USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 928 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 104 GLN :FLIP amide:sc= -0.346 F(o=-2.3,f=-0.78) USER MOD Set 1.2: A 106 HIS :FLIP no HD1:sc= -0.436 X(o=-0.78,f=-0.78) USER MOD Set 2.1: A 3 CYS SG : rot -88:sc= -2.59! USER MOD Set 2.2: A 5 CYS SG : rot -20:sc= -5.75! USER MOD Set 2.3: A 7 SER OG : rot -39:sc= 0.234 USER MOD Set 2.4: A 14 CYS SG : rot -76:sc= -0.162 USER MOD Set 2.5: A 15 CYS SG : rot 98:sc= -2.43! USER MOD Single : A 9 LYS NZ :NH3+ 162:sc= 0.84 (180deg=0.52) USER MOD Single : A 10 THR OG1 : rot 180:sc= -1.12 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 35:sc= 0.11 USER MOD Single : A 27 SER OG : rot 180:sc= -0.205 USER MOD Single : A 32 MET CE :methyl -150:sc= -0.207 (180deg=-2.32) USER MOD Single : A 34 SER OG : rot 88:sc= 0.467! USER MOD Single : A 36 TYR OH : rot 60:sc= -0.298 USER MOD Single : A 39 TYR OH : rot -100:sc= 0.473 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 180:sc= -0.602 USER MOD Single : A 50 THR OG1 : rot -72:sc= 0.725 USER MOD Single : A 51 THR OG1 : rot -139:sc= 0.955 USER MOD Single : A 61 HIS : no HD1:sc=-0.00323 X(o=-0.0032,f=0) USER MOD Single : A 64 ASN : amide:sc= -1.64 K(o=-1.6,f=-3.3!) USER MOD Single : A 68 MET CE :methyl -154:sc= -0.575 (180deg=-1.53) USER MOD Single : A 71 SER OG : rot -22:sc= 0.624 USER MOD Single : A 81 SER OG : rot 166:sc= 0.799 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.11 USER MOD Single : A 105 SER OG : rot 39:sc= 0.00486 USER MOD Single : A 107 HIS : no HD1:sc= -0.363 K(o=-0.36,f=-4.4!) USER MOD Single : A 110 SER OG : rot -117:sc= 0.392 USER MOD Single : A 111 GLN :FLIP amide:sc= -1.12 F(o=-2.1,f=-1.1) USER MOD Single : A 114 LYS NZ :NH3+ 159:sc= 1.24 (180deg=1.04) USER MOD Single : A 120 TYR OH : rot 180:sc= 0.815 USER MOD Single : A 122 SER OG : rot -90:sc= -0.0391 USER MOD ----------------------------------------------------------------- ATOM 34 N CYS A 3 -1.336 -4.411 -1.330 1.00 0.00 N ATOM 35 CA CYS A 3 -2.570 -5.118 -1.004 1.00 0.00 C ATOM 36 C CYS A 3 -2.251 -6.585 -0.748 1.00 0.00 C ATOM 37 O CYS A 3 -1.377 -7.148 -1.409 1.00 0.00 O ATOM 38 CB CYS A 3 -3.571 -5.000 -2.162 1.00 0.00 C ATOM 39 SG CYS A 3 -5.320 -5.141 -1.680 1.00 0.00 S ATOM 0 HA CYS A 3 -3.014 -4.675 -0.112 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -3.422 -4.040 -2.656 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -3.348 -5.774 -2.896 1.00 0.00 H new ATOM 0 HG CYS A 3 -5.672 -6.392 -1.685 1.00 0.00 H new ATOM 44 N VAL A 4 -2.950 -7.200 0.202 1.00 0.00 N ATOM 45 CA VAL A 4 -2.779 -8.627 0.483 1.00 0.00 C ATOM 46 C VAL A 4 -3.398 -9.475 -0.635 1.00 0.00 C ATOM 47 O VAL A 4 -4.391 -10.178 -0.445 1.00 0.00 O ATOM 48 CB VAL A 4 -3.379 -9.016 1.858 1.00 0.00 C ATOM 49 CG1 VAL A 4 -2.547 -8.414 2.986 1.00 0.00 C ATOM 50 CG2 VAL A 4 -4.834 -8.561 1.957 1.00 0.00 C ATOM 0 H VAL A 4 -3.640 -6.735 0.791 1.00 0.00 H new ATOM 0 HA VAL A 4 -1.708 -8.828 0.523 1.00 0.00 H new ATOM 0 HB VAL A 4 -3.356 -10.102 1.953 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -2.979 -8.695 3.947 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -1.525 -8.789 2.924 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -2.541 -7.328 2.894 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.238 -8.843 2.929 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -4.885 -7.478 1.843 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -5.418 -9.037 1.169 1.00 0.00 H new ATOM 60 N CYS A 5 -2.805 -9.368 -1.814 1.00 0.00 N ATOM 61 CA CYS A 5 -3.269 -10.082 -2.999 1.00 0.00 C ATOM 62 C CYS A 5 -2.162 -10.131 -4.046 1.00 0.00 C ATOM 63 O CYS A 5 -1.451 -9.140 -4.236 1.00 0.00 O ATOM 64 CB CYS A 5 -4.483 -9.389 -3.631 1.00 0.00 C ATOM 65 SG CYS A 5 -5.766 -8.835 -2.471 1.00 0.00 S ATOM 0 H CYS A 5 -1.986 -8.783 -1.979 1.00 0.00 H new ATOM 0 HA CYS A 5 -3.548 -11.087 -2.682 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -4.132 -8.525 -4.195 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -4.937 -10.074 -4.347 1.00 0.00 H new ATOM 0 HG CYS A 5 -5.644 -9.479 -1.349 1.00 0.00 H new ATOM 70 N GLY A 6 -2.027 -11.266 -4.730 1.00 0.00 N ATOM 71 CA GLY A 6 -1.141 -11.336 -5.880 1.00 0.00 C ATOM 72 C GLY A 6 -1.555 -10.331 -6.941 1.00 0.00 C ATOM 73 O GLY A 6 -2.456 -10.598 -7.739 1.00 0.00 O ATOM 0 H GLY A 6 -2.514 -12.135 -4.509 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -0.115 -11.140 -5.567 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -1.160 -12.342 -6.299 1.00 0.00 H new ATOM 77 N SER A 7 -0.920 -9.161 -6.922 1.00 0.00 N ATOM 78 CA SER A 7 -1.299 -8.056 -7.799 1.00 0.00 C ATOM 79 C SER A 7 -0.279 -6.919 -7.711 1.00 0.00 C ATOM 80 O SER A 7 0.092 -6.327 -8.725 1.00 0.00 O ATOM 81 CB SER A 7 -2.704 -7.549 -7.431 1.00 0.00 C ATOM 82 OG SER A 7 -2.824 -7.347 -6.027 1.00 0.00 O ATOM 0 H SER A 7 -0.135 -8.953 -6.304 1.00 0.00 H new ATOM 0 HA SER A 7 -1.314 -8.418 -8.827 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.906 -6.614 -7.955 1.00 0.00 H new ATOM 0 HB3 SER A 7 -3.452 -8.268 -7.763 1.00 0.00 H new ATOM 0 HG SER A 7 -2.360 -8.068 -5.552 1.00 0.00 H new ATOM 88 N GLY A 8 0.160 -6.614 -6.489 1.00 0.00 N ATOM 89 CA GLY A 8 1.136 -5.555 -6.282 1.00 0.00 C ATOM 90 C GLY A 8 0.506 -4.176 -6.315 1.00 0.00 C ATOM 91 O GLY A 8 1.207 -3.163 -6.315 1.00 0.00 O ATOM 0 H GLY A 8 -0.145 -7.084 -5.637 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.631 -5.703 -5.322 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.906 -5.619 -7.051 1.00 0.00 H new ATOM 95 N LYS A 9 -0.825 -4.141 -6.336 1.00 0.00 N ATOM 96 CA LYS A 9 -1.569 -2.884 -6.399 1.00 0.00 C ATOM 97 C LYS A 9 -2.158 -2.559 -5.032 1.00 0.00 C ATOM 98 O LYS A 9 -2.257 -3.438 -4.178 1.00 0.00 O ATOM 99 CB LYS A 9 -2.678 -2.977 -7.459 1.00 0.00 C ATOM 100 CG LYS A 9 -2.197 -3.596 -8.770 1.00 0.00 C ATOM 101 CD LYS A 9 -3.010 -3.130 -9.977 1.00 0.00 C ATOM 102 CE LYS A 9 -4.446 -3.639 -9.947 1.00 0.00 C ATOM 103 NZ LYS A 9 -5.287 -2.941 -10.954 1.00 0.00 N ATOM 0 H LYS A 9 -1.413 -4.974 -6.310 1.00 0.00 H new ATOM 0 HA LYS A 9 -0.889 -2.081 -6.684 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -3.502 -3.571 -7.064 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -3.070 -1.979 -7.656 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.148 -3.342 -8.924 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -2.254 -4.682 -8.696 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -3.015 -2.040 -10.008 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.526 -3.473 -10.891 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.458 -4.712 -10.140 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -4.866 -3.490 -8.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.150 -3.494 -11.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.546 -1.999 -10.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.754 -2.841 -11.842 1.00 0.00 H new ATOM 117 N THR A 10 -2.562 -1.309 -4.837 1.00 0.00 N ATOM 118 CA THR A 10 -3.057 -0.847 -3.542 1.00 0.00 C ATOM 119 C THR A 10 -4.389 -1.509 -3.186 1.00 0.00 C ATOM 120 O THR A 10 -4.974 -2.235 -3.999 1.00 0.00 O ATOM 121 CB THR A 10 -3.219 0.692 -3.512 1.00 0.00 C ATOM 122 OG1 THR A 10 -4.176 1.114 -4.491 1.00 0.00 O ATOM 123 CG2 THR A 10 -1.890 1.386 -3.775 1.00 0.00 C ATOM 0 H THR A 10 -2.557 -0.592 -5.563 1.00 0.00 H new ATOM 0 HA THR A 10 -2.312 -1.134 -2.800 1.00 0.00 H new ATOM 0 HB THR A 10 -3.571 0.969 -2.518 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.269 2.089 -4.459 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.032 2.466 -3.748 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.170 1.096 -3.010 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.515 1.094 -4.756 1.00 0.00 H new ATOM 131 N TYR A 11 -4.858 -1.270 -1.964 1.00 0.00 N ATOM 132 CA TYR A 11 -6.141 -1.798 -1.515 1.00 0.00 C ATOM 133 C TYR A 11 -7.270 -1.264 -2.391 1.00 0.00 C ATOM 134 O TYR A 11 -8.016 -2.038 -3.004 1.00 0.00 O ATOM 135 CB TYR A 11 -6.391 -1.432 -0.044 1.00 0.00 C ATOM 136 CG TYR A 11 -7.809 -1.713 0.427 1.00 0.00 C ATOM 137 CD1 TYR A 11 -8.273 -3.016 0.574 1.00 0.00 C ATOM 138 CD2 TYR A 11 -8.689 -0.671 0.709 1.00 0.00 C ATOM 139 CE1 TYR A 11 -9.565 -3.270 0.992 1.00 0.00 C ATOM 140 CE2 TYR A 11 -9.982 -0.921 1.126 1.00 0.00 C ATOM 141 CZ TYR A 11 -10.415 -2.221 1.265 1.00 0.00 C ATOM 142 OH TYR A 11 -11.704 -2.474 1.676 1.00 0.00 O ATOM 0 H TYR A 11 -4.366 -0.712 -1.266 1.00 0.00 H new ATOM 0 HA TYR A 11 -6.115 -2.884 -1.601 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -5.693 -1.988 0.582 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -6.174 -0.373 0.099 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -7.612 -3.843 0.358 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -8.355 0.350 0.600 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -9.908 -4.288 1.104 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -10.650 -0.101 1.342 1.00 0.00 H new ATOM 0 HH TYR A 11 -12.171 -1.626 1.828 1.00 0.00 H new ATOM 152 N ASP A 12 -7.365 0.060 -2.460 1.00 0.00 N ATOM 153 CA ASP A 12 -8.428 0.734 -3.204 1.00 0.00 C ATOM 154 C ASP A 12 -8.321 0.439 -4.698 1.00 0.00 C ATOM 155 O ASP A 12 -9.333 0.263 -5.378 1.00 0.00 O ATOM 156 CB ASP A 12 -8.377 2.249 -2.958 1.00 0.00 C ATOM 157 CG ASP A 12 -8.576 2.613 -1.493 1.00 0.00 C ATOM 158 OD1 ASP A 12 -7.573 2.666 -0.745 1.00 0.00 O ATOM 159 OD2 ASP A 12 -9.732 2.851 -1.083 1.00 0.00 O ATOM 0 H ASP A 12 -6.711 0.696 -2.004 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.384 0.351 -2.847 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -7.416 2.636 -3.297 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -9.146 2.736 -3.557 1.00 0.00 H new ATOM 164 N ASP A 13 -7.091 0.379 -5.205 1.00 0.00 N ATOM 165 CA ASP A 13 -6.857 0.063 -6.616 1.00 0.00 C ATOM 166 C ASP A 13 -7.326 -1.358 -6.916 1.00 0.00 C ATOM 167 O ASP A 13 -8.170 -1.589 -7.782 1.00 0.00 O ATOM 168 CB ASP A 13 -5.364 0.182 -6.960 1.00 0.00 C ATOM 169 CG ASP A 13 -5.098 0.141 -8.461 1.00 0.00 C ATOM 170 OD1 ASP A 13 -5.317 -0.916 -9.078 1.00 0.00 O ATOM 171 OD2 ASP A 13 -4.655 1.163 -9.029 1.00 0.00 O ATOM 0 H ASP A 13 -6.243 0.544 -4.663 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.419 0.774 -7.221 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -4.975 1.115 -6.552 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -4.819 -0.629 -6.477 1.00 0.00 H new ATOM 176 N CYS A 14 -6.770 -2.304 -6.171 1.00 0.00 N ATOM 177 CA CYS A 14 -7.038 -3.723 -6.375 1.00 0.00 C ATOM 178 C CYS A 14 -8.440 -4.118 -5.883 1.00 0.00 C ATOM 179 O CYS A 14 -9.333 -4.381 -6.688 1.00 0.00 O ATOM 180 CB CYS A 14 -5.946 -4.561 -5.683 1.00 0.00 C ATOM 181 SG CYS A 14 -6.461 -6.243 -5.202 1.00 0.00 S ATOM 0 H CYS A 14 -6.121 -2.110 -5.408 1.00 0.00 H new ATOM 0 HA CYS A 14 -7.015 -3.926 -7.446 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -5.088 -4.636 -6.351 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -5.611 -4.030 -4.792 1.00 0.00 H new ATOM 0 HG CYS A 14 -7.206 -6.181 -4.138 1.00 0.00 H new ATOM 186 N CYS A 15 -8.632 -4.160 -4.566 1.00 0.00 N ATOM 187 CA CYS A 15 -9.891 -4.644 -3.981 1.00 0.00 C ATOM 188 C CYS A 15 -11.042 -3.650 -4.141 1.00 0.00 C ATOM 189 O CYS A 15 -12.195 -4.061 -4.220 1.00 0.00 O ATOM 190 CB CYS A 15 -9.706 -4.990 -2.498 1.00 0.00 C ATOM 191 SG CYS A 15 -8.838 -6.564 -2.203 1.00 0.00 S ATOM 0 H CYS A 15 -7.936 -3.866 -3.881 1.00 0.00 H new ATOM 0 HA CYS A 15 -10.159 -5.544 -4.535 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.151 -4.186 -2.015 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -10.685 -5.033 -2.021 1.00 0.00 H new ATOM 0 HG CYS A 15 -7.585 -6.328 -1.952 1.00 0.00 H new ATOM 196 N GLY A 16 -10.722 -2.357 -4.208 1.00 0.00 N ATOM 197 CA GLY A 16 -11.747 -1.316 -4.122 1.00 0.00 C ATOM 198 C GLY A 16 -12.943 -1.520 -5.050 1.00 0.00 C ATOM 199 O GLY A 16 -14.082 -1.570 -4.580 1.00 0.00 O ATOM 0 H GLY A 16 -9.770 -2.008 -4.321 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -12.107 -1.263 -3.094 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.288 -0.354 -4.349 1.00 0.00 H new ATOM 203 N PRO A 17 -12.726 -1.673 -6.370 1.00 0.00 N ATOM 204 CA PRO A 17 -13.828 -1.843 -7.330 1.00 0.00 C ATOM 205 C PRO A 17 -14.530 -3.200 -7.190 1.00 0.00 C ATOM 206 O PRO A 17 -15.708 -3.342 -7.534 1.00 0.00 O ATOM 207 CB PRO A 17 -13.132 -1.710 -8.692 1.00 0.00 C ATOM 208 CG PRO A 17 -11.720 -2.116 -8.437 1.00 0.00 C ATOM 209 CD PRO A 17 -11.408 -1.650 -7.040 1.00 0.00 C ATOM 0 HA PRO A 17 -14.624 -1.114 -7.177 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -13.599 -2.351 -9.440 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -13.189 -0.688 -9.068 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.601 -3.196 -8.525 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -11.045 -1.661 -9.162 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.694 -2.310 -6.546 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -10.973 -0.651 -7.037 1.00 0.00 H new ATOM 217 N LEU A 18 -13.804 -4.191 -6.677 1.00 0.00 N ATOM 218 CA LEU A 18 -14.355 -5.533 -6.477 1.00 0.00 C ATOM 219 C LEU A 18 -15.287 -5.553 -5.267 1.00 0.00 C ATOM 220 O LEU A 18 -16.436 -5.985 -5.363 1.00 0.00 O ATOM 221 CB LEU A 18 -13.223 -6.564 -6.295 1.00 0.00 C ATOM 222 CG LEU A 18 -12.639 -7.163 -7.589 1.00 0.00 C ATOM 223 CD1 LEU A 18 -13.701 -7.949 -8.345 1.00 0.00 C ATOM 224 CD2 LEU A 18 -12.024 -6.087 -8.479 1.00 0.00 C ATOM 0 H LEU A 18 -12.830 -4.091 -6.391 1.00 0.00 H new ATOM 0 HA LEU A 18 -14.929 -5.802 -7.364 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.413 -6.090 -5.740 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -13.598 -7.380 -5.678 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.840 -7.848 -7.304 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -13.268 -8.363 -9.255 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -14.070 -8.760 -7.717 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.527 -7.287 -8.605 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.623 -6.547 -9.382 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -12.789 -5.360 -8.752 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.221 -5.584 -7.940 1.00 0.00 H new ATOM 236 N LEU A 19 -14.789 -5.054 -4.140 1.00 0.00 N ATOM 237 CA LEU A 19 -15.552 -5.019 -2.893 1.00 0.00 C ATOM 238 C LEU A 19 -16.783 -4.128 -3.040 1.00 0.00 C ATOM 239 O LEU A 19 -17.814 -4.369 -2.412 1.00 0.00 O ATOM 240 CB LEU A 19 -14.657 -4.529 -1.741 1.00 0.00 C ATOM 241 CG LEU A 19 -13.623 -5.555 -1.230 1.00 0.00 C ATOM 242 CD1 LEU A 19 -12.546 -4.877 -0.391 1.00 0.00 C ATOM 243 CD2 LEU A 19 -14.305 -6.648 -0.417 1.00 0.00 C ATOM 0 H LEU A 19 -13.850 -4.664 -4.063 1.00 0.00 H new ATOM 0 HA LEU A 19 -15.893 -6.028 -2.663 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -14.126 -3.635 -2.069 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -15.294 -4.233 -0.908 1.00 0.00 H new ATOM 0 HG LEU A 19 -13.148 -6.008 -2.100 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -11.831 -5.623 -0.044 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -12.028 -4.132 -0.996 