1.00 0.00 C ATOM 960 CG2 VAL A 73 0.896 -9.380 -8.038 1.00 0.00 C ATOM 0 H VAL A 73 1.299 -8.612 -4.903 1.00 0.00 H new ATOM 0 HA VAL A 73 -1.216 -9.065 -6.373 1.00 0.00 H new ATOM 0 HB VAL A 73 1.417 -10.596 -6.369 1.00 0.00 H new ATOM 0 HG11 VAL A 73 0.381 -12.046 -8.065 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -0.464 -12.149 -6.503 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.169 -11.203 -7.835 1.00 0.00 H new ATOM 0 HG21 VAL A 73 1.501 -9.951 -8.742 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.003 -9.022 -8.539 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.471 -8.529 -7.672 1.00 0.00 H new ATOM 970 N PRO A 74 -2.108 -10.303 -4.384 1.00 0.00 N ATOM 971 CA PRO A 74 -2.716 -11.143 -3.347 1.00 0.00 C ATOM 972 C PRO A 74 -2.897 -12.587 -3.804 1.00 0.00 C ATOM 973 O PRO A 74 -3.408 -12.845 -4.894 1.00 0.00 O ATOM 974 CB PRO A 74 -4.076 -10.483 -3.108 1.00 0.00 C ATOM 975 CG PRO A 74 -4.384 -9.777 -4.383 1.00 0.00 C ATOM 976 CD PRO A 74 -3.061 -9.326 -4.937 1.00 0.00 C ATOM 0 HA PRO A 74 -2.094 -11.203 -2.454 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -4.840 -11.224 -2.871 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -4.037 -9.787 -2.270 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -4.894 -10.439 -5.082 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -5.044 -8.927 -4.209 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -3.058 -9.334 -6.027 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -2.820 -8.310 -4.625 1.00 0.00 H new ATOM 984 N LEU A 75 -2.476 -13.525 -2.963 1.00 0.00 N ATOM 985 CA LEU A 75 -2.592 -14.945 -3.279 1.00 0.00 C ATOM 986 C LEU A 75 -3.916 -15.508 -2.774 1.00 0.00 C ATOM 987 O LEU A 75 -4.414 -16.511 -3.288 1.00 0.00 O ATOM 988 CB LEU A 75 -1.426 -15.722 -2.666 1.00 0.00 C ATOM 989 CG LEU A 75 -0.038 -15.393 -3.215 1.00 0.00 C ATOM 990 CD1 LEU A 75 1.043 -15.906 -2.276 1.00 0.00 C ATOM 991 CD2 LEU A 75 0.138 -15.984 -4.607 1.00 0.00 C ATOM 0 H LEU A 75 -2.051 -13.328 -2.057 1.00 0.00 H new ATOM 0 HA LEU A 75 -2.562 -15.054 -4.363 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.421 -15.543 -1.591 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.609 -16.787 -2.811 1.00 0.00 H new ATOM 0 HG LEU A 75 0.056 -14.309 -3.287 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.024 -15.663 -2.683 1.00 0.00 H new ATOM 0 HD12 LEU A 75 0.929 -15.436 -1.299 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.951 -16.987 -2.172 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.132 -15.740 -4.983 1.00 0.00 H new ATOM 0 HD22 LEU A 75 0.024 -17.067 -4.560 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.615 -15.569 -5.277 1.00 0.00 H new ATOM 1003 N THR A 76 -4.484 -14.857 -1.764 1.00 0.00 N ATOM 1004 CA THR A 76 -5.751 -15.292 -1.189 1.00 0.00 C ATOM 1005 C THR A 76 -6.648 -14.101 -0.871 1.00 0.00 C ATOM 1006 O THR A 76 -6.229 -13.158 -0.201 1.00 0.00 O ATOM 1007 CB THR A 76 -5.532 -16.114 0.095 1.00 0.00 C ATOM 1008 OG1 THR A 76 -6.792 -16.548 0.620 1.00 0.00 O ATOM 1009 CG2 THR A 76 -4.797 -15.293 1.144 1.00 0.00 C ATOM 0 H THR A 76 -4.086 -14.026 -1.327 1.00 0.00 H new ATOM 0 HA THR A 76 -6.238 -15.920 -1.935 1.00 0.00 H new ATOM 0 HB THR A 76 -4.924 -16.983 -0.156 1.00 0.00 H new ATOM 0 HG1 THR A 76 -6.644 -17.071 1.435 1.00 0.00 H new ATOM 0 HG21 THR A 76 -4.654 -15.894 2.042 1.00 0.00 H new ATOM 0 HG22 THR A 76 -3.826 -14.988 0.753 1.00 0.00 H new ATOM 0 HG23 THR A 76 -5.384 -14.408 1.390 1.00 0.00 H new ATOM 1017 N ALA A 77 -7.885 -14.152 -1.354 1.00 0.00 N ATOM 1018 CA ALA A 77 -8.842 -13.079 -1.118 1.00 0.00 C ATOM 1019 C ALA A 77 -9.117 -12.906 0.372 1.00 0.00 C ATOM 1020 O ALA A 77 -8.781 -13.771 1.179 1.00 0.00 O ATOM 1021 CB ALA A 77 -10.138 -13.353 -1.868 1.00 0.00 C ATOM 0 H ALA A 77 -8.248 -14.925 -1.911 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.409 -12.151 -1.491 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -10.844 -12.543 -1.683 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.933 -13.418 -2.937 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -10.566 -14.294 -1.523 1.00 0.00 H new ATOM 1027 N GLY A 78 -9.729 -11.781 0.729 1.00 0.00 N ATOM 1028 CA GLY A 78 -10.038 -11.515 2.122 1.00 0.00 C ATOM 1029 C GLY A 78 -9.583 -10.138 2.564 1.00 0.00 C ATOM 1030 O GLY A 78 -9.097 -9.348 1.754 1.00 0.00 O ATOM 0 H GLY A 78 -10.016 -11.049 0.079 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -11.113 -11.606 2.276 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -9.561 -12.270 2.747 1.00 0.00 H new ATOM 1034 N MET A 79 -9.743 -9.848 3.851 1.00 0.00 N ATOM 1035 CA MET A 79 -9.346 -8.556 4.398 1.00 0.00 C ATOM 1036 C MET A 79 -7.827 -8.429 4.443 1.00 0.00 C ATOM 1037 O MET A 79 -7.147 -9.218 5.099 1.00 0.00 O ATOM 1038 CB MET A 79 -9.927 -8.372 5.801 1.00 0.00 C ATOM 1039 CG MET A 79 -11.299 -7.719 5.811 1.00 0.00 C ATOM 1040 SD MET A 79 -11.211 -5.921 5.917 1.00 0.00 S ATOM 1041 CE MET A 79 -10.570 -5.516 4.294 1.00 0.00 C ATOM 0 H MET A 79 -10.145 -10.490 4.534 1.00 0.00 H new ATOM 0 HA MET A 79 -9.739 -7.777 3.745 1.00 0.00 H new ATOM 0 HB2 MET A 79 -9.993 -9.345 6.288 1.00 0.00 H new ATOM 0 HB3 MET A 79 -9.241 -7.766 6.392 1.00 0.00 H new ATOM 0 HG2 MET A 79 -11.837 -8.000 4.906 1.00 0.00 H new ATOM 0 HG3 MET A 79 -11.873 -8.101 6.655 1.00 0.00 H new ATOM 0 HE1 MET A 79 -10.878 -4.506 4.023 1.00 0.00 H new ATOM 0 HE2 MET A 79 -9.482 -5.572 4.308 1.00 0.00 H new ATOM 0 HE3 MET A 79 -10.960 -6.223 3.562 1.00 0.00 H new ATOM 1051 N TYR A 80 -7.300 -7.430 3.742 1.00 0.00 N ATOM 1052 CA TYR A 80 -5.861 -7.202 3.700 1.00 0.00 C ATOM 1053 C TYR A 80 -5.478 -5.983 4.534 1.00 0.00 C ATOM 1054 O TYR A 80 -6.294 -5.088 4.760 1.00 0.00 O ATOM 1055 CB TYR A 80 -5.396 -7.012 2.255 1.00 0.00 C ATOM 1056 CG TYR A 80 -5.015 -8.303 1.567 1.00 0.00 C ATOM 1057 CD1 TYR A 80 -3.723 -8.805 1.654 1.00 0.00 C ATOM 1058 CD2 TYR A 80 -5.948 -9.020 0.828 1.00 0.00 C ATOM 1059 CE1 TYR A 80 -3.370 -9.984 1.026 1.00 0.00 C ATOM 1060 CE2 TYR A 80 -5.605 -10.200 0.198 1.00 0.00 C ATOM 1061 CZ TYR A 80 -4.315 -10.678 0.300 1.00 0.00 C ATOM 1062 OH TYR A 80 -3.969 -11.853 -0.328 1.00 0.00 O ATOM 0 H TYR A 80 -7.848 -6.766 3.196 1.00 0.00 H new ATOM 0 HA TYR A 80 -5.367 -8.078 4.122 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.191 -6.528 1.687 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -4.540 -6.337 2.243 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -2.981 -8.264 2.223 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -6.959 -8.648 0.745 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -2.360 -10.360 1.103 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -6.343 -10.746 -0.372 1.00 0.00 H new ATOM 0 HH TYR A 80 -4.747 -12.448 -0.361 1.00 0.00 H new ATOM 1072 N THR A 81 -4.230 -5.954 4.990 1.00 0.00 N ATOM 1073 CA THR A 81 -3.737 -4.847 5.799 1.00 0.00 C ATOM 1074 C THR A 81 -2.511 -4.204 5.163 1.00 0.00 C ATOM 1075 O THR A 81 -1.377 -4.609 5.425 1.00 0.00 O ATOM 1076 CB THR A 81 -3.379 -5.309 7.225 1.00 0.00 C ATOM 1077 OG1 THR A 81 -4.528 -5.884 7.857 1.00 0.00 O ATOM 1078 CG2 THR A 81 -2.865 -4.144 8.058 1.00 0.00 C ATOM 0 H THR A 81 -3.542 -6.685 4.812 1.00 0.00 H new ATOM 0 HA THR A 81 -4.541 -4.113 5.854 1.00 0.00 H new ATOM 0 HB THR A 81 -2.591 -6.059 7.153 1.00 0.00 H new ATOM 0 HG1 THR A 81 -4.292 -6.177 8.762 1.00 0.00 H new ATOM 0 HG21 THR A 81 -2.619 -4.494 9.060 1.00 0.00 H new ATOM 0 HG22 THR A 81 -1.973 -3.728 7.590 1.00 0.00 H new ATOM 0 HG23 THR A 81 -3.634 -3.375 8.121 1.00 0.00 H new ATOM 1086 N LEU A 82 -2.743 -3.199 4.325 1.00 0.00 N ATOM 1087 CA LEU A 82 -1.656 -2.498 3.651 1.00 0.00 C ATOM 1088 C LEU A 82 -0.892 -1.610 4.627 1.00 0.00 C ATOM 1089 O LEU A 82 -1.478 -0.760 5.300 1.00 0.00 O ATOM 1090 CB LEU A 82 -2.204 -1.655 2.498 1.00 0.00 C ATOM 1091 CG LEU A 82 -3.267 -2.322 1.625 1.00 0.00 C ATOM 1092 CD1 LEU A 82 -3.879 -1.314 0.665 1.00 0.00 C ATOM 1093 CD2 LEU A 82 -2.670 -3.495 0.860 1.00 0.00 C ATOM 0 H LEU A 82 -3.674 -2.852 4.096 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.968 -3.244 3.253 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -2.625 -0.739 2.912 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -1.370 -1.362 1.860 1.00 0.00 H new ATOM 0 HG LEU A 82 -4.057 -2.701 2.274 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.633 -1.807 0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -4.343 -0.507 1.232 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.100 -0.904 0.022 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.441 -3.958 0.244 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.861 -3.139 0.222 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.280 -4.229 1.565 1.00 0.00 H new ATOM 1105 N THR A 83 0.420 -1.809 4.699 1.00 0.00 N ATOM 1106 CA THR A 83 1.265 -1.026 5.592 1.00 0.00 C ATOM 1107 C THR A 83 2.358 -0.299 4.818 1.00 0.00 C ATOM 1108 O THR A 83 3.291 -0.921 4.311 1.00 0.00 O ATOM 1109 CB THR A 83 1.918 -1.913 6.669 1.00 0.00 C ATOM 1110 OG1 THR A 83 0.940 -2.787 7.244 1.00 0.00 O ATOM 1111 CG2 THR A 83 2.549 -1.062 7.761 1.00 0.00 C ATOM 0 H THR A 83 0.921 -2.507 4.149 1.00 0.00 H new ATOM 0 HA THR A 83 0.619 -0.294 6.077 1.00 0.00 H new ATOM 0 HB THR A 83 2.700 -2.506 6.194 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.364 -3.348 7.926 1.00 0.00 H new ATOM 0 HG21 THR A 83 3.004 -1.710 8.510 1.00 0.00 H new ATOM 0 HG22 THR A 83 3.314 -0.419 7.325 1.00 0.00 H new ATOM 0 HG23 THR A 83 1.782 -0.446 8.231 1.00 0.00 H new ATOM 1119 N MET A 84 2.236 1.022 4.731 1.00 0.00 N ATOM 1120 CA MET A 84 3.216 1.834 4.019 1.00 0.00 C ATOM 1121 C MET A 84 3.900 2.815 4.966 1.00 0.00 C ATOM 1122 O MET A 84 3.246 3.649 5.592 1.00 0.00 O ATOM 1123 CB MET A 84 2.544 2.596 2.875 1.00 0.00 C ATOM 1124 CG MET A 84 3.527 3.308 1.960 1.00 0.00 C ATOM 1125 SD MET A 84 2.714 4.146 0.586 1.00 0.00 S ATOM 1126 CE MET A 84 2.517 2.790 -0.568 1.00 0.00 C ATOM 0 H MET A 84 1.469 1.552 5.144 1.00 0.00 H new ATOM 0 HA MET A 84 3.973 1.167 3.606 1.00 0.00 H new ATOM 0 HB2 MET A 84 1.950 1.899 2.284 1.00 0.00 H new ATOM 0 HB3 MET A 84 1.853 3.328 3.293 1.00 0.00 H new ATOM 0 HG2 MET A 84 4.095 4.036 2.539 1.00 0.00 H new ATOM 0 HG3 MET A 84 4.242 2.585 1.568 1.00 0.00 H new ATOM 0 HE1 MET A 84 2.510 3.177 -1.587 1.00 0.00 H new ATOM 0 HE2 MET A 84 3.344 2.090 -0.452 1.00 0.00 H new ATOM 0 HE3 MET A 84 1.576 2.276 -0.369 1.00 0.00 H new ATOM 1136 N LYS A 85 5.221 2.709 5.068 1.00 0.00 N ATOM 1137 CA LYS A 85 5.995 3.586 5.938 1.00 0.00 C ATOM 1138 C LYS A 85 7.084 4.309 5.152 1.00 0.00 C ATOM 1139 O LYS A 85 7.969 3.677 4.575 1.00 0.00 O ATOM 1140 CB LYS A 85 6.622 2.783 7.080 1.00 0.00 C ATOM 1141 CG LYS A 85 5.760 2.726 8.329 1.00 0.00 C ATOM 1142 CD LYS A 85 6.568 2.308 9.546 1.00 0.00 C ATOM 1143 CE LYS A 85 6.542 0.800 9.742 1.00 0.00 C ATOM 1144 NZ LYS A 85 5.407 0.373 10.607 1.00 0.00 N ATOM 0 H LYS A 85 5.778 2.023 4.558 1.00 0.00 H new ATOM 0 HA LYS A 85 5.318 4.331 6.356 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.815 1.767 6.735 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.587 3.222 7.334 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.311 3.703 8.507 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.942 2.023 8.175 1.00 0.00 H new ATOM 0 HD2 LYS A 85 7.599 2.643 9.432 1.00 0.00 H new ATOM 0 HD3 LYS A 85 6.170 2.798 10.434 1.00 0.00 H new ATOM 0 HE2 LYS A 85 6.464 0.309 8.772 1.00 0.00 H new ATOM 0 HE3 LYS A 85 7.482 0.476 10.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 5.424 -0.661 10.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 5.495 0.822 11.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.509 0.660 10.168 1.00 0.00 H new ATOM 1158 N TYR A 86 7.014 5.635 5.135 1.00 0.00 N ATOM 1159 CA TYR A 86 7.994 6.443 4.419 1.00 0.00 C ATOM 1160 C TYR A 86 9.037 7.010 5.377 1.00 0.00 C ATOM 1161 O TYR A 86 8.744 7.897 6.178 1.00 0.00 O ATOM 1162 CB TYR A 86 7.299 7.582 3.672 1.00 0.00 C ATOM 1163 CG TYR A 86 8.158 8.218 2.603 1.00 0.00 C ATOM 1164 CD1 TYR A 86 8.997 9.285 2.901 1.00 0.00 C ATOM 1165 CD2 TYR A 86 8.130 7.753 1.294 1.00 0.00 C ATOM 1166 CE1 TYR A 86 9.783 9.869 1.927 1.00 0.00 C ATOM 1167 CE2 TYR A 86 8.913 8.331 0.314 1.00 0.00 C ATOM 1168 CZ TYR A 86 9.738 9.388 0.635 1.00 0.00 C ATOM 1169 OH TYR A 86 10.519 9.967 -0.339 1.00 0.00 O ATOM 0 H TYR A 86 6.289 6.173 5.609 1.00 0.00 H new ATOM 0 HA TYR A 86 8.500 5.800 3.699 1.00 0.00 H new ATOM 0 HB2 TYR A 86 6.386 7.201 3.214 1.00 0.00 H new ATOM 0 HB3 TYR A 86 7.001 8.347 4.389 1.00 0.00 H new ATOM 0 HD1 TYR A 86 9.035 9.664 3.912 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.485 6.925 1.038 1.00 0.00 H new ATOM 0 HE1 TYR A 86 10.429 10.698 2.176 1.00 0.00 H new ATOM 0 HE2 TYR A 86 8.879 7.957 -0.699 1.00 0.00 H new ATOM 0 HH TYR A 86 10.370 9.510 -1.193 1.00 0.00 H new ATOM 1179 N GLY A 87 10.258 6.490 5.289 1.00 0.00 N ATOM 1180 CA GLY A 87 11.327 6.956 6.152 1.00 0.00 C ATOM 1181 C GLY A 87 11.137 6.527 7.593 1.00 0.00 C ATOM 1182 O GLY A 87 11.575 7.213 8.516 1.00 0.00 O ATOM 0 H GLY A 87 10.525 5.754 4.635 1.00 0.00 H new ATOM 0 HA2 GLY A 87 12.279 6.573 5.785 1.00 0.00 H new ATOM 0 HA3 GLY A 87 11.381 8.044 6.104 1.00 0.00 H new ATOM 1186 N GLY A 88 10.480 5.387 7.788 1.00 0.00 N ATOM 1187 CA GLY A 88 10.243 