USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=31 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 3 CYS SG : rot -163:sc= 0.289 USER MOD Set 1.2: A 5 CYS SG : rot -86:sc= -4.55! USER MOD Set 1.3: A 14 CYS SG : rot -74:sc= 0.233 USER MOD Set 1.4: A 15 CYS SG : rot 106:sc= -5.35! USER MOD Single : A 7 SER OG : rot 180:sc= -0.114 USER MOD Single : A 9 LYS NZ :NH3+ -135:sc= 1.13 (180deg=-0.326) USER MOD Single : A 10 THR OG1 : rot -133:sc= 0.857 USER MOD Single : A 11 TYR OH : rot 180:sc= -0.0105 USER MOD Single : A 22 THR OG1 : rot -38:sc= 0.465 USER MOD Single : A 24 SER OG : rot 180:sc= 0.00324 USER MOD Single : A 27 SER OG : rot 180:sc= -0.311 USER MOD Single : A 32 MET CE :methyl 172:sc= -3.18! (180deg=-3.32!) USER MOD Single : A 34 SER OG : rot 97:sc= 1.01 USER MOD Single : A 36 TYR OH : rot 180:sc= -0.134 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 37:sc= -0.737 USER MOD Single : A 50 THR OG1 : rot -73:sc= 0.952 USER MOD Single : A 51 THR OG1 : rot -146:sc= 1.14 USER MOD Single : A 61 HIS : no HD1:sc= -0.136 K(o=-0.14,f=-0.94) USER MOD Single : A 64 ASN : amide:sc= -1.07 K(o=-1.1,f=-2.4!) USER MOD Single : A 68 MET CE :methyl -115:sc= -1.35 (180deg=-3.76!) USER MOD Single : A 71 SER OG : rot 92:sc= 0.46 USER MOD Single : A 81 SER OG : rot 176:sc= 1.06 USER MOD Single : A 82 SER OG : rot 180:sc= -0.0673 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0.0126 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.514 USER MOD Single : A 104 GLN : amide:sc= -0.134 K(o=-0.13,f=-0.75) USER MOD Single : A 105 SER OG : rot 37:sc= 0.231 USER MOD Single : A 106 HIS : no HE2:sc= -0.286 K(o=-0.29,f=-3.3!) USER MOD Single : A 107 HIS : no HD1:sc= 0.265 K(o=0.27,f=-3.9!) USER MOD Single : A 110 SER OG : rot 23:sc= 0.32 USER MOD Single : A 111 GLN :FLIP amide:sc= -0.578 F(o=-2.2!,f=-0.58) USER MOD Single : A 114 LYS NZ :NH3+ -177:sc= 1.13 (180deg=1.12) USER MOD Single : A 120 TYR OH : rot 180:sc= 1.13 USER MOD Single : A 122 SER OG : rot -62:sc= 0.271 USER MOD ----------------------------------------------------------------- ATOM 34 N CYS A 3 -1.809 -4.636 -0.700 1.00 0.00 N ATOM 35 CA CYS A 3 -3.018 -5.438 -0.567 1.00 0.00 C ATOM 36 C CYS A 3 -2.678 -6.869 -0.183 1.00 0.00 C ATOM 37 O CYS A 3 -1.860 -7.508 -0.845 1.00 0.00 O ATOM 38 CB CYS A 3 -3.811 -5.455 -1.873 1.00 0.00 C ATOM 39 SG CYS A 3 -5.578 -5.823 -1.644 1.00 0.00 S ATOM 0 HA CYS A 3 -3.623 -4.983 0.218 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -3.710 -4.486 -2.363 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -3.377 -6.198 -2.543 1.00 0.00 H new ATOM 0 HG CYS A 3 -6.101 -6.166 -2.784 1.00 0.00 H new ATOM 44 N VAL A 4 -3.304 -7.368 0.880 1.00 0.00 N ATOM 45 CA VAL A 4 -3.235 -8.787 1.209 1.00 0.00 C ATOM 46 C VAL A 4 -3.722 -9.619 0.021 1.00 0.00 C ATOM 47 O VAL A 4 -4.909 -9.911 -0.126 1.00 0.00 O ATOM 48 CB VAL A 4 -4.047 -9.123 2.483 1.00 0.00 C ATOM 49 CG1 VAL A 4 -3.288 -8.670 3.726 1.00 0.00 C ATOM 50 CG2 VAL A 4 -5.432 -8.477 2.427 1.00 0.00 C ATOM 0 H VAL A 4 -3.863 -6.811 1.526 1.00 0.00 H new ATOM 0 HA VAL A 4 -2.194 -9.035 1.418 1.00 0.00 H new ATOM 0 HB VAL A 4 -4.182 -10.203 2.535 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -3.869 -8.912 4.616 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -2.326 -9.181 3.771 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -3.125 -7.593 3.681 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.986 -8.726 3.332 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -5.326 -7.395 2.352 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -5.972 -8.850 1.557 1.00 0.00 H new ATOM 60 N CYS A 5 -2.778 -9.932 -0.843 1.00 0.00 N ATOM 61 CA CYS A 5 -3.020 -10.630 -2.100 1.00 0.00 C ATOM 62 C CYS A 5 -1.681 -10.982 -2.736 1.00 0.00 C ATOM 63 O CYS A 5 -0.646 -10.451 -2.328 1.00 0.00 O ATOM 64 CB CYS A 5 -3.829 -9.759 -3.079 1.00 0.00 C ATOM 65 SG CYS A 5 -5.581 -9.523 -2.636 1.00 0.00 S ATOM 0 H CYS A 5 -1.795 -9.705 -0.692 1.00 0.00 H new ATOM 0 HA CYS A 5 -3.596 -11.531 -1.888 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -3.353 -8.781 -3.150 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -3.778 -10.210 -4.070 1.00 0.00 H new ATOM 0 HG CYS A 5 -6.284 -10.510 -3.106 1.00 0.00 H new ATOM 70 N GLY A 6 -1.694 -11.846 -3.747 1.00 0.00 N ATOM 71 CA GLY A 6 -0.483 -12.114 -4.509 1.00 0.00 C ATOM 72 C GLY A 6 -0.200 -11.004 -5.510 1.00 0.00 C ATOM 73 O GLY A 6 0.206 -11.260 -6.644 1.00 0.00 O ATOM 0 H GLY A 6 -2.517 -12.365 -4.053 1.00 0.00 H new ATOM 0 HA2 GLY A 6 0.362 -12.216 -3.828 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -0.585 -13.063 -5.035 1.00 0.00 H new ATOM 77 N SER A 7 -0.416 -9.765 -5.077 1.00 0.00 N ATOM 78 CA SER A 7 -0.306 -8.597 -5.937 1.00 0.00 C ATOM 79 C SER A 7 0.025 -7.374 -5.083 1.00 0.00 C ATOM 80 O SER A 7 -0.719 -7.044 -4.152 1.00 0.00 O ATOM 81 CB SER A 7 -1.627 -8.366 -6.691 1.00 0.00 C ATOM 82 OG SER A 7 -2.072 -9.551 -7.332 1.00 0.00 O ATOM 0 H SER A 7 -0.673 -9.545 -4.115 1.00 0.00 H new ATOM 0 HA SER A 7 0.487 -8.760 -6.667 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.390 -8.019 -5.994 1.00 0.00 H new ATOM 0 HB3 SER A 7 -1.491 -7.579 -7.432 1.00 0.00 H new ATOM 0 HG SER A 7 -2.914 -9.373 -7.801 1.00 0.00 H new ATOM 88 N GLY A 8 1.129 -6.708 -5.406 1.00 0.00 N ATOM 89 CA GLY A 8 1.587 -5.568 -4.629 1.00 0.00 C ATOM 90 C GLY A 8 0.660 -4.368 -4.723 1.00 0.00 C ATOM 91 O GLY A 8 0.830 -3.396 -3.984 1.00 0.00 O ATOM 0 H GLY A 8 1.722 -6.941 -6.202 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.683 -5.864 -3.584 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.581 -5.279 -4.971 1.00 0.00 H new ATOM 95 N LYS A 9 -0.318 -4.434 -5.631 1.00 0.00 N ATOM 96 CA LYS A 9 -1.290 -3.352 -5.813 1.00 0.00 C ATOM 97 C LYS A 9 -1.948 -2.968 -4.486 1.00 0.00 C ATOM 98 O LYS A 9 -1.993 -3.766 -3.543 1.00 0.00 O ATOM 99 CB LYS A 9 -2.377 -3.755 -6.823 1.00 0.00 C ATOM 100 CG LYS A 9 -1.835 -4.220 -8.172 1.00 0.00 C ATOM 101 CD LYS A 9 -2.941 -4.356 -9.219 1.00 0.00 C ATOM 102 CE LYS A 9 -3.505 -2.996 -9.620 1.00 0.00 C ATOM 103 NZ LYS A 9 -4.634 -3.112 -10.581 1.00 0.00 N ATOM 0 H LYS A 9 -0.458 -5.229 -6.254 1.00 0.00 H new ATOM 0 HA LYS A 9 -0.745 -2.490 -6.198 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -2.980 -4.554 -6.391 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -3.041 -2.906 -6.984 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.087 -3.511 -8.526 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.332 -5.179 -8.049 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.548 -4.862 -10.101 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -3.742 -4.981 -8.824 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -3.843 -2.469 -8.728 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -2.713 -2.394 -10.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -4.511 -2.419 -11.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.652 -4.072 -10.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -5.530 -2.927 -10.087 1.00 0.00 H new ATOM 117 N THR A 10 -2.480 -1.753 -4.433 1.00 0.00 N ATOM 118 CA THR A 10 -3.080 -1.214 -3.216 1.00 0.00 C ATOM 119 C THR A 10 -4.417 -1.896 -2.914 1.00 0.00 C ATOM 120 O THR A 10 -4.796 -2.880 -3.567 1.00 0.00 O ATOM 121 CB THR A 10 -3.311 0.308 -3.350 1.00 0.00 C ATOM 122 OG1 THR A 10 -4.389 0.557 -4.260 1.00 0.00 O ATOM 123 CG2 THR A 10 -2.058 1.011 -3.856 1.00 0.00 C ATOM 0 H THR A 10 -2.508 -1.115 -5.228 1.00 0.00 H new ATOM 0 HA THR A 10 -2.387 -1.407 -2.397 1.00 0.00 H new ATOM 0 HB THR A 10 -3.557 0.700 -2.363 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.125 1.253 -4.897 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.250 2.081 -3.941 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.239 0.843 -3.156 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.787 0.613 -4.834 1.00 0.00 H new ATOM 131 N TYR A 11 -5.129 -1.374 -1.921 1.00 0.00 N ATOM 132 CA TYR A 11 -6.458 -1.859 -1.590 1.00 0.00 C ATOM 133 C TYR A 11 -7.410 -1.575 -2.749 1.00 0.00 C ATOM 134 O TYR A 11 -7.991 -2.500 -3.331 1.00 0.00 O ATOM 135 CB TYR A 11 -6.959 -1.193 -0.300 1.00 0.00 C ATOM 136 CG TYR A 11 -8.410 -1.492 0.035 1.00 0.00 C ATOM 137 CD1 TYR A 11 -8.818 -2.779 0.358 1.00 0.00 C ATOM 138 CD2 TYR A 11 -9.370 -0.483 0.026 1.00 0.00 C ATOM 139 CE1 TYR A 11 -10.137 -3.052 0.663 1.00 0.00 C ATOM 140 CE2 TYR A 11 -10.691 -0.751 0.333 1.00 0.00 C ATOM 141 CZ TYR A 11 -11.068 -2.037 0.651 1.00 0.00 C ATOM 142 OH TYR A 11 -12.380 -2.315 0.962 1.00 0.00 O ATOM 0 H TYR A 11 -4.802 -0.610 -1.330 1.00 0.00 H new ATOM 0 HA TYR A 11 -6.418 -2.936 -1.424 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -6.332 -1.519 0.530 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -6.834 -0.114 -0.390 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -8.093 -3.579 0.371 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -9.077 0.526 -0.225 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -10.438 -4.059 0.910 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -11.423 0.043 0.324 1.00 0.00 H new ATOM 0 HH TYR A 11 -12.910 -1.492 0.909 1.00 0.00 H new ATOM 152 N ASP A 12 -7.524 -0.297 -3.102 1.00 0.00 N ATOM 153 CA ASP A 12 -8.430 0.143 -4.163 1.00 0.00 C ATOM 154 C ASP A 12 -7.962 -0.356 -5.528 1.00 0.00 C ATOM 155 O ASP A 12 -8.743 -0.927 -6.281 1.00 0.00 O ATOM 156 CB ASP A 12 -8.552 1.672 -4.171 1.00 0.00 C ATOM 157 CG ASP A 12 -9.433 2.187 -5.304 1.00 0.00 C ATOM 158 OD1 ASP A 12 -10.676 2.124 -5.181 1.00 0.00 O ATOM 159 OD2 ASP A 12 -8.883 2.662 -6.326 1.00 0.00 O ATOM 0 H ASP A 12 -6.996 0.459 -2.665 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.412 -0.285 -3.961 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -8.962 2.004 -3.218 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -7.558 2.111 -4.261 1.00 0.00 H new ATOM 164 N ASP A 13 -6.677 -0.164 -5.827 1.00 0.00 N ATOM 165 CA ASP A 13 -6.104 -0.589 -7.113 1.00 0.00 C ATOM 166 C ASP A 13 -6.339 -2.076 -7.366 1.00 0.00 C ATOM 167 O ASP A 13 -6.313 -2.534 -8.507 1.00 0.00 O ATOM 168 CB ASP A 13 -4.595 -0.297 -7.167 1.00 0.00 C ATOM 169 CG ASP A 13 -4.277 1.170 -7.409 1.00 0.00 C ATOM 170 OD1 ASP A 13 -4.635 2.014 -6.562 1.00 0.00 O ATOM 171 OD2 ASP A 13 -3.653 1.484 -8.443 1.00 0.00 O ATOM 0 H ASP A 13 -6.009 0.283 -5.198 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.609 -0.017 -7.891 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -4.137 -0.611 -6.229 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -4.144 -0.895 -7.959 1.00 0.00 H new ATOM 176 N CYS A 14 -6.544 -2.833 -6.297 1.00 0.00 N ATOM 177 CA CYS A 14 -6.769 -4.271 -6.414 1.00 0.00 C ATOM 178 C CYS A 14 -8.206 -4.663 -6.026 1.00 0.00 C ATOM 179 O CYS A 14 -9.061 -4.819 -6.896 1.00 0.00 O ATOM 180 CB CYS A 14 -5.722 -5.025 -5.581 1.00 0.00 C ATOM 181 SG CYS A 14 -6.069 -6.793 -5.313 1.00 0.00 S ATOM 0 H CYS A 14 -6.560 -2.479 -5.341 1.00 0.00 H new ATOM 0 HA CYS A 14 -6.652 -4.557 -7.459 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -4.754 -4.932 -6.073 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -5.634 -4.537 -4.610 1.00 0.00 H new ATOM 0 HG CYS A 14 -7.026 -6.920 -4.443 1.00 0.00 H new ATOM 186 N CYS A 15 -8.476 -4.832 -4.731 1.00 0.00 N ATOM 187 CA CYS A 15 -9.786 -5.327 -4.273 1.00 0.00 C ATOM 188 C CYS A 15 -10.898 -4.277 -4.357 1.00 0.00 C ATOM 189 O CYS A 15 -12.074 -4.635 -4.397 1.00 0.00 O ATOM 190 CB CYS A 15 -9.694 -5.883 -2.849 1.00 0.00 C ATOM 191 SG CYS A 15 -8.820 -7.476 -2.743 1.00 0.00 S ATOM 0 H CYS A 15 -7.813 -4.636 -3.981 1.00 0.00 H new ATOM 0 HA CYS A 15 -10.058 -6.129 -4.960 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.185 -5.156 -2.216 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -10.701 -6.003 -2.449 1.00 0.00 H new ATOM 0 HG CYS A 15 -7.641 -7.291 -2.228 1.00 0.00 H new ATOM 196 N GLY A 16 -10.525 -2.997 -4.386 1.00 0.00 N ATOM 197 CA GLY A 16 -11.503 -1.919 -4.246 1.00 0.00 C ATOM 198 C GLY A 16 -12.713 -2.039 -5.169 1.00 0.00 C ATOM 199 O GLY A 16 -13.849 -2.069 -4.688 1.00 0.00 O ATOM 0 H GLY A 16 -9.562 -2.684 -4.504 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -11.851 -1.893 -3.213 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.007 -0.968 -4.440 1.00 0.00 H new ATOM 203 N PRO A 17 -12.512 -2.148 -6.498 1.00 0.00 N ATOM 204 CA PRO A 17 -13.623 -2.230 -7.454 1.00 0.00 C ATOM 205 C PRO A 17 -14.504 -3.461 -7.224 1.00 0.00 C ATOM 206 O PRO A 17 -15.718 -3.420 -7.454 1.00 0.00 O ATOM 207 CB PRO A 17 -12.931 -2.291 -8.828 1.00 0.00 C ATOM 208 CG PRO A 17 -11.521 -2.688 -8.547 1.00 0.00 C ATOM 209 CD PRO A 17 -11.203 -2.159 -7.177 1.00 0.00 C ATOM 0 HA PRO A 17 -14.302 -1.383 -7.356 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -13.419 -3.014 -9.482 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -12.974 -1.326 -9.332 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.407 -3.771 -8.582 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -10.843 -2.272 -9.292 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.487 -2.796 -6.657 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -10.767 -1.161 -7.224 1.00 0.00 H new ATOM 217 N LEU A 18 -13.891 -4.546 -6.754 1.00 0.00 N ATOM 218 CA LEU A 18 -14.613 -5.794 -6.511 1.00 0.00 C ATOM 219 C LEU A 18 -15.451 -5.690 -5.238 1.00 0.00 C ATOM 220 O LEU A 18 -16.631 -6.045 -5.227 1.00 0.00 O ATOM 221 CB LEU A 18 -13.643 -6.987 -6.409 1.00 0.00 C ATOM 222 CG LEU A 18 -12.869 -7.346 -7.696 1.00 0.00 C ATOM 223 CD1 LEU A 18 -13.809 -7.423 -8.897 1.00 0.00 C ATOM 224 CD2 LEU A 18 -11.737 -6.357 -7.958 1.00 0.00 C ATOM 0 H LEU A 18 -12.896 -4.586 -6.534 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.277 -5.964 -7.358 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.920 -6.775 -5.622 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -14.209 -7.863 -6.094 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.425 -8.330 -7.548 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -13.238 -7.677 -9.790 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -14.565 -8.188 -8.719 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.296 -6.458 -9.040 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.212 -6.638 -8.871 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -12.149 -5.354 -8.070 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.040 -6.371 -7.120 1.00 0.00 H new ATOM 236 N LEU A 19 -14.835 -5.187 -4.173 1.00 0.00 N ATOM 237 CA LEU A 19 -15.504 -5.040 -2.880 1.00 0.00 C ATOM 238 C LEU A 19 -16.609 -3.984 -2.949 1.00 0.00 C ATOM 239 O LEU A 19 -17.544 -4.000 -2.149 1.00 0.00 O ATOM 240 CB LEU A 19 -14.475 -4.689 -1.790 1.00 0.00 C ATOM 241 CG LEU A 19 -13.752 -5.895 -1.152 1.00 0.00 C ATOM 242 CD1 LEU A 19 -12.516 -5.442 -0.381 1.00 0.00 C ATOM 243 CD2 LEU A 19 -14.696 -6.659 -0.230 1.00 0.00 C ATOM 0 H LEU A 19 -13.865 -4.871 -4.178 1.00 0.00 H new ATOM 0 HA LEU A 19 -15.973 -5.990 -2.624 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -13.726 -4.024 -2.221 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -14.981 -4.131 -1.002 1.00 0.00 H new ATOM 0 HG LEU A 19 -13.433 -6.560 -1.955 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -12.024 -6.309 0.059 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -11.827 -4.940 -1.060 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -12.813 -4.753 0.410 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -14.169 -7.505 0.210 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -15.045 -5.997 0.562 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -15.550 -7.022 -0.803 1.00 0.00 H new ATOM 255 N ALA A 20 -16.498 -3.070 -3.907 1.00 0.00 N ATOM 256 CA ALA A 20 -17.529 -2.055 -4.128 1.00 0.00 C ATOM 257 C ALA A 20 -18.586 -2.550 -5.118 1.00 0.00 C ATOM 258 O ALA A 20 -19.608 -1.893 -5.326 1.00 0.00 O ATOM 259 CB ALA A 20 -16.894 -0.763 -4.630 1.00 0.00 C ATOM 0 H ALA A 20 -15.705 -3.009 -4.545 1.00 0.00 H new ATOM 0 HA ALA A 20 -18.025 -1.860 -3.177 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -17.670 -0.015 -4.791 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -16.183 -0.395 -3.890 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -16.374 -0.954 -5.569 1.00 0.00 H new ATOM 265 N ARG A 21 -18.326 -3.716 -5.724 1.00 0.00 N ATOM 266 CA ARG A 21 -19.203 -4.294 -6.753 1.00 0.00 C ATOM 267 C ARG A 21 -19.321 -3.360 -7.965 1.00 0.00 C ATOM 268 O ARG A 21 -20.199 -3.535 -8.813 1.00 0.00 O ATOM 269 CB ARG A 21 -20.612 -4.599 -6.204 1.00 0.00 C ATOM 270 CG ARG A 21 -20.706 -5.794 -5.248 1.00 0.00 C ATOM 271 CD ARG A 21 -20.136 -5.503 -3.860 1.00 0.00 C ATOM 272 NE ARG A 21 -20.626 -6.471 -2.872 1.00 0.00 N ATOM 273 CZ ARG A 21 -20.124 -6.637 -1.646 1.00 0.00 C ATOM 274 NH1 ARG A 21 -19.074 -5.934 -1.245 1.00 0.00 N ATOM 275 NH2 ARG A 21 -20.682 -7.517 -0.825 1.00 0.00 N ATOM 0 H ARG A 21 -17.505 -4.284 -5.516 1.00 0.00 H new ATOM 0 HA ARG A 21 -18.743 -5.232 -7.063 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -20.981 -3.713 -5.687 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -21.280 -4.777 -7.047 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -21.750 -6.091 -5.150 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -20.174 -6.640 -5.682 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -19.047 -5.536 -3.897 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -20.414 -4.494 -3.554 1.00 0.00 H new ATOM 0 HE ARG A 21 -21.411 -7.063 -3.143 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -18.642 -5.258 -1.875 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -18.698 -6.069 -0.306 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -21.488 -8.061 -1.132 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -20.305 -7.650 0.113 1.00 0.00 H new ATOM 289 N THR A 22 -18.412 -2.394 -8.058 1.00 0.00 N ATOM 290 CA THR A 22 -18.463 -1.377 -9.106 1.00 0.00 C ATOM 291 C THR A 22 -17.753 -1.864 -10.372 1.00 0.00 C ATOM 292 O THR A 22 -17.632 -1.128 -11.356 1.00 0.00 O ATOM 293 CB THR A 22 -17.825 -0.050 -8.613 1.00 0.00 C ATOM 294 OG1 THR A 22 -18.046 1.010 -9.556 1.00 0.00 O ATOM 295 CG2 THR A 22 -16.327 -0.209 -8.379 1.00 0.00 C ATOM 0 H THR A 22 -17.626 -2.293 -7.416 1.00 0.00 H new ATOM 0 HA THR A 22 -19.510 -1.193 -9.345 1.00 0.00 H new ATOM 0 HB THR A 22 -18.306 0.204 -7.668 1.00 0.00 H new ATOM 0 HG1 THR A 22 -17.981 0.656 -10.467 1.00 0.00 H new ATOM 0 HG21 THR A 22 -15.910 0.737 -8.035 1.00 0.00 H new ATOM 0 HG22 THR A 22 -16.156 -0.977 -7.625 1.00 0.00 H new ATOM 0 HG23 THR A 22 -15.842 -0.501 -9.310 1.00 0.00 H new ATOM 303 N ARG A 23 -17.288 -3.109 -10.339 1.00 0.00 N ATOM 304 CA ARG A 23 -16.593 -3.709 -11.472 1.00 0.00 C ATOM 305 C ARG A 23 -16.566 -5.226 -11.325 1.00 0.00 C ATOM 306 O ARG A 23 -16.291 -5.743 -10.241 1.00 0.00 O ATOM 307 CB ARG A 23 -15.160 -3.166 -11.562 1.00 0.00 C ATOM 308 CG ARG A 23 -14.377 -3.671 -12.769 1.00 0.00 C ATOM 309 CD ARG A 23 -12.952 -3.123 -12.794 1.00 0.00 C ATOM 310 NE ARG A 23 -12.911 -1.657 -12.728 1.00 0.00 N ATOM 311 CZ ARG A 23 -11.847 -0.919 -13.060 1.00 0.00 C ATOM 312 NH1 ARG A 23 -10.751 -1.498 -13.544 1.00 0.00 N ATOM 313 NH2 ARG A 23 -11.883 0.399 -12.911 1.00 0.00 N ATOM 0 H ARG A 23 -17.381 -3.726 -9.532 1.00 0.00 H new ATOM 0 HA ARG A 23 -17.126 -3.451 -12.387 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -15.197 -2.077 -11.596 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.622 -3.438 -10.654 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.347 -4.760 -12.752 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.894 -3.381 -13.684 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -12.393 -3.537 -11.955 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -12.454 -3.456 -13.705 1.00 0.00 H new ATOM 0 HE ARG A 23 -13.748 -1.170 -12.408 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -10.719 -2.510 -13.664 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -9.942 -0.929 -13.795 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -12.722 0.848 -12.543 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -11.072 0.963 -13.164 1.00 0.00 H new ATOM 327 N SER A 24 -16.865 -5.933 -12.408 1.00 0.00 N ATOM 328 CA SER A 24 -16.803 -7.387 -12.415 1.00 0.00 C ATOM 329 C SER A 24 -15.372 -7.849 -12.697 1.00 0.00 C ATOM 330 O SER A 24 -14.706 -7.321 -13.590 1.00 0.00 O ATOM 331 CB SER A 24 -17.776 -7.952 -13.461 1.00 0.00 C ATOM 332 OG SER A 24 -17.571 -7.356 -14.734 1.00 0.00 O ATOM 0 H SER A 24 -17.154 -5.520 -13.295 1.00 0.00 H new ATOM 0 HA SER A 24 -17.098 -7.762 -11.435 1.00 0.00 H new ATOM 0 HB2 SER A 24 -17.644 -9.031 -13.537 1.00 0.00 H new ATOM 0 HB3 SER A 24 -18.802 -7.778 -13.137 1.00 0.00 H new ATOM 0 HG SER A 24 -18.203 -7.737 -15.379 1.00 0.00 H new ATOM 338 N ALA A 25 -14.896 -8.817 -11.917 1.00 0.00 N ATOM 339 CA ALA A 25 -13.545 -9.347 -12.085 1.00 0.00 C ATOM 340 C ALA A 25 -13.371 -9.964 -13.470 1.00 0.00 C ATOM 341 O ALA A 25 -12.322 -9.820 -14.095 1.00 0.00 O ATOM 342 CB ALA A 25 -13.238 -10.372 -10.998 1.00 0.00 C ATOM 0 H ALA A 25 -15.427 -9.251 -11.162 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.840 -8.521 -11.993 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -12.228 -10.758 -11.137 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.314 -9.898 -10.019 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.952 -11.193 -11.060 1.00 0.00 H new ATOM 348 N ALA A 26 -14.408 -10.670 -13.926 1.00 0.00 N ATOM 349 CA ALA A 26 -14.430 -11.292 -15.255 1.00 0.00 C ATOM 350 C ALA A 26 -13.374 -12.395 -15.402 1.00 0.00 C ATOM 351 O ALA A 26 -13.296 -13.050 -16.442 1.00 0.00 O ATOM 352 CB ALA A 26 -14.267 -10.236 -16.347 1.00 0.00 C ATOM 0 H ALA A 26 -15.258 -10.828 -13.385 1.00 0.00 H new ATOM 0 HA ALA A 26 -15.404 -11.768 -15.369 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -14.286 -10.718 -17.325 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -15.083 -9.516 -16.281 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -13.316 -9.720 -16.215 1.00 0.00 H new ATOM 358 N SER A 27 -12.597 -12.628 -14.348 1.00 0.00 N ATOM 359 CA SER A 27 -11.545 -13.639 -14.360 1.00 0.00 C ATOM 360 C SER A 27 -11.497 -14.333 -12.994 1.00 0.00 C ATOM 361 O SER A 27 -11.547 -13.661 -11.958 1.00 0.00 O ATOM 362 CB SER A 27 -10.193 -12.986 -14.692 1.00 0.00 C ATOM 363 OG SER A 27 -9.162 -13.951 -14.811 1.00 0.00 O ATOM 0 H SER A 27 -12.678 -12.124 -13.465 1.00 0.00 H new ATOM 0 HA SER A 27 -11.758 -14.384 -15.126 1.00 0.00 H new ATOM 0 HB2 SER A 27 -10.278 -12.427 -15.624 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.933 -12.270 -13.913 1.00 0.00 H new ATOM 0 HG SER A 27 -8.317 -13.502 -15.024 1.00 0.00 H new ATOM 369 N PRO A 28 -11.415 -15.683 -12.965 1.00 0.00 N ATOM 370 CA PRO A 28 -11.464 -16.450 -11.712 1.00 0.00 C ATOM 371 C PRO A 28 -10.311 -16.090 -10.776 1.00 0.00 C ATOM 372 O PRO A 28 -10.495 -15.984 -9.562 1.00 0.00 O ATOM 373 CB PRO A 28 -11.377 -17.918 -12.169 1.00 0.00 C ATOM 374 CG PRO A 28 -10.802 -17.867 -13.545 1.00 0.00 C ATOM 375 CD PRO A 28 -11.254 -16.559 -14.142 1.00 0.00 C ATOM 0 HA PRO A 28 -12.367 -16.241 -11.138 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -10.745 -18.502 -11.500 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.360 -18.389 -12.170 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.714 -17.926 -13.515 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -11.150 -18.709 -14.144 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.519 -16.161 -14.841 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -12.189 -16.670 -14.691 1.00 0.00 H new ATOM 383 N GLU A 29 -9.129 -15.881 -11.351 1.00 0.00 N ATOM 384 CA GLU A 29 -7.955 -15.489 -10.576 1.00 0.00 C ATOM 385 C GLU A 29 -8.149 -14.084 -9.997 1.00 0.00 C ATOM 386 O GLU A 29 -7.915 -13.850 -8.807 1.00 0.00 O ATOM 387 CB GLU A 29 -6.691 -15.555 -11.450 1.00 0.00 C ATOM 388 CG GLU A 29 -6.783 -14.729 -12.728 1.00 0.00 C ATOM 389 CD GLU A 29 -5.568 -14.888 -13.628 1.00 0.00 C ATOM 390 OE1 GLU A 29 -4.583 -14.140 -13.451 1.00 0.00 O ATOM 391 OE2 GLU A 29 -5.595 -15.757 -14.524 1.00 0.00 O ATOM 0 H GLU A 29 -8.959 -15.977 -12.352 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.830 -16.186 -9.747 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.838 -15.209 -10.866 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.497 -16.595 -11.714 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.677 -15.021 -13.279 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.899 -13.677 -12.466 1.00 0.00 H new ATOM 398 N ALA A 30 -8.628 -13.167 -10.839 1.00 0.00 N ATOM 399 CA ALA A 30 -8.865 -11.783 -10.434 1.00 0.00 C ATOM 400 C ALA A 30 -9.940 -11.710 -9.350 1.00 0.00 C ATOM 401 O ALA A 30 -9.978 -10.769 -8.551 1.00 0.00 O ATOM 402 CB ALA A 30 -9.264 -10.940 -11.640 1.00 0.00 C ATOM 0 H ALA A 30 -8.861 -13.362 -11.813 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.939 -11.384 -10.020 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.437 -9.911 -11.324 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.464 -10.962 -12.380 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.176 -11.343 -12.080 1.00 0.00 H new ATOM 408 N LEU A 31 -10.806 -12.713 -9.327 1.00 0.00 N ATOM 409 CA LEU A 31 -11.876 -12.790 -8.341 1.00 0.00 C ATOM 410 C LEU A 31 -11.360 -13.424 -7.046 1.00 0.00 C ATOM 411 O LEU A 31 -11.613 -12.916 -5.951 1.00 0.00 O ATOM 412 CB LEU A 31 -13.058 -13.592 -8.931 1.00 0.00 C ATOM 413 CG LEU A 31 -14.355 -13.666 -8.089 1.00 0.00 C ATOM 414 CD1 LEU A 31 -14.266 -14.743 -7.008 1.00 0.00 C ATOM 415 CD2 LEU A 31 -14.688 -12.305 -7.476 1.00 0.00 C ATOM 0 H LEU A 31 -10.788 -13.491 -9.986 1.00 0.00 H new ATOM 0 HA LEU A 31 -12.225 -11.786 -8.098 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -13.309 -13.160 -9.900 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -12.716 -14.611 -9.115 1.00 0.00 H new ATOM 0 HG LEU A 31 -15.165 -13.944 -8.763 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.195 -14.764 -6.438 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -14.104 -15.715 -7.475 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.435 -14.519 -6.339 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -15.603 -12.384 -6.890 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -13.870 -11.987 -6.830 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -14.829 -11.573 -8.271 1.00 0.00 H new ATOM 427 N MET A 32 -10.602 -14.511 -7.178 1.00 0.00 N ATOM 428 CA MET A 32 -10.209 -15.312 -6.021 1.00 0.00 C ATOM 429 C MET A 32 -9.283 -14.545 -5.074 1.00 0.00 C ATOM 430 O MET A 32 -9.387 -14.701 -3.858 1.00 0.00 O ATOM 431 CB MET A 32 -9.542 -16.629 -6.446 1.00 0.00 C ATOM 432 CG MET A 32 -8.143 -16.464 -7.014 1.00 0.00 C ATOM 433 SD MET A 32 -7.333 -18.042 -7.312 1.00 0.00 S ATOM 434 CE MET A 32 -5.719 -17.489 -7.844 1.00 0.00 C ATOM 0 H MET A 32 -10.249 -14.856 -8.071 1.00 0.00 H new ATOM 0 HA MET A 32 -11.129 -15.541 -5.484 1.00 0.00 H new ATOM 0 HB2 MET A 32 -9.496 -17.294 -5.584 1.00 0.00 H new ATOM 0 HB3 MET A 32 -10.170 -17.117 -7.192 1.00 0.00 H new ATOM 0 HG2 MET A 32 -8.197 -15.904 -7.948 1.00 0.00 H new ATOM 0 HG3 MET A 32 -7.541 -15.874 -6.323 1.00 0.00 H new ATOM 0 HE1 MET A 32 -5.051 -18.346 -7.931 1.00 0.00 H new ATOM 0 HE2 MET A 32 -5.804 -16.995 -8.812 1.00 0.00 H new ATOM 0 HE3 MET A 32 -5.316 -16.788 -7.113 1.00 0.00 H new ATOM 444 N ARG A 33 -8.373 -13.722 -5.612 1.00 0.00 N ATOM 445 CA ARG A 33 -7.446 -12.984 -4.747 1.00 0.00 C ATOM 446 C ARG A 33 -8.168 -11.820 -4.074 1.00 0.00 C ATOM 447 O ARG A 33 -7.744 -11.335 -3.023 1.00 0.00 O ATOM 448 CB ARG A 33 -6.182 -12.503 -5.495 1.00 0.00 C ATOM 449 CG ARG A 33 -6.274 -11.131 -6.167 1.00 0.00 C ATOM 450 CD ARG A 33 -7.110 -11.151 -7.437 1.00 0.00 C ATOM 451 NE ARG A 33 -6.933 -9.925 -8.219 1.00 0.00 N ATOM 452 CZ ARG A 33 -6.015 -9.783 -9.179 1.00 0.00 C ATOM 453 NH1 ARG A 33 -5.207 -10.790 -9.480 1.00 0.00 N ATOM 454 NH2 ARG A 33 -5.908 -8.638 -9.842 1.00 0.00 N ATOM 0 H ARG A 33 -8.260 -13.554 -6.612 1.00 0.00 H new ATOM 0 HA ARG A 33 -7.098 -13.676 -3.980 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -5.353 -12.483 -4.788 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -5.933 -13.242 -6.257 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -6.704 -10.416 -5.466 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -5.270 -10.780 -6.404 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -6.831 -12.013 -8.043 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -8.162 -11.270 -7.179 1.00 0.00 H new ATOM 0 HE ARG A 33 -7.546 -9.134 -8.019 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -5.286 -11.675 -8.978 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -4.507 -10.680 -10.213 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.529 -7.860 -9.620 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -5.205 -8.536 -10.574 1.00 0.00 H new ATOM 468 N SER A 34 -9.263 -11.379 -4.684 1.00 0.00 N ATOM 469 CA SER A 34 -10.132 -10.388 -4.068 1.00 0.00 C ATOM 470 C SER A 34 -10.885 -11.043 -2.912 1.00 0.00 C ATOM 471 O SER A 34 -11.047 -10.455 -1.841 1.00 0.00 O ATOM 472 CB SER A 34 -11.107 -9.820 -5.106 1.00 0.00 C ATOM 473 OG SER A 34 -10.403 -9.304 -6.227 1.00 0.00 O ATOM 0 H SER A 34 -9.568 -11.694 -5.605 1.00 0.00 H new ATOM 0 HA SER A 34 -9.537 -9.560 -3.683 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.796 -10.600 -5.430 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.709 -9.032 -4.654 1.00 0.00 H new ATOM 0 HG SER A 34 -10.382 -9.978 -6.938 1.00 0.00 H new ATOM 479 N ARG A 35 -11.309 -12.283 -3.148 1.00 0.00 N ATOM 480 CA ARG A 35 -11.960 -13.102 -2.132 1.00 0.00 C ATOM 481 C ARG A 35 -11.005 -13.344 -0.959 1.00 0.00 C ATOM 482 O ARG A 35 -11.377 -13.188 0.201 1.00 0.00 O ATOM 483 CB ARG A 35 -12.390 -14.441 -2.753 1.00 0.00 C ATOM 484 CG ARG A 35 -13.146 -15.365 -1.802 1.00 0.00 C ATOM 485 CD ARG A 35 -13.314 -16.763 -2.388 1.00 0.00 C ATOM 486 NE ARG A 35 -12.021 -17.429 -2.590 1.00 0.00 N ATOM 487 CZ ARG A 35 -11.878 -18.677 -3.047 1.00 0.00 C ATOM 488 NH1 ARG A 35 -12.941 -19.397 -3.384 1.00 0.00 N ATOM 489 NH2 ARG A 35 -10.665 -19.202 -3.175 1.00 0.00 N ATOM 0 H ARG A 35 -11.210 -12.747 -4.051 1.00 0.00 H new ATOM 0 HA ARG A 35 -12.841 -12.581 -1.758 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -13.019 -14.240 -3.620 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.503 -14.960 -3.116 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -12.610 -15.429 -0.855 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -14.127 -14.941 -1.585 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -13.932 -17.364 -1.722 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -13.841 -16.697 -3.340 1.00 0.00 H new ATOM 0 HE ARG A 35 -11.175 -16.904 -2.367 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -13.876 -18.999 -3.295 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -12.823 -20.349 -3.732 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -9.843 -18.653 -2.925 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -10.556 -20.154 -3.524 1.00 0.00 H new ATOM 503 N TYR A 36 -9.766 -13.715 -1.280 1.00 0.00 N ATOM 504 CA TYR A 36 -8.735 -13.958 -0.269 1.00 0.00 C ATOM 505 C TYR A 36 -8.586 -12.748 0.649 1.00 0.00 C ATOM 506 O TYR A 36 -8.564 -12.878 1.875 1.00 0.00 O ATOM 507 CB TYR A 36 -7.389 -14.275 -0.949 1.00 0.00 C ATOM 508 CG TYR A 36 -6.211 -14.346 0.012 1.00 0.00 C ATOM 509 CD1 TYR A 36 -5.964 -15.493 0.760 1.00 0.00 C ATOM 510 CD2 TYR A 36 -5.350 -13.262 0.174 1.00 0.00 C ATOM 511 CE1 TYR A 36 -4.900 -15.555 1.640 1.00 0.00 C ATOM 512 CE2 TYR A 36 -4.284 -13.319 1.051 1.00 0.00 C ATOM 513 CZ TYR A 36 -4.064 -14.467 1.782 1.00 0.00 C ATOM 514 OH TYR A 36 -3.006 -14.528 2.661 1.00 0.00 O ATOM 0 H TYR A 36 -9.449 -13.855 -2.239 1.00 0.00 H new ATOM 0 HA TYR A 36 -9.039 -14.814 0.334 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -7.474 -15.226 -1.474 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.185 -13.513 -1.701 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -6.614 -16.349 0.651 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -5.519 -12.361 -0.397 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -4.724 -16.452 2.215 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -3.627 -12.469 1.163 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.515 -13.680 2.641 1.00 0.00 H new ATOM 524 N ALA A 37 -8.497 -11.572 0.038 1.00 0.00 N ATOM 525 CA ALA A 37 -8.326 -10.333 0.778 1.00 0.00 C ATOM 526 C ALA A 37 -9.507 -10.086 1.712 1.00 0.00 C ATOM 527 O ALA A 37 -9.329 -9.595 2.821 1.00 0.00 O ATOM 528 CB ALA A 37 -8.142 -9.165 -0.183 1.00 0.00 C ATOM 0 H ALA A 37 -8.541 -11.453 -0.974 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.430 -10.421 1.392 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.015 -8.243 0.385 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.259 -9.336 -0.799 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.020 -9.079 -0.823 1.00 0.00 H new ATOM 534 N ALA A 38 -10.708 -10.453 1.264 1.00 0.00 N ATOM 535 CA ALA A 38 -11.924 -10.254 2.053 1.00 0.00 C ATOM 536 C ALA A 38 -11.799 -10.897 3.431 1.00 0.00 C ATOM 537 O ALA A 38 -12.253 -10.337 4.427 1.00 0.00 O ATOM 538 CB ALA A 38 -13.139 -10.796 1.308 1.00 0.00 C ATOM 0 H ALA A 38 -10.865 -10.891 0.356 1.00 0.00 H new ATOM 0 HA ALA A 38 -12.060 -9.183 2.199 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -14.034 -10.640 1.910 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.245 -10.274 0.357 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -13.007 -11.862 1.124 1.00 0.00 H new ATOM 544 N TYR A 39 -11.164 -12.062 3.488 1.00 0.00 N ATOM 545 CA TYR A 39 -10.934 -12.743 4.759 1.00 0.00 C ATOM 546 C TYR A 39 -9.922 -11.977 5.610 1.00 0.00 C ATOM 547 O TYR A 39 -10.149 -11.734 6.795 1.00 0.00 O ATOM 548 CB TYR A 39 -10.460 -14.190 4.528 1.00 0.00 C ATOM 549 CG TYR A 39 -11.570 -15.233 4.556 1.00 0.00 C ATOM 550 CD1 TYR A 39 -12.759 -15.008 5.249 1.00 0.00 C ATOM 551 CD2 TYR A 39 -11.419 -16.453 3.904 1.00 0.00 C ATOM 552 CE1 TYR A 39 -13.757 -15.965 5.286 1.00 0.00 C ATOM 553 CE2 TYR A 39 -12.412 -17.413 3.941 1.00 0.00 C ATOM 554 CZ TYR A 39 -13.578 -17.164 4.633 1.00 0.00 C ATOM 555 OH TYR A 39 -14.570 -18.118 4.671 1.00 0.00 O ATOM 0 H TYR A 39 -10.800 -12.554 2.672 1.00 0.00 H new ATOM 0 HA TYR A 39 -11.880 -12.776 5.299 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -9.954 -14.243 3.564 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.723 -14.443 5.290 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -12.903 -14.071 5.766 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -10.508 -16.653 3.359 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -14.673 -15.773 5.825 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -12.275 -18.355 3.430 1.00 0.00 H new ATOM 0 HH TYR A 39 -14.287 -18.905 4.160 1.00 0.00 H new ATOM 565 N ALA A 40 -8.816 -11.578 4.995 1.00 0.00 N ATOM 566 CA ALA A 40 -7.759 -10.860 5.704 1.00 0.00 C ATOM 567 C ALA A 40 -8.187 -9.424 6.029 1.00 0.00 C ATOM 568 O ALA A 40 -7.539 -8.731 6.815 1.00 0.00 O ATOM 569 CB ALA A 40 -6.477 -10.877 4.883 1.00 0.00 C ATOM 0 H ALA A 40 -8.625 -11.739 4.006 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.572 -11.366 6.651 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.695 -10.340 5.419 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.163 -11.908 4.720 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.654 -10.396 3.921 1.00 0.00 H new ATOM 575 N LEU A 41 -9.279 -8.985 5.406 1.00 0.00 N ATOM 576 CA LEU A 41 -9.858 -7.664 5.658 1.00 0.00 C ATOM 577 C LEU A 41 -11.131 -7.792 6.497 1.00 0.00 C ATOM 578 O LEU A 41 -11.957 -6.877 6.535 1.00 0.00 O ATOM 579 CB LEU A 41 -10.158 -6.957 4.329 1.00 0.00 C ATOM 580 CG LEU A 41 -8.927 -6.660 3.455 1.00 0.00 C ATOM 581 CD1 LEU A 41 -9.349 -6.100 2.101 1.00 0.00 C ATOM 582 CD2 LEU A 41 -7.975 -5.699 4.167 1.00 0.00 C ATOM 0 H LEU A 41 -9.788 -9.533 4.713 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.138 -7.065 6.216 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -10.851 -7.573 3.756 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -10.668 -6.018 4.542 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.397 -7.597 3.285 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.463 -5.897 1.499 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.978 -6.826 1.587 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.908 -5.176 2.248 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.112 -5.503 3.530 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.492 -4.762 4.375 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.641 -6.145 5.104 1.00 0.00 H new ATOM 594 N LYS A 42 -11.259 -8.940 7.175 1.00 0.00 N ATOM 595 CA LYS A 42 -12.399 -9.269 8.053 1.00 0.00 C ATOM 596 C LYS A 42 -13.757 -8.913 7.437 1.00 0.00 C ATOM 597 O LYS A 42 -14.723 -8.637 8.153 1.00 0.00 O ATOM 598 CB LYS A 42 -12.257 -8.661 9.476 1.00 0.00 C ATOM 599 CG LYS A 42 -12.089 -7.140 9.555 1.00 0.00 C ATOM 600 CD LYS A 42 -10.622 -6.711 9.503 1.00 0.00 C ATOM 601 CE LYS A 42 -9.826 -7.244 10.690 1.00 0.00 C ATOM 602 NZ LYS A 42 -8.395 -6.844 10.624 1.00 0.00 N ATOM 0 H LYS A 42 -10.562 -9.683 7.130 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.371 -10.354 8.157 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -13.138 -8.938 10.055 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -11.398 -9.125 9.961 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -12.630 -6.674 8.731 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -12.539 -6.775 10.478 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -10.173 -7.068 8.576 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -10.563 -5.623 9.487 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -10.264 -6.873 11.617 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -9.898 -8.331 10.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -7.889 -7.226 11.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -7.969 -7.219 9.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -8.324 -5.806 10.625 1.00 0.00 H new ATOM 616 N ASP A 43 -13.842 -8.955 6.112 1.00 0.00 N ATOM 617 CA ASP A 43 -15.124 -8.823 5.424 1.00 0.00 C ATOM 618 C ASP A 43 -15.530 -10.196 4.900 1.00 0.00 C ATOM 619 O ASP A 43 -15.697 -10.408 3.696 1.00 0.00 O ATOM 620 CB ASP A 43 -15.060 -7.797 4.280 1.00 0.00 C ATOM 621 CG ASP A 43 -16.449 -7.319 3.856 1.00 0.00 C ATOM 622 OD1 ASP A 43 -17.124 -8.011 3.065 1.00 0.00 O ATOM 623 OD2 ASP A 43 -16.875 -6.241 4.320 1.00 0.00 O ATOM 0 H ASP A 43 -13.041 -9.079 5.493 1.00 0.00 H new ATOM 0 HA ASP A 43 -15.869 -8.453 6.128 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -14.463 -6.941 4.595 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -14.553 -8.241 3.423 1.00 0.00 H new ATOM 628 N PHE A 44 -15.661 -11.140 5.829 1.00 0.00 N ATOM 629 CA PHE A 44 -16.033 -12.515 5.502 1.00 0.00 C ATOM 630 C PHE A 44 -17.408 -12.574 4.832 1.00 0.00 C ATOM 631 O PHE A 44 -17.805 -13.611 4.294 1.00 0.00 O ATOM 632 CB PHE A 44 -16.002 -13.391 6.766 1.00 0.00 C ATOM 633 CG PHE A 44 -16.773 -12.821 7.935 1.00 0.00 C ATOM 634 CD1 PHE A 44 -18.130 -13.075 8.088 1.00 0.00 C ATOM 635 CD2 PHE A 44 -16.136 -12.030 8.884 1.00 0.00 C ATOM 636 CE1 PHE A 44 -18.831 -12.553 9.158 1.00 0.00 C ATOM 637 CE2 PHE A 44 -16.835 -11.507 9.956 1.00 0.00 C ATOM 638 CZ PHE A 44 -18.183 -11.768 10.093 1.00 0.00 C ATOM 0 H PHE A 44 -15.513 -10.975 6.825 1.00 0.00 H new ATOM 0 HA PHE A 44 -15.304 -12.904 4.791 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -16.406 -14.374 6.523 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -14.965 -13.538 7.067 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -18.643 -13.688 7.362 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -15.081 -11.821 8.783 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -19.886 -12.758 9.264 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -16.326 -10.895 10.686 1.00 0.00 H new ATOM 0 HZ PHE A 44 -18.731 -11.360 10.929 1.00 0.00 H new ATOM 648 N ASP A 45 -18.125 -11.454 4.867 1.00 0.00 N ATOM 649 CA ASP A 45 -19.417 -11.342 4.202 1.00 0.00 C ATOM 650 C ASP A 45 -19.241 -11.381 2.683 1.00 0.00 C ATOM 651 O ASP A 45 -19.985 -12.074 1.987 1.00 0.00 O ATOM 652 CB ASP A 45 -20.127 -10.049 4.622 1.00 0.00 C ATOM 653 CG ASP A 45 -21.491 -9.893 3.965 1.00 0.00 C ATOM 654 OD1 ASP A 45 -22.430 -10.617 4.356 1.00 0.00 O ATOM 655 OD2 ASP A 45 -21.633 -9.034 3.068 1.00 0.00 O ATOM 0 H ASP A 45 -17.829 -10.607 5.352 1.00 0.00 H new ATOM 0 HA ASP A 45 -20.033 -12.189 4.503 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -20.246 -10.039 5.705 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -19.502 -9.194 4.362 1.00 0.00 H new ATOM 660 N TYR A 46 -18.236 -10.657 2.177 1.00 0.00 N ATOM 661 CA TYR A 46 -17.960 -10.626 0.737 1.00 0.00 C ATOM 662 C TYR A 46 -17.666 -12.033 0.226 1.00 0.00 C ATOM 663 O TYR A 46 -17.980 -12.366 -0.917 1.00 0.00 O ATOM 664 CB TYR A 46 -16.791 -9.679 0.412 1.00 0.00 C ATOM 665 CG TYR A 46 -16.555 -9.483 -1.077 1.00 0.00 C ATOM 666 CD1 TYR A 46 -17.524 -8.889 -1.878 1.00 0.00 C ATOM 667 CD2 TYR A 46 -15.365 -9.886 -1.680 1.00 0.00 C ATOM 668 CE1 TYR A 46 -17.317 -8.700 -3.230 1.00 0.00 C ATOM 669 CE2 TYR A 46 -15.152 -9.699 -3.033 1.00 0.00 C ATOM 670 CZ TYR A 46 -16.132 -9.108 -3.803 1.00 0.00 C ATOM 671 OH TYR A 46 -15.926 -8.920 -5.151 1.00 0.00 O ATOM 0 H TYR A 46 -17.604 -10.088 2.740 1.00 0.00 H new ATOM 0 HA TYR A 46 -18.847 -10.245 0.231 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -16.983 -8.709 0.871 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -15.881 -10.071 0.866 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -18.456 -8.570 -1.435 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -14.597 -10.352 -1.081 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -18.080 -8.234 -3.836 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -14.223 -10.014 -3.485 1.00 0.00 H new ATOM 0 HH TYR A 46 -16.323 -8.068 -5.427 1.00 0.00 H new ATOM 681 N ILE A 47 -17.063 -12.853 1.086 1.00 0.00 N ATOM 682 CA ILE A 47 -16.813 -14.258 0.772 1.00 0.00 C ATOM 683 C ILE A 47 -18.121 -14.944 0.395 1.00 0.00 C ATOM 684 O ILE A 47 -18.230 -15.575 -0.655 1.00 0.00 O ATOM 685 CB ILE A 47 -16.194 -15.010 1.975 1.00 0.00 C ATOM 686 CG1 ILE A 47 -14.918 -14.306 2.456 1.00 0.00 C ATOM 687 CG2 ILE A 47 -15.908 -16.469 1.611 1.00 0.00 C ATOM 688 CD1 ILE A 47 -13.784 -14.337 1.461 1.00 0.00 C ATOM 0 H ILE A 47 -16.738 -12.566 2.009 1.00 0.00 H new ATOM 0 HA ILE A 47 -16.110 -14.287 -0.060 1.00 0.00 H new ATOM 0 HB ILE A 47 -16.915 -15.000 2.793 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -15.155 -13.268 2.689 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.586 -14.773 3.383 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.473 -16.980 2.470 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.838 -16.962 1.328 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.209 -16.505 0.775 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -12.920 -13.819 1.877 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -13.517 -15.372 1.246 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.094 -13.843 0.540 1.00 0.00 H new ATOM 700 N VAL A 48 -19.113 -14.787 1.265 1.00 0.00 N ATOM 701 CA VAL A 48 -20.430 -15.376 1.061 1.00 0.00 C ATOM 702 C VAL A 48 -21.078 -14.794 -0.197 1.00 0.00 C ATOM 703 O VAL A 48 -21.711 -15.508 -0.976 1.00 0.00 O ATOM 704 CB VAL A 48 -21.348 -15.126 2.287 1.00 0.00 C ATOM 705 CG1 VAL A 48 -22.662 -15.887 2.151 1.00 0.00 C ATOM 706 CG2 VAL A 48 -20.634 -15.503 3.584 1.00 0.00 C ATOM 0 H VAL A 48 -19.027 -14.250 2.128 1.00 0.00 H new ATOM 0 HA VAL A 48 -20.304 -16.452 0.938 1.00 0.00 H new ATOM 0 HB VAL A 48 -21.579 -14.061 2.323 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -23.286 -15.694 3.023 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -23.183 -15.556 1.252 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -22.458 -16.955 2.080 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -21.296 -15.320 4.430 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -20.364 -16.559 3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.732 -14.900 3.691 1.00 0.00 H new ATOM 716 N GLU A 49 -20.887 -13.492 -0.398 1.00 0.00 N ATOM 717 CA GLU A 49 -21.433 -12.793 -1.559 1.00 0.00 C ATOM 718 C GLU A 49 -20.807 -13.291 -2.864 1.00 0.00 C ATOM 719 O GLU A 49 -21.440 -13.234 -3.921 1.00 0.00 O ATOM 720 CB GLU A 49 -21.217 -11.280 -1.419 1.00 0.00 C ATOM 721 CG GLU A 49 -22.027 -10.642 -0.293 1.00 0.00 C ATOM 722 CD GLU A 49 -23.528 -10.792 -0.492 1.00 0.00 C ATOM 723 OE1 GLU A 49 -24.028 -10.414 -1.574 1.00 0.00 O ATOM 724 OE2 GLU A 49 -24.217 -11.271 0.432 1.00 0.00 O ATOM 0 H GLU A 49 -20.353 -12.895 0.234 1.00 0.00 H new ATOM 0 HA GLU A 49 -22.502 -13.004 -1.598 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.158 -11.088 -1.245 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -21.478 -10.797 -2.360 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -21.743 -11.097 0.656 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -21.777 -9.583 -0.226 1.00 0.00 H new ATOM 731 N THR A 50 -19.567 -13.773 -2.789 1.00 0.00 N ATOM 732 CA THR A 50 -18.862 -14.276 -3.970 1.00 0.00 C ATOM 733 C THR A 50 -18.952 -15.796 -4.062 1.00 0.00 C ATOM 734 O THR A 50 -18.232 -16.424 -4.840 1.00 0.00 O ATOM 735 CB THR A 50 -17.376 -13.844 -3.971 1.00 0.00 C ATOM 736 OG1 THR A 50 -16.760 -14.166 -2.716 1.00 0.00 