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -13.007 -4.390 0.468 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.558 -7.360 -0.067 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -14.811 -6.202 0.439 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -15.034 -7.164 -1.041 1.00 0.00 H new ATOM 255 N ALA A 20 -16.671 -3.108 -3.889 1.00 0.00 N ATOM 256 CA ALA A 20 -17.789 -2.212 -4.179 1.00 0.00 C ATOM 257 C ALA A 20 -18.858 -2.916 -5.023 1.00 0.00 C ATOM 258 O ALA A 20 -19.930 -2.360 -5.270 1.00 0.00 O ATOM 259 CB ALA A 20 -17.287 -0.959 -4.887 1.00 0.00 C ATOM 0 H ALA A 20 -15.812 -2.881 -4.391 1.00 0.00 H new ATOM 0 HA ALA A 20 -18.248 -1.923 -3.234 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -18.128 -0.299 -5.098 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -16.571 -0.442 -4.248 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -16.802 -1.239 -5.822 1.00 0.00 H new ATOM 265 N ARG A 21 -18.537 -4.134 -5.479 1.00 0.00 N ATOM 266 CA ARG A 21 -19.458 -4.967 -6.265 1.00 0.00 C ATOM 267 C ARG A 21 -19.784 -4.327 -7.617 1.00 0.00 C ATOM 268 O ARG A 21 -20.694 -4.773 -8.323 1.00 0.00 O ATOM 269 CB ARG A 21 -20.750 -5.250 -5.473 1.00 0.00 C ATOM 270 CG ARG A 21 -20.534 -6.092 -4.217 1.00 0.00 C ATOM 271 CD ARG A 21 -20.106 -7.521 -4.551 1.00 0.00 C ATOM 272 NE ARG A 21 -21.195 -8.301 -5.152 1.00 0.00 N ATOM 273 CZ ARG A 21 -21.027 -9.231 -6.099 1.00 0.00 C ATOM 274 NH1 ARG A 21 -19.826 -9.440 -6.631 1.00 0.00 N ATOM 275 NH2 ARG A 21 -22.067 -9.940 -6.523 1.00 0.00 N ATOM 0 H ARG A 21 -17.630 -4.570 -5.313 1.00 0.00 H new ATOM 0 HA ARG A 21 -18.956 -5.915 -6.461 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -21.205 -4.301 -5.189 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -21.459 -5.762 -6.124 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -19.774 -5.623 -3.592 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -21.455 -6.116 -3.634 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -19.260 -7.494 -5.237 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -19.764 -8.018 -3.643 1.00 0.00 H new ATOM 0 HE ARG A 21 -22.144 -8.122 -4.825 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -19.026 -8.890 -6.317 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -19.705 -10.151 -7.353 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -22.992 -9.775 -6.127 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -21.940 -10.649 -7.245 1.00 0.00 H new ATOM 289 N THR A 22 -19.018 -3.304 -7.987 1.00 0.00 N ATOM 290 CA THR A 22 -19.226 -2.601 -9.249 1.00 0.00 C ATOM 291 C THR A 22 -18.397 -3.230 -10.368 1.00 0.00 C ATOM 292 O THR A 22 -18.769 -3.159 -11.542 1.00 0.00 O ATOM 293 CB THR A 22 -18.877 -1.094 -9.127 1.00 0.00 C ATOM 294 OG1 THR A 22 -19.036 -0.436 -10.395 1.00 0.00 O ATOM 295 CG2 THR A 22 -17.451 -0.891 -8.626 1.00 0.00 C ATOM 0 H THR A 22 -18.245 -2.943 -7.428 1.00 0.00 H new ATOM 0 HA THR A 22 -20.284 -2.692 -9.494 1.00 0.00 H new ATOM 0 HB THR A 22 -19.564 -0.658 -8.402 1.00 0.00 H new ATOM 0 HG1 THR A 22 -18.814 0.514 -10.301 1.00 0.00 H new ATOM 0 HG21 THR A 22 -17.240 0.176 -8.552 1.00 0.00 H new ATOM 0 HG22 THR A 22 -17.341 -1.351 -7.644 1.00 0.00 H new ATOM 0 HG23 THR A 22 -16.751 -1.352 -9.323 1.00 0.00 H new ATOM 303 N ARG A 23 -17.279 -3.850 -10.005 1.00 0.00 N ATOM 304 CA ARG A 23 -16.383 -4.448 -10.989 1.00 0.00 C ATOM 305 C ARG A 23 -16.430 -5.967 -10.917 1.00 0.00 C ATOM 306 O ARG A 23 -16.381 -6.554 -9.832 1.00 0.00 O ATOM 307 CB ARG A 23 -14.945 -3.963 -10.773 1.00 0.00 C ATOM 308 CG ARG A 23 -13.941 -4.509 -11.789 1.00 0.00 C ATOM 309 CD ARG A 23 -12.546 -3.943 -11.553 1.00 0.00 C ATOM 310 NE ARG A 23 -11.581 -4.383 -12.562 1.00 0.00 N ATOM 311 CZ ARG A 23 -11.213 -3.647 -13.613 1.00 0.00 C ATOM 312 NH1 ARG A 23 -11.812 -2.489 -13.866 1.00 0.00 N ATOM 313 NH2 ARG A 23 -10.264 -4.081 -14.427 1.00 0.00 N ATOM 0 H ARG A 23 -16.972 -3.952 -9.038 1.00 0.00 H new ATOM 0 HA ARG A 23 -16.719 -4.136 -11.978 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.931 -2.874 -10.814 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.623 -4.249 -9.771 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -13.910 -5.597 -11.723 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.270 -4.260 -12.798 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -12.595 -2.854 -11.553 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -12.197 -4.246 -10.566 1.00 0.00 H new ATOM 0 HE ARG A 23 -11.165 -5.308 -12.455 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -12.558 -2.157 -13.255 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -11.526 -1.932 -14.671 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -9.813 -4.979 -14.252 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.984 -3.518 -15.230 1.00 0.00 H new ATOM 327 N SER A 24 -16.539 -6.591 -12.076 1.00 0.00 N ATOM 328 CA SER A 24 -16.448 -8.034 -12.195 1.00 0.00 C ATOM 329 C SER A 24 -14.994 -8.425 -12.450 1.00 0.00 C ATOM 330 O SER A 24 -14.365 -7.913 -13.379 1.00 0.00 O ATOM 331 CB SER A 24 -17.352 -8.513 -13.337 1.00 0.00 C ATOM 332 OG SER A 24 -17.133 -7.746 -14.513 1.00 0.00 O ATOM 0 H SER A 24 -16.693 -6.110 -12.962 1.00 0.00 H new ATOM 0 HA SER A 24 -16.782 -8.508 -11.272 1.00 0.00 H new ATOM 0 HB2 SER A 24 -17.158 -9.566 -13.543 1.00 0.00 H new ATOM 0 HB3 SER A 24 -18.397 -8.435 -13.036 1.00 0.00 H new ATOM 0 HG SER A 24 -16.185 -7.505 -14.574 1.00 0.00 H new ATOM 338 N ALA A 25 -14.454 -9.303 -11.605 1.00 0.00 N ATOM 339 CA ALA A 25 -13.073 -9.762 -11.747 1.00 0.00 C ATOM 340 C ALA A 25 -12.818 -10.326 -13.146 1.00 0.00 C ATOM 341 O ALA A 25 -11.701 -10.250 -13.657 1.00 0.00 O ATOM 342 CB ALA A 25 -12.754 -10.802 -10.681 1.00 0.00 C ATOM 0 H ALA A 25 -14.953 -9.711 -10.814 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.413 -8.905 -11.611 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.723 -11.137 -10.796 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -12.884 -10.362 -9.692 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.426 -11.653 -10.790 1.00 0.00 H new ATOM 348 N ALA A 26 -13.864 -10.901 -13.747 1.00 0.00 N ATOM 349 CA ALA A 26 -13.805 -11.430 -15.116 1.00 0.00 C ATOM 350 C ALA A 26 -12.749 -12.530 -15.260 1.00 0.00 C ATOM 351 O ALA A 26 -12.433 -12.955 -16.369 1.00 0.00 O ATOM 352 CB ALA A 26 -13.549 -10.301 -16.115 1.00 0.00 C ATOM 0 H ALA A 26 -14.774 -11.013 -13.301 1.00 0.00 H new ATOM 0 HA ALA A 26 -14.773 -11.881 -15.335 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.508 -10.711 -17.124 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -14.355 -9.570 -16.052 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.601 -9.817 -15.881 1.00 0.00 H new ATOM 358 N SER A 27 -12.238 -13.010 -14.129 1.00 0.00 N ATOM 359 CA SER A 27 -11.207 -14.043 -14.111 1.00 0.00 C ATOM 360 C SER A 27 -11.210 -14.761 -12.758 1.00 0.00 C ATOM 361 O SER A 27 -11.221 -14.106 -11.713 1.00 0.00 O ATOM 362 CB SER A 27 -9.829 -13.417 -14.382 1.00 0.00 C ATOM 363 OG SER A 27 -9.807 -12.760 -15.639 1.00 0.00 O ATOM 0 H SER A 27 -12.526 -12.695 -13.203 1.00 0.00 H new ATOM 0 HA SER A 27 -11.419 -14.771 -14.894 1.00 0.00 H new ATOM 0 HB2 SER A 27 -9.587 -12.706 -13.592 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.063 -14.192 -14.359 1.00 0.00 H new ATOM 0 HG SER A 27 -8.921 -12.369 -15.788 1.00 0.00 H new ATOM 369 N PRO A 28 -11.212 -16.113 -12.754 1.00 0.00 N ATOM 370 CA PRO A 28 -11.222 -16.908 -11.516 1.00 0.00 C ATOM 371 C PRO A 28 -10.051 -16.550 -10.596 1.00 0.00 C ATOM 372 O PRO A 28 -10.219 -16.419 -9.380 1.00 0.00 O ATOM 373 CB PRO A 28 -11.115 -18.366 -12.008 1.00 0.00 C ATOM 374 CG PRO A 28 -10.650 -18.268 -13.424 1.00 0.00 C ATOM 375 CD PRO A 28 -11.213 -16.976 -13.949 1.00 0.00 C ATOM 0 HA PRO A 28 -12.117 -16.726 -10.920 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -10.411 -18.936 -11.401 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.077 -18.875 -11.944 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.561 -18.272 -13.480 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -11.002 -19.116 -14.011 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.599 -16.562 -14.748 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -12.217 -17.106 -14.354 1.00 0.00 H new ATOM 383 N GLU A 29 -8.870 -16.376 -11.190 1.00 0.00 N ATOM 384 CA GLU A 29 -7.677 -15.992 -10.436 1.00 0.00 C ATOM 385 C GLU A 29 -7.883 -14.630 -9.769 1.00 0.00 C ATOM 386 O GLU A 29 -7.590 -14.455 -8.585 1.00 0.00 O ATOM 387 CB GLU A 29 -6.445 -15.953 -11.354 1.00 0.00 C ATOM 388 CG GLU A 29 -6.619 -15.068 -12.585 1.00 0.00 C ATOM 389 CD GLU A 29 -5.314 -14.819 -13.325 1.00 0.00 C ATOM 390 OE1 GLU A 29 -4.555 -13.920 -12.905 1.00 0.00 O ATOM 391 OE2 GLU A 29 -5.045 -15.512 -14.328 1.00 0.00 O ATOM 0 H GLU A 29 -8.714 -16.495 -12.191 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.507 -16.739 -9.661 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.588 -15.598 -10.781 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.213 -16.968 -11.678 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.332 -15.535 -13.264 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.047 -14.112 -12.282 1.00 0.00 H new ATOM 398 N ALA A 30 -8.417 -13.680 -10.535 1.00 0.00 N ATOM 399 CA ALA A 30 -8.662 -12.328 -10.042 1.00 0.00 C ATOM 400 C ALA A 30 -9.734 -12.337 -8.958 1.00 0.00 C ATOM 401 O ALA A 30 -9.676 -11.558 -8.007 1.00 0.00 O ATOM 402 CB ALA A 30 -9.066 -11.410 -11.191 1.00 0.00 C ATOM 0 H ALA A 30 -8.690 -13.825 -11.507 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.739 -11.947 -9.604 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.245 -10.405 -10.808 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.266 -11.379 -11.931 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -9.976 -11.789 -11.657 1.00 0.00 H new ATOM 408 N LEU A 31 -10.705 -13.234 -9.102 1.00 0.00 N ATOM 409 CA LEU A 31 -11.790 -13.361 -8.136 1.00 0.00 C ATOM 410 C LEU A 31 -11.220 -13.804 -6.787 1.00 0.00 C ATOM 411 O LEU A 31 -11.525 -13.212 -5.749 1.00 0.00 O ATOM 412 CB LEU A 31 -12.848 -14.351 -8.671 1.00 0.00 C ATOM 413 CG LEU A 31 -14.217 -14.376 -7.951 1.00 0.00 C ATOM 414 CD1 LEU A 31 -14.130 -15.056 -6.587 1.00 0.00 C ATOM 415 CD2 LEU A 31 -14.784 -12.963 -7.821 1.00 0.00 C ATOM 0 H LEU A 31 -10.762 -13.887 -9.884 1.00 0.00 H new ATOM 0 HA LEU A 31 -12.282 -12.399 -7.991 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -13.023 -14.124 -9.723 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -12.425 -15.355 -8.628 1.00 0.00 H new ATOM 0 HG LEU A 31 -14.898 -14.967 -8.563 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.113 -15.052 -6.115 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -13.792 -16.085 -6.714 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.423 -14.517 -5.956 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -15.747 -13.003 -7.312 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -14.094 -12.346 -7.245 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -14.916 -12.531 -8.813 1.00 0.00 H new ATOM 427 N MET A 32 -10.367 -14.829 -6.814 1.00 0.00 N ATOM 428 CA MET A 32 -9.684 -15.296 -5.606 1.00 0.00 C ATOM 429 C MET A 32 -8.791 -14.200 -5.037 1.00 0.00 C ATOM 430 O MET A 32 -8.826 -13.913 -3.843 1.00 0.00 O ATOM 431 CB MET A 32 -8.839 -16.547 -5.894 1.00 0.00 C ATOM 432 CG MET A 32 -9.643 -17.836 -5.948 1.00 0.00 C ATOM 433 SD MET A 32 -10.528 -18.164 -4.407 1.00 0.00 S ATOM 434 CE MET A 32 -9.191 -18.101 -3.212 1.00 0.00 C ATOM 0 H MET A 32 -10.133 -15.351 -7.658 1.00 0.00 H new ATOM 0 HA MET A 32 -10.450 -15.553 -4.874 1.00 0.00 H new ATOM 0 HB2 MET A 32 -8.322 -16.413 -6.844 1.00 0.00 H new ATOM 0 HB3 MET A 32 -8.073 -16.641 -5.125 1.00 0.00 H new ATOM 0 HG2 MET A 32 -10.358 -17.781 -6.769 1.00 0.00 H new ATOM 0 HG3 MET A 32 -8.974 -18.669 -6.163 1.00 0.00 H new ATOM 0 HE1 MET A 32 -9.418 -18.763 -2.377 1.00 0.00 H new ATOM 0 HE2 MET A 32 -8.263 -18.421 -3.687 1.00 0.00 H new ATOM 0 HE3 MET A 32 -9.078 -17.081 -2.846 1.00 0.00 H new ATOM 444 N ARG A 33 -8.003 -13.591 -5.914 1.00 0.00 N ATOM 445 CA ARG A 33 -7.069 -12.533 -5.536 1.00 0.00 C ATOM 446 C ARG A 33 -7.793 -11.367 -4.855 1.00 0.00 C ATOM 447 O ARG A 33 -7.244 -10.720 -3.961 1.00 0.00 O ATOM 448 CB ARG A 33 -6.274 -12.093 -6.792 1.00 0.00 C ATOM 449 CG ARG A 33 -5.952 -10.598 -6.917 1.00 0.00 C ATOM 450 CD ARG A 33 -7.103 -9.809 -7.552 1.00 0.00 C ATOM 451 NE ARG A 33 -6.633 -8.634 -8.289 1.00 0.00 N ATOM 452 CZ ARG A 33 -7.409 -7.605 -8.645 1.00 0.00 C ATOM 453 NH1 ARG A 33 -8.683 -7.552 -8.273 1.00 0.00 N ATOM 454 NH2 ARG A 33 -6.908 -6.625 -9.380 1.00 0.00 N ATOM 0 H ARG A 33 -7.992 -13.815 -6.909 1.00 0.00 H new ATOM 0 HA ARG A 33 -6.361 -12.912 -4.798 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -5.335 -12.646 -6.811 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.839 -12.394 -7.674 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -5.736 -10.191 -5.929 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -5.052 -10.471 -7.518 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -7.658 -10.460 -8.227 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -7.797 -9.493 -6.773 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.647 -8.598 -8.548 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -9.081 -8.302 -7.708 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -9.263 -6.761 -8.552 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -5.932 -6.656 -9.674 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.498 -5.839 -9.653 1.00 0.00 H new ATOM 468 N SER A 34 -9.016 -11.095 -5.291 1.00 0.00 N ATOM 469 CA SER A 34 -9.825 -10.031 -4.706 1.00 0.00 C ATOM 470 C SER A 34 -10.449 -10.462 -3.377 1.00 0.00 C ATOM 471 O SER A 34 -10.303 -9.774 -2.364 1.00 0.00 O ATOM 472 CB SER A 34 -10.908 -9.608 -5.699 1.00 0.00 C ATOM 473 OG SER A 34 -10.328 -9.225 -6.937 1.00 0.00 O ATOM 0 H SER A 34 -9.472 -11.599 -6.052 1.00 0.00 H new ATOM 0 HA SER A 34 -9.175 -9.182 -4.496 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.606 -10.431 -5.857 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.482 -8.778 -5.288 1.00 0.00 H new ATOM 0 HG SER A 34 -10.234 -10.013 -7.512 1.00 0.00 H new ATOM 479 N ARG A 35 -11.120 -11.616 -3.380 1.00 0.00 N ATOM 480 CA ARG A 35 -11.902 -12.046 -2.222 1.00 0.00 C ATOM 481 C ARG A 35 -11.004 -12.491 -1.069 1.00 0.00 C ATOM 482 O ARG A 35 -11.374 -12.348 0.093 1.00 0.00 O ATOM 483 CB ARG A 35 -12.906 -13.153 -2.593 1.00 0.00 C ATOM 484 CG ARG A 35 -12.291 -14.526 -2.846 1.00 0.00 C ATOM 485 CD ARG A 35 -13.371 -15.593 -3.004 1.00 0.00 C ATOM 486 NE ARG A 35 -12.805 -16.938 -3.136 1.00 0.00 N ATOM 487 CZ ARG A 35 -13.147 -17.976 -2.367 1.00 0.00 C ATOM 488 NH1 ARG A 35 -14.054 -17.828 -1.406 1.00 0.00 N ATOM 489 NH2 ARG A 35 -12.581 -19.161 -2.567 1.00 0.00 N ATOM 0 H ARG A 35 -11.137 -12.265 -4.167 1.00 0.00 H new ATOM 0 HA ARG A 35 -12.471 -11.180 -1.885 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -13.638 -13.242 -1.790 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -13.449 -12.845 -3.487 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -11.675 -14.492 -3.745 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -11.633 -14.791 -2.019 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -14.037 -15.564 -2.142 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -13.976 -15.368 -3.882 1.00 0.00 H new ATOM 0 HE ARG A 35 -12.105 -17.092 -3.862 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -14.492 -16.919 -1.253 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -14.312 -18.623 -0.821 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -11.887 -19.277 -3.306 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -12.840 -19.955 -1.982 1.00 0.00 H new ATOM 503 N TYR A 36 -9.830 -13.037 -1.385 1.00 0.00 N ATOM 504 CA TYR A 36 -8.883 -13.458 -0.349 1.00 0.00 C ATOM 505 C TYR A 36 -8.593 -12.305 0.611 1.00 0.00 C ATOM 506 O TYR A 36 -8.461 -12.504 1.822 1.00 0.00 O ATOM 507 CB TYR A 36 -7.569 -13.960 -0.965 1.00 0.00 C ATOM 508 CG TYR A 36 -6.487 -14.212 0.071 1.00 0.00 C ATOM 509 CD1 TYR A 36 -6.499 -15.363 0.854 1.00 0.00 C ATOM 510 CD2 TYR A 36 -5.469 -13.285 0.284 1.00 0.00 C ATOM 511 CE1 TYR A 36 -5.533 -15.579 1.818 1.00 0.00 C ATOM 512 CE2 TYR A 36 -4.498 -13.499 1.243 1.00 0.00 C ATOM 513 CZ TYR A 36 -4.535 -14.646 2.007 1.00 0.00 C ATOM 514 OH TYR A 36 -3.577 -14.856 2.970 1.00 0.00 O ATOM 0 H TYR A 36 -9.512 -13.198 -2.341 1.00 0.00 H new ATOM 0 HA TYR A 36 -9.341 -14.279 0.202 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -7.760 -14.882 -1.514 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.209 -13.227 -1.687 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -7.276 -16.099 0.706 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -5.438 -12.384 -0.311 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -5.559 -16.475 2.421 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -3.714 -12.772 1.393 1.00 0.00 H new ATOM 0 HH TYR A 36 -3.094 -15.686 2.775 1.00 0.00 H new ATOM 524 N ALA A 37 -8.504 -11.098 0.060 1.00 0.00 N ATOM 525 CA ALA A 37 -8.247 -9.907 0.858 1.00 0.00 C ATOM 526 C ALA A 37 -9.360 -9.700 1.878 1.00 0.00 C ATOM 527 O ALA A 37 -9.122 -9.198 2.973 1.00 0.00 O ATOM 528 CB ALA A 37 -8.100 -8.684 -0.037 1.00 0.00 C ATOM 0 H ALA A 37 -8.607 -10.920 -0.939 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.310 -10.047 1.397 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.908 -7.804 0.578 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.268 -8.834 -0.725 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.018 -8.537 -0.605 1.00 0.00 H new ATOM 534 N ALA A 38 -10.573 -10.109 1.512 1.00 0.00 N ATOM 535 CA ALA A 38 -11.720 -10.019 2.407 1.00 0.00 C ATOM 536 C ALA A 38 -11.509 -10.914 3.629 1.00 0.00 C ATOM 537 O ALA A 38 -11.847 -10.537 4.747 1.00 0.00 O ATOM 538 CB ALA A 38 -13.002 -10.389 1.670 1.00 0.00 C ATOM 0 H ALA A 38 -10.785 -10.507 0.597 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.817 -8.990 2.752 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -13.848 -10.316 2.353 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.151 -9.706 0.834 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -12.925 -11.410 1.295 1.00 0.00 H new ATOM 544 N TYR A 39 -10.929 -12.094 3.410 1.00 0.00 N ATOM 545 CA TYR A 39 -10.563 -12.986 4.512 1.00 0.00 C ATOM 546 C TYR A 39 -9.527 -12.312 5.411 1.00 0.00 C ATOM 547 O TYR A 39 -9.663 -12.297 6.637 1.00 0.00 O ATOM 548 CB TYR A 39 -10.009 -14.325 3.981 1.00 0.00 C ATOM 549 CG TYR A 39 -11.043 -15.430 3.809 1.00 0.00 C ATOM 550 CD1 TYR A 39 -12.407 -15.164 3.832 1.00 0.00 C ATOM 551 CD2 TYR A 39 -10.641 -16.751 3.635 1.00 0.00 C ATOM 552 CE1 TYR A 39 -13.336 -16.179 3.684 1.00 0.00 C ATOM 553 CE2 TYR A 39 -11.564 -17.769 3.487 1.00 0.00 C ATOM 554 CZ TYR A 39 -12.909 -17.478 3.512 1.00 0.00 C ATOM 555 OH TYR A 39 -13.833 -18.489 3.355 1.00 0.00 O ATOM 0 H TYR A 39 -10.703 -12.454 2.483 1.00 0.00 H new ATOM 0 HA TYR A 39 -11.462 -13.194 5.093 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -9.529 -14.146 3.019 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.235 -14.676 4.663 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -12.748 -14.148 3.968 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -9.587 -16.985 3.615 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -14.392 -15.954 3.703 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -11.232 -18.788 3.352 1.00 0.00 H new ATOM 0 HH TYR A 39 -13.954 -18.957 4.208 1.00 0.00 H new ATOM 565 N ALA A 40 -8.501 -11.740 4.786 1.00 0.00 N ATOM 566 CA ALA A 40 -7.420 -11.076 5.513 1.00 0.00 C ATOM 567 C ALA A 40 -7.915 -9.804 6.204 1.00 0.00 C ATOM 568 O ALA A 40 -7.342 -9.363 7.202 1.00 0.00 O ATOM 569 CB ALA A 40 -6.268 -10.759 4.566 1.00 0.00 C ATOM 0 H ALA A 40 -8.395 -11.723 3.772 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.063 -11.755 6.287 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.469 -10.265 5.118 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.890 -11.684 4.130 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.621 -10.101 3.771 1.00 0.00 H new ATOM 575 N LEU A 41 -8.979 -9.215 5.666 1.00 0.00 N ATOM 576 CA LEU A 41 -9.581 -8.010 6.238 1.00 0.00 C ATOM 577 C LEU A 41 -10.892 -8.346 6.948 1.00 0.00 C ATOM 578 O LEU A 41 -11.718 -7.467 7.196 1.00 0.00 O ATOM 579 CB LEU A 41 -9.803 -6.960 5.143 1.00 0.00 C ATOM 580 CG LEU A 41 -8.519 -6.467 4.453 1.00 0.00 C ATOM 581 CD1 LEU A 41 -8.846 -5.456 3.362 1.00 0.00 C ATOM 582 CD2 LEU A 41 -7.549 -5.868 5.473 1.00 0.00 C ATOM 0 H LEU A 41 -9.447 -9.555 4.826 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.897 -7.595 6.979 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -10.467 -7.379 4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -10.316 -6.103 5.579 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.034 -7.325 3.987 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.923 -5.121 2.888 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.489 -5.922 2.615 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.360 -4.601 3.801 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.649 -5.526 4.962 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.024 -5.025 5.975 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.282 -6.626 6.210 1.00 0.00 H new ATOM 594 N LYS A 42 -11.046 -9.632 7.279 1.00 0.00 N ATOM 595 CA LYS A 42 -12.191 -10.167 8.036 1.00 0.00 C ATOM 596 C LYS A 42 -13.551 -9.631 7.562 1.00 0.00 C ATOM 597 O LYS A 42 -14.492 -9.525 8.350 1.00 0.00 O ATOM 598 CB LYS A 42 -12.024 -9.971 9.565 1.00 0.00 C ATOM 599 CG LYS A 42 -11.777 -8.538 10.051 1.00 0.00 C ATOM 600 CD LYS A 42 -10.286 -8.194 10.139 1.00 0.00 C ATOM 601 CE LYS A 42 -9.530 -9.151 11.058 1.00 0.00 C ATOM 602 NZ LYS A 42 -8.128 -8.714 11.286 1.00 0.00 N ATOM 0 H LYS A 42 -10.366 -10.348 7.025 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.191 -11.237 7.827 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -12.921 -10.347 10.057 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -11.193 -10.592 9.899 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -12.268 -7.839 9.374 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -12.235 -8.407 11.031 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -9.847 -8.227 9.142 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -10.171 -7.174 10.505 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -10.048 -9.220 12.014 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -9.532 -10.150 10.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -7.651 -9.391 11.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -7.625 -8.673 10.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -8.125 -7.772 11.726 1.00 0.00 H new ATOM 616 N ASP A 43 -13.666 -9.329 6.272 1.00 0.00 N ATOM 617 CA ASP A 43 -14.959 -8.995 5.675 1.00 0.00 C ATOM 618 C ASP A 43 -15.480 -10.199 4.895 1.00 0.00 C ATOM 619 O ASP A 43 -15.337 -10.278 3.675 1.00 0.00 O ATOM 620 CB ASP A 43 -14.859 -7.764 4.756 1.00 0.00 C ATOM 621 CG ASP A 43 -16.216 -7.332 4.199 1.00 0.00 C ATOM 622 OD1 ASP A 43 -16.999 -6.706 4.949 1.00 0.00 O ATOM 623 OD2 ASP A 43 -16.502 -7.595 3.010 1.00 0.00 O ATOM 0 H ASP A 43 -12.882 -9.308 5.620 1.00 0.00 H new ATOM 0 HA ASP A 43 -15.655 -8.746 6.476 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -14.418 -6.936 5.311 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -14.185 -7.987 3.929 1.00 0.00 H new ATOM 628 N PHE A 44 -16.052 -11.160 5.616 1.00 0.00 N ATOM 629 CA PHE A 44 -16.560 -12.382 4.996 1.00 0.00 C ATOM 630 C PHE A 44 -17.821 -12.088 4.185 1.00 0.00 C ATOM 631 O PHE A 44 -18.292 -12.930 3.416 1.00 0.00 O ATOM 632 CB PHE A 44 -16.818 -13.471 6.053 1.00 0.00 C ATOM 633 CG PHE A 44 -17.764 -13.070 7.161 1.00 0.00 C ATOM 634 CD1 PHE A 44 -17.284 -12.480 8.323 1.00 0.00 C ATOM 635 CD2 PHE A 44 -19.130 -13.298 7.048 1.00 0.00 C ATOM 636 CE1 PHE A 44 -18.145 -12.121 9.343 1.00 0.00 C ATOM 637 CE2 PHE A 44 -19.993 -12.942 8.067 1.00 0.00 C ATOM 638 CZ PHE A 44 -19.500 -12.354 9.215 1.00 0.00 C ATOM 0 H PHE A 44 -16.175 -11.117 6.628 1.00 0.00 H new ATOM 0 HA PHE A 44 -15.800 -12.760 4.313 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -17.219 -14.353 5.554 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -15.865 -13.760 6.496 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -16.225 -12.299 8.431 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -19.522 -13.759 6.153 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -17.758 -11.659 10.239 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -21.053 -13.124 7.965 1.00 0.00 H new ATOM 0 HZ PHE A 44 -20.174 -12.077 10.012 1.00 0.00 H new ATOM 648 N ASP A 45 -18.348 -10.880 4.364 1.00 0.00 N ATOM 649 CA ASP A 45 -19.502 -10.398 3.608 1.00 0.00 C ATOM 650 C ASP A 45 -19.273 -10.552 2.103 1.00 0.00 C ATOM 651 O ASP A 45 -20.059 -11.201 1.408 1.00 0.00 O ATOM 652 CB ASP A 45 -19.767 -8.927 3.953 1.00 0.00 C ATOM 653 CG ASP A 45 -20.893 -8.312 3.135 1.00 0.00 C ATOM 654 OD1 ASP A 45 -22.074 -8.584 3.440 1.00 0.00 O ATOM 655 OD2 ASP A 45 -20.600 -7.532 2.202 1.00 0.00 O ATOM 0 H ASP A 45 -17.987 -10.206 5.039 1.00 0.00 H new ATOM 0 HA ASP A 45 -20.371 -10.997 3.882 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -20.011 -8.847 5.012 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -18.855 -8.353 3.792 1.00 0.00 H new ATOM 660 N TYR A 46 -18.175 -9.974 1.612 1.00 0.00 N ATOM 661 CA TYR A 46 -17.846 -10.034 0.188 1.00 0.00 C ATOM 662 C TYR A 46 -17.674 -11.482 -0.273 1.00 0.00 C ATOM 663 O TYR A 46 -17.981 -11.818 -1.416 1.00 0.00 O ATOM 664 CB TYR A 46 -16.579 -9.219 -0.117 1.00 0.00 C ATOM 665 CG TYR A 46 -16.172 -9.235 -1.581 1.00 0.00 C ATOM 666 CD1 TYR A 46 -16.960 -8.623 -2.550 1.00 0.00 C ATOM 667 CD2 TYR A 46 -14.994 -9.854 -1.990 1.00 0.00 C ATOM 668 CE1 TYR A 46 -16.588 -8.629 -3.881 1.00 0.00 C ATOM 669 CE2 TYR A 46 -14.617 -9.862 -3.319 1.00 0.00 C ATOM 670 CZ TYR A 46 -15.417 -9.249 -4.260 1.00 0.00 C ATOM 671 OH TYR A 46 -15.045 -9.261 -5.586 1.00 0.00 O ATOM 0 H TYR A 46 -17.500 -9.460 2.179 1.00 0.00 H new ATOM 0 HA TYR A 46 -18.677 -9.596 -0.365 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -16.740 -8.187 0.194 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -15.756 -9.608 0.483 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -17.878 -8.135 -2.257 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -14.365 -10.336 -1.256 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -17.212 -8.150 -4.621 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -13.700 -10.346 -3.620 1.00 0.00 H new ATOM 0 HH TYR A 46 -14.194 -9.738 -5.683 1.00 0.00 H new ATOM 681 N ILE A 47 -17.187 -12.335 0.625 1.00 0.00 N ATOM 682 CA ILE A 47 -16.999 -13.750 0.316 1.00 0.00 C ATOM 683 C ILE A 47 -18.334 -14.402 -0.018 1.00 0.00 C ATOM 684 O ILE A 47 -18.461 -15.107 -1.021 1.00 0.00 O ATOM 685 CB ILE A 47 -16.348 -14.512 1.492 1.00 0.00 C ATOM 686 CG1 ILE A 47 -15.007 -13.864 1.865 1.00 0.00 C ATOM 687 CG2 ILE A 47 -16.162 -15.991 1.138 1.00 0.00 C ATOM 688 CD1 ILE A 47 -13.966 -13.929 0.768 1.00 0.00 C ATOM 0 H ILE A 47 -16.916 -12.071 1.572 1.00 0.00 H new ATOM 0 HA ILE A 47 -16.332 -13.804 -0.544 1.00 0.00 H new ATOM 0 HB ILE A 47 -17.010 -14.454 2.356 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -15.180 -12.820 2.126 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.613 -14.355 2.755 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.702 -16.511 1.978 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -17.132 -16.438 0.921 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.519 -16.077 0.262 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.048 -13.450 1.109 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -13.762 -14.971 0.521 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.337 -13.413 -0.117 1.00 0.00 H new ATOM 700 N VAL A 48 -19.329 -14.146 0.820 1.00 0.00 N ATOM 701 CA VAL A 48 -20.665 -14.689 0.612 1.00 0.00 C ATOM 702 C VAL A 48 -21.255 -14.130 -0.686 1.00 0.00 C ATOM 703 O VAL A 48 -21.958 -14.828 -1.418 1.00 0.00 O ATOM 704 CB VAL A 48 -21.603 -14.363 1.805 1.00 0.00 C ATOM 705 CG1 VAL A 48 -22.937 -15.090 1.667 1.00 0.00 C ATOM 706 CG2 VAL A 48 -20.935 -14.715 3.134 1.00 0.00 C ATOM 0 H VAL A 48 -19.236 -13.564 1.653 1.00 0.00 H new ATOM 0 HA VAL A 48 -20.582 -15.773 0.539 1.00 0.00 H new ATOM 0 HB VAL A 48 -21.798 -13.291 1.793 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -23.575 -14.844 2.516 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -23.426 -14.780 0.744 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -22.764 -16.166 1.643 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -21.611 -14.478 3.955 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -20.701 -15.779 3.153 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -20.016 -14.139 3.243 1.00 0.00 H new ATOM 716 N GLU A 49 -20.926 -12.870 -0.974 1.00 0.00 N ATOM 717 CA GLU A 49 -21.382 -12.198 -2.193 1.00 0.00 C ATOM 718 C GLU A 49 -20.583 -12.646 -3.422 1.00 0.00 C ATOM 719 O GLU A 49 -20.892 -12.246 -4.543 1.00 0.00 O ATOM 720 CB GLU A 49 -21.285 -10.674 -2.029 1.00 0.00 C ATOM 721 CG GLU A 49 -22.304 -10.095 -1.053 1.00 0.00 C ATOM 722 CD GLU A 49 -23.738 -10.286 -1.526 1.00 0.00 C ATOM 723 OE1 GLU A 49 -24.151 -9.586 -2.478 1.00 0.00 O ATOM 724 OE2 GLU A 49 -24.457 -11.137 -0.954 1.00 0.00 O ATOM 0 H GLU A 49 -20.340 -12.289 -0.374 1.00 0.00 H new ATOM 0 HA GLU A 49 -22.423 -12.478 -2.352 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.282 -10.418 -1.688 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -21.420 -10.204 -3.003 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -22.180 -10.569 -0.079 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -22.108 -9.031 -0.917 1.00 0.00 H new ATOM 731 N THR A 50 -19.550 -13.460 -3.212 1.00 0.00 N ATOM 732 CA THR A 50 -18.780 -14.027 -4.321 1.00 0.00 C ATOM 733 C THR A 50 -18.924 -15.545 -4.355 1.00 0.00 C ATOM 734 O THR A 50 -18.135 -16.246 -4.992 1.00 0.00 O ATOM 735 CB THR A 50 -17.282 -13.638 -4.251 1.00 0.00 C ATOM 736 OG1 THR A 50 -16.766 -13.857 -2.932 1.00 0.00 O ATOM 737 CG2 THR A 50 -17.080 -12.180 -4.644 1.00 0.00 C ATOM 0 H THR A 