4.888 9.130 1.00 0.00 C ATOM 1188 C GLY A 88 8.971 5.444 9.739 1.00 0.00 C ATOM 1189 O GLY A 88 8.571 5.042 10.831 1.00 0.00 O ATOM 0 H GLY A 88 10.108 4.801 7.041 1.00 0.00 H new ATOM 0 HA2 GLY A 88 10.185 3.800 9.105 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.090 5.147 9.765 1.00 0.00 H new ATOM 1193 N GLU A 89 8.335 6.372 9.032 1.00 0.00 N ATOM 1194 CA GLU A 89 7.102 6.986 9.512 1.00 0.00 C ATOM 1195 C GLU A 89 5.925 6.615 8.614 1.00 0.00 C ATOM 1196 O GLU A 89 5.971 6.809 7.398 1.00 0.00 O ATOM 1197 CB GLU A 89 7.252 8.507 9.571 1.00 0.00 C ATOM 1198 CG GLU A 89 8.498 8.967 10.310 1.00 0.00 C ATOM 1199 CD GLU A 89 8.312 10.311 10.987 1.00 0.00 C ATOM 1200 OE1 GLU A 89 7.408 11.065 10.572 1.00 0.00 O ATOM 1201 OE2 GLU A 89 9.071 10.608 11.933 1.00 0.00 O ATOM 0 H GLU A 89 8.652 6.715 8.125 1.00 0.00 H new ATOM 0 HA GLU A 89 6.905 6.609 10.516 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.276 8.901 8.555 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.374 8.932 10.057 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.768 8.222 11.058 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.330 9.030 9.608 1.00 0.00 H new ATOM 1208 N LEU A 90 4.871 6.081 9.221 1.00 0.00 N ATOM 1209 CA LEU A 90 3.680 5.682 8.478 1.00 0.00 C ATOM 1210 C LEU A 90 3.053 6.879 7.772 1.00 0.00 C ATOM 1211 O LEU A 90 3.199 8.020 8.212 1.00 0.00 O ATOM 1212 CB LEU A 90 2.660 5.037 9.418 1.00 0.00 C ATOM 1213 CG LEU A 90 2.751 3.518 9.567 1.00 0.00 C ATOM 1214 CD1 LEU A 90 1.950 3.051 10.773 1.00 0.00 C ATOM 1215 CD2 LEU A 90 2.264 2.828 8.301 1.00 0.00 C ATOM 0 H LEU A 90 4.816 5.914 10.226 1.00 0.00 H new ATOM 0 HA LEU A 90 3.979 4.954 7.723 1.00 0.00 H new ATOM 0 HB2 LEU A 90 2.771 5.486 10.405 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.660 5.288 9.064 1.00 0.00 H new ATOM 0 HG LEU A 90 3.796 3.249 9.724 1.00 0.00 H new ATOM 0 HD11 LEU A 90 2.026 1.967 10.863 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.344 3.519 11.675 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.904 3.332 10.646 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.336 1.747 8.425 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.226 3.103 8.113 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.881 3.138 7.457 1.00 0.00 H new ATOM 1227 N VAL A 91 2.351 6.612 6.675 1.00 0.00 N ATOM 1228 CA VAL A 91 1.697 7.667 5.909 1.00 0.00 C ATOM 1229 C VAL A 91 0.243 7.834 6.335 1.00 0.00 C ATOM 1230 O VAL A 91 -0.357 6.949 6.946 1.00 0.00 O ATOM 1231 CB VAL A 91 1.748 7.377 4.398 1.00 0.00 C ATOM 1232 CG1 VAL A 91 2.968 8.033 3.769 1.00 0.00 C ATOM 1233 CG2 VAL A 91 1.749 5.877 4.143 1.00 0.00 C ATOM 0 H VAL A 91 2.221 5.674 6.297 1.00 0.00 H new ATOM 0 HA VAL A 91 2.240 8.590 6.112 1.00 0.00 H new ATOM 0 HB VAL A 91 0.857 7.801 3.934 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.987 7.817 2.701 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.920 9.111 3.920 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.872 7.641 4.235 1.00 0.00 H new ATOM 0 HG21 VAL A 91 1.785 5.690 3.070 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.620 5.428 4.619 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.842 5.437 4.557 1.00 0.00 H new ATOM 1243 N PRO A 92 -0.340 8.996 6.005 1.00 0.00 N ATOM 1244 CA PRO A 92 -1.732 9.307 6.342 1.00 0.00 C ATOM 1245 C PRO A 92 -2.724 8.469 5.542 1.00 0.00 C ATOM 1246 O PRO A 92 -3.937 8.651 5.652 1.00 0.00 O ATOM 1247 CB PRO A 92 -1.864 10.787 5.975 1.00 0.00 C ATOM 1248 CG PRO A 92 -0.826 11.012 4.931 1.00 0.00 C ATOM 1249 CD PRO A 92 0.315 10.096 5.277 1.00 0.00 C ATOM 0 HA PRO A 92 -1.956 9.091 7.387 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -2.861 11.014 5.597 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -1.698 11.426 6.842 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -1.217 10.790 3.938 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -0.502 12.053 4.921 1.00 0.00 H new ATOM 0 HD2 PRO A 92 0.828 9.738 4.384 1.00 0.00 H new ATOM 0 HD3 PRO A 92 1.061 10.598 5.893 1.00 0.00 H new ATOM 1257 N HIS A 93 -2.200 7.551 4.736 1.00 0.00 N ATOM 1258 CA HIS A 93 -3.040 6.684 3.917 1.00 0.00 C ATOM 1259 C HIS A 93 -2.907 5.228 4.353 1.00 0.00 C ATOM 1260 O HIS A 93 -3.541 4.339 3.786 1.00 0.00 O ATOM 1261 CB HIS A 93 -2.667 6.823 2.441 1.00 0.00 C ATOM 1262 CG HIS A 93 -2.586 8.244 1.975 1.00 0.00 C ATOM 1263 ND1 HIS A 93 -1.686 9.216 2.251 1.00 0.00 N flip