O ATOM 737 CG2 THR A 50 -17.242 -12.350 -4.238 1.00 0.00 C ATOM 0 H THR A 50 -19.029 -13.826 -1.924 1.00 0.00 H new ATOM 0 HA THR A 50 -19.352 -13.840 -4.840 1.00 0.00 H new ATOM 0 HB THR A 50 -16.871 -14.388 -4.769 1.00 0.00 H new ATOM 0 HG1 THR A 50 -17.086 -13.553 -2.025 1.00 0.00 H new ATOM 0 HG21 THR A 50 -16.188 -12.073 -4.233 1.00 0.00 H new ATOM 0 HG22 THR A 50 -17.675 -12.114 -5.210 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.767 -11.793 -3.462 1.00 0.00 H new ATOM 745 N THR A 51 -19.840 -16.388 -3.273 1.00 0.00 N ATOM 746 CA THR A 51 -20.058 -17.824 -3.320 1.00 0.00 C ATOM 747 C THR A 51 -21.120 -18.162 -4.371 1.00 0.00 C ATOM 748 O THR A 51 -21.986 -17.338 -4.672 1.00 0.00 O ATOM 749 CB THR A 51 -20.496 -18.369 -1.944 1.00 0.00 C ATOM 750 OG1 THR A 51 -19.555 -17.963 -0.942 1.00 0.00 O ATOM 751 CG2 THR A 51 -20.591 -19.892 -1.962 1.00 0.00 C ATOM 0 H THR A 51 -20.419 -15.894 -2.594 1.00 0.00 H new ATOM 0 HA THR A 51 -19.114 -18.297 -3.591 1.00 0.00 H new ATOM 0 HB THR A 51 -21.481 -17.963 -1.715 1.00 0.00 H new ATOM 0 HG1 THR A 51 -19.483 -18.662 -0.259 1.00 0.00 H new ATOM 0 HG21 THR A 51 -20.901 -20.249 -0.980 1.00 0.00 H new ATOM 0 HG22 THR A 51 -21.322 -20.202 -2.709 1.00 0.00 H new ATOM 0 HG23 THR A 51 -19.617 -20.314 -2.210 1.00 0.00 H new ATOM 759 N ASP A 52 -21.030 -19.368 -4.932 1.00 0.00 N ATOM 760 CA ASP A 52 -21.993 -19.853 -5.924 1.00 0.00 C ATOM 761 C ASP A 52 -23.421 -19.659 -5.409 1.00 0.00 C ATOM 762 O ASP A 52 -23.698 -19.951 -4.244 1.00 0.00 O ATOM 763 CB ASP A 52 -21.741 -21.343 -6.198 1.00 0.00 C ATOM 764 CG ASP A 52 -22.443 -21.865 -7.445 1.00 0.00 C ATOM 765 OD1 ASP A 52 -23.681 -22.029 -7.416 1.00 0.00 O ATOM 766 OD2 ASP A 52 -21.753 -22.125 -8.454 1.00 0.00 O ATOM 0 H ASP A 52 -20.290 -20.035 -4.713 1.00 0.00 H new ATOM 0 HA ASP A 52 -21.869 -19.287 -6.847 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -20.668 -21.508 -6.300 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -22.072 -21.923 -5.336 1.00 0.00 H new ATOM 771 N PRO A 53 -24.346 -19.173 -6.263 1.00 0.00 N ATOM 772 CA PRO A 53 -25.743 -18.922 -5.869 1.00 0.00 C ATOM 773 C PRO A 53 -26.388 -20.139 -5.196 1.00 0.00 C ATOM 774 O PRO A 53 -27.343 -20.003 -4.426 1.00 0.00 O ATOM 775 CB PRO A 53 -26.450 -18.585 -7.200 1.00 0.00 C ATOM 776 CG PRO A 53 -25.483 -18.970 -8.276 1.00 0.00 C ATOM 777 CD PRO A 53 -24.114 -18.826 -7.673 1.00 0.00 C ATOM 0 HA PRO A 53 -25.818 -18.124 -5.130 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -27.385 -19.136 -7.298 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -26.697 -17.525 -7.256 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -25.657 -19.993 -8.609 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -25.594 -18.327 -9.149 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -23.392 -19.495 -8.142 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -23.727 -17.813 -7.783 1.00 0.00 H new ATOM 785 N GLU A 54 -25.858 -21.322 -5.494 1.00 0.00 N ATOM 786 CA GLU A 54 -26.335 -22.563 -4.890 1.00 0.00 C ATOM 787 C GLU A 54 -25.572 -22.864 -3.598 1.00 0.00 C ATOM 788 O GLU A 54 -26.169 -23.199 -2.573 1.00 0.00 O ATOM 789 CB GLU A 54 -26.176 -23.718 -5.887 1.00 0.00 C ATOM 790 CG GLU A 54 -26.999 -23.537 -7.159 1.00 0.00 C ATOM 791 CD GLU A 54 -26.736 -24.609 -8.203 1.00 0.00 C ATOM 792 OE1 GLU A 54 -26.857 -25.810 -7.880 1.00 0.00 O ATOM 793 OE2 GLU A 54 -26.417 -24.257 -9.359 1.00 0.00 O ATOM 0 H GLU A 54 -25.092 -21.448 -6.156 1.00 0.00 H new ATOM 0 HA GLU A 54 -27.390 -22.450 -4.641 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -25.124 -23.815 -6.154 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -26.469 -24.649 -5.403 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -28.058 -23.542 -6.902 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -26.780 -22.560 -7.589 1.00 0.00 H new ATOM 800 N ARG A 55 -24.249 -22.718 -3.648 1.00 0.00 N ATOM 801 CA ARG A 55 -23.389 -23.041 -2.505 1.00 0.00 C ATOM 802 C ARG A 55 -23.574 -22.040 -1.367 1.00 0.00 C ATOM 803 O ARG A 55 -23.288 -22.350 -0.213 1.00 0.00 O ATOM 804 CB ARG A 55 -21.913 -23.054 -2.922 1.00 0.00 C ATOM 805 CG ARG A 55 -21.556 -24.101 -3.971 1.00 0.00 C ATOM 806 CD ARG A 55 -21.681 -25.527 -3.445 1.00 0.00 C ATOM 807 NE ARG A 55 -21.163 -26.498 -4.413 1.00 0.00 N ATOM 808 CZ ARG A 55 -20.687 -27.704 -4.096 1.00 0.00 C ATOM 809 NH1 ARG A 55 -20.685 -28.117 -2.835 1.00 0.00 N ATOM 810 NH2 ARG A 55 -20.199 -28.490 -5.048 1.00 0.00 N ATOM 0 H ARG A 55 -23.746 -22.378 -4.468 1.00 0.00 H new ATOM 0 HA ARG A 55 -23.680 -24.032 -2.156 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.650 -22.069 -3.307 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -21.301 -23.224 -2.036 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -22.207 -23.979 -4.837 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -20.535 -23.933 -4.314 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -21.135 -25.620 -2.506 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -22.727 -25.747 -3.229 1.00 0.00 H new ATOM 0 HE ARG A 55 -21.167 -26.234 -5.398 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -21.049 -27.511 -2.099 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -20.319 -29.040 -2.601 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -20.189 -28.171 -6.017 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -19.834 -29.412 -4.811 1.00 0.00 H new ATOM 824 N ARG A 56 -24.052 -20.840 -1.695 1.00 0.00 N ATOM 825 CA ARG A 56 -24.167 -19.764 -0.709 1.00 0.00 C ATOM 826 C ARG A 56 -25.140 -20.142 0.407 1.00 0.00 C ATOM 827 O ARG A 56 -25.040 -19.639 1.529 1.00 0.00 O ATOM 828 CB ARG A 56 -24.611 -18.452 -1.374 1.00 0.00 C ATOM 829 CG ARG A 56 -24.444 -17.238 -0.462 1.00 0.00 C ATOM 830 CD ARG A 56 -24.852 -15.933 -1.135 1.00 0.00 C ATOM 831 NE ARG A 56 -26.307 -15.790 -1.245 1.00 0.00 N ATOM 832 CZ ARG A 56 -26.948 -14.620 -1.184 1.00 0.00 C ATOM 833 NH1 ARG A 56 -26.268 -13.493 -0.993 1.00 0.00 N ATOM 834 NH2 ARG A 56 -28.270 -14.580 -1.296 1.00 0.00 N ATOM 0 H ARG A 56 -24.365 -20.588 -2.633 1.00 0.00 H new ATOM 0 HA ARG A 56 -23.180 -19.614 -0.271 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -24.033 -18.298 -2.285 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -25.656 -18.536 -1.671 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -25.043 -17.380 0.438 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -23.404 -17.168 -0.145 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -24.449 -15.094 -0.568 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -24.409 -15.887 -2.130 1.00 0.00 H new ATOM 0 HE ARG A 56 -26.863 -16.635 -1.376 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -25.253 -13.520 -0.893 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -26.761 -12.601 -0.947 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -28.797 -15.443 -1.429 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -28.759 -13.686 -1.249 1.00 0.00 H new ATOM 848 N ASP A 57 -26.070 -21.041 0.101 1.00 0.00 N ATOM 849 CA ASP A 57 -27.052 -21.495 1.085 1.00 0.00 C ATOM 850 C ASP A 57 -26.377 -22.376 2.135 1.00 0.00 C ATOM 851 O ASP A 57 -26.922 -22.622 3.210 1.00 0.00 O ATOM 852 CB ASP A 57 -28.188 -22.261 0.397 1.00 0.00 C ATOM 853 CG ASP A 57 -29.354 -22.535 1.335 1.00 0.00 C ATOM 854 OD1 ASP A 57 -30.222 -21.648 1.479 1.00 0.00 O ATOM 855 OD2 ASP A 57 -29.411 -23.632 1.934 1.00 0.00 O ATOM 0 H ASP A 57 -26.166 -21.470 -0.819 1.00 0.00 H new ATOM 0 HA ASP A 57 -27.477 -20.622 1.580 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -28.542 -21.688 -0.460 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -27.805 -23.206 0.013 1.00 0.00 H new ATOM 860 N LEU A 58 -25.178 -22.841 1.805 1.00 0.00 N ATOM 861 CA LEU A 58 -24.385 -23.676 2.703 1.00 0.00 C ATOM 862 C LEU A 58 -23.332 -22.830 3.422 1.00 0.00 C ATOM 863 O LEU A 58 -22.481 -23.352 4.146 1.00 0.00 O ATOM 864 CB LEU A 58 -23.715 -24.800 1.897 1.00 0.00 C ATOM 865 CG LEU A 58 -24.682 -25.671 1.072 1.00 0.00 C ATOM 866 CD1 LEU A 58 -23.915 -26.645 0.182 1.00 0.00 C ATOM 867 CD2 LEU A 58 -25.650 -26.423 1.986 1.00 0.00 C ATOM 0 H LEU A 58 -24.728 -22.651 0.910 1.00 0.00 H new ATOM 0 HA LEU A 58 -25.038 -24.118 3.455 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.983 -24.357 1.222 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -23.166 -25.443 2.585 1.00 0.00 H new ATOM 0 HG LEU A 58 -25.263 -25.010 0.429 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -24.620 -27.248 -0.390 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.277 -26.087 -0.503 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -23.300 -27.297 0.802 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -26.323 -27.031 1.382 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -25.087 -27.067 2.661 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -26.231 -25.708 2.568 1.00 0.00 H new ATOM 879 N PHE A 59 -23.404 -21.517 3.216 1.00 0.00 N ATOM 880 CA PHE A 59 -22.456 -20.573 3.803 1.00 0.00 C ATOM 881 C PHE A 59 -23.108 -19.770 4.924 1.00 0.00 C ATOM 882 O PHE A 59 -24.153 -19.144 4.729 1.00 0.00 O ATOM 883 CB PHE A 59 -21.917 -19.618 2.724 1.00 0.00 C ATOM 884 CG PHE A 59 -20.642 -20.087 2.067 1.00 0.00 C ATOM 885 CD1 PHE A 59 -20.551 -21.351 1.499 1.00 0.00 C ATOM 886 CD2 PHE A 59 -19.534 -19.255 2.018 1.00 0.00 C ATOM 887 CE1 PHE A 59 -19.378 -21.772 0.900 1.00 0.00 C ATOM 888 CE2 PHE A 59 -18.362 -19.669 1.420 1.00 0.00 C ATOM 889 CZ PHE A 59 -18.282 -20.930 0.861 1.00 0.00 C ATOM 0 H PHE A 59 -24.120 -21.078 2.638 1.00 0.00 H new ATOM 0 HA PHE A 59 -21.628 -21.144 4.223 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -22.680 -19.485 1.957 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -21.743 -18.640 3.173 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -21.405 -22.012 1.525 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -19.589 -18.269 2.454 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -19.318 -22.758 0.463 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -17.508 -19.008 1.389 1.00 0.00 H new ATOM 0 HZ PHE A 59 -17.365 -21.257 0.394 1.00 0.00 H new ATOM 899 N ASP A 60 -22.480 -19.788 6.094 1.00 0.00 N ATOM 900 CA ASP A 60 -22.919 -18.981 7.229 1.00 0.00 C ATOM 901 C ASP A 60 -21.808 -18.025 7.637 1.00 0.00 C ATOM 902 O ASP A 60 -20.645 -18.424 7.740 1.00 0.00 O ATOM 903 CB ASP A 60 -23.311 -19.861 8.424 1.00 0.00 C ATOM 904 CG ASP A 60 -24.549 -20.703 8.159 1.00 0.00 C ATOM 905 OD1 ASP A 60 -25.673 -20.160 8.233 1.00 0.00 O ATOM 906 OD2 ASP A 60 -24.407 -21.915 7.900 1.00 0.00 O ATOM 0 H ASP A 60 -21.656 -20.359 6.283 1.00 0.00 H new ATOM 0 HA ASP A 60 -23.800 -18.416 6.923 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -22.478 -20.518 8.674 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -23.488 -19.227 9.293 1.00 0.00 H new ATOM 911 N HIS A 61 -22.172 -16.771 7.880 1.00 0.00 N ATOM 912 CA HIS A 61 -21.208 -15.734 8.243 1.00 0.00 C ATOM 913 C HIS A 61 -20.395 -16.152 9.467 1.00 0.00 C ATOM 914 O HIS A 61 -19.198 -15.878 9.552 1.00 0.00 O ATOM 915 CB HIS A 61 -21.927 -14.409 8.520 1.00 0.00 C ATOM 916 CG HIS A 61 -22.700 -13.884 7.349 1.00 0.00 C ATOM 917 ND1 HIS A 61 -24.076 -13.855 7.310 1.00 0.00 N ATOM 918 CD2 HIS A 61 -22.283 -13.363 6.171 1.00 0.00 C ATOM 919 CE1 HIS A 61 -24.471 -13.341 6.161 1.00 0.00 C ATOM 920 NE2 HIS A 61 -23.403 -13.032 5.451 1.00 0.00 N ATOM 0 H HIS A 61 -23.137 -16.444 7.832 1.00 0.00 H new ATOM 0 HA HIS A 61 -20.526 -15.598 7.404 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -22.607 -14.544 9.361 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -21.191 -13.663 8.822 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -21.258 -13.232 5.856 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -25.496 -13.197 5.853 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -23.409 -12.616 4.520 1.00 0.00 H new ATOM 929 N ASP A 62 -21.056 -16.831 10.402 1.00 0.00 N ATOM 930 CA ASP A 62 -20.411 -17.301 11.632 1.00 0.00 C ATOM 931 C ASP A 62 -19.302 -18.300 11.321 1.00 0.00 C ATOM 932 O ASP A 62 -18.227 -18.262 11.926 1.00 0.00 O ATOM 933 CB ASP A 62 -21.443 -17.944 12.570 1.00 0.00 C ATOM 934 CG ASP A 62 -22.487 -16.950 13.056 1.00 0.00 C ATOM 935 OD1 ASP A 62 -23.513 -16.769 12.365 1.00 0.00 O ATOM 936 OD2 ASP A 62 -22.282 -16.335 14.122 1.00 0.00 O ATOM 0 H ASP A 62 -22.045 -17.071 10.333 1.00 0.00 H new ATOM 0 HA ASP A 62 -19.970 -16.436 12.128 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -21.940 -18.764 12.051 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -20.929 -18.376 13.429 1.00 0.00 H new ATOM 941 N VAL A 63 -19.563 -19.186 10.365 1.00 0.00 N ATOM 942 CA VAL A 63 -18.589 -20.197 9.972 1.00 0.00 C ATOM 943 C VAL A 63 -17.397 -19.538 9.281 1.00 0.00 C ATOM 944 O VAL A 63 -16.237 -19.843 9.585 1.00 0.00 O ATOM 945 CB VAL A 63 -19.213 -21.259 9.032 1.00 0.00 C ATOM 946 CG1 VAL A 63 -18.184 -22.327 8.667 1.00 0.00 C ATOM 947 CG2 VAL A 63 -20.449 -21.890 9.672 1.00 0.00 C ATOM 0 H VAL A 63 -20.442 -19.224 9.848 1.00 0.00 H new ATOM 0 HA VAL A 63 -18.256 -20.702 10.879 1.00 0.00 H new ATOM 0 HB VAL A 63 -19.525 -20.761 8.114 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -18.642 -23.063 8.006 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -17.339 -21.860 8.160 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -17.835 -22.821 9.574 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -20.871 -22.632 8.994 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -20.168 -22.372 10.609 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -21.191 -21.117 9.870 1.00 0.00 H new ATOM 957 N ASN A 64 -17.694 -18.625 8.359 1.00 0.00 N ATOM 958 CA ASN A 64 -16.662 -17.868 7.655 1.00 0.00 C ATOM 959 C ASN A 64 -15.842 -17.044 8.645 1.00 0.00 C ATOM 960 O ASN A 64 -14.630 -16.878 8.479 1.00 0.00 O ATOM 961 CB ASN A 64 -17.289 -16.947 6.597 1.00 0.00 C ATOM 962 CG ASN A 64 -17.960 -17.711 5.466 1.00 0.00 C ATOM 963 OD1 ASN A 64 -18.481 -18.809 5.659 1.00 0.00 O ATOM 964 ND2 ASN A 64 -17.954 -17.128 4.277 1.00 0.00 N ATOM 0 H ASN A 64 -18.647 -18.391 8.081 1.00 0.00 H new ATOM 0 HA ASN A 64 -16.004 -18.576 7.151 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -18.023 -16.299 7.076 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -16.516 -16.300 6.182 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -18.392 -17.590 3.480 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -17.511 -16.217 4.158 1.00 0.00 H new ATOM 971 N ARG A 65 -16.513 -16.537 9.680 1.00 0.00 N ATOM 972 CA ARG A 65 -15.844 -15.784 10.735 1.00 0.00 C ATOM 973 C ARG A 65 -14.824 -16.680 11.425 1.00 0.00 C ATOM 974 O ARG A 65 -13.635 -16.379 11.447 1.00 0.00 O ATOM 975 CB ARG A 65 -16.865 -15.273 11.766 1.00 0.00 C ATOM 976 CG ARG A 65 -16.294 -14.282 12.780 1.00 0.00 C ATOM 977 CD ARG A 65 -17.211 -14.117 13.992 1.00 0.00 C ATOM 978 NE ARG A 65 -17.117 -15.263 14.902 1.00 0.00 N ATOM 979 CZ ARG A 65 -18.022 -15.577 15.830 1.00 0.00 C ATOM 980 NH1 ARG A 65 -19.156 -14.897 15.931 1.00 0.00 N ATOM 981 NH2 ARG A 65 -17.798 -16.592 16.653 1.00 0.00 N ATOM 0 H ARG A 65 -17.520 -16.636 9.808 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.341 -14.925 10.290 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.691 -14.798 11.237 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -17.279 -16.126 12.303 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -15.313 -14.625 13.110 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -16.149 -13.314 12.300 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -16.947 -13.205 14.527 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -18.242 -14.002 13.656 1.00 0.00 H new ATOM 0 HE ARG A 65 -16.298 -15.865 14.819 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -19.345 -14.123 15.294 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -19.839 -15.148 16.645 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -16.935 -17.131 16.576 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -18.488 -16.834 17.364 1.00 0.00 H new ATOM 995 N ALA A 66 -15.304 -17.813 11.933 1.00 0.00 N ATOM 996 CA ALA A 66 -14.463 -18.761 12.659 1.00 0.00 C ATOM 997 C ALA A 66 -13.229 -19.141 11.845 1.00 0.00 C ATOM 998 O ALA A 66 -12.127 -19.260 12.385 1.00 0.00 O ATOM 999 CB ALA A 66 -15.271 -20.003 13.014 1.00 0.00 C ATOM 0 H ALA A 66 -16.280 -18.098 11.854 1.00 0.00 H new ATOM 0 HA ALA A 66 -14.120 -18.283 13.577 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -14.638 -20.706 13.555 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -16.117 -19.720 13.640 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -15.637 -20.473 12.101 1.00 0.00 H new ATOM 1005 N TRP A 67 -13.427 -19.303 10.541 1.00 0.00 N ATOM 1006 CA TRP A 67 -12.355 -19.692 9.630 1.00 0.00 C ATOM 1007 C TRP A 67 -11.214 -18.675 9.670 1.00 0.00 C ATOM 1008 O TRP A 67 -10.056 -19.038 9.886 1.00 0.00 O ATOM 1009 CB TRP A 67 -12.907 -19.825 8.201 1.00 0.00 C ATOM 1010 CG TRP A 67 -11.918 -20.371 7.211 1.00 0.00 C ATOM 1011 CD1 TRP A 67 -10.992 -19.665 6.497 1.00 0.00 C ATOM 1012 CD2 TRP A 67 -11.763 -21.742 6.823 1.00 0.00 C ATOM 1013 NE1 TRP A 67 -10.270 -20.512 5.694 1.00 0.00 N ATOM 1014 CE2 TRP A 67 -10.723 -21.792 5.876 1.00 0.00 C ATOM 1015 CE3 TRP A 67 -12.401 -22.932 7.187 1.00 0.00 C ATOM 1016 CZ2 TRP A 67 -10.308 -22.985 5.288 1.00 0.00 C ATOM 1017 CZ3 TRP A 67 -11.989 -24.115 6.603 1.00 0.00 C ATOM 1018 CH2 TRP A 67 -10.950 -24.135 5.663 1.00 0.00 C ATOM 0 H TRP A 67 -14.330 -19.169 10.087 1.00 0.00 H new ATOM 0 HA TRP A 67 -11.959 -20.656 9.948 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.782 -20.474 8.220 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -13.244 -18.846 7.860 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -10.849 -18.596 6.556 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -9.518 -20.234 5.064 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -13.202 -22.927 7.912 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -9.508 -23.002 4.562 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -12.476 -25.040 6.876 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -10.650 -25.076 5.226 1.00 0.00 H new ATOM 1029 N MET A 68 -11.548 -17.401 9.474 1.00 0.00 N ATOM 1030 CA MET A 68 -10.539 -16.342 9.463 1.00 0.00 C ATOM 1031 C MET A 68 -9.982 -16.093 10.866 1.00 0.00 C ATOM 1032 O MET A 68 -8.830 -15.682 11.018 1.00 0.00 O ATOM 1033 CB MET A 68 -11.108 -15.034 8.889 1.00 0.00 C ATOM 1034 CG MET A 68 -12.262 -14.444 9.692 1.00 0.00 C ATOM 1035 SD MET A 68 -12.548 -12.705 9.318 1.00 0.00 S ATOM 1036 CE MET A 68 -11.001 -11.999 9.886 1.00 0.00 C ATOM 0 H MET A 68 -12.503 -17.077 9.321 1.00 0.00 H new ATOM 0 HA MET A 68 -9.727 -16.680 8.819 1.00 0.00 H new ATOM 0 HB2 MET A 68 -10.307 -14.297 8.832 1.00 0.00 H new ATOM 0 HB3 MET A 68 -11.447 -15.216 7.869 1.00 0.00 H new ATOM 0 HG2 MET A 68 -13.170 -15.010 9.486 1.00 0.00 H new ATOM 0 HG3 MET A 68 -12.053 -14.553 10.756 1.00 0.00 H new ATOM 0 HE1 MET A 68 -11.191 -11.339 10.732 1.00 0.00 H new ATOM 0 HE2 MET A 68 -10.327 -12.799 10.194 1.00 0.00 H new ATOM 0 HE3 MET A 68 -10.542 -11.430 9.078 1.00 0.00 H new ATOM 1046 N GLU A 69 -10.794 -16.351 11.889 1.00 0.00 N ATOM 1047 CA GLU A 69 -10.373 -16.127 13.272 1.00 0.00 C ATOM 1048 C GLU A 69 -9.230 -17.061 13.649 1.00 0.00 C ATOM 1049 O GLU A 69 -8.314 -16.673 14.378 1.00 0.00 O ATOM 1050 CB GLU A 69 -11.537 -16.326 14.249 1.00 0.00 C ATOM 1051 CG GLU A 69 -12.680 -15.342 14.057 1.00 0.00 C ATOM 1052 CD GLU A 69 -13.725 -15.447 15.153 1.00 0.00 C ATOM 1053 OE1 GLU A 69 -14.543 -16.388 15.111 1.00 0.00 O ATOM 1054 OE2 GLU A 69 -13.729 -14.593 16.066 1.00 0.00 O ATOM 0 H GLU A 69 -11.742 -16.713 11.789 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.031 -15.094 13.342 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.922 -17.340 14.138 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.162 -16.237 15.268 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.282 -14.327 14.034 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.152 -15.521 13.091 1.00 0.00 H new ATOM 1061 N GLU A 70 -9.290 -18.292 13.156 1.00 0.00 N ATOM 1062 CA GLU A 70 -8.272 -19.289 13.468 1.00 0.00 C ATOM 1063 C GLU A 70 -7.214 -19.359 12.368 1.00 0.00 C ATOM 1064 O GLU A 70 -6.319 -20.204 12.417 1.00 0.00 O ATOM 1065 CB GLU A 70 -8.915 -20.668 13.669 1.00 0.00 C ATOM 1066 CG GLU A 70 -9.549 -21.255 12.411 1.00 0.00 C ATOM 1067 CD GLU A 70 -10.066 -22.669 12.624 1.00 0.00 C ATOM 1068 OE1 GLU A 70 -9.237 -23.599 12.739 1.00 0.00 O ATOM 1069 OE2 GLU A 70 -11.299 -22.860 12.694 1.00 0.00 O ATOM 0 H GLU A 70 -10.032 -18.624 12.539 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.782 -18.988 14.394 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -8.157 -21.359 14.036 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -9.678 -20.591 14.444 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.371 -20.616 12.090 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.815 -21.258 11.605 1.00 0.00 H new ATOM 1076 N SER A 71 -7.311 -18.473 11.379 1.00 0.00 N ATOM 1077 CA SER A 71 -6.361 -18.471 10.265 1.00 0.00 C ATOM 1078 C SER A 71 -5.882 -17.055 9.935 1.00 0.00 C ATOM 1079 O SER A 71 -6.616 -16.266 9.338 1.00 0.00 O ATOM 1080 CB SER A 71 -7.006 -19.108 9.027 1.00 0.00 C ATOM 1081 OG SER A 71 -7.546 -20.383 9.333 1.00 0.00 O ATOM 0 H SER A 71 -8.031 -17.752 11.324 1.00 0.00 H new ATOM 0 HA SER A 71 -5.492 -19.056 10.566 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.794 -18.457 8.648 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.263 -19.204 8.235 1.00 0.00 H new ATOM 0 HG SER A 71 -8.487 -20.287 9.591 1.00 0.00 H new ATOM 1087 N ASP A 72 -4.653 -16.734 10.340 1.00 0.00 N ATOM 1088 CA ASP A 72 -4.028 -15.464 9.968 1.00 0.00 C ATOM 1089 C ASP A 72 -3.542 -15.531 8.524 1.00 0.00 C ATOM 1090 O ASP A 72 -2.476 -16.083 8.252 1.00 0.00 O ATOM 1091 CB ASP A 72 -2.838 -15.131 10.887 1.00 0.00 C ATOM 1092 CG ASP A 72 -3.248 -14.739 12.296 1.00 0.00 C ATOM 1093 OD1 ASP A 72 -3.625 -13.564 12.507 1.00 0.00 O ATOM 1094 OD2 ASP A 72 -3.160 -15.588 13.209 1.00 0.00 O ATOM 0 H ASP A 72 -4.071 -17.334 10.925 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.777 -14.680 10.076 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -2.176 -15.995 10.938 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.265 -14.316 10.444 1.00 0.00 H new ATOM 1099 N PHE A 73 -4.330 -14.996 7.601 1.00 0.00 N ATOM 1100 CA PHE A 73 -3.979 -15.022 6.183 1.00 0.00 C ATOM 1101 C PHE A 73 -2.751 -14.151 5.922 1.00 0.00 C ATOM 1102 O PHE A 73 -2.792 -12.929 6.086 1.00 0.00 O ATOM 1103 CB PHE A 73 -5.174 -14.577 5.333 1.00 0.00 C ATOM 1104 CG PHE A 73 -6.333 -15.538 5.414 1.00 0.00 C ATOM 1105 CD1 PHE A 73 -6.416 -16.618 4.546 1.00 0.00 C ATOM 1106 CD2 PHE A 73 -7.327 -15.376 6.369 1.00 0.00 C ATOM 1107 CE1 PHE A 73 -7.466 -17.511 4.625 1.00 0.00 C ATOM 1108 CE2 PHE A 73 -8.377 -16.269 6.452 1.00 0.00 C ATOM 1109 CZ PHE A 73 -8.447 -17.336 5.579 1.00 0.00 C ATOM 0 H PHE A 73 -5.218 -14.538 7.807 1.00 0.00 H new ATOM 0 HA PHE A 73 -3.727 -16.044 5.898 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.501 -13.590 5.661 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.860 -14.479 4.294 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.649 -16.762 3.799 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -7.279 -14.543 7.054 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.519 -18.345 3.941 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -9.144 -16.133 7.200 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.269 -18.033 5.643 1.00 0.00 H new ATOM 1119 N LEU A 74 -1.662 -14.800 5.514 1.00 0.00 N ATOM 1120 CA LEU A 74 -0.359 -14.152 5.388 1.00 0.00 C ATOM 1121 C LEU A 74 -0.027 -13.819 3.934 1.00 0.00 C ATOM 1122 O LEU A 74 0.375 -12.696 3.622 1.00 0.00 O ATOM 1123 CB LEU A 74 0.730 -15.070 5.967 1.00 0.00 C ATOM 1124 CG LEU A 74 0.580 -15.416 7.460 1.00 0.00 C ATOM 1125 CD1 LEU A 74 1.623 -16.444 7.892 1.00 0.00 C ATOM 1126 CD2 LEU A 74 0.677 -14.159 8.319 1.00 0.00 C ATOM 0 H LEU A 74 -1.658 -15.788 5.262 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.397 -13.215 5.944 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.740 -15.998 5.396 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.699 -14.594 5.818 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.407 -15.855 7.604 1.00 0.00 H new ATOM 0 HD11 LEU A 74 1.494 -16.670 8.950 1.00 0.00 H new ATOM 0 HD12 LEU A 74 1.498 -17.356 7.308 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.622 -16.041 7.726 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.568 -14.427 9.370 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.647 -13.686 8.164 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.115 -13.464 8.038 1.00 0.00 H new ATOM 1138 N GLU A 75 -0.189 -14.797 3.048 1.00 0.00 N ATOM 1139 CA GLU A 75 0.214 -14.641 1.652 1.00 0.00 C ATOM 1140 C GLU A 75 -0.609 -15.539 0.731 1.00 0.00 C ATOM 1141 O GLU A 75 -1.104 -16.589 1.148 1.00 0.00 O ATOM 1142 CB GLU A 75 1.708 -14.974 1.498 1.00 0.00 C ATOM 1143 CG GLU A 75 2.234 -14.844 0.070 1.00 0.00 C ATOM 1144 CD GLU A 75 2.239 -13.407 -0.432 1.00 0.00 C ATOM 1145 OE1 GLU A 75 1.156 -12.877 -0.763 1.00 0.00 O ATOM 1146 OE2 GLU A 75 3.329 -12.799 -0.491 1.00 0.00 O ATOM 0 H GLU A 75 -0.596 -15.705 3.270 1.00 0.00 H new ATOM 0 HA GLU A 75 0.036 -13.605 1.365 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.285 -14.315 2.147 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.879 -15.993 1.845 1.00 0.00 H new ATOM 0 HG2 GLU A 75 3.247 -15.243 0.024 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.621 -15.453 -0.594 1.00 0.00 H new ATOM 1153 N LEU A 76 -0.735 -15.120 -0.525 1.00 0.00 N ATOM 1154 CA LEU A 76 -1.400 -15.913 -1.551 1.00 0.00 C ATOM 1155 C LEU A 76 -0.432 -16.171 -2.704 1.00 0.00 C ATOM 1156 O LEU A 76 0.245 -15.254 -3.174 1.00 0.00 O ATOM 1157 CB LEU A 76 -2.654 -15.195 -2.067 1.00 0.00 C ATOM 1158 CG LEU A 76 -3.483 -15.989 -3.092 1.00 0.00 C ATOM 1159 CD1 LEU A 76 -4.047 -17.261 -2.464 1.00 0.00 C ATOM 1160 CD2 LEU A 76 -4.604 -15.129 -3.668 1.00 0.00 C ATOM 0 H LEU A 76 -0.380 -14.224 -0.858 1.00 0.00 H new ATOM 0 HA LEU A 76 -1.707 -16.863 -1.115 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.291 -14.952 -1.217 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.353 -14.250 -2.519 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.822 -16.277 -3.910 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -4.629 -17.806 -3.207 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.227 -17.888 -2.114 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -4.688 -16.998 -1.622 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.176 -15.712 -4.390 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.262 -14.802 -2.863 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.176 -14.257 -4.163 1.00 0.00 H new ATOM 1172 N ARG A 77 -0.384 -17.415 -3.164 1.00 0.00 N ATOM 1173 CA ARG A 77 0.541 -17.827 -4.209 1.00 0.00 C ATOM 1174 C ARG A 77 -0.227 -18.517 -5.332 1.00 0.00 C ATOM 1175 O ARG A 77 -0.606 -19.684 -5.222 1.00 0.00 O ATOM 1176 CB ARG A 77 1.626 -18.748 -3.626 1.00 0.00 C ATOM 1177 CG ARG A 77 2.547 -19.371 -4.672 1.00 0.00 C ATOM 1178 CD ARG A 77 3.737 -20.073 -4.027 1.00 0.00 C ATOM 1179 NE ARG A 77 4.724 -19.120 -3.511 1.00 0.00 N ATOM 1180 CZ ARG A 77 5.805 -19.464 -2.810 1.00 0.00 C ATOM 1181 NH1 ARG A 77 5.970 -20.713 -2.392 1.00 0.00 N ATOM 1182 NH2 ARG A 77 6.709 -18.551 -2.493 1.00 0.00 N ATOM 0 H ARG A 77 -0.985 -18.165 -2.823 1.00 0.00 H new ATOM 0 HA ARG A 77 1.037 -16.949 -4.622 1.00 0.00 H new ATOM 0 HB2 ARG A 77 2.230 -18.178 -2.920 1.00 0.00 H new ATOM 0 HB3 ARG A 77 1.144 -19.546 -3.061 1.00 0.00 H new ATOM 0 HG2 ARG A 77 1.985 -20.086 -5.273 1.00 0.00 H new ATOM 0 HG3 ARG A 77 2.905 -18.596 -5.350 1.00 0.00 H new ATOM 0 HD2 ARG A 77 3.386 -20.707 -3.213 1.00 0.00 H new ATOM 0 HD3 ARG A 77 4.212 -20.727 -4.758 1.00 0.00 H new ATOM 0 HE ARG A 77 4.574 -18.129 -3.700 1.00 0.00 H new ATOM 0 HH11 ARG A 77 5.266 -21.420 -2.606 1.00 0.00 H new ATOM 0 HH12 ARG A 77 6.800 -20.966 -1.856 1.00 0.00 H new ATOM 0 HH21 ARG A 77 6.580 -17.582 -2.785 1.00 0.00 H new ATOM 0 HH22 ARG A 77 7.535 -18.816 -1.957 1.00 0.00 H new ATOM 1196 N VAL A 78 -0.485 -17.765 -6.390 1.00 0.00 N ATOM 1197 CA VAL A 78 -1.243 -18.251 -7.535 1.00 0.00 C ATOM 1198 C VAL A 78 -0.373 -19.151 -8.411 1.00 0.00 C ATOM 1199 O VAL A 78 0.805 -18.858 -8.631 1.00 0.00 O ATOM 1200 CB VAL A 78 -1.769 -17.062 -8.371 1.00 0.00 C ATOM 1201 CG1 VAL A 78 -2.569 -17.541 -9.584 1.00 0.00 C ATOM 1202 CG2 VAL A 78 -2.598 -16.117 -7.500 1.00 0.00 C ATOM 0 H VAL A 78 -0.174 -16.798 -6.480 1.00 0.00 H new ATOM 0 HA VAL A 78 -2.089 -18.831 -7.165 1.00 0.00 H new ATOM 0 HB VAL A 78 -0.908 -16.510 -8.748 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.924 -16.679 -10.149 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -1.932 -18.155 -10.220 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.422 -18.130 -9.248 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -2.959 -15.286 -8.106 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.447 -16.658 -7.082 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.979 -15.732 -6.690 1.00 0.00 H new ATOM 1212 N LEU A 79 -0.949 -20.244 -8.906 1.00 0.00 N ATOM 1213 CA LEU A 79 -0.206 -21.200 -9.723 1.00 0.00 C ATOM 1214 C LEU A 79 -0.683 -21.161 -11.176 1.00 0.00 C ATOM 1215 O LEU A 79 0.049 -20.719 -12.064 1.00 0.00 O ATOM 1216 CB LEU A 79 -0.349 -22.616 -9.149 1.00 0.00 C ATOM 1217 CG LEU A 79 0.057 -22.770 -7.673 1.00 0.00 C ATOM 1218 CD1 LEU A 79 -0.062 -24.224 -7.235 1.00 0.00 C ATOM 1219 CD2 LEU A 79 1.474 -22.248 -7.435 1.00 0.00 C ATOM 0 H LEU A 79 -1.928 -20.490 -8.756 1.00 0.00 H new ATOM 0 HA LEU A 79 0.847 -20.920 -9.704 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.387 -22.932 -9.258 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.256 -23.296 -9.748 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.626 -22.171 -7.070 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.229 -24.314 -6.188 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.093 -24.557 -7.355 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.593 -24.843 -7.848 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.735 -22.369 -6.384 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.177 -22.810 -8.050 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.522 -21.192 -7.701 1.00 0.00 H new ATOM 1231 N GLY A 80 -1.918 -21.603 -11.407 1.00 0.00 N ATOM 1232 CA GLY A 80 -2.453 -21.674 -12.760 1.00 0.00 C ATOM 1233 C GLY A 80 -3.934 -21.360 -12.808 1.00 0.00 C ATOM 1234 O GLY A 80 -4.603 -21.361 -11.773 1.00 0.00 O ATOM 0 H GLY A 80 -2.561 -21.915 -10.679 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.914 -20.974 -13.399 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.282 -22.672 -13.165 1.00 0.00 H new ATOM 1238 N SER A 81 -4.452 -21.102 -14.005 1.00 0.00 N ATOM 1239 CA SER A 81 -5.853 -20.725 -14.178 1.00 0.00 C ATOM 1240 C SER A 81 -6.370 -21.151 -15.554 1.00 0.00 C ATOM 1241 O SER A 81 -5.598 -21.266 -16.510 1.00 0.00 O ATOM 1242 CB SER A 81 -6.001 -19.211 -13.997 1.00 0.00 C ATOM 1243 OG SER A 81 -5.103 -18.507 -14.842 1.00 0.00 O ATOM 0 H SER A 81 -3.920 -21.147 -14.874 1.00 0.00 H new ATOM 0 HA SER A 81 -6.450 -21.239 -13.424 1.00 0.00 H new ATOM 0 HB2 SER A 81 -7.025 -18.913 -14.220 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.811 -18.945 -12.957 1.00 0.00 H new ATOM 0 HG SER A 81 -5.266 -17.544 -14.763 1.00 0.00 H new ATOM 1249 N SER A 82 -7.678 -21.389 -15.645 1.00 0.00 N ATOM 1250 CA SER A 82 -8.313 -21.793 -16.895 1.00 0.00 C ATOM 1251 C SER A 82 -9.780 -21.345 -16.919 1.00 0.00 C ATOM 1252 O SER A 82 -10.568 -21.735 -16.051 1.00 0.00 O ATOM 1253 CB SER A 82 -8.236 -23.319 -17.057 1.00 0.00 C ATOM 1254 OG SER A 82 -6.905 -23.792 -16.906 1.00 0.00 O ATOM 0 H SER A 82 -8.322 -21.307 -14.858 1.00 0.00 H new ATOM 0 HA SER A 82 -7.784 -21.317 -17.721 1.00 0.00 H new ATOM 0 HB2 SER A 82 -8.879 -23.797 -16.318 1.00 0.00 H new ATOM 0 HB3 SER A 82 -8.614 -23.601 -18.040 1.00 0.00 H new ATOM 0 HG SER A 82 -6.890 -24.766 -17.013 1.00 0.00 H new ATOM 1260 N GLU A 83 -10.139 -20.516 -17.898 1.00 0.00 N ATOM 1261 CA GLU A 83 -11.529 -20.115 -18.101 1.00 0.00 C ATOM 1262 C GLU A 83 -12.142 -20.963 -19.210 1.00 0.00 C ATOM 1263 O GLU A 83 -11.714 -20.896 -20.366 1.00 0.00 O ATOM 1264 CB GLU A 83 -11.634 -18.624 -18.465 1.00 0.00 C ATOM 1265 CG GLU A 83 -13.068 -18.164 -18.731 1.00 0.00 C ATOM 1266 CD GLU A 83 -13.159 -16.728 -19.225 1.00 0.00 C ATOM 1267 OE1 GLU A 83 -12.750 -16.468 -20.377 1.00 0.00 O ATOM 1268 OE2 GLU A 83 -13.649 -15.851 -18.477 1.00 0.00 O ATOM 0 H GLU A 83 -9.484 -20.108 -18.565 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.072 -20.271 -17.169 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.214 -18.029 -17.654 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -11.028 -18.430 -19.350 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.523 -18.824 -19.470 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -13.650 -18.263 -17.814 1.00 0.00 H new ATOM 1275 N LYS A 84 -13.135 -21.768 -18.856 1.00 0.00 N ATOM 1276 CA LYS A 84 -13.795 -22.645 -19.814 1.00 0.00 C ATOM 1277 C LYS A 84 -15.205 -22.127 -20.096 1.00 0.00 C ATOM 1278 O LYS A 84 -16.195 -22.848 -19.949 1.00 0.00 O ATOM 1279 CB LYS A 84 -13.834 -24.087 -19.273 1.00 0.00 C ATOM 1280 CG LYS A 84 -12.492 -24.589 -18.740 1.00 0.00 C ATOM 1281 CD LYS A 84 -11.398 -24.539 -19.803 1.00 0.00 C ATOM 1282 CE LYS A 84 -11.668 -25.495 -20.958 1.00 0.00 C ATOM 1283 NZ LYS A 84 -10.657 -25.346 -22.038 1.00 0.00 N ATOM 0 H LYS A 84 -13.503 -21.832 -17.907 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.234 -22.651 -20.749 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -14.574 -24.145 -18.475 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -14.169 -24.753 -20.068 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -12.193 -23.984 -17.884 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -12.604 -25.613 -18.383 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -11.315 -23.523 -20.188 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.440 -24.786 -19.346 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.661 -26.521 -20.591 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -12.663 -25.308 -21.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -10.871 -26.011 -22.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.681 -24.373 -22.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -9.711 -25.549 -21.658 1.00 0.00 H new ATOM 1297 N GLY A 85 -15.281 -20.857 -20.485 1.00 0.00 N ATOM 1298 CA GLY A 85 -16.560 -20.228 -20.756 1.00 0.00 C ATOM 1299 C GLY A 85 -17.232 -19.733 -19.490 1.00 0.00 C ATOM 1300 O GLY A 85 -16.720 -18.836 -18.819 1.00 0.00 O ATOM 0 H GLY A 85 -14.473 -20.249 -20.618 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.414 -19.391 -21.439 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -17.214 -20.940 -21.259 1.00 0.00 H new ATOM 1304 N SER A 86 -18.367 -20.333 -19.151 1.00 0.00 N ATOM 1305 CA SER A 86 -19.138 -19.934 -17.978 1.00 0.00 C ATOM 1306 C SER A 86 -18.750 -20.765 -16.752 1.00 0.00 C ATOM 1307 O SER A 86 -19.308 -20.595 -15.666 1.00 0.00 O ATOM 1308 CB SER A 86 -20.633 -20.069 -18.277 1.00 0.00 C ATOM 1309 OG SER A 86 -20.935 -21.351 -18.808 1.00 0.00 O ATOM 0 H SER A 86 -18.777 -21.105 -19.677 1.00 0.00 H new ATOM 0 HA SER A 86 -18.913 -18.892 -17.749 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.206 -19.906 -17.364 1.00 0.00 H new ATOM 0 HB3 SER A 86 -20.936 -19.298 -18.985 1.00 0.00 H new ATOM 0 HG SER A 86 -21.896 -21.412 -18.989 1.00 0.00 H new ATOM 1315 N ARG A 87 -17.786 -21.661 -16.935 1.00 0.00 N ATOM 1316 CA ARG A 87 -17.259 -22.479 -15.847 1.00 0.00 C ATOM 1317 C ARG A 87 -15.737 -22.430 -15.913 1.00 0.00 C ATOM 1318 O ARG A 87 -15.162 -22.567 -16.989 1.00 0.00 O ATOM 1319 CB ARG A 87 -17.773 -23.929 -15.978 1.00 0.00 C ATOM 1320 CG ARG A 87 -17.816 -24.725 -14.668 1.00 0.00 C ATOM 1321 CD ARG A 87 -16.433 -25.091 -14.137 1.00 0.00 C ATOM 1322 NE ARG A 87 -15.685 -25.961 -15.055 1.00 0.00 N ATOM 1323 CZ ARG A 87 -14.979 -27.031 -14.669 1.00 0.00 C ATOM 1324 NH1 ARG A 87 -15.037 -27.452 -13.410 1.00 0.00 N ATOM 1325 NH2 ARG A 87 -14.250 -27.704 -15.552 1.00 0.00 N ATOM 0 H ARG A 87 -17.349 -21.841 -17.839 1.00 0.00 H new ATOM 0 HA ARG A 87 -17.595 -22.097 -14.883 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -18.776 -23.905 -16.404 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -17.138 -24.460 -16.687 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -18.344 -24.142 -13.914 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -18.390 -25.638 -14.825 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -15.863 -24.179 -13.962 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -16.539 -25.591 -13.174 1.00 0.00 H new ATOM 0 HE ARG A 87 -15.705 -25.735 -16.050 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -15.621 -26.960 -12.734 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -14.498 -28.268 -13.120 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -14.227 -27.406 -16.527 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -13.713 -28.519 -15.255 1.00 0.00 H new ATOM 1339 N GLY A 88 -15.084 -22.214 -14.781 1.00 0.00 N ATOM 1340 CA GLY A 88 -13.638 -22.094 -14.780 1.00 0.00 C ATOM 1341 C GLY A 88 -12.998 -22.761 -13.588 1.00 0.00 C ATOM 1342 O GLY A 88 -13.685 -23.236 -12.680 1.00 0.00 O ATOM 0 H GLY A 88 -15.525 -22.120 -13.866 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -13.241 -22.535 -15.694 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.365 -21.039 -14.790 1.00 0.00 H new ATOM 1346 N THR A 89 -11.675 -22.802 -13.596 1.00 0.00 N ATOM 1347 CA THR A 89 -10.905 -23.400 -12.519 1.00 0.00 C ATOM 1348 C THR A 89 -9.596 -22.640 -12.341 1.00 0.00 C ATOM 1349 O THR A 89 -8.975 -22.224 -13.323 1.00 0.00 O ATOM 1350 CB THR A 89 -10.599 -24.887 -12.818 1.00 0.00 C ATOM 1351 OG1 THR A 89 -11.820 -25.592 -13.083 1.00 0.00 O ATOM 1352 CG2 THR A 89 -9.870 -25.552 -11.655 1.00 0.00 C ATOM 0 H THR A 89 -11.105 -22.421 -14.351 1.00 0.00 H new ATOM 0 HA THR A 89 -11.494 -23.343 -11.604 1.00 0.00 H new ATOM 0 HB THR A 89 -9.951 -24.925 -13.693 1.00 0.00 H new ATOM 0 HG1 THR A 89 -11.620 -26.532 -13.273 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.671 -26.595 -11.899 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.927 -25.036 -11.473 1.00 0.00 H new ATOM 0 HG23 THR A 89 -10.490 -25.501 -10.760 1.00 0.00 H new ATOM 1360 N VAL A 90 -9.193 -22.439 -11.095 1.00 0.00 N ATOM 1361 CA VAL A 90 -7.926 -21.795 -10.795 1.00 0.00 C ATOM 1362 C VAL A 90 -7.266 -22.485 -9.604 1.00 0.00 C ATOM 1363 O VAL A 90 -7.928 -22.820 -8.616 1.00 0.00 O ATOM 1364 CB VAL A 90 -8.101 -20.275 -10.528 1.00 0.00 C ATOM 1365 CG1 VAL A 90 -9.016 -20.018 -9.335 1.00 0.00 C ATOM 1366 CG2 VAL A 90 -6.745 -19.596 -10.336 1.00 0.00 C ATOM 0 H VAL A 90 -9.729 -22.715 -10.273 1.00 0.00 H new ATOM 0 HA VAL A 90 -7.280 -21.892 -11.667 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.578 -19.839 -11.406 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -9.116 -18.944 -9.178 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.998 -20.449 -9.530 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.589 -20.477 -8.443 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.894 -18.532 -10.151 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.231 -20.044 -9.486 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -6.142 -19.727 -11.235 1.00 0.00 H new ATOM 1376 N GLU A 91 -5.971 -22.730 -9.727 1.00 0.00 N ATOM 1377 CA GLU A 91 -5.209 -23.450 -8.717 1.00 0.00 C ATOM 1378 C GLU A 91 -4.240 -22.496 -8.026 1.00 0.00 C ATOM 1379 O GLU A 91 -3.525 -21.738 -8.692 1.00 0.00 O ATOM 1380 CB GLU A 91 -4.454 -24.607 -9.381 1.00 0.00 C ATOM 1381 CG GLU A 91 -3.834 -25.594 -8.404 1.00 0.00 C ATOM 1382 CD GLU A 91 -3.192 -26.773 -9.114 1.00 0.00 C ATOM 1383 OE1 GLU A 91 -3.916 -27.502 -9.828 1.00 0.00 O ATOM 1384 OE2 GLU A 91 -1.966 -26.963 -8.972 1.00 0.00 O ATOM 0 H GLU A 91 -5.417 -22.435 -10.531 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.884 -23.858 -7.964 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.140 -25.144 -10.036 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.666 -24.196 -10.013 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.084 -25.083 -7.800 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.601 -25.957 -7.720 1.00 0.00 H new ATOM 1391 N PHE A 92 -4.211 -22.535 -6.698 1.00 0.00 N ATOM 1392 CA PHE A 92 -3.414 -21.591 -5.923 1.00 0.00 C ATOM 1393 C PHE A 92 -3.000 -22.183 -4.578 1.00 0.00 C ATOM 1394 O PHE A 92 -3.377 -23.306 -4.229 1.00 0.00 O ATOM 1395 CB PHE A 92 -4.198 -20.285 -5.708 1.00 0.00 C ATOM 1396 CG PHE A 92 -5.520 -20.470 -4.997 1.00 0.00 C ATOM 1397 CD1 PHE A 92 -6.665 -20.809 -5.706 1.00 0.00 C ATOM 1398 CD2 PHE A 92 -5.617 -20.301 -3.621 1.00 0.00 C ATOM 1399 CE1 PHE A 92 -7.874 -20.976 -5.060 1.00 0.00 C ATOM 1400 CE2 PHE A 92 -6.825 -20.468 -2.972 1.00 0.00 C ATOM 1401 CZ PHE A 92 -7.954 -20.805 -3.692 1.00 0.00 C ATOM 0 H PHE A 92 -4.730 -23.210 -6.136 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.507 -21.376 -6.488 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.582 -19.594 -5.133 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -4.380 -19.819 -6.676 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.609 -20.944 -6.776 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.738 -20.036 -3.052 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.756 -21.240 -5.624 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.886 -20.335 -1.902 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.899 -20.935 -3.186 1.00 0.00 H new ATOM 1411 N ILE A 93 -2.215 -21.409 -3.837 1.00 0.00 N ATOM 1412 CA ILE A 93 -1.755 -21.780 -2.507 1.00 0.00 C ATOM 1413 C ILE A 93 -2.038 -20.640 -1.531 1.00 0.00 C ATOM 1414 O ILE A 93 -1.546 -19.525 -1.714 1.00 0.00 O ATOM 1415 CB ILE A 93 -0.234 -22.088 -2.500 1.00 0.00 C ATOM 1416 CG1 ILE A 93 0.077 -23.317 -3.370 1.00 0.00 C ATOM 1417 CG2 ILE A 93 0.268 -22.302 -1.072 1.00 0.00 C ATOM 1418 CD1 ILE A 93 1.558 -23.582 -3.544 1.00 0.00 C ATOM 0 H ILE A 93 -1.878 -20.498 -4.147 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.291 -22.679 -2.204 1.00 0.00 H new ATOM 0 HB ILE A 93 0.287 -21.229 -2.922 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.390 -24.195 -2.923 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.376 -23.180 -4.352 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.337 -22.517 -1.090 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.089 -21.402 -0.485 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.263 -23.141 -0.622 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.699 -24.464 -4.169 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.028 -22.721 -4.020 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.014 -23.752 -2.569 1.00 0.00 H new ATOM 1430 N ALA A 94 -2.847 -20.913 -0.515 1.00 0.00 N ATOM 1431 CA ALA A 94 -3.149 -19.925 0.517 1.00 0.00 C ATOM 1432 C ALA A 94 -2.272 -20.162 1.743 1.00 0.00 C ATOM 1433 O ALA A 94 -2.416 -21.178 2.426 1.00 0.00 O ATOM 1434 CB ALA A 94 -4.628 -19.985 0.891 1.00 0.00 C ATOM 0 H ALA A 94 -3.308 -21.813 -0.382 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.935 -18.930 0.127 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.839 -19.243 1.661 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.235 -19.776 0.010 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.868 -20.979 1.269 1.00 0.00 H new ATOM 1440 N ARG A 95 -1.348 -19.238 2.006 1.00 0.00 N ATOM 1441 CA ARG A 95 -0.449 -19.358 3.151 1.00 0.00 C ATOM 1442 C ARG A 95 -0.973 -18.535 4.325 1.00 0.00 C ATOM 1443 O ARG A 95 -0.968 -17.303 4.291 1.00 0.00 O ATOM 1444 CB ARG A 95 0.980 -18.920 2.782 1.00 0.00 C ATOM 1445 CG ARG A 95 2.018 -19.224 3.873 1.00 0.00 C ATOM 1446 CD ARG A 95 2.604 -17.962 4.504 1.00 0.00 C ATOM 1447 NE ARG A 95 3.449 -17.215 3.566 1.00 0.00 N ATOM 1448 CZ ARG A 95 4.740 -16.935 3.778 1.00 0.00 C ATOM 1449 NH1 ARG A 95 5.329 -17.284 4.916 1.00 0.00 N ATOM 1450 NH2 ARG A 95 5.441 -16.281 2.861 1.00 0.00 N ATOM 0 H ARG A 95 -1.203 -18.400 1.442 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.414 -20.407 3.446 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.277 -19.420 1.860 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.982 -17.849 2.579 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.554 -19.831 4.650 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.825 -19.818 3.444 1.00 0.00 H new ATOM 0 HD2 ARG A 95 1.793 -17.321 4.850 1.00 0.00 H new ATOM 0 HD3 ARG A 95 3.191 -18.235 5.381 1.00 0.00 H new ATOM 0 HE ARG A 95 3.026 -16.888 2.697 1.00 0.00 H new ATOM 0 HH11 ARG A 95 4.797 -17.770 5.638 1.00 0.00 H new ATOM 0 HH12 ARG A 95 6.314 -17.066 5.068 1.00 0.00 H new ATOM 0 HH21 ARG A 95 4.996 -15.990 1.991 1.00 0.00 H new ATOM 0 HH22 ARG A 95 6.425 -16.069 3.026 1.00 0.00 H new ATOM 1464 N PHE A 96 -1.431 -19.232 5.353 1.00 0.00 N ATOM 1465 CA PHE A 96 -1.969 -18.612 6.558 1.00 0.00 C ATOM 1466 C PHE A 96 -1.307 -19.218 7.792 1.00 0.00 C ATOM 1467 O PHE A 96 -0.702 -20.285 7.712 1.00 0.00 O ATOM 1468 CB PHE A 96 -3.497 -18.802 6.611 1.00 0.00 C ATOM 1469 CG PHE A 96 -3.961 -20.159 6.128 1.00 0.00 C ATOM 1470 CD1 PHE A 96 -3.602 -21.319 6.801 1.00 0.00 C ATOM 1471 CD2 PHE A 96 -4.751 -20.271 4.991 1.00 0.00 C ATOM 1472 CE1 PHE A 96 -4.018 -22.557 6.350 1.00 0.00 C ATOM 1473 CE2 PHE A 96 -5.171 -21.507 4.539 1.00 0.00 C ATOM 1474 CZ PHE A 96 -4.804 -22.651 5.219 1.00 0.00 C ATOM 0 H PHE A 96 -1.441 -20.252 5.377 1.00 0.00 H new ATOM 0 HA PHE A 96 -1.755 -17.543 6.539 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -3.836 -18.656 7.636 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -3.971 -18.030 6.005 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -2.990 -21.253 7.688 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -5.041 -19.380 4.453 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -3.728 -23.451 6.882 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -5.786 -21.578 3.654 1.00 0.00 H new ATOM 0 HZ PHE A 96 -5.131 -23.618 4.867 1.00 0.00 H new ATOM 1484 N ARG A 97 -1.406 -18.537 8.926 1.00 0.00 N ATOM 1485 CA ARG A 97 -0.857 -19.053 10.173 1.00 0.00 C ATOM 1486 C ARG A 97 -1.962 -19.729 10.977 1.00 0.00 C ATOM 1487 O ARG A 97 -2.959 -19.095 11.331 1.00 0.00 O ATOM 1488 CB ARG A 97 -0.196 -17.935 10.990 1.00 0.00 C ATOM 1489 CG ARG A 97 0.589 -18.447 12.195 1.00 0.00 C ATOM 1490 CD ARG A 97 1.380 -17.335 12.874 1.00 0.00 C ATOM 1491 NE ARG A 97 2.260 -16.637 11.933 1.00 0.00 N ATOM 1492 CZ ARG A 97 3.567 -16.877 11.794 1.00 0.00 C ATOM 1493 NH1 ARG A 97 4.159 -17.825 12.509 1.00 0.00 N ATOM 1494 NH2 ARG A 97 4.282 -16.167 10.932 1.00 0.00 N ATOM 0 H ARG A 97 -1.861 -17.628 9.008 1.00 0.00 H new ATOM 0 HA ARG A 97 -0.086 -19.787 9.939 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.474 -17.370 10.343 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.965 -17.243 11.334 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -0.099 -18.893 12.913 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.271 -19.235 11.875 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.690 -16.621 13.323 1.00 0.00 H new ATOM 0 HD3 ARG A 97 1.976 -17.756 13.684 1.00 0.00 H new ATOM 0 HE ARG A 97 1.845 -15.917 11.342 1.00 0.00 H new ATOM 0 HH11 ARG A 97 3.616 -18.378 13.172 1.00 0.00 H new ATOM 0 HH12 ARG A 97 5.157 -18.001 12.396 1.00 0.00 H new ATOM 0 HH21 ARG A 97 3.834 -15.439 10.376 1.00 0.00 H new ATOM 0 HH22 ARG A 97 5.280 -16.349 10.825 1.00 0.00 H new ATOM 1508 N ARG A 98 -1.780 -21.017 11.247 1.00 0.00 N ATOM 1509 CA ARG A 98 -2.787 -21.821 11.929 1.00 0.00 C ATOM 1510 C ARG A 98 -2.871 -21.439 13.406 1.00 0.00 C ATOM 1511 O ARG A 98 -1.869 -21.490 14.126 1.00 0.00 O ATOM 1512 CB ARG A 98 -2.451 -23.314 11.794 1.00 0.00 C ATOM 1513 CG ARG A 98 -3.550 -24.245 12.303 1.00 0.00 C ATOM 1514 CD ARG A 98 -3.091 -25.698 12.333 1.00 0.00 C ATOM 1515 NE ARG A 98 -2.006 -25.900 13.296 1.00 0.00 N ATOM 1516 CZ ARG A 98 -1.205 -26.966 13.320 1.00 0.00 C ATOM 1517 NH1 ARG A 98 -1.354 -27.941 12.430 1.00 0.00 N ATOM 1518 NH2 ARG A 98 -0.258 -27.052 14.245 1.00 0.00 N ATOM 0 H ARG A 98 -0.934 -21.531 11.001 1.00 0.00 H new ATOM 0 HA ARG A 98 -3.754 -21.628 11.464 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -2.255 -23.539 10.746 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -1.531 -23.520 12.342 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -3.851 -23.938 13.305 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -4.428 -24.154 11.664 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -3.932 -26.341 12.592 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -2.756 -25.995 11.339 1.00 0.00 H new ATOM 0 HE ARG A 98 -1.852 -25.175 13.997 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -2.085 -27.878 11.722 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -0.737 -28.753 12.455 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -0.146 -26.306 14.931 1.00 0.00 H new ATOM 0 HH22 ARG A 98 0.358 -27.864 14.270 1.00 0.00 H new ATOM 1553 N PRO A 102 2.228 -21.853 14.182 1.00 0.00 N ATOM 1554 CA PRO A 102 2.814 -22.388 12.951 1.00 0.00 C ATOM 1555 C PRO A 102 2.077 -21.910 11.701 1.00 0.00 C ATOM 1556 O PRO A 102 0.854 -21.738 11.716 1.00 0.00 O ATOM 1557 CB PRO A 102 2.650 -23.899 13.131 1.00 0.00 C ATOM 1558 CG PRO A 102 1.397 -24.040 13.929 1.00 0.00 C ATOM 1559 CD PRO A 102 1.348 -22.840 14.847 1.00 0.00 C ATOM 0 HA PRO A 102 3.845 -22.066 12.805 1.00 0.00 H new ATOM 0 HB2 PRO A 102 2.570 -24.408 12.170 1.00 0.00 H new ATOM 0 HB3 PRO A 102 3.504 -24.333 13.651 1.00 0.00 H new ATOM 0 HG2 PRO A 102 0.522 -24.070 13.279 1.00 0.00 H new ATOM 0 HG3 PRO A 102 1.401 -24.968 14.501 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.332 -22.461 14.956 1.00 0.00 H new ATOM 0 HD3 PRO A 102 1.706 -23.086 15.847 1.00 0.00 H new ATOM 1567 N GLU A 103 2.824 -21.681 10.627 1.00 0.00 N ATOM 1568 CA GLU A 103 2.229 -21.334 9.343 1.00 0.00 C ATOM 1569 C GLU A 103 1.701 -22.592 8.664 1.00 0.00 C ATOM 1570 O GLU A 103 2.000 -23.711 9.087 1.00 0.00 O ATOM 1571 CB GLU A 103 3.251 -20.649 8.425 1.00 0.00 C ATOM 1572 CG GLU A 103 3.809 -19.340 8.968 1.00 0.00 C ATOM 1573 CD GLU A 103 4.844 -18.726 8.037 1.00 0.00 C ATOM 1574 OE1 GLU A 103 5.910 -19.345 7.839 1.00 0.00 O ATOM 1575 OE2 GLU A 103 4.597 -17.628 7.492 1.00 0.00 O ATOM 0 H GLU A 103 3.843 -21.730 10.620 1.00 0.00 H new ATOM 0 HA GLU A 103 1.410 -20.639 9.526 1.00 0.00 H new ATOM 0 HB2 GLU A 103 4.078 -21.336 8.247 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.782 -20.457 7.460 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.993 -18.633 9.117 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.260 -19.517 9.944 1.00 0.00 H new ATOM 1582 N GLN A 104 0.920 -22.398 7.618 1.00 0.00 N ATOM 1583 CA GLN A 104 0.397 -23.494 6.824 1.00 0.00 C ATOM 1584 C GLN A 104 0.002 -22.965 5.453 1.00 0.00 C ATOM 1585 O GLN A 104 -0.496 -21.845 5.332 1.00 0.00 O ATOM 1586 CB GLN A 104 -0.812 -24.137 7.518 1.00 0.00 C ATOM 1587 CG GLN A 104 -1.290 -25.425 6.858 1.00 0.00 C ATOM 1588 CD GLN A 104 -2.520 -26.005 7.532 1.00 0.00 C ATOM 1589 OE1 GLN A 104 -3.649 -25.703 7.150 1.00 0.00 O ATOM 1590 NE2 GLN A 104 -2.314 -26.826 8.550 1.00 0.00 N ATOM 0 H GLN A 104 0.630 -21.475 7.294 1.00 0.00 H new ATOM 0 HA GLN A 104 1.165 -24.259 6.714 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -0.554 -24.346 8.556 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -1.634 -23.421 7.532 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -1.513 -25.230 5.809 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -0.486 -26.161 6.882 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -1.362 -27.053 8.838 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -3.107 -27.232 9.047 1.00 0.00 H new ATOM 1599 N SER A 105 0.236 -23.759 4.427 1.00 0.00 N ATOM 1600 CA SER A 105 -0.066 -23.360 3.062 1.00 0.00 C ATOM 1601 C SER A 105 -0.943 -24.412 2.396 1.00 0.00 C ATOM 1602 O SER A 105 -0.517 -25.553 2.193 1.00 0.00 O ATOM 1603 CB SER A 105 1.237 -23.148 2.278 1.00 0.00 C ATOM 1604 OG SER A 105 2.089 -24.278 2.374 1.00 0.00 O ATOM 0 H SER A 105 0.638 -24.693 4.512 1.00 0.00 H new ATOM 0 HA SER A 105 -0.614 -22.418 3.072 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.006 -22.953 1.231 1.00 0.00 H new ATOM 0 HB3 SER A 105 1.754 -22.267 2.660 1.00 0.00 H new ATOM 0 HG SER A 105 1.549 -25.096 2.368 1.00 0.00 H new ATOM 1610 N HIS A 106 -2.178 -24.036 2.088 1.00 0.00 N ATOM 1611 CA HIS A 106 -3.125 -24.954 1.475 1.00 0.00 C ATOM 1612 C HIS A 106 -3.051 -24.846 -0.044 1.00 0.00 C ATOM 1613 O HIS A 106 -3.526 -23.871 -0.630 1.00 0.00 O ATOM 1614 CB HIS A 106 -4.552 -24.663 1.965 1.00 0.00 C ATOM 1615 CG HIS A 106 -5.559 -25.703 1.558 1.00 0.00 C ATOM 1616 ND1 HIS A 106 -6.766 -25.401 0.967 1.00 0.00 N ATOM 1617 CD2 HIS A 106 -5.541 -27.050 1.695 1.00 0.00 C ATOM 1618 CE1 HIS A 106 -7.445 -26.515 0.763 1.00 0.00 C ATOM 1619 NE2 HIS A 106 -6.724 -27.530 1.194 1.00 0.00 N ATOM 0 H HIS A 106 -2.546 -23.099 2.254 1.00 0.00 H new ATOM 0 HA HIS A 106 -2.864 -25.971 1.767 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.544 -24.585 3.052 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.868 -23.694 1.578 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -7.085 -24.463 0.725 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -4.742 -27.638 2.121 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -8.427 -26.583 0.318 1.00 0.00 H new ATOM 1628 N HIS A 107 -2.424 -25.836 -0.667 1.00 0.00 N ATOM 1629 CA HIS A 107 -2.351 -25.914 -2.121 1.00 0.00 C ATOM 1630 C HIS A 107 -3.610 -26.590 -2.645 1.00 0.00 C ATOM 1631 O HIS A 107 -3.736 -27.815 -2.596 1.00 0.00 O ATOM 1632 CB HIS A 107 -1.091 -26.687 -2.551 1.00 0.00 C ATOM 1633 CG HIS A 107 -0.971 -26.938 -4.031 1.00 0.00 C ATOM 1634 ND1 HIS A 107 -0.099 -27.866 -4.560 1.00 0.00 N ATOM 1635 CD2 HIS A 107 -1.604 -26.378 -5.092 1.00 0.00 C ATOM 1636 CE1 HIS A 107 -0.201 -27.866 -5.876 1.00 0.00 C ATOM 1637 NE2 HIS A 107 -1.106 -26.975 -6.223 1.00 0.00 N ATOM 0 H HIS A 107 -1.955 -26.602 -0.183 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.285 -24.910 -2.541 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -0.213 -26.133 -2.220 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -1.077 -27.646 -2.033 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.359 -25.607 -5.054 1.00 0.00 H new ATOM 0 HE1 HIS A 107 0.362 -28.491 -6.553 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.391 -26.762 -7.179 1.00 0.00 H new ATOM 1646 N GLU A 108 -4.543 -25.788 -3.138 1.00 0.00 N ATOM 1647 CA GLU A 108 -5.833 -26.298 -3.574 1.00 0.00 C ATOM 1648 C GLU A 108 -6.138 -25.878 -5.004 1.00 0.00 C ATOM 1649 O GLU A 108 -5.437 -25.051 -5.594 1.00 0.00 O ATOM 1650 CB GLU A 108 -6.947 -25.813 -2.637 1.00 0.00 C ATOM 1651 CG GLU A 108 -7.133 -24.299 -2.625 1.00 0.00 C ATOM 1652 CD GLU A 108 -8.283 -23.859 -1.732 1.00 0.00 C ATOM 1653 OE1 GLU A 108 -9.446 -23.901 -2.189 1.00 0.00 O ATOM 1654 OE2 GLU A 108 -8.028 -23.487 -0.565 1.00 0.00 O ATOM 0 H GLU A 108 -4.429 -24.780 -3.246 1.00 0.00 H new ATOM 0 HA GLU A 108 -5.788 -27.387 -3.540 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -7.886 -26.282 -2.932 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -6.728 -26.150 -1.624 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.212 -23.826 -2.285 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -7.313 -23.951 -3.642 1.00 0.00 H new ATOM 1661 N ARG A 109 -7.194 -26.462 -5.541 1.00 0.00 N ATOM 1662 CA ARG A 109 -7.653 -26.190 -6.890 1.00 0.00 C ATOM 1663 C ARG A 109 -9.155 -25.927 -6.845 1.00 0.00 C ATOM 1664 O ARG A 109 -9.953 -26.857 -6.699 1.00 0.00 O ATOM 1665 CB ARG A 109 -7.323 -27.388 -7.793 1.00 0.00 C ATOM 1666 CG ARG A 109 -7.698 -27.200 -9.257 1.00 0.00 C ATOM 1667 CD ARG A 109 -7.213 -28.368 -10.109 1.00 0.00 C ATOM 1668 NE ARG A 109 -7.574 -28.203 -11.517 1.00 0.00 N ATOM 1669 CZ ARG A 109 -6.747 -27.742 -12.456 1.00 0.00 C ATOM 1670 NH1 ARG A 109 -5.498 -27.404 -12.153 1.00 0.00 N ATOM 1671 NH2 ARG A 109 -7.169 -27.627 -13.705 1.00 0.00 N ATOM 0 H ARG A 109 -7.764 -27.147 -5.045 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.153 -25.313 -7.300 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -6.254 -27.591 -7.728 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.839 -28.268 -7.409 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.780 -27.106 -9.348 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.265 -26.272 -9.629 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -6.130 -28.457 -10.020 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.642 -29.296 -9.731 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.521 -28.457 -11.799 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -5.163 -27.496 -11.194 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -4.874 -27.053 -12.879 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -8.124 -27.891 -13.947 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -6.539 -27.275 -14.426 1.00 0.00 H new ATOM 1685 N SER A 110 -9.532 -24.657 -6.926 1.00 0.00 N ATOM 1686 CA SER A 110 -10.921 -24.253 -6.746 1.00 0.00 C ATOM 1687 C SER A 110 -11.586 -23.981 -8.094 1.00 0.00 C ATOM 1688 O SER A 110 -10.996 -23.355 -8.979 1.00 0.00 O ATOM 1689 CB SER A 110 -10.991 -23.007 -5.849 1.00 0.00 C ATOM 1690 OG SER A 110 -12.333 -22.648 -5.550 1.00 0.00 O ATOM 0 H SER A 110 -8.892 -23.886 -7.116 1.00 0.00 H new ATOM 0 HA SER A 110 -11.461 -25.067 -6.263 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.450 -23.195 -4.922 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.493 -22.174 -6.345 1.00 0.00 H new ATOM 0 HG SER A 110 -12.912 -23.433 -5.650 1.00 0.00 H new ATOM 1696 N GLN A 111 -12.805 -24.491 -8.257 1.00 0.00 N ATOM 1697 CA GLN A 111 -13.600 -24.233 -9.450 1.00 0.00 C ATOM 1698 C GLN A 111 -14.582 -23.096 -9.182 1.00 0.00 C ATOM 1699 O GLN A 111 -15.194 -23.027 -8.110 1.00 0.00 O ATOM 1700 CB GLN A 111 -14.364 -25.489 -9.899 1.00 0.00 C ATOM 1701 CG GLN A 111 -13.476 -26.644 -10.364 1.00 0.00 C ATOM 1702 CD GLN A 111 -12.808 -27.392 -9.222 1.00 0.00 C ATOM 1703 OE1 GLN A 111 -11.609 -26.976 -8.852 1.00 0.00 O flip ATOM 1704 NE2 GLN A 111 -13.363 -28.348 -8.687 1.00 0.00 N flip ATOM 0 H GLN A 111 -13.264 -25.090 -7.571 1.00 0.00 H new ATOM 0 HA GLN A 111 -12.920 -23.948 -10.253 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -14.984 -25.835 -9.072 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -15.038 -25.217 -10.711 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -14.078 -27.344 -10.944 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.707 -26.255 -11.032 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -14.289 -28.640 -8.999 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -12.898 -28.850 -7.930 1.00 0.00 H new ATOM 1713 N PHE A 112 -14.722 -22.210 -10.159 1.00 0.00 N ATOM 1714 CA PHE A 112 -15.607 -21.056 -10.048 1.00 0.00 C ATOM 1715 C PHE A 112 -16.629 -21.068 -11.184 1.00 0.00 C ATOM 1716 O PHE A 112 -16.355 -21.574 -12.277 1.00 0.00 O ATOM 1717 CB PHE A 112 -14.795 -19.750 -10.082 1.00 0.00 C ATOM 1718 CG PHE A 112 -13.935 -19.526 -8.863 1.00 0.00 C ATOM 1719 CD1 PHE A 112 -12.739 -20.209 -8.703 1.00 0.00 C ATOM 1720 CD2 PHE A 112 -14.324 -18.629 -7.878 1.00 0.00 C ATOM 1721 CE1 PHE A 112 -11.951 -20.004 -7.587 1.00 0.00 C ATOM 1722 CE2 PHE A 112 -13.539 -18.420 -6.760 1.00 0.00 C ATOM 1723 CZ PHE A 112 -12.351 -19.108 -6.615 1.00 0.00 C ATOM 0 H PHE A 112 -14.227 -22.270 -11.049 1.00 0.00 H new ATOM 0 HA PHE A 112 -16.134 -21.113 -9.096 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -14.158 -19.754 -10.967 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -15.482 -18.910 -10.188 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -12.420 -20.910 -9.460 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -15.252 -18.087 -7.987 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -11.023 -20.544 -7.475 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -13.854 -17.720 -6.001 1.00 0.00 H new ATOM 0 HZ PHE A 112 -11.735 -18.946 -5.743 1.00 0.00 H new ATOM 1733 N ARG A 113 -17.800 -20.513 -10.911 1.00 0.00 N ATOM 1734 CA ARG A 113 -18.882 -20.422 -11.882 1.00 0.00 C ATOM 1735 C ARG A 113 -19.097 -18.971 -12.292 