50 -19.226 -13.742 -2.287 1.00 0.00 H new ATOM 0 HA THR A 50 -19.188 -13.607 -5.240 1.00 0.00 H new ATOM 0 HB THR A 50 -16.741 -14.269 -4.956 1.00 0.00 H new ATOM 0 HG1 THR A 50 -17.123 -13.176 -2.324 1.00 0.00 H new ATOM 0 HG21 THR A 50 -16.020 -11.931 -4.587 1.00 0.00 H new ATOM 0 HG22 THR A 50 -17.435 -12.025 -5.663 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.640 -11.539 -3.964 1.00 0.00 H new ATOM 745 N THR A 51 -19.950 -16.047 -3.675 1.00 0.00 N ATOM 746 CA THR A 51 -20.270 -17.464 -3.714 1.00 0.00 C ATOM 747 C THR A 51 -21.407 -17.710 -4.706 1.00 0.00 C ATOM 748 O THR A 51 -22.217 -16.817 -4.962 1.00 0.00 O ATOM 749 CB THR A 51 -20.684 -17.994 -2.324 1.00 0.00 C ATOM 750 OG1 THR A 51 -19.676 -17.660 -1.360 1.00 0.00 O ATOM 751 CG2 THR A 51 -20.878 -19.510 -2.357 1.00 0.00 C ATOM 0 H THR A 51 -20.573 -15.490 -3.090 1.00 0.00 H new ATOM 0 HA THR A 51 -19.373 -17.998 -4.029 1.00 0.00 H new ATOM 0 HB THR A 51 -21.629 -17.529 -2.044 1.00 0.00 H new ATOM 0 HG1 THR A 51 -19.540 -18.418 -0.754 1.00 0.00 H new ATOM 0 HG21 THR A 51 -21.169 -19.861 -1.367 1.00 0.00 H new ATOM 0 HG22 THR A 51 -21.658 -19.761 -3.075 1.00 0.00 H new ATOM 0 HG23 THR A 51 -19.945 -19.990 -2.652 1.00 0.00 H new ATOM 759 N ASP A 52 -21.446 -18.913 -5.269 1.00 0.00 N ATOM 760 CA ASP A 52 -22.497 -19.312 -6.203 1.00 0.00 C ATOM 761 C ASP A 52 -23.880 -19.074 -5.595 1.00 0.00 C ATOM 762 O ASP A 52 -24.091 -19.363 -4.417 1.00 0.00 O ATOM 763 CB ASP A 52 -22.334 -20.794 -6.540 1.00 0.00 C ATOM 764 CG ASP A 52 -23.240 -21.255 -7.668 1.00 0.00 C ATOM 765 OD1 ASP A 52 -22.827 -21.172 -8.841 1.00 0.00 O ATOM 766 OD2 ASP A 52 -24.366 -21.708 -7.381 1.00 0.00 O ATOM 0 H ASP A 52 -20.752 -19.639 -5.092 1.00 0.00 H new ATOM 0 HA ASP A 52 -22.410 -18.712 -7.109 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -21.297 -20.985 -6.815 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -22.543 -21.387 -5.650 1.00 0.00 H new ATOM 771 N PRO A 53 -24.843 -18.558 -6.386 1.00 0.00 N ATOM 772 CA PRO A 53 -26.203 -18.269 -5.904 1.00 0.00 C ATOM 773 C PRO A 53 -26.858 -19.483 -5.239 1.00 0.00 C ATOM 774 O PRO A 53 -27.711 -19.337 -4.360 1.00 0.00 O ATOM 775 CB PRO A 53 -26.970 -17.859 -7.179 1.00 0.00 C ATOM 776 CG PRO A 53 -26.099 -18.281 -8.319 1.00 0.00 C ATOM 777 CD PRO A 53 -24.688 -18.210 -7.808 1.00 0.00 C ATOM 0 HA PRO A 53 -26.202 -17.496 -5.135 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -27.943 -18.348 -7.226 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -27.151 -16.784 -7.200 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -26.346 -19.291 -8.646 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -26.236 -17.625 -9.179 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -24.033 -18.910 -8.327 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -24.260 -17.216 -7.938 1.00 0.00 H new ATOM 785 N GLU A 54 -26.453 -20.676 -5.663 1.00 0.00 N ATOM 786 CA GLU A 54 -26.965 -21.916 -5.089 1.00 0.00 C ATOM 787 C GLU A 54 -26.114 -22.332 -3.891 1.00 0.00 C ATOM 788 O GLU A 54 -26.628 -22.556 -2.793 1.00 0.00 O ATOM 789 CB GLU A 54 -26.963 -23.027 -6.148 1.00 0.00 C ATOM 790 CG GLU A 54 -27.777 -22.694 -7.395 1.00 0.00 C ATOM 791 CD GLU A 54 -29.263 -22.554 -7.107 1.00 0.00 C ATOM 792 OE1 GLU A 54 -29.964 -23.589 -7.053 1.00 0.00 O ATOM 793 OE2 GLU A 54 -29.745 -21.415 -6.933 1.00 0.00 O ATOM 0 H GLU A 54 -25.768 -20.811 -6.406 1.00 0.00 H new ATOM 0 HA GLU A 54 -27.989 -21.751 -4.753 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -25.934 -23.233 -6.442 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -27.356 -23.941 -5.703 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -27.406 -21.765 -7.828 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -27.628 -23.475 -8.140 1.00 0.00 H new ATOM 800 N ARG A 55 -24.800 -22.399 -4.104 1.00 0.00 N ATOM 801 CA ARG A 55 -23.866 -22.859 -3.072 1.00 0.00 C ATOM 802 C ARG A 55 -23.844 -21.902 -1.882 1.00 0.00 C ATOM 803 O ARG A 55 -23.392 -22.262 -0.795 1.00 0.00 O ATOM 804 CB ARG A 55 -22.448 -23.004 -3.647 1.00 0.00 C ATOM 805 CG ARG A 55 -22.377 -23.876 -4.895 1.00 0.00 C ATOM 806 CD ARG A 55 -22.851 -25.300 -4.633 1.00 0.00 C ATOM 807 NE ARG A 55 -23.050 -26.042 -5.879 1.00 0.00 N ATOM 808 CZ ARG A 55 -22.071 -26.618 -6.583 1.00 0.00 C ATOM 809 NH1 ARG A 55 -20.817 -26.583 -6.151 1.00 0.00 N ATOM 810 NH2 ARG A 55 -22.355 -27.244 -7.718 1.00 0.00 N ATOM 0 H ARG A 55 -24.355 -22.140 -4.985 1.00 0.00 H new ATOM 0 HA ARG A 55 -24.211 -23.834 -2.728 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -22.059 -22.014 -3.884 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -21.797 -23.427 -2.882 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -22.987 -23.431 -5.681 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -21.351 -23.899 -5.262 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -22.120 -25.819 -4.013 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -23.785 -25.275 -4.071 1.00 0.00 H new ATOM 0 HE ARG A 55 -24.002 -26.125 -6.235 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -20.593 -26.113 -5.274 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -20.077 -27.026 -6.696 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -23.318 -27.285 -8.051 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -21.610 -27.685 -8.258 1.00 0.00 H new ATOM 824 N ARG A 56 -24.341 -20.684 -2.091 1.00 0.00 N ATOM 825 CA ARG A 56 -24.379 -19.676 -1.035 1.00 0.00 C ATOM 826 C ARG A 56 -25.269 -20.148 0.114 1.00 0.00 C ATOM 827 O ARG A 56 -25.096 -19.732 1.261 1.00 0.00 O ATOM 828 CB ARG A 56 -24.882 -18.330 -1.584 1.00 0.00 C ATOM 829 CG ARG A 56 -24.510 -17.138 -0.706 1.00 0.00 C ATOM 830 CD ARG A 56 -25.096 -15.827 -1.222 1.00 0.00 C ATOM 831 NE ARG A 56 -26.539 -15.743 -0.989 1.00 0.00 N ATOM 832 CZ ARG A 56 -27.216 -14.599 -0.864 1.00 0.00 C ATOM 833 NH1 ARG A 56 -26.592 -13.429 -0.970 1.00 0.00 N ATOM 834 NH2 ARG A 56 -28.517 -14.631 -0.618 1.00 0.00 N ATOM 0 H ARG A 56 -24.723 -20.372 -2.984 1.00 0.00 H new ATOM 0 HA ARG A 56 -23.366 -19.534 -0.659 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -24.472 -18.178 -2.583 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -25.966 -18.371 -1.687 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -24.863 -17.315 0.310 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -23.425 -17.052 -0.656 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -24.600 -14.990 -0.731 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -24.895 -15.735 -2.289 1.00 0.00 H new ATOM 0 HE ARG A 56 -27.062 -16.616 -0.917 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -25.588 -13.401 -1.148 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -27.117 -12.560 -0.873 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -28.997 -15.526 -0.525 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -29.039 -13.760 -0.521 1.00 0.00 H new ATOM 848 N ASP A 57 -26.215 -21.031 -0.204 1.00 0.00 N ATOM 849 CA ASP A 57 -27.097 -21.622 0.804 1.00 0.00 C ATOM 850 C ASP A 57 -26.294 -22.503 1.759 1.00 0.00 C ATOM 851 O ASP A 57 -26.632 -22.639 2.939 1.00 0.00 O ATOM 852 CB ASP A 57 -28.205 -22.447 0.132 1.00 0.00 C ATOM 853 CG ASP A 57 -29.143 -23.101 1.139 1.00 0.00 C ATOM 854 OD1 ASP A 57 -29.958 -22.377 1.752 1.00 0.00 O ATOM 855 OD2 ASP A 57 -29.063 -24.336 1.330 1.00 0.00 O ATOM 0 H ASP A 57 -26.391 -21.354 -1.155 1.00 0.00 H new ATOM 0 HA ASP A 57 -27.559 -20.815 1.373 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -28.782 -21.802 -0.530 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -27.751 -23.218 -0.490 1.00 0.00 H new ATOM 860 N LEU A 58 -25.215 -23.080 1.238 1.00 0.00 N ATOM 861 CA LEU A 58 -24.338 -23.952 2.015 1.00 0.00 C ATOM 862 C LEU A 58 -23.387 -23.127 2.886 1.00 0.00 C ATOM 863 O LEU A 58 -22.662 -23.671 3.721 1.00 0.00 O ATOM 864 CB LEU A 58 -23.533 -24.864 1.075 1.00 0.00 C ATOM 865 CG LEU A 58 -24.370 -25.724 0.111 1.00 0.00 C ATOM 866 CD1 LEU A 58 -23.466 -26.556 -0.796 1.00 0.00 C ATOM 867 CD2 LEU A 58 -25.335 -26.622 0.885 1.00 0.00 C ATOM 0 H LEU A 58 -24.924 -22.957 0.268 1.00 0.00 H new ATOM 0 HA LEU A 58 -24.956 -24.568 2.668 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.856 -24.244 0.487 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -22.914 -25.526 1.681 1.00 0.00 H new ATOM 0 HG LEU A 58 -24.958 -25.055 -0.517 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -24.079 -27.156 -1.469 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -22.828 -25.893 -1.380 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.846 -27.213 -0.187 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -25.916 -27.221 0.184 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -24.770 -27.281 1.544 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -26.008 -26.005 1.480 1.00 0.00 H new ATOM 879 N PHE A 59 -23.388 -21.813 2.675 1.00 0.00 N ATOM 880 CA PHE A 59 -22.539 -20.902 3.439 1.00 0.00 C ATOM 881 C PHE A 59 -23.250 -20.410 4.698 1.00 0.00 C ATOM 882 O PHE A 59 -24.353 -19.863 4.631 1.00 0.00 O ATOM 883 CB PHE A 59 -22.115 -19.702 2.573 1.00 0.00 C ATOM 884 CG PHE A 59 -20.826 -19.916 1.818 1.00 0.00 C ATOM 885 CD1 PHE A 59 -20.623 -21.061 1.060 1.00 0.00 C ATOM 886 CD2 PHE A 59 -19.814 -18.966 1.873 1.00 0.00 C ATOM 887 CE1 PHE A 59 -19.438 -21.253 0.374 1.00 0.00 C ATOM 888 CE2 PHE A 59 -18.630 -19.152 1.189 1.00 0.00 C ATOM 889 CZ PHE A 59 -18.440 -20.297 0.438 1.00 0.00 C ATOM 0 H PHE A 59 -23.972 -21.353 1.976 1.00 0.00 H new ATOM 0 HA PHE A 59 -21.649 -21.454 3.740 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -22.910 -19.483 1.860 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -22.009 -18.825 3.212 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -21.399 -21.810 1.005 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -19.956 -18.070 2.459 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -19.292 -22.149 -0.211 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -17.853 -18.404 1.240 1.00 0.00 H new ATOM 0 HZ PHE A 59 -17.514 -20.445 -0.098 1.00 0.00 H new ATOM 899 N ASP A 60 -22.609 -20.619 5.841 1.00 0.00 N ATOM 900 CA ASP A 60 -23.090 -20.096 7.116 1.00 0.00 C ATOM 901 C ASP A 60 -22.189 -18.950 7.552 1.00 0.00 C ATOM 902 O ASP A 60 -20.991 -18.960 7.272 1.00 0.00 O ATOM 903 CB ASP A 60 -23.106 -21.189 8.195 1.00 0.00 C ATOM 904 CG ASP A 60 -24.156 -22.259 7.942 1.00 0.00 C ATOM 905 OD1 ASP A 60 -25.320 -22.063 8.346 1.00 0.00 O ATOM 906 OD2 ASP A 60 -23.822 -23.307 7.350 1.00 0.00 O ATOM 0 H ASP A 60 -21.743 -21.154 5.912 1.00 0.00 H new ATOM 0 HA ASP A 60 -24.112 -19.741 6.986 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -22.123 -21.657 8.245 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -23.290 -20.730 9.166 1.00 0.00 H new ATOM 911 N HIS A 61 -22.759 -17.974 8.244 1.00 0.00 N ATOM 912 CA HIS A 61 -22.014 -16.782 8.646 1.00 0.00 C ATOM 913 C HIS A 61 -20.953 -17.147 9.682 1.00 0.00 C ATOM 914 O HIS A 61 -19.811 -16.688 9.606 1.00 0.00 O ATOM 915 CB HIS A 61 -22.965 -15.713 9.205 1.00 0.00 C ATOM 916 CG HIS A 61 -24.052 -15.322 8.249 1.00 0.00 C ATOM 917 ND1 HIS A 61 -23.925 -14.295 7.339 1.00 0.00 N ATOM 918 CD2 HIS A 61 -25.289 -15.840 8.056 1.00 0.00 C ATOM 919 CE1 HIS A 61 -25.033 -14.201 6.629 1.00 0.00 C ATOM 920 NE2 HIS A 61 -25.878 -15.126 7.043 1.00 0.00 N ATOM 0 H HIS A 61 -23.735 -17.981 8.540 1.00 0.00 H new ATOM 0 HA HIS A 61 -21.517 -16.371 7.767 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -23.417 -16.085 10.125 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -22.388 -14.827 9.469 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -25.730 -16.663 8.599 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -25.218 -13.486 5.841 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -26.815 -15.284 6.671 1.00 0.00 H new ATOM 929 N ASP A 62 -21.340 -17.992 10.635 1.00 0.00 N ATOM 930 CA ASP A 62 -20.428 -18.459 11.678 1.00 0.00 C ATOM 931 C ASP A 62 -19.294 -19.277 11.067 1.00 0.00 C ATOM 932 O ASP A 62 -18.119 -18.965 11.255 1.00 0.00 O ATOM 933 CB ASP A 62 -21.178 -19.311 12.714 1.00 0.00 C ATOM 934 CG ASP A 62 -22.226 -18.522 13.483 1.00 0.00 C ATOM 935 OD1 ASP A 62 -23.376 -18.420 13.003 1.00 0.00 O ATOM 936 OD2 ASP A 62 -21.908 -17.998 14.572 1.00 0.00 O ATOM 0 H ASP A 62 -22.285 -18.370 10.707 1.00 0.00 H new ATOM 0 HA ASP A 62 -20.010 -17.585 12.177 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -21.660 -20.148 12.208 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -20.460 -19.734 13.417 1.00 0.00 H new ATOM 941 N VAL A 63 -19.664 -20.310 10.312 1.00 0.00 N ATOM 942 CA VAL A 63 -18.690 -21.216 9.699 1.00 0.00 C ATOM 943 C VAL A 63 -17.743 -20.455 8.769 1.00 0.00 C ATOM 944 O VAL A 63 -16.553 -20.765 8.689 1.00 0.00 O ATOM 945 CB VAL A 63 -19.393 -22.353 8.913 1.00 0.00 C ATOM 946 CG1 VAL A 63 -18.372 -23.320 8.310 1.00 0.00 C ATOM 947 CG2 VAL A 63 -20.382 -23.098 9.810 1.00 0.00 C ATOM 0 H VAL A 63 -20.636 -20.542 10.108 1.00 0.00 H new ATOM 0 HA VAL A 63 -18.110 -21.661 10.508 1.00 0.00 H new ATOM 0 HB VAL A 63 -19.949 -21.900 8.092 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -18.894 -24.107 7.765 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -17.717 -22.779 7.627 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -17.777 -23.765 9.108 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -20.864 -23.892 9.239 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -19.850 -23.532 10.657 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -21.138 -22.402 10.175 1.00 0.00 H new ATOM 957 N ASN A 64 -18.277 -19.451 8.078 1.00 0.00 N ATOM 958 CA ASN A 64 -17.472 -18.613 7.190 1.00 0.00 C ATOM 959 C ASN A 64 -16.405 -17.875 7.998 1.00 0.00 C ATOM 960 O ASN A 64 -15.227 -17.857 7.633 1.00 0.00 O ATOM 961 CB ASN A 64 -18.368 -17.612 6.440 1.00 0.00 C ATOM 962 CG ASN A 64 -17.649 -16.870 5.319 1.00 0.00 C ATOM 963 OD1 ASN A 64 -16.443 -16.642 5.367 1.00 0.00 O ATOM 964 ND2 ASN A 64 -18.397 -16.480 4.297 1.00 0.00 N ATOM 0 H ASN A 64 -19.264 -19.197 8.115 1.00 0.00 H new ATOM 0 HA ASN A 64 -16.979 -19.249 6.455 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -19.223 -18.144 6.022 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -18.761 -16.886 7.151 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -17.974 -15.974 3.519 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -19.396 -16.686 4.288 1.00 0.00 H new ATOM 971 N ARG A 65 -16.824 -17.290 9.119 1.00 0.00 N ATOM 972 CA ARG A 65 -15.909 -16.557 9.987 1.00 0.00 C ATOM 973 C ARG A 65 -14.912 -17.518 10.633 1.00 0.00 C ATOM 974 O ARG A 65 -13.754 -17.172 10.857 1.00 0.00 O ATOM 975 CB ARG A 65 -16.686 -15.799 11.076 1.00 0.00 C ATOM 976 CG ARG A 65 -15.873 -14.700 11.759 1.00 0.00 C ATOM 977 CD ARG A 65 -16.594 -14.112 12.970 1.00 0.00 C ATOM 978 NE ARG A 65 -16.454 -14.957 14.161 1.00 0.00 N ATOM 979 CZ ARG A 65 -17.437 -15.669 14.710 1.00 0.00 C ATOM 980 NH1 ARG A 65 -18.649 -15.677 14.169 1.00 0.00 N ATOM 981 NH2 ARG A 65 -17.206 -16.377 15.806 1.00 0.00 N ATOM 0 H ARG A 65 -17.790 -17.310 9.446 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.365 -15.834 9.380 