ATOM 1264 CD2 HIS A 93 -3.507 8.809 1.118 1.00 0.00 C flip ATOM 1265 CE1 HIS A 93 -2.075 10.339 1.563 1.00 0.00 C flip ATOM 1266 NE2 HIS A 93 -3.177 10.067 0.887 1.00 0.00 N flip ATOM 0 H HIS A 93 -1.198 7.388 4.632 1.00 0.00 H new ATOM 0 HA HIS A 93 -4.077 6.992 4.052 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.706 6.338 2.270 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -3.403 6.293 1.837 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.364 8.302 0.701 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -1.563 11.290 1.573 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -3.686 10.718 0.289 1.00 0.00 H new ATOM 1275 N PHE A 94 -2.077 4.992 5.364 1.00 0.00 N ATOM 1276 CA PHE A 94 -1.858 3.644 5.875 1.00 0.00 C ATOM 1277 C PHE A 94 -1.800 3.643 7.400 1.00 0.00 C ATOM 1278 O PHE A 94 -1.438 4.635 8.033 1.00 0.00 O ATOM 1279 CB PHE A 94 -0.563 3.063 5.304 1.00 0.00 C ATOM 1280 CG PHE A 94 -0.582 2.910 3.810 1.00 0.00 C ATOM 1281 CD1 PHE A 94 -0.499 4.020 2.985 1.00 0.00 C ATOM 1282 CD2 PHE A 94 -0.683 1.655 3.230 1.00 0.00 C ATOM 1283 CE1 PHE A 94 -0.517 3.882 1.610 1.00 0.00 C ATOM 1284 CE2 PHE A 94 -0.702 1.511 1.856 1.00 0.00 C ATOM 1285 CZ PHE A 94 -0.618 2.625 1.045 1.00 0.00 C ATOM 0 H PHE A 94 -1.545 5.717 5.845 1.00 0.00 H new ATOM 0 HA PHE A 94 -2.696 3.023 5.560 1.00 0.00 H new ATOM 0 HB2 PHE A 94 0.270 3.708 5.585 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -0.380 2.089 5.759 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.419 5.005 3.422 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.748 0.780 3.859 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -0.452 4.755 0.978 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.783 0.528 1.417 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.631 2.514 -0.029 1.00 0.00 H new ATOM 1295 N PRO A 95 -2.166 2.504 8.005 1.00 0.00 N ATOM 1296 CA PRO A 95 -2.600 1.317 7.261 1.00 0.00 C ATOM 1297 C PRO A 95 -3.957 1.514 6.595 1.00 0.00 C ATOM 1298 O PRO A 95 -4.770 2.320 7.047 1.00 0.00 O ATOM 1299 CB PRO A 95 -2.686 0.234 8.340 1.00 0.00 C ATOM 1300 CG PRO A 95 -2.919 0.981 9.608 1.00 0.00 C ATOM 1301 CD PRO A 95 -2.186 2.286 9.461 1.00 0.00 C ATOM 0 HA PRO A 95 -1.917 1.074 6.447 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -3.498 -0.464 8.137 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -1.768 -0.351 8.388 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -3.984 1.148 9.773 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -2.548 0.420 10.465 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -2.698 3.095 9.981 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.178 2.229 9.873 1.00 0.00 H new ATOM 1309 N ALA A 96 -4.196 0.772 5.518 1.00 0.00 N ATOM 1310 CA ALA A 96 -5.456 0.864 4.791 1.00 0.00 C ATOM 1311 C ALA A 96 -6.025 -0.520 4.503 1.00 0.00 C ATOM 1312 O ALA A 96 -5.373 -1.351 3.870 1.00 0.00 O ATOM 1313 CB ALA A 96 -5.262 1.638 3.495 1.00 0.00 C ATOM 0 H ALA A 96 -3.533 0.101 5.130 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.171 1.399 5.417 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.211 1.699 2.962 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.908 2.644 3.721 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.528 1.126 2.872 1.00 0.00 H new ATOM 1319 N ARG A 97 -7.245 -0.763 4.971 1.00 0.00 N ATOM 1320 CA ARG A 97 -7.901 -2.048 4.765 1.00 0.00 C ATOM 1321 C ARG A 97 -8.563 -2.107 3.391 1.00 0.00 C ATOM 1322 O ARG A 97 -9.191 -1.143 2.951 1.00 0.00 O ATOM 1323 CB ARG A 97 -8.945 -2.293 5.856 1.00 0.00 C ATOM 1324 CG ARG A 97 -10.059 -1.258 5.876 1.00 0.00 C ATOM 1325 CD ARG A 97 -11.240 -1.695 5.022 1.00 0.00 C ATOM 1326 NE ARG A 97 -12.506 -1.178 5.534 1.00 0.00 N ATOM 1327 CZ ARG A 97 -13.639 -1.189 4.840 1.00 0.00 C ATOM 1328 NH1 ARG A 97 -13.663 -1.688 3.612 1.00 0.00 N ATOM 1329 NH2 ARG A 97 -14.750 -0.700 5.375 1.00 0.00 N ATOM 0 H ARG A 97 -7.799 -0.086 5.496 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.141 -2.827 4.817 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -9.381 -3.282 5.714 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.449 -2.300 6.827 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -10.390 -1.098 6.902 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.678 -0.304 5.511 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -11.095 -1.350 3.998 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -11.280 -2.784 4.988 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.521 -0.787 6.476 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.810 -2.065 3.198 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -14.534 -1.695 3.081 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -14.735 -0.315 6.320 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -15.619 -0.709 4.842 1.00 0.00 H new ATOM 1343 N VAL A 98 -8.416 -3.243 2.717 1.00 0.00 N ATOM 1344 CA VAL A 98 -8.999 -3.428 1.394 1.00 0.00 C ATOM 1345 C VAL A 98 -9.564 -4.835 1.233 1.00 0.00 C ATOM 1346 O VAL A 98 -8.950 -5.815 1.657 1.00 0.00 O ATOM 1347 CB VAL A 98 -7.963 -3.173 0.283 1.00 0.00 C ATOM 1348 CG1 VAL A 98 -8.630 -3.190 -1.084 1.00 0.00 C ATOM 1349 CG2 VAL A 98 -7.245 -1.852 0.518 1.00 0.00 C ATOM 0 H VAL A 98 -7.898 -4.049 3.066 1.00 0.00 H new ATOM 0 HA VAL A 98 -9.807 -2.702 1.301 1.00 0.00 H new ATOM 0 HB VAL A 98 -7.223 -3.973 0.310 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -7.882 -3.008 -1.856 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -9.094 -4.162 -1.250 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -9.392 -2.412 -1.127 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -6.517 -1.687 -0.276 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -7.971 -1.039 0.519 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -6.733 -1.882 1.480 1.00 0.00 H new ATOM 1359 N LYS A 99 -10.737 -4.929 0.618 1.00 0.00 N ATOM 1360 CA LYS A 99 -11.386 -6.217 0.398 1.00 0.00 C ATOM 1361 C LYS A 99 -11.007 -6.792 -0.962 1.00 0.00 C ATOM 1362 O LYS A 99 -11.283 -6.191 -2.001 1.00 0.00 O ATOM 1363 CB LYS A 99 -12.906 -6.069 0.496 1.00 0.00 C ATOM 1364 CG LYS A 99 -13.646 -7.395 0.516 1.00 0.00 C ATOM 1365 CD LYS A 99 -15.094 -7.219 0.941 1.00 0.00 C ATOM 1366 CE LYS A 99 -15.837 -8.546 0.951 1.00 0.00 C ATOM 1367 NZ LYS A 99 -15.403 -9.416 2.079 1.00 0.00 N ATOM 0 H LYS A 99 -11.259 -4.128 0.262 1.00 0.00 H new ATOM 0 HA LYS A 99 -11.044 -6.905 1.171 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -13.151 -5.512 1.400 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -13.260 -5.477 -0.348 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -13.609 -7.848 -0.475 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -13.146 -8.081 1.199 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -15.131 -6.773 1.935 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -15.592 -6.527 0.262 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -16.909 -8.362 1.026 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -15.668 -9.064 0.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -15.979 -10.282 2.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -14.402 -9.669 1.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -15.525 -8.906 2.977 1.00 0.00 H new ATOM 1381 N VAL A 100 -10.373 -7.961 -0.950 1.00 0.00 N ATOM 1382 CA VAL A 100 -9.958 -8.619 -2.183 1.00 0.00 C ATOM 1383 C VAL A 100 -10.912 -9.750 -2.550 1.00 0.00 C ATOM 1384 O VAL A 100 -11.244 -10.590 -1.715 1.00 0.00 O ATOM 1385 CB VAL A 100 -8.531 -9.184 -2.065 1.00 0.00 C ATOM 1386 CG1 VAL A 100 -8.159 -9.962 -3.318 1.00 0.00 C ATOM 1387 CG2 VAL A 100 -7.534 -8.064 -1.808 1.00 0.00 C ATOM 0 H VAL A 100 -10.136 -8.472 -0.099 1.00 0.00 H new ATOM 0 HA VAL A 100 -9.977 -7.862 -2.967 1.00 0.00 H new ATOM 0 HB VAL A 100 -8.500 -9.869 -1.218 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -7.147 -10.354 -3.216 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.856 -10.789 -3.453 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.207 -9.302 -4.184 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.530 -8.482 -1.727 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.566 -7.352 -2.633 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.791 -7.554 -0.879 1.00 0.00 H new ATOM 1397 N GLU A 101 -11.349 -9.764 -3.806 1.00 0.00 N ATOM 1398 CA GLU A 101 -12.266 -10.793 -4.283 1.00 0.00 C ATOM 1399 C GLU A 101 -11.500 -11.971 -4.878 1.00 0.00 C ATOM 1400 O GLU A 101 -10.329 -11.862 -5.244 1.00 0.00 O ATOM 1401 CB GLU A 101 -13.221 -10.211 -5.328 1.00 0.00 C ATOM 1402 CG GLU A 101 -14.484 -9.613 -4.731 1.00 0.00 C ATOM 1403 CD GLU A 101 -15.596 -9.461 -5.752 1.00 0.00 C ATOM 1404 OE1 GLU A 101 -15.409 -8.699 -6.723 1.00 0.00 O ATOM 1405 OE2 GLU A 101 -16.652 -10.103 -5.578 1.00 0.00 O ATOM 0 H GLU A 101 -11.083 -9.076 -4.510 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.845 -11.151 -3.432 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -12.699 -9.442 -5.897 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -13.498 -10.996 -6.032 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -14.830 -10.246 -3.914 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -14.253 -8.638 -4.303 1.00 0.00 H new ATOM 1412 N PRO A 102 -12.175 -13.125 -4.978 1.00 0.00 N ATOM 1413 CA PRO A 102 -11.579 -14.346 -5.528 1.00 0.00 C ATOM 1414 C PRO A 102 -11.334 -14.246 -7.030 1.00 0.00 C ATOM 1415 O PRO A 102 -11.996 -13.477 -7.727 1.00 0.00 O ATOM 1416 CB PRO A 102 -12.627 -15.420 -5.228 1.00 0.00 C ATOM 1417 CG PRO A 102 -13.915 -14.676 -5.134 1.00 0.00 C ATOM 1418 CD PRO A 102 -13.573 -13.328 -4.563 1.00 0.00 C ATOM 0 HA PRO A 102 -10.601 -14.553 -5.093 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -12.661 -16.172 -6.017 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -12.403 -15.943 -4.298 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -14.381 -14.578 -6.114 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -14.624 -15.202 -4.495 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -14.226 -12.548 -4.956 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -13.676 -13.314 -3.478 1.00 0.00 H new ATOM 1426 N ALA A 103 -10.379 -15.028 -7.523 1.00 0.00 N ATOM 1427 CA ALA A 103 -10.049 -15.029 -8.943 1.00 0.00 C ATOM 1428 C ALA A 103 -10.913 -16.027 -9.707 1.00 0.00 C ATOM 1429 O ALA A 103 -10.410 -16.806 -10.517 1.00 0.00 O ATOM 1430 CB ALA A 103 -8.574 -15.344 -9.141 1.00 0.00 C ATOM 0 H ALA A 103 -9.820 -15.669 -6.960 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.253 -14.034 -9.339 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -8.341 -15.342 -10.206 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -7.970 -14.590 -8.636 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -8.352 -16.326 -8.723 1.00 0.00 H new ATOM 1436 N VAL A 104 -12.215 -15.998 -9.443 1.00 0.00 N ATOM 1437 CA VAL A 104 -13.149 -16.900 -10.106 1.00 0.00 C ATOM 1438 C VAL A 104 -13.098 -16.728 -11.620 1.00 0.00 C ATOM 1439 O VAL A 104 -13.250 -15.620 -12.135 1.00 0.00 O ATOM 1440 CB VAL A 104 -14.593 -16.667 -9.623 1.00 0.00 C ATOM 1441 CG1 VAL A 104 -14.849 -17.414 -8.323 1.00 0.00 C ATOM 1442 CG2 VAL A 104 -14.865 -15.179 -9.455 1.00 0.00 C ATOM 0 H VAL A 104 -12.647 -15.360 -8.775 1.00 0.00 H new ATOM 0 HA VAL A 104 -12.846 -17.915 -9.848 1.00 0.00 H new ATOM 0 HB VAL A 104 -15.277 -17.055 -10.378 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -15.874 -17.237 -7.998 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -14.697 -18.482 -8.481 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -14.159 -17.059 -7.557 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -15.890 -15.033 -9.113 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -14.175 -14.764 -8.721 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -14.726 -14.673 -10.411 1.00 0.00 H new ATOM 1452 N ASP A 105 -12.883 -17.832 -12.328 1.00 0.00 N ATOM 1453 CA ASP A 105 -12.813 -17.804 -13.784 1.00 0.00 C ATOM 1454 C ASP A 105 -11.860 -16.714 -14.262 1.00 0.00 C ATOM 1455 O ASP A 105 -12.071 -16.104 -15.311 1.00 0.00 O ATOM 1456 CB ASP A 105 -14.204 -17.580 -14.379 1.00 0.00 C ATOM 1457 CG ASP A 105 -15.007 -18.862 -14.476 1.00 0.00 C ATOM 1458 OD1 ASP A 105 -15.447 -19.368 -13.422 1.00 0.00 O ATOM 1459 OD2 ASP A 105 -15.196 -19.360 -15.605 1.00 0.00 O ATOM 0 H ASP A 105 -12.754 -18.757 -11.917 1.00 0.00 H new ATOM 0 HA ASP A 105 -12.433 -18.768 -14.123 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -14.747 -16.861 -13.765 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -14.105 -17.141 -15.372 1.00 0.00 H new ATOM 1464 N THR A 106 -10.809 -16.471 -13.485 1.00 0.00 N ATOM 1465 CA THR A 106 -9.824 -15.453 -13.827 1.00 0.00 C ATOM 1466 C THR A 106 -9.020 -15.856 -15.058 1.00 0.00 C ATOM 1467 O THR A 106 -9.067 -17.007 -15.491 1.00 0.00 O ATOM 1468 CB THR A 106 -8.855 -15.193 -12.658 1.00 0.00 C ATOM 1469 OG1 THR A 106 -8.163 -13.956 -12.861 1.00 0.00 O ATOM 1470 CG2 THR A 106 -7.849 -16.327 -12.526 1.00 0.00 C ATOM 0 H THR A 106 -10.618 -16.966 -12.614 1.00 0.00 H new ATOM 0 HA THR A 106 -10.377 -14.539 -14.041 1.00 0.00 H new ATOM 0 HB THR A 106 -9.437 -15.136 -11.738 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.550 -13.797 -12.113 1.00 0.00 H new ATOM 0 HG21 THR A 106 -7.176 -16.121 -11.694 1.00 0.00 