1.00 0.00 C ATOM 1736 O ARG A 113 -19.268 -18.096 -11.442 1.00 0.00 O ATOM 1737 CB ARG A 113 -20.156 -21.009 -11.270 1.00 0.00 C ATOM 1738 CG ARG A 113 -21.426 -20.805 -12.090 1.00 0.00 C ATOM 1739 CD ARG A 113 -22.555 -21.666 -11.529 1.00 0.00 C ATOM 1740 NE ARG A 113 -23.852 -21.410 -12.157 1.00 0.00 N ATOM 1741 CZ ARG A 113 -25.020 -21.605 -11.537 1.00 0.00 C ATOM 1742 NH1 ARG A 113 -25.043 -21.996 -10.264 1.00 0.00 N ATOM 1743 NH2 ARG A 113 -26.165 -21.395 -12.179 1.00 0.00 N ATOM 0 H ARG A 113 -18.029 -20.110 -10.003 1.00 0.00 H new ATOM 0 HA ARG A 113 -18.623 -20.990 -12.776 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -20.008 -22.078 -11.120 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -20.304 -20.566 -10.285 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.716 -19.754 -12.072 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -21.242 -21.067 -13.132 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -22.298 -22.717 -11.659 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -22.638 -21.489 -10.457 1.00 0.00 H new ATOM 0 HE ARG A 113 -23.865 -21.065 -13.117 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -24.169 -22.147 -9.761 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -25.935 -22.144 -9.792 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -26.155 -21.083 -13.150 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -27.053 -21.546 -11.700 1.00 0.00 H new ATOM 1757 N LYS A 114 -19.078 -18.722 -13.592 1.00 0.00 N ATOM 1758 CA LYS A 114 -19.202 -17.372 -14.120 1.00 0.00 C ATOM 1759 C LYS A 114 -20.666 -17.037 -14.397 1.00 0.00 C ATOM 1760 O LYS A 114 -21.281 -17.597 -15.310 1.00 0.00 O ATOM 1761 CB LYS A 114 -18.376 -17.233 -15.398 1.00 0.00 C ATOM 1762 CG LYS A 114 -18.144 -15.784 -15.807 1.00 0.00 C ATOM 1763 CD LYS A 114 -17.227 -15.665 -17.020 1.00 0.00 C ATOM 1764 CE LYS A 114 -16.724 -14.239 -17.188 1.00 0.00 C ATOM 1765 NZ LYS A 114 -15.883 -14.082 -18.407 1.00 0.00 N ATOM 0 H LYS A 114 -18.977 -19.443 -14.306 1.00 0.00 H new ATOM 0 HA LYS A 114 -18.824 -16.671 -13.376 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -17.413 -17.722 -15.255 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -18.882 -17.756 -16.209 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -19.102 -15.314 -16.031 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -17.709 -15.238 -14.970 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -16.380 -16.342 -16.907 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -17.764 -15.973 -17.917 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -17.574 -13.559 -17.245 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -16.145 -13.953 -16.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -15.520 -13.109 -18.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -15.085 -14.748 -18.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -16.456 -14.280 -19.252 1.00 0.00 H new ATOM 1779 N ALA A 115 -21.217 -16.128 -13.602 1.00 0.00 N ATOM 1780 CA ALA A 115 -22.602 -15.699 -13.748 1.00 0.00 C ATOM 1781 C ALA A 115 -22.666 -14.189 -13.970 1.00 0.00 C ATOM 1782 O ALA A 115 -22.222 -13.410 -13.121 1.00 0.00 O ATOM 1783 CB ALA A 115 -23.409 -16.101 -12.518 1.00 0.00 C ATOM 0 H ALA A 115 -20.718 -15.669 -12.840 1.00 0.00 H new ATOM 0 HA ALA A 115 -23.036 -16.191 -14.618 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -24.442 -15.775 -12.638 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -23.381 -17.185 -12.403 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -22.981 -15.631 -11.633 1.00 0.00 H new ATOM 1789 N ARG A 116 -23.192 -13.790 -15.129 1.00 0.00 N ATOM 1790 CA ARG A 116 -23.355 -12.376 -15.483 1.00 0.00 C ATOM 1791 C ARG A 116 -22.027 -11.618 -15.399 1.00 0.00 C ATOM 1792 O ARG A 116 -21.992 -10.430 -15.072 1.00 0.00 O ATOM 1793 CB ARG A 116 -24.425 -11.706 -14.599 1.00 0.00 C ATOM 1794 CG ARG A 116 -25.859 -12.114 -14.942 1.00 0.00 C ATOM 1795 CD ARG A 116 -26.165 -13.556 -14.552 1.00 0.00 C ATOM 1796 NE ARG A 116 -26.238 -13.729 -13.099 1.00 0.00 N ATOM 1797 CZ ARG A 116 -26.733 -14.813 -12.501 1.00 0.00 C ATOM 1798 NH1 ARG A 116 -27.087 -15.871 -13.223 1.00 0.00 N ATOM 1799 NH2 ARG A 116 -26.834 -14.852 -11.180 1.00 0.00 N ATOM 0 H ARG A 116 -23.517 -14.435 -15.849 1.00 0.00 H new ATOM 0 HA ARG A 116 -23.693 -12.335 -16.518 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -24.227 -11.954 -13.556 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -24.334 -10.624 -14.693 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -26.555 -11.448 -14.432 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -26.023 -11.988 -16.012 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -27.111 -13.860 -15.001 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -25.394 -14.212 -14.957 1.00 0.00 H new ATOM 0 HE ARG A 116 -25.889 -12.974 -12.509 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -26.980 -15.855 -14.237 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -27.465 -16.699 -12.763 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -26.533 -14.053 -10.622 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -27.213 -15.681 -10.722 1.00 0.00 H new ATOM 1813 N GLY A 117 -20.938 -12.310 -15.720 1.00 0.00 N ATOM 1814 CA GLY A 117 -19.630 -11.676 -15.770 1.00 0.00 C ATOM 1815 C GLY A 117 -18.856 -11.785 -14.469 1.00 0.00 C ATOM 1816 O GLY A 117 -17.638 -11.586 -14.452 1.00 0.00 O ATOM 0 H GLY A 117 -20.937 -13.304 -15.948 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -19.045 -12.129 -16.571 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -19.754 -10.623 -16.023 1.00 0.00 H new ATOM 1820 N ARG A 118 -19.542 -12.100 -13.372 1.00 0.00 N ATOM 1821 CA ARG A 118 -18.867 -12.263 -12.087 1.00 0.00 C ATOM 1822 C ARG A 118 -18.601 -13.738 -11.831 1.00 0.00 C ATOM 1823 O ARG A 118 -19.397 -14.591 -12.213 1.00 0.00 O ATOM 1824 CB ARG A 118 -19.684 -11.686 -10.917 1.00 0.00 C ATOM 1825 CG ARG A 118 -20.096 -10.223 -11.077 1.00 0.00 C ATOM 1826 CD ARG A 118 -21.422 -10.084 -11.815 1.00 0.00 C ATOM 1827 NE ARG A 118 -22.502 -10.796 -11.123 1.00 0.00 N ATOM 1828 CZ ARG A 118 -23.798 -10.528 -11.272 1.00 0.00 C ATOM 1829 NH1 ARG A 118 -24.194 -9.551 -12.080 1.00 0.00 N ATOM 1830 NH2 ARG A 118 -24.694 -11.240 -10.601 1.00 0.00 N ATOM 0 H ARG A 118 -20.551 -12.246 -13.346 1.00 0.00 H new ATOM 0 HA ARG A 118 -17.930 -11.709 -12.143 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -20.583 -12.289 -10.789 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -19.100 -11.786 -10.002 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -20.177 -9.759 -10.094 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -19.320 -9.684 -11.621 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -21.680 -9.029 -11.905 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -21.318 -10.474 -12.827 1.00 0.00 H new ATOM 0 HE ARG A 118 -22.243 -11.548 -10.484 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -23.504 -9.001 -12.591 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -25.188 -9.351 -12.189 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -24.388 -11.986 -9.977 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -25.689 -11.041 -10.710 1.00 0.00 H new ATOM 1844 N TRP A 119 -17.479 -14.030 -11.192 1.00 0.00 N ATOM 1845 CA TRP A 119 -17.130 -15.399 -10.841 1.00 0.00 C ATOM 1846 C TRP A 119 -17.531 -15.695 -9.402 1.00 0.00 C ATOM 1847 O TRP A 119 -17.298 -14.884 -8.506 1.00 0.00 O ATOM 1848 CB TRP A 119 -15.631 -15.632 -11.044 1.00 0.00 C ATOM 1849 CG TRP A 119 -15.237 -15.700 -12.489 1.00 0.00 C ATOM 1850 CD1 TRP A 119 -14.897 -14.664 -13.310 1.00 0.00 C ATOM 1851 CD2 TRP A 119 -15.163 -16.881 -13.286 1.00 0.00 C ATOM 1852 NE1 TRP A 119 -14.596 -15.140 -14.564 1.00 0.00 N ATOM 1853 CE2 TRP A 119 -14.757 -16.497 -14.573 1.00 0.00 C ATOM 1854 CE3 TRP A 119 -15.396 -18.228 -13.028 1.00 0.00 C ATOM 1855 CZ2 TRP A 119 -14.579 -17.416 -15.601 1.00 0.00 C ATOM 1856 CZ3 TRP A 119 -15.224 -19.140 -14.047 1.00 0.00 C ATOM 1857 CH2 TRP A 119 -14.816 -18.732 -15.321 1.00 0.00 C ATOM 0 H TRP A 119 -16.791 -13.334 -10.904 1.00 0.00 H new ATOM 0 HA TRP A 119 -17.676 -16.079 -11.495 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -15.076 -14.829 -10.560 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -15.344 -16.561 -10.551 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -14.869 -13.625 -13.018 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -14.301 -14.573 -15.358 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.706 -18.554 -12.046 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -14.265 -17.101 -16.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.407 -20.187 -13.858 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.686 -19.471 -16.098 1.00 0.00 H new ATOM 1868 N TYR A 120 -18.149 -16.850 -9.199 1.00 0.00 N ATOM 1869 CA TYR A 120 -18.600 -17.274 -7.880 1.00 0.00 C ATOM 1870 C TYR A 120 -17.966 -18.613 -7.517 1.00 0.00 C ATOM 1871 O TYR A 120 -17.824 -19.489 -8.367 1.00 0.00 O ATOM 1872 CB TYR A 120 -20.130 -17.389 -7.854 1.00 0.00 C ATOM 1873 CG TYR A 120 -20.851 -16.077 -8.126 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -21.098 -15.653 -9.429 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -21.278 -15.263 -7.081 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -21.749 -14.460 -9.680 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -21.930 -14.068 -7.327 1.00 0.00 C ATOM 1878 CZ TYR A 120 -22.163 -13.672 -8.628 1.00 0.00 C ATOM 1879 OH TYR A 120 -22.809 -12.480 -8.877 1.00 0.00 O ATOM 0 H TYR A 120 -18.352 -17.519 -9.942 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.294 -16.528 -7.147 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -20.442 -18.124 -8.596 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -20.440 -17.767 -6.880 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -20.776 -16.267 -10.257 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -21.097 -15.569 -6.061 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -21.933 -14.146 -10.697 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -22.255 -13.448 -6.505 1.00 0.00 H new ATOM 0 HH TYR A 120 -23.035 -12.047 -8.028 1.00 0.00 H new ATOM 1889 N PHE A 121 -17.577 -18.759 -6.260 1.00 0.00 N ATOM 1890 CA PHE A 121 -16.945 -19.984 -5.780 1.00 0.00 C ATOM 1891 C PHE A 121 -17.923 -21.157 -5.803 1.00 0.00 C ATOM 1892 O PHE A 121 -18.918 -21.156 -5.079 1.00 0.00 O ATOM 1893 CB PHE A 121 -16.398 -19.766 -4.363 1.00 0.00 C ATOM 1894 CG PHE A 121 -16.081 -21.043 -3.621 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -14.908 -21.736 -3.871 1.00 0.00 C ATOM 1896 CD2 PHE A 121 -16.966 -21.552 -2.677 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -14.622 -22.906 -3.197 1.00 0.00 C ATOM 1898 CE2 PHE A 121 -16.685 -22.722 -2.001 1.00 0.00 C ATOM 1899 CZ PHE A 121 -15.511 -23.401 -2.261 1.00 0.00 C ATOM 0 H PHE A 121 -17.688 -18.039 -5.546 1.00 0.00 H new ATOM 0 HA PHE A 121 -16.119 -20.230 -6.448 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -15.494 -19.160 -4.423 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -17.127 -19.195 -3.788 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -14.209 -21.356 -4.602 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -17.886 -21.025 -2.470 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -13.703 -23.435 -3.401 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -17.382 -23.106 -1.270 1.00 0.00 H new ATOM 0 HZ PHE A 121 -15.288 -24.317 -1.734 1.00 0.00 H new ATOM 1909 N SER A 122 -17.624 -22.160 -6.624 1.00 0.00 N ATOM 1910 CA SER A 122 -18.464 -23.345 -6.729 1.00 0.00 C ATOM 1911 C SER A 122 -18.005 -24.411 -5.736 1.00 0.00 C ATOM 1912 O SER A 122 -18.789 -24.890 -4.919 1.00 0.00 O ATOM 1913 CB SER A 122 -18.429 -23.892 -8.161 1.00 0.00 C ATOM 1914 OG SER A 122 -18.874 -22.916 -9.091 1.00 0.00 O ATOM 0 H SER A 122 -16.802 -22.173 -7.228 1.00 0.00 H new ATOM 0 HA SER A 122 -19.491 -23.070 -6.487 1.00 0.00 H new ATOM 0 HB2 SER A 122 -17.414 -24.201 -8.411 1.00 0.00 H new ATOM 0 HB3 SER A 122 -19.059 -24.779 -8.230 1.00 0.00 H new ATOM 0 HG SER A 122 -19.804 -22.677 -8.895 1.00 0.00 H new ATOM 1920 N GLU A 123 -16.726 -24.767 -5.801 1.00 0.00 N ATOM 1921 CA GLU A 123 -16.162 -25.782 -4.916 1.00 0.00 C ATOM 1922 C GLU A 123 -14.637 -25.755 -4.973 1.00 0.00 C ATOM 1923 O GLU A 123 -14.051 -25.170 -5.888 1.00 0.00 O ATOM 1924 CB GLU A 123 -16.706 -27.174 -5.281 1.00 0.00 C ATOM 1925 CG GLU A 123 -16.551 -27.538 -6.754 1.00 0.00 C ATOM 1926 CD GLU A 123 -17.345 -28.778 -7.135 1.00 0.00 C ATOM 1927 OE1 GLU A 123 -18.570 -28.658 -7.370 1.00 0.00 O ATOM 1928 OE2 GLU A 123 -16.757 -29.880 -7.199 1.00 0.00 O ATOM 0 H GLU A 123 -16.058 -24.366 -6.460 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.463 -25.559 -3.892 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.193 -27.922 -4.677 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -17.762 -27.220 -5.016 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -16.877 -26.699 -7.368 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.497 -27.704 -6.975 1.00 0.00 H new ATOM 1935 N GLY A 124 -14.003 -26.366 -3.979 1.00 0.00 N ATOM 1936 CA GLY A 124 -12.554 -26.374 -3.897 1.00 0.00 C ATOM 1937 C GLY A 124 -12.039 -27.653 -3.274 1.00 0.00 C ATOM 1938 O GLY A 124 -12.621 -28.156 -2.311 1.00 0.00 O ATOM 0 H GLY A 124 -14.472 -26.861 -3.221 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.132 -26.259 -4.895 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -12.217 -25.521 -3.308 1.00 0.00 H new ATOM 1942 N GLU A 125 -10.950 -28.178 -3.820 1.00 0.00 N ATOM 1943 CA GLU A 125 -10.392 -29.450 -3.375 1.00 0.00 C ATOM 1944 C GLU A 125 -8.869 -29.407 -3.419 1.00 0.00 C ATOM 1945 O GLU A 125 -8.285 -28.543 -4.076 1.00 0.00 O ATOM 1946 CB GLU A 125 -10.917 -30.579 -4.270 1.00 0.00 C ATOM 1947 CG GLU A 125 -10.536 -30.415 -5.740 1.00 0.00 C ATOM 1948 CD GLU A 125 -11.250 -31.399 -6.650 1.00 0.00 C ATOM 1949 OE1 GLU A 125 -10.893 -32.594 -6.647 1.00 0.00 O ATOM 1950 OE2 GLU A 125 -12.179 -30.982 -7.373 1.00 0.00 O ATOM 0 H GLU A 125 -10.430 -27.738 -4.579 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.700 -29.634 -2.346 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -10.530 -31.531 -3.906 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -12.003 -30.624 -4.187 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.768 -29.399 -6.059 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -9.459 -30.544 -5.847 1.00 0.00 H new ATOM 1957 N ALA A 126 -8.230 -30.330 -2.713 1.00 0.00 N ATOM 1958 CA ALA A 126 -6.780 -30.446 -2.738 1.00 0.00 C ATOM 1959 C ALA A 126 -6.351 -31.190 -3.997 1.00 0.00 C ATOM 1960 O ALA A 126 -6.692 -32.360 -4.180 1.00 0.00 O ATOM 1961 CB ALA A 126 -6.277 -31.160 -1.488 1.00 0.00 C ATOM 0 H ALA A 126 -8.696 -31.011 -2.114 1.00 0.00 H new ATOM 0 HA ALA A 126 -6.341 -29.448 -2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -5.190 -31.237 -1.525 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.571 -30.595 -0.603 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -6.710 -32.159 -1.441 1.00 0.00 H new