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.578 -15.356 10.632 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -17.025 -16.510 11.830 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -14.911 -15.105 12.073 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -15.666 -13.906 11.042 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -16.196 -13.120 13.182 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.651 -13.988 12.737 1.00 0.00 H new ATOM 0 HE ARG A 65 -15.535 -15.003 14.602 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -18.834 -15.135 13.325 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -19.395 -16.225 14.597 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -16.277 -16.376 16.227 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -17.957 -16.923 16.228 1.00 0.00 H new ATOM 995 N ALA A 66 -15.371 -18.738 10.899 1.00 0.00 N ATOM 996 CA ALA A 66 -14.571 -19.747 11.593 1.00 0.00 C ATOM 997 C ALA A 66 -13.184 -19.915 10.968 1.00 0.00 C ATOM 998 O ALA A 66 -12.212 -20.185 11.675 1.00 0.00 O ATOM 999 CB ALA A 66 -15.312 -21.078 11.613 1.00 0.00 C ATOM 0 H ALA A 66 -16.305 -19.056 10.641 1.00 0.00 H new ATOM 0 HA ALA A 66 -14.422 -19.402 12.616 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -14.708 -21.823 12.132 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -16.263 -20.957 12.131 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -15.495 -21.408 10.590 1.00 0.00 H new ATOM 1005 N TRP A 67 -13.093 -19.741 9.651 1.00 0.00 N ATOM 1006 CA TRP A 67 -11.815 -19.873 8.949 1.00 0.00 C ATOM 1007 C TRP A 67 -10.831 -18.779 9.367 1.00 0.00 C ATOM 1008 O TRP A 67 -9.670 -19.065 9.667 1.00 0.00 O ATOM 1009 CB TRP A 67 -12.021 -19.869 7.427 1.00 0.00 C ATOM 1010 CG TRP A 67 -12.560 -21.172 6.909 1.00 0.00 C ATOM 1011 CD1 TRP A 67 -11.968 -22.395 7.025 1.00 0.00 C ATOM 1012 CD2 TRP A 67 -13.783 -21.386 6.193 1.00 0.00 C ATOM 1013 NE1 TRP A 67 -12.748 -23.357 6.438 1.00 0.00 N ATOM 1014 CE2 TRP A 67 -13.869 -22.765 5.919 1.00 0.00 C ATOM 1015 CE3 TRP A 67 -14.816 -20.550 5.763 1.00 0.00 C ATOM 1016 CZ2 TRP A 67 -14.944 -23.323 5.232 1.00 0.00 C ATOM 1017 CZ3 TRP A 67 -15.883 -21.105 5.081 1.00 0.00 C ATOM 1018 CH2 TRP A 67 -15.941 -22.480 4.823 1.00 0.00 C ATOM 0 H TRP A 67 -13.884 -19.509 9.050 1.00 0.00 H new ATOM 0 HA TRP A 67 -11.383 -20.833 9.232 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -12.707 -19.065 7.160 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -11.072 -19.653 6.937 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -11.021 -22.579 7.510 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -12.529 -24.352 6.395 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -14.782 -19.489 5.960 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -14.989 -24.383 5.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -16.686 -20.467 4.741 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -16.790 -22.883 4.291 1.00 0.00 H new ATOM 1029 N MET A 68 -11.291 -17.529 9.400 1.00 0.00 N ATOM 1030 CA MET A 68 -10.432 -16.421 9.829 1.00 0.00 C ATOM 1031 C MET A 68 -10.145 -16.522 11.326 1.00 0.00 C ATOM 1032 O MET A 68 -9.140 -16.002 11.816 1.00 0.00 O ATOM 1033 CB MET A 68 -11.058 -15.049 9.518 1.00 0.00 C ATOM 1034 CG MET A 68 -12.341 -14.755 10.290 1.00 0.00 C ATOM 1035 SD MET A 68 -12.619 -12.992 10.547 1.00 0.00 S ATOM 1036 CE MET A 68 -11.261 -12.607 11.654 1.00 0.00 C ATOM 0 H MET A 68 -12.239 -17.258 9.139 1.00 0.00 H new ATOM 0 HA MET A 68 -9.501 -16.501 9.267 1.00 0.00 H new ATOM 0 HB2 MET A 68 -10.328 -14.271 9.740 1.00 0.00 H new ATOM 0 HB3 MET A 68 -11.269 -14.993 8.450 1.00 0.00 H new ATOM 0 HG2 MET A 68 -13.189 -15.176 9.749 1.00 0.00 H new ATOM 0 HG3 MET A 68 -12.299 -15.256 11.257 1.00 0.00 H new ATOM 0 HE1 MET A 68 -11.521 -11.740 12.262 1.00 0.00 H new ATOM 0 HE2 MET A 68 -11.068 -13.461 12.304 1.00 0.00 H new ATOM 0 HE3 MET A 68 -10.367 -12.386 11.070 1.00 0.00 H new ATOM 1046 N GLU A 69 -11.039 -17.194 12.042 1.00 0.00 N ATOM 1047 CA GLU A 69 -10.909 -17.365 13.483 1.00 0.00 C ATOM 1048 C GLU A 69 -9.870 -18.435 13.807 1.00 0.00 C ATOM 1049 O GLU A 69 -9.108 -18.301 14.764 1.00 0.00 O ATOM 1050 CB GLU A 69 -12.267 -17.741 14.094 1.00 0.00 C ATOM 1051 CG GLU A 69 -13.362 -16.704 13.851 1.00 0.00 C ATOM 1052 CD GLU A 69 -13.161 -15.421 14.642 1.00 0.00 C ATOM 1053 OE1 GLU A 69 -12.299 -14.600 14.260 1.00 0.00 O ATOM 1054 OE2 GLU A 69 -13.876 -15.224 15.646 1.00 0.00 O ATOM 0 H GLU A 69 -11.869 -17.633 11.643 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.576 -16.421 13.915 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -12.588 -18.698 13.682 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -12.145 -17.882 15.168 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.398 -16.466 12.788 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -14.327 -17.137 14.113 1.00 0.00 H new ATOM 1061 N GLU A 70 -9.837 -19.495 13.000 1.00 0.00 N ATOM 1062 CA GLU A 70 -8.925 -20.610 13.241 1.00 0.00 C ATOM 1063 C GLU A 70 -7.531 -20.311 12.688 1.00 0.00 C ATOM 1064 O GLU A 70 -6.536 -20.871 13.156 1.00 0.00 O ATOM 1065 CB GLU A 70 -9.469 -21.912 12.624 1.00 0.00 C ATOM 1066 CG GLU A 70 -9.502 -21.920 11.097 1.00 0.00 C ATOM 1067 CD GLU A 70 -9.956 -23.256 10.522 1.00 0.00 C ATOM 1068 OE1 GLU A 70 -9.131 -24.194 10.460 1.00 0.00 O ATOM 1069 OE2 GLU A 70 -11.134 -23.378 10.131 1.00 0.00 O ATOM 0 H GLU A 70 -10.429 -19.604 12.177 1.00 0.00 H new ATOM 0 HA GLU A 70 -8.848 -20.742 14.320 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -8.856 -22.746 12.967 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -10.478 -22.083 12.998 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.172 -21.134 10.749 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.508 -21.685 10.716 1.00 0.00 H new ATOM 1076 N SER A 71 -7.454 -19.439 11.685 1.00 0.00 N ATOM 1077 CA SER A 71 -6.178 -19.107 11.057 1.00 0.00 C ATOM 1078 C SER A 71 -6.155 -17.655 10.574 1.00 0.00 C ATOM 1079 O SER A 71 -7.137 -17.152 10.019 1.00 0.00 O ATOM 1080 CB SER A 71 -5.904 -20.063 9.887 1.00 0.00 C ATOM 1081 OG SER A 71 -5.844 -21.411 10.333 1.00 0.00 O ATOM 0 H SER A 71 -8.258 -18.951 11.291 1.00 0.00 H new ATOM 0 HA SER A 71 -5.393 -19.221 11.804 1.00 0.00 H new ATOM 0 HB2 SER A 71 -6.688 -19.959 9.137 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.964 -19.794 9.405 1.00 0.00 H new ATOM 0 HG SER A 71 -5.638 -21.430 11.291 1.00 0.00 H new ATOM 1087 N ASP A 72 -5.028 -16.987 10.799 1.00 0.00 N ATOM 1088 CA ASP A 72 -4.839 -15.604 10.366 1.00 0.00 C ATOM 1089 C ASP A 72 -4.241 -15.569 8.964 1.00 0.00 C ATOM 1090 O ASP A 72 -3.051 -15.817 8.789 1.00 0.00 O ATOM 1091 CB ASP A 72 -3.930 -14.856 11.349 1.00 0.00 C ATOM 1092 CG ASP A 72 -4.576 -14.672 12.712 1.00 0.00 C ATOM 1093 OD1 ASP A 72 -4.497 -15.595 13.549 1.00 0.00 O ATOM 1094 OD2 ASP A 72 -5.177 -13.603 12.949 1.00 0.00 O ATOM 0 H ASP A 72 -4.223 -17.385 11.284 1.00 0.00 H new ATOM 0 HA ASP A 72 -5.810 -15.110 10.346 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -2.995 -15.405 11.464 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -3.678 -13.880 10.935 1.00 0.00 H new ATOM 1099 N PHE A 73 -5.073 -15.279 7.969 1.00 0.00 N ATOM 1100 CA PHE A 73 -4.636 -15.268 6.572 1.00 0.00 C ATOM 1101 C PHE A 73 -3.581 -14.187 6.339 1.00 0.00 C ATOM 1102 O PHE A 73 -3.782 -13.021 6.684 1.00 0.00 O ATOM 1103 CB PHE A 73 -5.839 -15.078 5.642 1.00 0.00 C ATOM 1104 CG PHE A 73 -6.823 -16.220 5.726 1.00 0.00 C ATOM 1105 CD1 PHE A 73 -6.644 -17.365 4.960 1.00 0.00 C ATOM 1106 CD2 PHE A 73 -7.912 -16.159 6.585 1.00 0.00 C ATOM 1107 CE1 PHE A 73 -7.531 -18.420 5.047 1.00 0.00 C ATOM 1108 CE2 PHE A 73 -8.800 -17.215 6.676 1.00 0.00 C ATOM 1109 CZ PHE A 73 -8.610 -18.346 5.906 1.00 0.00 C ATOM 0 H PHE A 73 -6.057 -15.047 8.102 1.00 0.00 H new ATOM 0 HA PHE A 73 -4.177 -16.230 6.344 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -6.346 -14.147 5.895 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.488 -14.981 4.615 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.801 -17.431 4.288 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -8.067 -15.277 7.189 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.381 -19.303 4.443 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -9.642 -17.156 7.349 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.304 -19.171 5.976 1.00 0.00 H new ATOM 1119 N LEU A 74 -2.456 -14.591 5.751 1.00 0.00 N ATOM 1120 CA LEU A 74 -1.285 -13.723 5.622 1.00 0.00 C ATOM 1121 C LEU A 74 -0.986 -13.393 4.157 1.00 0.00 C ATOM 1122 O LEU A 74 -0.892 -12.223 3.779 1.00 0.00 O ATOM 1123 CB LEU A 74 -0.057 -14.409 6.246 1.00 0.00 C ATOM 1124 CG LEU A 74 -0.191 -14.807 7.728 1.00 0.00 C ATOM 1125 CD1 LEU A 74 1.073 -15.515 8.217 1.00 0.00 C ATOM 1126 CD2 LEU A 74 -0.498 -13.587 8.595 1.00 0.00 C ATOM 0 H LEU A 74 -2.330 -15.522 5.353 1.00 0.00 H new ATOM 0 HA LEU A 74 -1.503 -12.792 6.145 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.168 -15.305 5.668 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.799 -13.742 6.145 1.00 0.00 H new ATOM 0 HG LEU A 74 -1.026 -15.503 7.816 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.955 -15.787 9.266 1.00 0.00 H new ATOM 0 HD12 LEU A 74 1.238 -16.415 7.625 1.00 0.00 H new ATOM 0 HD13 LEU A 74 1.928 -14.848 8.109 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -0.588 -13.894 9.637 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.309 -12.860 8.499 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.434 -13.135 8.268 1.00 0.00 H new ATOM 1138 N GLU A 75 -0.858 -14.431 3.335 1.00 0.00 N ATOM 1139 CA GLU A 75 -0.358 -14.284 1.968 1.00 0.00 C ATOM 1140 C GLU A 75 -1.061 -15.254 1.019 1.00 0.00 C ATOM 1141 O GLU A 75 -1.403 -16.368 1.406 1.00 0.00 O ATOM 1142 CB GLU A 75 1.155 -14.549 1.957 1.00 0.00 C ATOM 1143 CG GLU A 75 1.793 -14.538 0.572 1.00 0.00 C ATOM 1144 CD GLU A 75 3.229 -15.032 0.596 1.00 0.00 C ATOM 1145 OE1 GLU A 75 3.435 -16.265 0.609 1.00 0.00 O ATOM 1146 OE2 GLU A 75 4.156 -14.197 0.616 1.00 0.00 O ATOM 0 H GLU A 75 -1.095 -15.389 3.592 1.00 0.00 H new ATOM 0 HA GLU A 75 -0.563 -13.270 1.626 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.646 -13.797 2.575 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.344 -15.517 2.422 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.207 -15.164 -0.101 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.766 -13.525 0.170 1.00 0.00 H new ATOM 1153 N LEU A 76 -1.265 -14.827 -0.225 1.00 0.00 N ATOM 1154 CA LEU A 76 -1.857 -15.680 -1.257 1.00 0.00 C ATOM 1155 C LEU A 76 -0.867 -15.881 -2.404 1.00 0.00 C ATOM 1156 O LEU A 76 -0.056 -14.995 -2.694 1.00 0.00 O ATOM 1157 CB LEU A 76 -3.155 -15.057 -1.796 1.00 0.00 C ATOM 1158 CG LEU A 76 -3.901 -15.898 -2.851 1.00 0.00 C ATOM 1159 CD1 LEU A 76 -4.409 -17.206 -2.246 1.00 0.00 C ATOM 1160 CD2 LEU A 76 -5.050 -15.101 -3.467 1.00 0.00 C ATOM 0 H LEU A 76 -1.028 -13.888 -0.546 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.091 -16.646 -0.810 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.828 -14.877 -0.957 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.919 -14.085 -2.230 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.197 -16.146 -3.645 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -4.932 -17.781 -3.010 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.565 -17.785 -1.870 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.093 -16.986 -1.426 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.562 -15.714 -4.208 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.754 -14.814 -2.686 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.655 -14.205 -3.947 1.00 0.00 H new ATOM 1172 N ARG A 77 -0.937 -17.043 -3.047 1.00 0.00 N ATOM 1173 CA ARG A 77 -0.097 -17.346 -4.198 1.00 0.00 C ATOM 1174 C ARG A 77 -0.890 -18.143 -5.230 1.00 0.00 C ATOM 1175 O ARG A 77 -1.222 -19.304 -5.004 1.00 0.00 O ATOM 1176 CB ARG A 77 1.155 -18.133 -3.776 1.00 0.00 C ATOM 1177 CG ARG A 77 2.000 -18.585 -4.963 1.00 0.00 C ATOM 1178 CD ARG A 77 3.264 -19.324 -4.543 1.00 0.00 C ATOM 1179 NE ARG A 77 4.051 -19.722 -5.712 1.00 0.00 N ATOM 1180 CZ ARG A 77 4.723 -20.866 -5.822 1.00 0.00 C ATOM 1181 NH1 ARG A 77 4.768 -21.725 -4.813 1.00 0.00 N ATOM 1182 NH2 ARG A 77 5.359 -21.148 -6.950 1.00 0.00 N ATOM 0 H ARG A 77 -1.574 -17.796 -2.786 1.00 0.00 H new ATOM 0 HA ARG A 77 0.225 -16.404 -4.641 1.00 0.00 H new ATOM 0 HB2 ARG A 77 1.764 -17.512 -3.119 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.852 -19.006 -3.199 1.00 0.00 H new ATOM 0 HG2 ARG A 77 1.401 -19.234 -5.603 1.00 0.00 H new ATOM 0 HG3 ARG A 77 2.275 -17.715 -5.559 1.00 0.00 H new ATOM 0 HD2 ARG A 77 3.865 -18.685 -3.896 1.00 0.00 H new ATOM 0 HD3 ARG A 77 2.998 -20.207 -3.962 1.00 0.00 H new ATOM 0 HE ARG A 77 4.087 -19.075 -6.500 1.00 0.00 H new ATOM 0 HH11 ARG A 77 4.284 -21.513 -3.940 1.00 0.00 H new ATOM 0 HH12 ARG A 77 5.286 -22.598 -4.909 1.00 0.00 H new ATOM 0 HH21 ARG A 77 5.332 -20.490 -7.729 1.00 0.00 H new ATOM 0 HH22 ARG A 77 5.875 -22.023 -7.039 1.00 0.00 H new ATOM 1196 N VAL A 78 -1.202 -17.509 -6.352 1.00 0.00 N ATOM 1197 CA VAL A 78 -1.928 -18.163 -7.436 1.00 0.00 C ATOM 1198 C VAL A 78 -0.955 -18.936 -8.326 1.00 0.00 C ATOM 1199 O VAL A 78 -0.005 -18.363 -8.862 1.00 0.00 O ATOM 1200 CB VAL A 78 -2.714 -17.132 -8.284 1.00 0.00 C ATOM 1201 CG1 VAL A 78 -3.388 -17.802 -9.484 1.00 0.00 C ATOM 1202 CG2 VAL A 78 -3.743 -16.400 -7.421 1.00 0.00 C ATOM 0 H VAL A 78 -0.962 -16.535 -6.537 1.00 0.00 H new ATOM 0 HA VAL A 78 -2.643 -18.857 -6.994 1.00 0.00 H new ATOM 0 HB VAL A 78 -2.004 -16.400 -8.668 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -3.932 -17.054 -10.060 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.630 -18.266 -10.115 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -4.083 -18.565 -9.132 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.285 -15.680 -8.034 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -4.445 -17.121 -7.001 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.233 -15.877 -6.612 1.00 0.00 H new ATOM 1212 N LEU A 79 -1.188 -20.238 -8.470 1.00 0.00 N ATOM 1213 CA LEU A 79 -0.289 -21.106 -9.229 1.00 0.00 C ATOM 1214 C LEU A 79 -0.730 -21.219 -10.685 1.00 0.00 C ATOM 1215 O LEU A 79 0.068 -21.013 -11.601 1.00 0.00 O ATOM 1216 CB LEU A 79 -0.236 -22.500 -8.590 1.00 0.00 C ATOM 1217 CG LEU A 79 0.241 -22.535 -7.130 1.00 0.00 C ATOM 1218 CD1 LEU A 79 0.269 -23.967 -6.606 1.00 0.00 C ATOM 1219 CD2 LEU A 79 1.615 -21.884 -6.992 1.00 0.00 C ATOM 0 H LEU A 79 -1.994 -20.717 -8.070 1.00 0.00 H new ATOM 0 HA LEU A 79 0.706 -20.661 -9.207 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.231 -22.943 -8.641 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.424 -23.130 -9.186 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.467 -21.965 -6.529 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.610 -23.969 -5.571 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.733 -24.394 -6.659 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.950 -24.563 -7.213 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.932 -21.921 -5.950 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.335 -22.421 -7.609 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.560 -20.845 -7.318 1.00 0.00 H new ATOM 1231 N GLY A 80 -2.002 -21.546 -10.889 1.00 0.00 N ATOM 1232 CA GLY A 80 -2.524 -21.730 -12.232 1.00 0.00 C ATOM 1233 C GLY A 80 -3.971 -21.306 -12.339 1.00 0.00 C ATOM 1234 O GLY A 80 -4.667 -21.213 -11.327 1.00 0.00 O ATOM 0 H GLY A 80 -2.684 -21.688 -10.144 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.924 -21.154 -12.936 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.431 -22.778 -12.517 1.00 0.00 H new ATOM 1238 N SER A 81 -4.431 -21.061 -13.561 1.00 0.00 N ATOM 1239 CA SER A 81 -5.790 -20.588 -13.794 1.00 0.00 C ATOM 1240 C SER A 81 -6.225 -20.873 -15.231 1.00 0.00 C ATOM 1241 O SER A 81 -5.409 -20.841 -16.156 1.00 0.00 O ATOM 1242 CB SER A 81 -5.874 -19.085 -13.496 1.00 0.00 C ATOM 1243 OG SER A 81 -4.838 -18.372 -14.158 1.00 0.00 O ATOM 0 H SER A 81 -3.879 -21.183 -14.410 1.00 0.00 H new ATOM 0 HA SER A 81 -6.466 -21.122 -13.126 1.00 0.00 H new ATOM 0 HB2 SER A 81 -6.844 -18.702 -13.814 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.803 -18.920 -12.421 1.00 0.00 H new ATOM 0 HG SER A 81 -5.039 -17.413 -14.142 1.00 0.00 H new ATOM 1249 N SER A 82 -7.508 -21.173 -15.407 1.00 0.00 N ATOM 1250 CA SER A 82 -8.084 -21.412 -16.726 1.00 0.00 C ATOM 1251 C SER A 82 -9.545 -20.961 -16.755 1.00 0.00 C ATOM 1252 O SER A 82 -10.324 -21.302 -15.860 1.00 0.00 O ATOM 1253 CB SER A 82 -7.993 -22.902 -17.092 1.00 0.00 C ATOM 1254 OG SER A 82 -6.644 -23.335 -17.180 1.00 0.00 O ATOM 0 H SER A 82 -8.176 -21.257 -14.641 1.00 0.00 H new ATOM 0 HA SER A 82 -7.518 -20.835 -17.457 1.00 0.00 H new ATOM 0 HB2 SER A 82 -8.518 -23.494 -16.343 1.00 0.00 H new ATOM 0 HB3 SER A 82 -8.495 -23.075 -18.044 1.00 0.00 H new ATOM 0 HG SER A 82 -6.620 -24.287 -17.413 1.00 0.00 H new ATOM 1260 N GLU A 83 -9.901 -20.180 -17.770 1.00 0.00 N ATOM 1261 CA GLU A 83 -11.285 -19.773 -17.990 1.00 0.00 C ATOM 1262 C GLU A 83 -11.853 -20.534 -19.180 1.00 0.00 C ATOM 1263 O GLU A 83 -11.388 -20.372 -20.310 1.00 0.00 O ATOM 1264 CB GLU A 83 -11.379 -18.261 -18.242 1.00 0.00 C ATOM 1265 CG GLU A 83 -12.792 -17.789 -18.581 1.00 0.00 C ATOM 1266 CD GLU A 83 -12.871 -16.295 -18.852 1.00 0.00 C ATOM 1267 OE1 GLU A 83 -12.553 -15.875 -19.986 1.00 0.00 O ATOM 1268 OE2 GLU A 83 -13.251 -15.532 -17.937 1.00 0.00 O ATOM 0 H GLU A 83 -9.244 -19.814 -18.459 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.863 -20.005 -17.096 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.029 -17.730 -17.357 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -10.709 -17.994 -19.059 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.150 -18.331 -19.457 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -13.460 -18.039 -17.757 1.00 0.00 H new ATOM 1275 N LYS A 84 -12.844 -21.372 -18.923 1.00 0.00 N ATOM 1276 CA LYS A 84 -13.476 -22.165 -19.969 1.00 0.00 C ATOM 1277 C LYS A 84 -14.895 -21.656 -20.213 1.00 0.00 C ATOM 1278 O LYS A 84 -15.881 -22.319 -19.875 1.00 0.00 O ATOM 1279 CB LYS A 84 -13.486 -23.655 -19.583 1.00 0.00 C ATOM 1280 CG LYS A 84 -12.152 -24.168 -19.042 1.00 0.00 C ATOM 1281 CD LYS A 84 -11.007 -23.958 -20.031 1.00 0.00 C ATOM 1282 CE LYS A 84 -11.169 -24.793 -21.296 1.00 0.00 C ATOM 1283 NZ LYS A 84 -10.010 -24.635 -22.214 1.00 0.00 N ATOM 0 H LYS A 84 -13.232 -21.522 -17.992 1.00 0.00 H new ATOM 0 HA LYS A 84 -12.904 -22.062 -20.891 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -14.258 -23.819 -18.831 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -13.762 -24.244 -20.458 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -11.921 -23.657 -18.108 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -12.240 -25.230 -18.811 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -10.952 -22.903 -20.300 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.063 -24.213 -19.549 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.279 -25.843 -21.027 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -12.083 -24.499 -21.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -10.157 -25.218 -23.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -9.920 -23.637 -22.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -9.141 -24.940 -21.731 1.00 0.00 H new ATOM 1297 N GLY A 85 -14.985 -20.451 -20.766 1.00 0.00 N ATOM 1298 CA GLY A 85 -16.271 -19.848 -21.058 1.00 0.00 C ATOM 1299 C GLY A 85 -17.028 -19.450 -19.802 1.00 0.00 C ATOM 1300 O GLY A 85 -16.680 -18.465 -19.149 1.00 0.00 O ATOM 0 H GLY A 85 -14.181 -19.877 -21.019 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.122 -18.967 -21.682 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.874 -20.549 -21.635 1.00 0.00 H new ATOM 1304 N SER A 86 -18.060 -20.218 -19.465 1.00 0.00 N ATOM 1305 CA SER A 86 -18.885 -19.940 -18.292 1.00 0.00 C ATOM 1306 C SER A 86 -18.370 -20.704 -17.070 1.00 0.00 C ATOM 1307 O SER A 86 -18.823 -20.480 -15.946 1.00 0.00 O ATOM 1308 CB SER A 86 -20.343 -20.304 -18.590 1.00 0.00 C ATOM 1309 OG SER A 86 -20.797 -19.634 -19.758 1.00 0.00 O ATOM 0 H SER A 86 -18.347 -21.043 -19.991 1.00 0.00 H new ATOM 0 HA SER A 86 -18.827 -18.876 -18.064 1.00 0.00 H new ATOM 0 HB2 SER A 86 -20.434 -21.382 -18.724 1.00 0.00 H new ATOM 0 HB3 SER A 86 -20.972 -20.034 -17.742 1.00 0.00 H new ATOM 0 HG SER A 86 -21.729 -19.879 -19.934 1.00 0.00 H new ATOM 1315 N ARG A 87 -17.427 -21.613 -17.300 1.00 0.00 N ATOM 1316 CA ARG A 87 -16.767 -22.345 -16.226 1.00 0.00 C ATOM 1317 C ARG A 87 -15.334 -21.860 -16.080 1.00 0.00 C ATOM 1318 O ARG A 87 -14.733 -21.390 -17.044 1.00 0.00 O ATOM 1319 CB ARG A 87 -16.788 -23.854 -16.510 1.00 0.00 C ATOM 1320 CG ARG A 87 -18.089 -24.540 -16.108 1.00 0.00 C ATOM 1321 CD ARG A 87 -18.257 -24.600 -14.589 1.00 0.00 C ATOM 1322 NE ARG A 87 -17.272 -25.487 -13.957 1.00 0.00 N ATOM 1323 CZ ARG A 87 -17.324 -25.886 -12.680 1.00 0.00 C ATOM 1324 NH1 ARG A 87 -18.268 -25.428 -11.866 1.00 0.00 N ATOM 1325 NH2 ARG A 87 -16.423 -26.741 -12.215 1.00 0.00 N ATOM 0 H ARG A 87 -17.100 -21.862 -18.234 1.00 0.00 H new ATOM 0 HA ARG A 87 -17.304 -22.163 -15.295 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -16.617 -24.016 -17.574 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -15.961 -24.325 -15.979 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -18.932 -24.005 -16.545 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -18.107 -25.551 -16.515 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -18.159 -23.597 -14.174 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -19.262 -24.947 -14.350 1.00 0.00 H new ATOM 0 HE ARG A 87 -16.497 -25.821 -14.529 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -18.962 -24.766 -12.212 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -18.299 -25.738 -10.895 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -15.690 -27.095 -12.830 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -16.463 -27.045 -11.242 1.00 0.00 H new ATOM 1339 N GLY A 88 -14.796 -21.959 -14.876 1.00 0.00 N ATOM 1340 CA GLY A 88 -13.429 -21.550 -14.634 1.00 0.00 C ATOM 1341 C GLY A 88 -12.847 -22.252 -13.437 1.00 0.00 C ATOM 1342 O GLY A 88 -13.584 -22.738 -12.576 1.00 0.00 O ATOM 0 H GLY A 88 -15.285 -22.318 -14.056 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.823 -21.765 -15.514 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.393 -20.472 -14.478 1.00 0.00 H new ATOM 1346 N THR A 89 -11.531 -22.320 -13.377 1.00 0.00 N ATOM 1347 CA THR A 89 -10.851 -22.997 -12.288 1.00 0.00 C ATOM 1348 C THR A 89 -9.489 -22.356 -12.037 1.00 0.00 C ATOM 1349 O THR A 89 -8.814 -21.930 -12.977 1.00 0.00 O ATOM 1350 CB THR A 89 -10.680 -24.501 -12.606 1.00 0.00 C ATOM 1351 OG1 THR A 89 -11.945 -25.063 -12.989 1.00 0.00 O ATOM 1352 CG2 THR A 89 -10.137 -25.262 -11.404 1.00 0.00 C ATOM 0 H THR A 89 -10.908 -21.912 -14.074 1.00 0.00 H new ATOM 0 HA THR A 89 -11.459 -22.899 -11.388 1.00 0.00 H new ATOM 0 HB THR A 89 -9.966 -24.592 -13.425 1.00 0.00 H new ATOM 0 HG1 THR A 89 -11.832 -26.015 -13.191 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.028 -26.316 -11.660 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.166 -24.854 -11.124 1.00 0.00 H new ATOM 0 HG23 THR A 89 -10.828 -25.161 -10.567 1.00 0.00 H new ATOM 1360 N VAL A 90 -9.104 -22.267 -10.768 1.00 0.00 N ATOM 1361 CA VAL A 90 -7.820 -21.694 -10.386 1.00 0.00 C ATOM 1362 C VAL A 90 -7.195 -22.494 -9.244 1.00 0.00 C ATOM 1363 O VAL A 90 -7.863 -22.820 -8.256 1.00 0.00 O ATOM 1364 CB VAL A 90 -7.964 -20.200 -9.979 1.00 0.00 C ATOM 1365 CG1 VAL A 90 -9.000 -20.027 -8.874 1.00 0.00 C ATOM 1366 CG2 VAL A 90 -6.618 -19.611 -9.555 1.00 0.00 C ATOM 0 H VAL A 90 -9.669 -22.588 -9.982 1.00 0.00 H new ATOM 0 HA VAL A 90 -7.163 -21.745 -11.254 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.311 -19.653 -10.856 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -9.078 -18.972 -8.611 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.968 -20.387 -9.223 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.695 -20.598 -7.997 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.750 -18.566 -9.276 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.230 -20.168 -8.702 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.914 -19.679 -10.384 1.00 0.00 H new ATOM 1376 N GLU A 91 -5.922 -22.831 -9.406 1.00 0.00 N ATOM 1377 CA GLU A 91 -5.161 -23.549 -8.390 1.00 0.00 C ATOM 1378 C GLU A 91 -4.240 -22.565 -7.681 1.00 0.00 C ATOM 1379 O GLU A 91 -3.550 -21.776 -8.336 1.00 0.00 O ATOM 1380 CB GLU A 91 -4.345 -24.673 -9.040 1.00 0.00 C ATOM 1381 CG GLU A 91 -3.702 -25.628 -8.042 1.00 0.00 C ATOM 1382 CD GLU A 91 -2.882 -26.714 -8.719 1.00 0.00 C ATOM 1383 OE1 GLU A 91 -3.416 -27.395 -9.618 1.00 0.00 O ATOM 1384 OE2 GLU A 91 -1.702 -26.891 -8.353 1.00 0.00 O ATOM 0 H GLU A 91 -5.387 -22.614 -10.247 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.841 -23.997 -7.666 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.995 -25.242 -9.705 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.564 -24.230 -9.659 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.062 -25.063 -7.365 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.480 -26.090 -7.434 1.00 0.00 H new ATOM 1391 N PHE A 92 -4.224 -22.601 -6.355 1.00 0.00 N ATOM 1392 CA PHE A 92 -3.499 -21.599 -5.583 1.00 0.00 C ATOM 1393 C PHE A 92 -2.975 -22.170 -4.269 1.00 0.00 C ATOM 1394 O PHE A 92 -3.165 -23.351 -3.964 1.00 0.00 O ATOM 1395 CB PHE A 92 -4.414 -20.392 -5.311 1.00 0.00 C ATOM 1396 CG PHE A 92 -5.683 -20.741 -4.567 1.00 0.00 C ATOM 1397 CD1 PHE A 92 -6.774 -21.277 -5.240 1.00 0.00 C ATOM 1398 CD2 PHE A 92 -5.783 -20.536 -3.197 1.00 0.00 C ATOM 1399 CE1 PHE A 92 -7.934 -21.600 -4.564 1.00 0.00 C ATOM 1400 CE2 PHE A 92 -6.942 -20.858 -2.517 1.00 0.00 C ATOM 1401 CZ PHE A 92 -8.018 -21.391 -3.201 1.00 0.00 C ATOM 0 H PHE A 92 -4.701 -23.307 -5.794 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.637 -21.280 -6.169 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.860 -19.650 -4.736 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -4.678 -19.927 -6.261 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.714 -21.443 -6.305 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.945 -20.120 -2.657 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.774 -22.015 -5.100 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -7.007 -20.693 -1.452 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.924 -21.644 -2.670 1.00 0.00 H new ATOM 1411 N ILE A 93 -2.297 -21.310 -3.518 1.00 0.00 N ATOM 1412 CA ILE A 93 -1.786 -21.628 -2.194 1.00 0.00 C ATOM 1413 C ILE A 93 -2.096 -20.472 -1.245 1.00 0.00 C ATOM 1414 O ILE A 93 -1.673 -19.334 -1.480 1.00 0.00 O ATOM 1415 CB ILE A 93 -0.252 -21.892 -2.214 1.00 0.00 C ATOM 1416 CG1 ILE A 93 0.054 -23.249 -2.873 1.00 0.00 C ATOM 1417 CG2 ILE A 93 0.332 -21.836 -0.800 1.00 0.00 C ATOM 1418 CD1 ILE A 93 1.531 -23.581 -2.937 1.00 0.00 C ATOM 0 H ILE A 93 -2.085 -20.359 -3.818 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.274 -22.541 -1.852 1.00 0.00 H new ATOM 0 HB ILE A 93 0.219 -21.107 -2.805 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.461 -24.035 -2.320 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.353 -23.251 -3.884 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.405 -22.024 -0.842 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.153 -20.850 -0.371 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.145 -22.594 -0.179 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.665 -24.552 -3.414 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.051 -22.817 -3.515 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.941 -23.613 -1.927 1.00 0.00 H new ATOM 1430 N ALA A 94 -2.854 -20.762 -0.195 1.00 0.00 N ATOM 1431 CA ALA A 94 -3.216 -19.760 0.800 1.00 0.00 C ATOM 1432 C ALA A 94 -2.360 -19.919 2.053 1.00 0.00 C ATOM 1433 O ALA A 94 -2.436 -20.943 2.737 1.00 0.00 O ATOM 1434 CB ALA A 94 -4.698 -19.875 1.145 1.00 0.00 C ATOM 0 H ALA A 94 -3.233 -21.691 -0.010 1.00 0.00 H new ATOM 0 HA ALA A 94 -3.031 -18.770 0.383 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.958 -19.122 1.889 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.294 -19.718 0.246 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.902 -20.868 1.547 1.00 0.00 H new ATOM 1440 N ARG A 95 -1.540 -18.912 2.343 1.00 0.00 N ATOM 1441 CA ARG A 95 -0.696 -18.923 3.533 1.00 0.00 C ATOM 1442 C ARG A 95 -1.386 -18.182 4.671 1.00 0.00 C ATOM 1443 O ARG A 95 -1.937 -17.095 4.480 1.00 0.00 O ATOM 1444 CB ARG A 95 0.668 -18.265 3.270 1.00 0.00 C ATOM 1445 CG ARG A 95 1.613 -18.355 4.474 1.00 0.00 C ATOM 1446 CD ARG A 95 2.494 -17.121 4.625 1.00 0.00 C ATOM 1447 NE ARG A 95 3.403 -16.930 3.495 1.00 0.00 N ATOM 1448 CZ ARG A 95 4.700 -16.652 3.624 1.00 0.00 C ATOM 1449 NH1 ARG A 95 5.260 -16.593 4.827 1.00 0.00 N ATOM 1450 NH2 ARG A 95 5.434 -16.434 2.544 1.00 0.00 N ATOM 0 H ARG A 95 -1.443 -18.076 1.767 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.533 -19.966 3.804 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.137 -18.742 2.410 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.517 -17.217 3.010 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.026 -18.490 5.382 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.245 -19.237 4.369 1.00 0.00 H new ATOM 0 HD2 ARG A 95 1.861 -16.239 4.729 1.00 0.00 H new ATOM 0 HD3 ARG A 95 3.076 -17.206 5.543 1.00 0.00 H new ATOM 0 HE ARG A 95 3.022 -17.015 2.553 1.00 0.00 H new ATOM 0 HH11 ARG A 95 4.697 -16.761 5.661 1.00 0.00 H new ATOM 0 HH12 ARG A 95 6.253 -16.380 4.917 1.00 0.00 H new ATOM 0 HH21 ARG A 95 5.006 -16.479 1.619 1.00 0.00 H new ATOM 0 HH22 ARG A 95 6.427 -16.221 2.637 1.00 0.00 H new ATOM 1464 N PHE A 96 -1.328 -18.768 5.855 1.00 0.00 N ATOM 1465 CA PHE A 96 -1.950 -18.206 7.043 1.00 0.00 C ATOM 1466 C PHE A 96 -1.180 -18.638 8.284 1.00 0.00 C ATOM 1467 O PHE A 96 -0.385 -19.575 8.232 1.00 0.00 O ATOM 1468 CB PHE A 96 -3.414 -18.666 7.135 1.00 0.00 C ATOM 1469 CG PHE A 96 -3.605 -20.124 6.793 1.00 0.00 C ATOM 1470 CD1 PHE A 96 -3.223 -21.122 