H new ATOM 0 HG22 THR A 106 -8.377 -17.262 -12.342 1.00 0.00 H new ATOM 0 HG23 THR A 106 -7.272 -16.411 -13.447 1.00 0.00 H new ATOM 1478 N SER A 107 -8.283 -14.902 -15.616 1.00 0.00 N ATOM 1479 CA SER A 107 -7.470 -15.158 -16.800 1.00 0.00 C ATOM 1480 C SER A 107 -6.545 -16.350 -16.576 1.00 0.00 C ATOM 1481 O SER A 107 -6.183 -16.665 -15.443 1.00 0.00 O ATOM 1482 CB SER A 107 -6.648 -13.919 -17.158 1.00 0.00 C ATOM 1483 OG SER A 107 -5.946 -14.106 -18.375 1.00 0.00 O ATOM 0 H SER A 107 -8.232 -13.945 -15.268 1.00 0.00 H new ATOM 0 HA SER A 107 -8.140 -15.391 -17.627 1.00 0.00 H new ATOM 0 HB2 SER A 107 -7.306 -13.054 -17.244 1.00 0.00 H new ATOM 0 HB3 SER A 107 -5.941 -13.704 -16.356 1.00 0.00 H new ATOM 0 HG SER A 107 -5.430 -13.299 -18.582 1.00 0.00 H new ATOM 1489 N SER A 108 -6.165 -17.009 -17.666 1.00 0.00 N ATOM 1490 CA SER A 108 -5.284 -18.169 -17.590 1.00 0.00 C ATOM 1491 C SER A 108 -3.911 -17.847 -18.171 1.00 0.00 C ATOM 1492 O SER A 108 -3.716 -16.804 -18.794 1.00 0.00 O ATOM 1493 CB SER A 108 -5.901 -19.353 -18.337 1.00 0.00 C ATOM 1494 OG SER A 108 -5.311 -20.576 -17.930 1.00 0.00 O ATOM 0 H SER A 108 -6.453 -16.760 -18.612 1.00 0.00 H new ATOM 0 HA SER A 108 -5.162 -18.434 -16.540 1.00 0.00 H new ATOM 0 HB2 SER A 108 -6.975 -19.384 -18.152 1.00 0.00 H new ATOM 0 HB3 SER A 108 -5.766 -19.220 -19.410 1.00 0.00 H new ATOM 0 HG SER A 108 -5.724 -21.317 -18.420 1.00 0.00 H new ATOM 1500 N GLY A 109 -2.959 -18.752 -17.961 1.00 0.00 N ATOM 1501 CA GLY A 109 -1.615 -18.547 -18.469 1.00 0.00 C ATOM 1502 C GLY A 109 -0.561 -18.678 -17.388 1.00 0.00 C ATOM 1503 O GLY A 109 -0.109 -17.691 -16.808 1.00 0.00 O ATOM 0 H GLY A 109 -3.095 -19.623 -17.448 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.414 -19.271 -19.258 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -1.547 -17.557 -18.920 1.00 0.00 H new ATOM 1507 N PRO A 110 -0.153 -19.924 -17.102 1.00 0.00 N ATOM 1508 CA PRO A 110 0.859 -20.211 -16.081 1.00 0.00 C ATOM 1509 C PRO A 110 2.250 -19.746 -16.497 1.00 0.00 C ATOM 1510 O PRO A 110 2.490 -19.441 -17.665 1.00 0.00 O ATOM 1511 CB PRO A 110 0.818 -21.736 -15.960 1.00 0.00 C ATOM 1512 CG PRO A 110 0.307 -22.207 -17.278 1.00 0.00 C ATOM 1513 CD PRO A 110 -0.648 -21.148 -17.754 1.00 0.00 C ATOM 0 HA PRO A 110 0.654 -19.690 -15.146 1.00 0.00 H new ATOM 0 HB2 PRO A 110 1.807 -22.143 -15.750 1.00 0.00 H new ATOM 0 HB3 PRO A 110 0.165 -22.051 -15.146 1.00 0.00 H new ATOM 0 HG2 PRO A 110 1.124 -22.343 -17.987 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -0.195 -23.170 -17.181 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -0.638 -21.057 -18.840 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.674 -21.372 -17.462 1.00 0.00 H new ATOM 1521 N SER A 111 3.164 -19.694 -15.533 1.00 0.00 N ATOM 1522 CA SER A 111 4.532 -19.263 -15.799 1.00 0.00 C ATOM 1523 C SER A 111 5.502 -19.891 -14.804 1.00 0.00 C ATOM 1524 O SER A 111 5.375 -19.704 -13.594 1.00 0.00 O ATOM 1525 CB SER A 111 4.630 -17.738 -15.733 1.00 0.00 C ATOM 1526 OG SER A 111 4.477 -17.274 -14.402 1.00 0.00 O ATOM 0 H SER A 111 2.982 -19.945 -14.561 1.00 0.00 H new ATOM 0 HA SER A 111 4.803 -19.594 -16.802 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.594 -17.415 -16.125 1.00 0.00 H new ATOM 0 HB3 SER A 111 3.863 -17.293 -16.367 1.00 0.00 H new ATOM 0 HG SER A 111 4.649 -18.009 -13.777 1.00 0.00 H new ATOM 1532 N SER A 112 6.473 -20.636 -15.323 1.00 0.00 N ATOM 1533 CA SER A 112 7.464 -21.294 -14.480 1.00 0.00 C ATOM 1534 C SER A 112 8.288 -20.269 -13.707 1.00 0.00 C ATOM 1535 O SER A 112 9.222 -19.674 -14.244 1.00 0.00 O ATOM 1536 CB SER A 112 8.387 -22.170 -15.331 1.00 0.00 C ATOM 1537 OG SER A 112 9.222 -21.378 -16.158 1.00 0.00 O ATOM 0 H SER A 112 6.594 -20.799 -16.323 1.00 0.00 H new ATOM 0 HA SER A 112 6.935 -21.923 -13.764 1.00 0.00 H new ATOM 0 HB2 SER A 112 9.000 -22.795 -14.682 1.00 0.00 H new ATOM 0 HB3 SER A 112 7.790 -22.841 -15.948 1.00 0.00 H new ATOM 0 HG SER A 112 9.280 -20.471 -15.792 1.00 0.00 H new ATOM 1543 N GLY A 113 7.934 -20.068 -12.441 1.00 0.00 N ATOM 1544 CA GLY A 113 8.650 -19.114 -11.614 1.00 0.00 C ATOM 1545 C GLY A 113 7.763 -18.479 -10.561 1.00 0.00 C ATOM 1546 O GLY A 113 6.582 -18.229 -10.804 1.00 0.00 O ATOM 0 H GLY A 113 7.165 -20.548 -11.974 1.00 0.00 H new ATOM 0 HA2 GLY A 113 9.486 -19.616 -11.126 1.00 0.00 H new ATOM 0 HA3 GLY A 113 9.072 -18.334 -12.247 1.00 0.00 H new TER 1550 GLY A 113