7.680 1.00 0.00 C ATOM 1471 CD2 PHE A 96 -4.152 -20.494 5.573 1.00 0.00 C ATOM 1472 CE1 PHE A 96 -3.384 -22.453 7.354 1.00 0.00 C ATOM 1473 CE2 PHE A 96 -4.315 -21.824 5.247 1.00 0.00 C ATOM 1474 CZ PHE A 96 -3.930 -22.805 6.139 1.00 0.00 C ATOM 0 H PHE A 96 -0.846 -19.651 6.020 1.00 0.00 H new ATOM 0 HA PHE A 96 -1.929 -17.118 6.978 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -3.781 -18.486 8.145 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -4.021 -18.060 6.462 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -2.796 -20.854 8.635 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.454 -19.731 4.870 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -3.082 -23.220 8.052 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -4.744 -22.098 4.294 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.057 -23.847 5.885 1.00 0.00 H new ATOM 1484 N ARG A 97 -1.411 -17.952 9.391 1.00 0.00 N ATOM 1485 CA ARG A 97 -0.819 -18.333 10.661 1.00 0.00 C ATOM 1486 C ARG A 97 -1.763 -19.301 11.364 1.00 0.00 C ATOM 1487 O ARG A 97 -2.871 -18.927 11.758 1.00 0.00 O ATOM 1488 CB ARG A 97 -0.547 -17.093 11.522 1.00 0.00 C ATOM 1489 CG ARG A 97 0.259 -17.385 12.784 1.00 0.00 C ATOM 1490 CD ARG A 97 0.674 -16.102 13.499 1.00 0.00 C ATOM 1491 NE ARG A 97 -0.476 -15.273 13.879 1.00 0.00 N ATOM 1492 CZ ARG A 97 -0.651 -14.006 13.492 1.00 0.00 C ATOM 1493 NH1 ARG A 97 0.201 -13.439 12.648 1.00 0.00 N ATOM 1494 NH2 ARG A 97 -1.688 -13.314 13.940 1.00 0.00 N ATOM 0 H ARG A 97 -2.007 -17.125 9.435 1.00 0.00 H new ATOM 0 HA ARG A 97 0.140 -18.824 10.494 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -0.012 -16.356 10.923 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -1.498 -16.643 11.806 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -0.333 -18.002 13.459 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.148 -17.960 12.523 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.245 -16.356 14.392 1.00 0.00 H new ATOM 0 HD3 ARG A 97 1.335 -15.526 12.851 1.00 0.00 H new ATOM 0 HE ARG A 97 -1.188 -15.691 14.478 1.00 0.00 H new ATOM 0 HH11 ARG A 97 0.995 -13.971 12.291 1.00 0.00 H new ATOM 0 HH12 ARG A 97 0.062 -12.472 12.356 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -2.353 -13.748 14.580 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -1.822 -12.347 13.645 1.00 0.00 H new ATOM 1508 N ARG A 98 -1.333 -20.552 11.478 1.00 0.00 N ATOM 1509 CA ARG A 98 -2.185 -21.623 11.974 1.00 0.00 C ATOM 1510 C ARG A 98 -2.296 -21.556 13.494 1.00 0.00 C ATOM 1511 O ARG A 98 -1.331 -21.841 14.211 1.00 0.00 O ATOM 1512 CB ARG A 98 -1.624 -22.982 11.532 1.00 0.00 C ATOM 1513 CG ARG A 98 -2.627 -24.130 11.605 1.00 0.00 C ATOM 1514 CD ARG A 98 -3.829 -23.881 10.698 1.00 0.00 C ATOM 1515 NE ARG A 98 -4.621 -25.093 10.481 1.00 0.00 N ATOM 1516 CZ ARG A 98 -5.889 -25.102 10.065 1.00 0.00 C ATOM 1517 NH1 ARG A 98 -6.533 -23.966 9.832 1.00 0.00 N ATOM 1518 NH2 ARG A 98 -6.503 -26.258 9.869 1.00 0.00 N ATOM 0 H ARG A 98 -0.389 -20.850 11.231 1.00 0.00 H new ATOM 0 HA ARG A 98 -3.184 -21.503 11.555 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -1.262 -22.896 10.508 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -0.764 -23.227 12.155 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -2.138 -25.060 11.316 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -2.966 -24.254 12.634 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -4.461 -23.111 11.139 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -3.484 -23.498 9.738 1.00 0.00 H new ATOM 0 HE ARG A 98 -4.173 -25.992 10.660 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -6.059 -23.073 9.971 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.502 -23.985 9.514 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -6.007 -27.134 10.036 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -7.472 -26.273 9.551 1.00 0.00 H new ATOM 1553 N PRO A 102 2.754 -21.268 14.583 1.00 0.00 N ATOM 1554 CA PRO A 102 3.452 -21.338 13.293 1.00 0.00 C ATOM 1555 C PRO A 102 2.553 -20.999 12.105 1.00 0.00 C ATOM 1556 O PRO A 102 1.327 -20.912 12.233 1.00 0.00 O ATOM 1557 CB PRO A 102 3.898 -22.802 13.230 1.00 0.00 C ATOM 1558 CG PRO A 102 2.844 -23.541 13.984 1.00 0.00 C ATOM 1559 CD PRO A 102 2.392 -22.612 15.085 1.00 0.00 C ATOM 0 HA PRO A 102 4.266 -20.615 13.230 1.00 0.00 H new ATOM 0 HB2 PRO A 102 3.970 -23.152 12.200 1.00 0.00 H new ATOM 0 HB3 PRO A 102 4.880 -22.938 13.682 1.00 0.00 H new ATOM 0 HG2 PRO A 102 2.012 -23.807 13.332 1.00 0.00 H new ATOM 0 HG3 PRO A 102 3.237 -24.471 14.395 1.00 0.00 H new ATOM 0 HD2 PRO A 102 1.320 -22.697 15.265 1.00 0.00 H new ATOM 0 HD3 PRO A 102 2.892 -22.835 16.027 1.00 0.00 H new ATOM 1567 N GLU A 103 3.178 -20.807 10.950 1.00 0.00 N ATOM 1568 CA GLU A 103 2.457 -20.569 9.709 1.00 0.00 C ATOM 1569 C GLU A 103 2.102 -21.900 9.050 1.00 0.00 C ATOM 1570 O GLU A 103 2.649 -22.949 9.402 1.00 0.00 O ATOM 1571 CB GLU A 103 3.302 -19.727 8.740 1.00 0.00 C ATOM 1572 CG GLU A 103 3.636 -18.327 9.243 1.00 0.00 C ATOM 1573 CD GLU A 103 4.628 -17.609 8.335 1.00 0.00 C ATOM 1574 OE1 GLU A 103 5.850 -17.820 8.493 1.00 0.00 O ATOM 1575 OE2 GLU A 103 4.195 -16.839 7.451 1.00 0.00 O ATOM 0 H GLU A 103 4.193 -20.812 10.849 1.00 0.00 H new ATOM 0 HA GLU A 103 1.544 -20.022 9.944 1.00 0.00 H new ATOM 0 HB2 GLU A 103 4.232 -20.257 8.535 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.769 -19.641 7.793 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.720 -17.740 9.313 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.050 -18.394 10.249 1.00 0.00 H new ATOM 1582 N GLN A 104 1.188 -21.841 8.097 1.00 0.00 N ATOM 1583 CA GLN A 104 0.797 -22.996 7.305 1.00 0.00 C ATOM 1584 C GLN A 104 0.170 -22.512 6.006 1.00 0.00 C ATOM 1585 O GLN A 104 -0.451 -21.448 5.970 1.00 0.00 O ATOM 1586 CB GLN A 104 -0.187 -23.890 8.078 1.00 0.00 C ATOM 1587 CG GLN A 104 -0.743 -25.055 7.257 1.00 0.00 C ATOM 1588 CD GLN A 104 -1.687 -25.954 8.043 1.00 0.00 C ATOM 1589 OE1 GLN A 104 -1.419 -26.134 9.327 1.00 0.00 O flip ATOM 1590 NE2 GLN A 104 -2.641 -26.505 7.492 1.00 0.00 N flip ATOM 0 H GLN A 104 0.692 -20.985 7.849 1.00 0.00 H new ATOM 0 HA GLN A 104 1.681 -23.595 7.087 1.00 0.00 H new ATOM 0 HB2 GLN A 104 0.315 -24.287 8.960 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -1.017 -23.279 8.431 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -1.270 -24.659 6.389 1.00 0.00 H new ATOM 0 HG3 GLN A 104 0.087 -25.653 6.881 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -2.819 -26.345 6.501 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -3.252 -27.122 8.027 1.00 0.00 H new ATOM 1599 N SER A 105 0.343 -23.280 4.946 1.00 0.00 N ATOM 1600 CA SER A 105 -0.182 -22.915 3.641 1.00 0.00 C ATOM 1601 C SER A 105 -0.987 -24.064 3.042 1.00 0.00 C ATOM 1602 O SER A 105 -0.491 -25.189 2.922 1.00 0.00 O ATOM 1603 CB SER A 105 0.973 -22.511 2.716 1.00 0.00 C ATOM 1604 OG SER A 105 2.057 -23.423 2.822 1.00 0.00 O ATOM 0 H SER A 105 0.847 -24.167 4.963 1.00 0.00 H new ATOM 0 HA SER A 105 -0.855 -22.065 3.753 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.622 -22.477 1.685 1.00 0.00 H new ATOM 0 HB3 SER A 105 1.312 -21.507 2.970 1.00 0.00 H new ATOM 0 HG SER A 105 1.710 -24.335 2.913 1.00 0.00 H new ATOM 1610 N HIS A 106 -2.237 -23.782 2.693 1.00 0.00 N ATOM 1611 CA HIS A 106 -3.083 -24.752 2.010 1.00 0.00 C ATOM 1612 C HIS A 106 -2.809 -24.692 0.518 1.00 0.00 C ATOM 1613 O HIS A 106 -2.520 -23.623 -0.019 1.00 0.00 O ATOM 1614 CB HIS A 106 -4.576 -24.483 2.266 1.00 0.00 C ATOM 1615 CG HIS A 106 -5.095 -24.981 3.584 1.00 0.00 C ATOM 1616 ND1 HIS A 106 -6.124 -24.541 4.349 1.00 0.00 N flip ATOM 1617 CD2 HIS A 106 -4.559 -26.060 4.257 1.00 0.00 C flip ATOM 1618 CE1 HIS A 106 -6.187 -25.352 5.455 1.00 0.00 C flip ATOM 1619 NE2 HIS A 106 -5.233 -26.260 5.375 1.00 0.00 N flip ATOM 0 H HIS A 106 -2.688 -22.885 2.873 1.00 0.00 H new ATOM 0 HA HIS A 106 -2.848 -25.742 2.401 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.751 -23.409 2.206 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -5.155 -24.945 1.467 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -3.719 -26.650 3.921 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -6.901 -25.261 6.260 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -5.048 -26.992 6.060 1.00 0.00 H new ATOM 1628 N HIS A 107 -2.876 -25.838 -0.138 1.00 0.00 N ATOM 1629 CA HIS A 107 -2.718 -25.907 -1.583 1.00 0.00 C ATOM 1630 C HIS A 107 -3.908 -26.646 -2.178 1.00 0.00 C ATOM 1631 O HIS A 107 -3.973 -27.880 -2.149 1.00 0.00 O ATOM 1632 CB HIS A 107 -1.393 -26.597 -1.947 1.00 0.00 C ATOM 1633 CG HIS A 107 -1.132 -26.718 -3.423 1.00 0.00 C ATOM 1634 ND1 HIS A 107 -0.145 -27.529 -3.940 1.00 0.00 N ATOM 1635 CD2 HIS A 107 -1.725 -26.130 -4.491 1.00 0.00 C ATOM 1636 CE1 HIS A 107 -0.143 -27.438 -5.255 1.00 0.00 C ATOM 1637 NE2 HIS A 107 -1.091 -26.597 -5.615 1.00 0.00 N ATOM 0 H HIS A 107 -3.040 -26.740 0.310 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.685 -24.900 -1.998 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -0.573 -26.042 -1.491 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -1.386 -27.595 -1.508 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.543 -25.426 -4.463 1.00 0.00 H new ATOM 0 HE1 HIS A 107 0.523 -27.964 -5.924 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.317 -26.335 -6.574 1.00 0.00 H new ATOM 1646 N GLU A 108 -4.856 -25.884 -2.702 1.00 0.00 N ATOM 1647 CA GLU A 108 -6.070 -26.442 -3.273 1.00 0.00 C ATOM 1648 C GLU A 108 -6.358 -25.826 -4.635 1.00 0.00 C ATOM 1649 O GLU A 108 -5.579 -25.018 -5.150 1.00 0.00 O ATOM 1650 CB GLU A 108 -7.270 -26.229 -2.329 1.00 0.00 C ATOM 1651 CG GLU A 108 -7.587 -24.768 -2.011 1.00 0.00 C ATOM 1652 CD GLU A 108 -6.635 -24.157 -0.992 1.00 0.00 C ATOM 1653 OE1 GLU A 108 -6.920 -24.262 0.221 1.00 0.00 O ATOM 1654 OE2 GLU A 108 -5.605 -23.582 -1.400 1.00 0.00 O ATOM 0 H GLU A 108 -4.805 -24.866 -2.743 1.00 0.00 H new ATOM 0 HA GLU A 108 -5.917 -27.514 -3.401 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -8.152 -26.688 -2.777 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -7.076 -26.755 -1.394 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.547 -24.185 -2.931 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.607 -24.698 -1.634 1.00 0.00 H new ATOM 1661 N ARG A 109 -7.479 -26.229 -5.216 1.00 0.00 N ATOM 1662 CA ARG A 109 -7.909 -25.731 -6.511 1.00 0.00 C ATOM 1663 C ARG A 109 -9.417 -25.511 -6.489 1.00 0.00 C ATOM 1664 O ARG A 109 -10.184 -26.444 -6.257 1.00 0.00 O ATOM 1665 CB ARG A 109 -7.504 -26.723 -7.611 1.00 0.00 C ATOM 1666 CG ARG A 109 -7.929 -26.305 -9.013 1.00 0.00 C ATOM 1667 CD ARG A 109 -7.240 -27.138 -10.087 1.00 0.00 C ATOM 1668 NE ARG A 109 -7.499 -28.571 -9.940 1.00 0.00 N ATOM 1669 CZ ARG A 109 -6.630 -29.525 -10.280 1.00 0.00 C ATOM 1670 NH1 ARG A 109 -5.442 -29.201 -10.780 1.00 0.00 N ATOM 1671 NH2 ARG A 109 -6.945 -30.800 -10.111 1.00 0.00 N ATOM 0 H ARG A 109 -8.115 -26.910 -4.801 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.424 -24.778 -6.725 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -6.421 -26.847 -7.593 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.940 -27.696 -7.386 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -9.010 -26.408 -9.111 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.695 -25.251 -9.165 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.580 -26.810 -11.069 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.165 -26.961 -10.046 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.399 -28.858 -9.554 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -5.192 -28.220 -10.905 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -4.781 -29.933 -11.039 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -7.853 -31.054 -9.721 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -6.280 -31.528 -10.371 1.00 0.00 H new ATOM 1685 N SER A 110 -9.839 -24.273 -6.706 1.00 0.00 N ATOM 1686 CA SER A 110 -11.248 -23.915 -6.604 1.00 0.00 C ATOM 1687 C SER A 110 -11.865 -23.729 -7.989 1.00 0.00 C ATOM 1688 O SER A 110 -11.263 -23.117 -8.878 1.00 0.00 O ATOM 1689 CB SER A 110 -11.405 -22.638 -5.767 1.00 0.00 C ATOM 1690 OG SER A 110 -12.771 -22.318 -5.551 1.00 0.00 O ATOM 0 H SER A 110 -9.225 -23.498 -6.954 1.00 0.00 H new ATOM 0 HA SER A 110 -11.777 -24.729 -6.108 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.905 -22.768 -4.807 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.912 -21.808 -6.273 1.00 0.00 H new ATOM 0 HG SER A 110 -12.973 -21.451 -5.961 1.00 0.00 H new ATOM 1696 N GLN A 111 -13.055 -24.298 -8.172 1.00 0.00 N ATOM 1697 CA GLN A 111 -13.822 -24.137 -9.399 1.00 0.00 C ATOM 1698 C GLN A 111 -14.868 -23.037 -9.209 1.00 0.00 C ATOM 1699 O GLN A 111 -15.486 -22.930 -8.143 1.00 0.00 O ATOM 1700 CB GLN A 111 -14.516 -25.451 -9.795 1.00 0.00 C ATOM 1701 CG GLN A 111 -13.574 -26.620 -10.094 1.00 0.00 C ATOM 1702 CD GLN A 111 -12.924 -27.215 -8.852 1.00 0.00 C ATOM 1703 OE1 GLN A 111 -11.730 -26.751 -8.519 1.00 0.00 O flip ATOM 1704 NE2 GLN A 111 -13.482 -28.105 -8.209 1.00 0.00 N flip ATOM 0 H GLN A 111 -13.512 -24.883 -7.472 1.00 0.00 H new ATOM 0 HA GLN A 111 -13.136 -23.860 -10.199 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -15.190 -25.745 -8.990 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -15.132 -25.267 -10.675 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -14.131 -27.401 -10.611 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.793 -26.281 -10.775 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -14.403 -28.439 -8.494 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -13.023 -28.508 -7.392 1.00 0.00 H new ATOM 1713 N PHE A 112 -15.065 -22.231 -10.243 1.00 0.00 N ATOM 1714 CA PHE A 112 -15.972 -21.088 -10.183 1.00 0.00 C ATOM 1715 C PHE A 112 -16.954 -21.116 -11.351 1.00 0.00 C ATOM 1716 O PHE A 112 -16.666 -21.685 -12.410 1.00 0.00 O ATOM 1717 CB PHE A 112 -15.177 -19.773 -10.213 1.00 0.00 C ATOM 1718 CG PHE A 112 -14.323 -19.543 -8.993 1.00 0.00 C ATOM 1719 CD1 PHE A 112 -13.050 -20.085 -8.903 1.00 0.00 C ATOM 1720 CD2 PHE A 112 -14.797 -18.785 -7.933 1.00 0.00 C ATOM 1721 CE1 PHE A 112 -12.273 -19.875 -7.783 1.00 0.00 C ATOM 1722 CE2 PHE A 112 -14.022 -18.573 -6.812 1.00 0.00 C ATOM 1723 CZ PHE A 112 -12.759 -19.119 -6.737 1.00 0.00 C ATOM 0 H PHE A 112 -14.604 -22.348 -11.145 1.00 0.00 H new ATOM 0 HA PHE A 112 -16.531 -21.150 -9.250 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -14.539 -19.767 -11.097 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -15.874 -18.942 -10.317 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -12.663 -20.678 -9.718 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -15.786 -18.355 -7.986 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -11.283 -20.303 -7.725 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -14.404 -17.980 -5.994 1.00 0.00 H new ATOM 0 HZ PHE A 112 -12.150 -18.955 -5.860 1.00 0.00 H new ATOM 1733 N ARG A 113 -18.108 -20.497 -11.144 1.00 0.00 N ATOM 1734 CA ARG A 113 -19.123 -20.350 -12.179 1.00 0.00 C ATOM 1735 C ARG A 113 -19.251 -18.883 -12.563 1.00 0.00 C ATOM 1736 O ARG A 113 -19.269 -18.007 -11.697 1.00 0.00 O ATOM 1737 CB ARG A 113 -20.473 -20.884 -11.683 1.00 0.00 C ATOM 1738 CG ARG A 113 -21.630 -20.656 -12.653 1.00 0.00 C ATOM 1739 CD ARG A 113 -22.908 -21.326 -12.160 1.00 0.00 C ATOM 1740 NE ARG A 113 -24.005 -21.213 -13.120 1.00 0.00 N ATOM 1741 CZ ARG A 113 -25.220 -21.731 -12.933 1.00 0.00 C ATOM 1742 NH1 ARG A 113 -25.509 -22.385 -11.811 1.00 0.00 N ATOM 1743 NH2 ARG A 113 -26.146 -21.587 -13.871 1.00 0.00 N ATOM 0 H ARG A 113 -18.368 -20.081 -10.250 1.00 0.00 H new ATOM 0 HA ARG A 113 -18.823 -20.927 -13.054 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -20.380 -21.953 -11.491 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -20.712 -20.409 -10.732 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.801 -19.586 -12.773 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -21.367 -21.049 -13.635 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -22.709 -22.379 -11.962 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -23.209 -20.876 -11.214 1.00 0.00 H new ATOM 0 HE ARG A 113 -23.830 -20.706 -13.988 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -24.799 -22.493 -11.086 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -26.440 -22.778 -11.675 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -25.928 -21.082 -14.730 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -27.077 -21.981 -13.734 1.00 0.00 H new ATOM 1757 N LYS A 114 -19.330 -18.621 -13.858 1.00 0.00 N ATOM 1758 CA LYS A 114 -19.439 -17.261 -14.358 1.00 0.00 C ATOM 1759 C LYS A 114 -20.906 -16.913 -14.593 1.00 0.00 C ATOM 1760 O LYS A 114 -21.523 -17.396 -15.544 1.00 0.00 O ATOM 1761 CB LYS A 114 -18.629 -17.117 -15.649 1.00 0.00 C ATOM 1762 CG LYS A 114 -18.240 -15.679 -15.967 1.00 0.00 C ATOM 1763 CD LYS A 114 -17.267 -15.609 -17.137 1.00 0.00 C ATOM 1764 CE LYS A 114 -16.596 -14.247 -17.225 1.00 0.00 C ATOM 1765 NZ LYS A 114 -15.671 -14.163 -18.390 1.00 0.00 N ATOM 0 H LYS A 114 -19.321 -19.337 -14.585 1.00 0.00 H new ATOM 0 HA LYS A 114 -19.035 -16.568 -13.620 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -17.725 -17.720 -15.570 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -19.209 -17.520 -16.479 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -19.135 -15.102 -16.202 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -17.787 -15.221 -15.088 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -16.508 -16.383 -17.027 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -17.799 -15.814 -18.066 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -17.357 -13.471 -17.308 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -16.042 -14.054 -16.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -15.510 -13.165 -18.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -14.764 -14.610 -18.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -16.092 -14.655 -19.204 1.00 0.00 H new ATOM 1779 N ALA A 115 -21.460 -16.090 -13.710 1.00 0.00 N ATOM 1780 CA ALA A 115 -22.863 -15.697 -13.782 1.00 0.00 C ATOM 1781 C ALA A 115 -22.985 -14.182 -13.886 1.00 0.00 C ATOM 1782 O ALA A 115 -22.435 -13.449 -13.058 1.00 0.00 O ATOM 1783 CB ALA A 115 -23.619 -16.214 -12.562 1.00 0.00 C ATOM 0 H ALA A 115 -20.952 -15.678 -12.927 1.00 0.00 H new ATOM 0 HA ALA A 115 -23.305 -16.139 -14.675 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -24.665 -15.914 -12.628 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -23.555 -17.302 -12.528 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -23.178 -15.796 -11.657 1.00 0.00 H new ATOM 1789 N ARG A 116 -23.681 -13.720 -14.926 1.00 0.00 N ATOM 1790 CA ARG A 116 -23.909 -12.290 -15.146 1.00 0.00 C ATOM 1791 C ARG A 116 -22.563 -11.576 -15.358 1.00 0.00 C ATOM 1792 O ARG A 116 -22.447 -10.363 -15.185 1.00 0.00 O ATOM 1793 CB ARG A 116 -24.687 -11.693 -13.947 1.00 0.00 C ATOM 1794 CG ARG A 116 -25.742 -10.642 -14.311 1.00 0.00 C ATOM 1795 CD ARG A 116 -25.137 -9.380 -14.913 1.00 0.00 C ATOM 1796 NE ARG A 116 -26.133 -8.320 -15.093 1.00 0.00 N ATOM 1797 CZ ARG A 116 -25.830 -7.060 -15.415 1.00 0.00 C ATOM 1798 NH1 ARG A 116 -24.572 -6.725 -15.669 1.00 0.00 N ATOM 1799 NH2 ARG A 116 -26.788 -6.147 -15.511 1.00 0.00 N ATOM 0 H ARG A 116 -24.100 -14.321 -15.635 1.00 0.00 H new ATOM 0 HA ARG A 116 -24.511 -12.145 -16.043 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -25.177 -12.506 -13.412 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -23.972 -11.243 -13.258 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -26.449 -11.074 -15.020 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -26.308 -10.377 -13.418 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -24.337 -9.019 -14.267 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -24.685 -9.619 -15.876 1.00 0.00 H new ATOM 0 HE ARG A 116 -27.116 -8.559 -14.965 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -23.836 -7.430 -15.618 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -24.340 -5.763 -15.915 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -27.759 -6.407 -15.339 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -26.553 -5.185 -15.757 1.00 0.00 H new ATOM 1813 N GLY A 117 -21.548 -12.348 -15.741 1.00 0.00 N ATOM 1814 CA GLY A 117 -20.223 -11.797 -15.972 1.00 0.00 C ATOM 1815 C GLY A 117 -19.336 -11.848 -14.740 1.00 0.00 C ATOM 1816 O GLY A 117 -18.121 -11.664 -14.838 1.00 0.00 O ATOM 0 H GLY A 117 -21.622 -13.353 -15.896 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -19.743 -12.347 -16.782 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -20.318 -10.762 -16.302 1.00 0.00 H new ATOM 1820 N ARG A 118 -19.930 -12.102 -13.575 1.00 0.00 N ATOM 1821 CA ARG A 118 -19.163 -12.179 -12.334 1.00 0.00 C ATOM 1822 C ARG A 118 -18.827 -13.632 -12.026 1.00 0.00 C ATOM 1823 O ARG A 118 -19.582 -14.538 -12.378 1.00 0.00 O ATOM 1824 CB ARG A 118 -19.925 -11.574 -11.140 1.00 0.00 C ATOM 1825 CG ARG A 118 -20.467 -10.161 -11.358 1.00 0.00 C ATOM 1826 CD ARG A 118 -21.824 -10.173 -12.055 1.00 0.00 C ATOM 1827 NE ARG A 118 -22.400 -8.831 -12.167 1.00 0.00 N ATOM 1828 CZ ARG A 118 -23.590 -8.482 -11.675 1.00 0.00 C ATOM 1829 NH1 ARG A 118 -24.343 -9.372 -11.037 1.00 0.00 N ATOM 1830 NH2 ARG A 118 -24.032 -7.242 -11.828 1.00 0.00 N ATOM 0 H ARG A 118 -20.932 -12.257 -13.465 1.00 0.00 H new ATOM 0 HA ARG A 118 -18.252 -11.599 -12.480 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -20.759 -12.231 -10.892 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -19.261 -11.561 -10.276 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -20.557 -9.655 -10.397 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -19.757 -9.588 -11.955 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -21.716 -10.604 -13.050 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -22.509 -10.816 -11.502 1.00 0.00 H new ATOM 0 HE ARG A 118 -21.856 -8.117 -12.652 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -24.012 -10.330 -10.921 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -25.252 -9.097 -10.664 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -23.462 -6.555 -12.322 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -24.942 -6.975 -11.452 1.00 0.00 H new ATOM 1844 N TRP A 119 -17.694 -13.849 -11.374 1.00 0.00 N ATOM 1845 CA TRP A 119 -17.281 -15.188 -10.975 1.00 0.00 C ATOM 1846 C TRP A 119 -17.741 -15.492 -9.555 1.00 0.00 C ATOM 1847 O TRP A 119 -17.533 -14.691 -8.642 1.00 0.00 O ATOM 1848 CB TRP A 119 -15.761 -15.331 -11.094 1.00 0.00 C ATOM 1849 CG TRP A 119 -15.303 -15.465 -12.513 1.00 0.00 C ATOM 1850 CD1 TRP A 119 -14.818 -14.487 -13.332 1.00 0.00 C ATOM 1851 CD2 TRP A 119 -15.316 -16.663 -13.285 1.00 0.00 C ATOM 1852 NE1 TRP A 119 -14.510 -15.018 -14.562 1.00 0.00 N ATOM 1853 CE2 TRP A 119 -14.812 -16.350 -14.556 1.00 0.00 C ATOM 1854 CE3 TRP A 119 -15.703 -17.973 -13.017 1.00 0.00 C ATOM 1855 CZ2 TRP A 119 -14.684 -17.301 -15.559 1.00 0.00 C ATOM 1856 CZ3 TRP A 119 -15.578 -18.919 -14.013 1.00 0.00 C ATOM 1857 CH2 TRP A 119 -15.072 -18.578 -15.272 1.00 0.00 C ATOM 0 H TRP A 119 -17.041 -13.112 -11.109 1.00 0.00 H new ATOM 0 HA TRP A 119 -17.750 -15.909 -11.644 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -15.282 -14.462 -10.642 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -15.437 -16.204 -10.528 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -14.695 -13.450 -13.055 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -14.120 -14.502 -15.350 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -16.094 -18.244 -12.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -14.292 -17.040 -16.531 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.875 -19.939 -13.818 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.987 -19.340 -16.032 1.00 0.00 H new ATOM 1868 N TYR A 120 -18.375 -16.647 -9.386 1.00 0.00 N ATOM 1869 CA TYR A 120 -18.891 -17.076 -8.091 1.00 0.00 C ATOM 1870 C TYR A 120 -18.385 -18.477 -7.749 1.00 0.00 C ATOM 1871 O TYR A 120 -18.417 -19.380 -8.588 1.00 0.00 O ATOM 1872 CB TYR A 120 -20.426 -17.048 -8.098 1.00 0.00 C ATOM 1873 CG TYR A 120 -21.008 -15.651 -8.231 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -21.055 -14.796 -7.136 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -21.505 -15.186 -9.445 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -21.576 -13.523 -7.245 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -22.029 -13.911 -9.559 1.00 0.00 C ATOM 1878 CZ TYR A 120 -22.061 -13.084 -8.454 1.00 0.00 C ATOM 1879 OH TYR A 120 -22.576 -11.809 -8.561 1.00 0.00 O ATOM 0 H TYR A 120 -18.546 -17.311 -10.141 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.531 -16.386 -7.328 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -20.789 -17.664 -8.921 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -20.794 -17.500 -7.177 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -20.677 -15.134 -6.183 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -21.481 -15.831 -10.311 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -21.603 -12.873 -6.383 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -22.411 -13.564 -10.508 1.00 0.00 H new ATOM 0 HH TYR A 120 -22.876 -11.653 -9.481 1.00 0.00 H new ATOM 1889 N PHE A 121 -17.907 -18.643 -6.519 1.00 0.00 N ATOM 1890 CA PHE A 121 -17.384 -19.924 -6.042 1.00 0.00 C ATOM 1891 C PHE A 121 -18.431 -21.029 -6.145 1.00 0.00 C ATOM 1892 O PHE A 121 -19.519 -20.914 -5.585 1.00 0.00 O ATOM 1893 CB PHE A 121 -16.900 -19.785 -4.590 1.00 0.00 C ATOM 1894 CG PHE A 121 -16.645 -21.104 -3.895 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -15.415 -21.738 -3.999 1.00 0.00 C ATOM 1896 CD2 PHE A 121 -17.644 -21.712 -3.143 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -15.188 -22.947 -3.367 1.00 0.00 C ATOM 1898 CE2 PHE A 121 -17.421 -22.918 -2.511 1.00 0.00 C ATOM 1899 CZ PHE A 121 -16.192 -23.538 -2.623 1.00 0.00 C ATOM 0 H PHE A 121 -17.870 -17.897 -5.825 1.00 0.00 H new ATOM 0 HA PHE A 121 -16.544 -20.202 -6.678 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -15.982 -19.197 -4.579 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -17.644 -19.225 -4.022 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -14.627 -21.282 -4.580 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -18.608 -21.234 -3.052 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -14.226 -23.430 -3.455 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -18.207 -23.377 -1.929 1.00 0.00 H new ATOM 0 HZ PHE A 121 -16.016 -24.483 -2.130 1.00 0.00 H new ATOM 1909 N SER A 122 -18.085 -22.103 -6.848 1.00 0.00 N ATOM 1910 CA SER A 122 -18.968 -23.254 -6.983 1.00 0.00 C ATOM 1911 C SER A 122 -18.512 -24.378 -6.053 1.00 0.00 C ATOM 1912 O SER A 122 -19.219 -24.744 -5.112 1.00 0.00 O ATOM 1913 CB SER A 122 -18.985 -23.729 -8.437 1.00 0.00 C ATOM 1914 OG SER A 122 -19.386 -22.682 -9.307 1.00 0.00 O ATOM 0 H SER A 122 -17.194 -22.199 -7.335 1.00 0.00 H new ATOM 0 HA SER A 122 -19.980 -22.964 -6.700 1.00 0.00 H new ATOM 0 HB2 SER A 122 -17.994 -24.083 -8.720 1.00 0.00 H new ATOM 0 HB3 SER A 122 -19.666 -24.574 -8.540 1.00 0.00 H new ATOM 0 HG SER A 122 -20.360 -22.701 -9.414 1.00 0.00 H new ATOM 1920 N GLU A 123 -17.320 -24.910 -6.313 1.00 0.00 N ATOM 1921 CA GLU A 123 -16.752 -25.977 -5.496 1.00 0.00 C ATOM 1922 C GLU A 123 -15.226 -25.901 -5.505 1.00 0.00 C ATOM 1923 O GLU A 123 -14.645 -24.966 -6.062 1.00 0.00 O ATOM 1924 CB GLU A 123 -17.223 -27.361 -5.983 1.00 0.00 C ATOM 1925 CG GLU A 123 -16.925 -27.664 -7.455 1.00 0.00 C ATOM 1926 CD GLU A 123 -17.944 -27.069 -8.416 1.00 0.00 C ATOM 1927 OE1 GLU A 123 -19.156 -27.307 -8.220 1.00 0.00 O ATOM 1928 OE2 GLU A 123 -17.538 -26.381 -9.378 1.00 0.00 O ATOM 0 H GLU A 123 -16.726 -24.616 -7.089 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.104 -25.841 -4.473 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.751 -28.126 -5.367 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -18.298 -27.440 -5.822 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -15.936 -27.280 -7.704 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -16.892 -28.744 -7.596 1.00 0.00 H new ATOM 1935 N GLY A 124 -14.586 -26.875 -4.870 1.00 0.00 N ATOM 1936 CA GLY A 124 -13.137 -26.919 -4.823 1.00 0.00 C ATOM 1937 C GLY A 124 -12.636 -27.664 -3.605 1.00 0.00 C ATOM 1938 O GLY A 124 -13.313 -27.698 -2.574 1.00 0.00 O ATOM 0 H GLY A 124 -15.050 -27.642 -4.383 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.759 -27.401 -5.725 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -12.743 -25.903 -4.815 1.00 0.00 H new ATOM 1942 N GLU A 125 -11.460 -28.265 -3.722 1.00 0.00 N ATOM 1943 CA GLU A 125 -10.861 -29.023 -2.626 1.00 0.00 C ATOM 1944 C GLU A 125 -9.346 -29.092 -2.801 1.00 0.00 C ATOM 1945 O GLU A 125 -8.803 -28.565 -3.781 1.00 0.00 O ATOM 1946 CB GLU A 125 -11.450 -30.442 -2.575 1.00 0.00 C ATOM 1947 CG GLU A 125 -11.126 -31.287 -3.805 1.00 0.00 C ATOM 1948 CD GLU A 125 -11.748 -32.673 -3.755 1.00 0.00 C ATOM 1949 OE1 GLU A 125 -11.389 -33.458 -2.852 1.00 0.00 O ATOM 1950 OE2 GLU A 125 -12.604 -32.982 -4.614 1.00 0.00 O ATOM 0 H GLU A 125 -10.896 -28.243 -4.571 1.00 0.00 H new ATOM 0 HA GLU A 125 -11.086 -28.516 -1.688 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -11.074 -30.950 -1.687 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -12.533 -30.373 -2.468 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -11.478 -30.769 -4.697 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -10.044 -31.384 -3.898 1.00 0.00 H new ATOM 1957 N ALA A 126 -8.668 -29.739 -1.853 1.00 0.00 N ATOM 1958 CA ALA A 126 -7.222 -29.924 -1.926 1.00 0.00 C ATOM 1959 C ALA A 126 -6.844 -30.630 -3.226 1.00 0.00 C ATOM 1960 O ALA A 126 -7.386 -31.692 -3.550 1.00 0.00 O ATOM 1961 CB ALA A 126 -6.722 -30.707 -0.716 1.00 0.00 C ATOM 0 H ALA A 126 -9.101 -30.145 -1.023 1.00 0.00 H new ATOM 0 HA ALA A 126 -6.743 -28.945 -1.917 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -5.642 -30.836 -0.787 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.963 -30.161 0.196 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.203 -31.685 -0.691 1.00 0.00 H new