USER MOD reduce.3.24.130724 H: found=0, std=0, add=1118, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1119 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 19 ASN : amide:sc= -0.174 X(o=-0.17,f=-0.23!) USER MOD Set 1.2: A 149 TYR OH : rot 35:sc= 0.00442 USER MOD Set 2.1: A 76 LYS NZ :NH3+ -112:sc= 0.33 (180deg=0) USER MOD Set 2.2: A 108 TYR OH : rot 180:sc= 0.313 USER MOD Set 3.1: A 97 SER OG : rot 139:sc= 0.928 USER MOD Set 3.2: A 101 LYS NZ :NH3+ -160:sc= 0.951 (180deg=-0.15) USER MOD Set 4.1: A 59 GLN : amide:sc= -2.33! C(o=-1.3!,f=-1.5!) USER MOD Set 4.2: A 143 GLN : amide:sc= 0.984 K(o=-1.3,f=-7.7!) USER MOD Set 5.1: A 55 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 57 THR OG1 : rot 180:sc= -0.586 USER MOD Set 6.1: A 40 THR OG1 : rot -82:sc= 1.29 USER MOD Set 6.2: A 41 GLN : amide:sc= -0.309 X(o=0.98,f=0.8) USER MOD Set 7.1: A 5 THR OG1 : rot -145:sc= 0.413 USER MOD Set 7.2: A 7 ASN : amide:sc= -0.309 K(o=0.16,f=2.9) USER MOD Set 7.3: A 9 THR OG1 : rot -170:sc= 0.0529 USER MOD Single : A 4 LYS NZ :NH3+ -157:sc= 1.12 (180deg=-0.263) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.238 X(o=-0.24,f=-0.12) USER MOD Single : A 29 ASN : amide:sc= -0.458 X(o=-0.46,f=-0.22) USER MOD Single : A 32 GLN : amide:sc= -1.73! K(o=-1.7!,f=-0.18) USER MOD Single : A 33 ASN : amide:sc= -1.97 K(o=-2,f=-0.0065) USER MOD Single : A 39 SER OG : rot -33:sc= -1.87! USER MOD Single : A 45 HIS : no HE2:sc= -0.208 K(o=-0.21,f=-1.7) USER MOD Single : A 46 ASN : amide:sc= 0.757 K(o=0.76,f=-3!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.0112 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= -0.22 USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 72 SER OG : rot 27:sc= 1.05 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= -1.12 USER MOD Single : A 78 SER OG : rot -51:sc= 0.341 USER MOD Single : A 80 SER OG : rot -118:sc= 0.276 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 135:sc= -1.75! USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.222 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot -125:sc= 1.23 USER MOD Single : A 90 THR OG1 : rot 130:sc= 0.273 USER MOD Single : A 95 TYR OH : rot -127:sc= -0.936! USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 THR OG1 : rot 180:sc=-0.00283 USER MOD Single : A 110 THR OG1 : rot -154:sc= 0.594 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -0.988 K(o=-0.99,f=-0.36) USER MOD Single : A 134 THR OG1 : rot 180:sc=-0.00569 USER MOD Single : A 135 ASN : amide:sc= -0.0108 X(o=-0.011,f=-0.49) USER MOD Single : A 147 ASN : amide:sc= 0.388 K(o=0.39,f=-0.33) USER MOD Single : A 151 ASN : amide:sc= -0.539 X(o=-0.54,f=-0.066) USER MOD Single : A 152 ASN : amide:sc= -0.46 X(o=-0.46,f=0) USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 23 N ALA A 2 14.381 4.410 0.025 1.00 0.00 N ATOM 24 CA ALA A 2 13.268 4.877 0.791 1.00 0.00 C ATOM 25 C ALA A 2 12.022 4.912 -0.077 1.00 0.00 C ATOM 26 O ALA A 2 12.034 4.418 -1.213 1.00 0.00 O ATOM 27 CB ALA A 2 13.602 6.248 1.341 1.00 0.00 C ATOM 0 HA ALA A 2 13.068 4.203 1.624 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.762 6.619 1.929 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.486 6.180 1.975 1.00 0.00 H new ATOM 0 HB3 ALA A 2 13.798 6.933 0.516 1.00 0.00 H new ATOM 33 N CYS A 3 10.959 5.478 0.421 1.00 0.00 N ATOM 34 CA CYS A 3 9.729 5.484 -0.317 1.00 0.00 C ATOM 35 C CYS A 3 8.916 6.698 0.082 1.00 0.00 C ATOM 36 O CYS A 3 9.108 7.253 1.171 1.00 0.00 O ATOM 37 CB CYS A 3 8.971 4.190 -0.041 1.00 0.00 C ATOM 38 SG CYS A 3 7.564 3.823 -1.152 1.00 0.00 S ATOM 0 H CYS A 3 10.919 5.939 1.330 1.00 0.00 H new ATOM 0 HA CYS A 3 9.926 5.541 -1.388 1.00 0.00 H new ATOM 0 HB2 CYS A 3 9.677 3.361 -0.097 1.00 0.00 H new ATOM 0 HB3 CYS A 3 8.599 4.223 0.983 1.00 0.00 H new ATOM 43 N LYS A 4 8.012 7.092 -0.771 1.00 0.00 N ATOM 44 CA LYS A 4 7.243 8.303 -0.586 1.00 0.00 C ATOM 45 C LYS A 4 5.799 8.124 -1.075 1.00 0.00 C ATOM 46 O LYS A 4 5.490 7.197 -1.824 1.00 0.00 O ATOM 47 CB LYS A 4 7.964 9.478 -1.306 1.00 0.00 C ATOM 48 CG LYS A 4 8.097 9.371 -2.813 1.00 0.00 C ATOM 49 CD LYS A 4 6.944 9.997 -3.527 1.00 0.00 C ATOM 50 CE LYS A 4 7.195 10.023 -5.002 1.00 0.00 C ATOM 51 NZ LYS A 4 8.353 10.848 -5.387 1.00 0.00 N ATOM 0 H LYS A 4 7.782 6.581 -1.623 1.00 0.00 H new ATOM 0 HA LYS A 4 7.179 8.535 0.477 1.00 0.00 H new ATOM 0 HB2 LYS A 4 7.428 10.399 -1.076 1.00 0.00 H new ATOM 0 HB3 LYS A 4 8.963 9.576 -0.882 1.00 0.00 H new ATOM 0 HG2 LYS A 4 9.023 9.852 -3.129 1.00 0.00 H new ATOM 0 HG3 LYS A 4 8.171 8.321 -3.096 1.00 0.00 H new ATOM 0 HD2 LYS A 4 6.032 9.439 -3.317 1.00 0.00 H new ATOM 0 HD3 LYS A 4 6.789 11.012 -3.160 1.00 0.00 H new ATOM 0 HE2 LYS A 4 7.353 9.003 -5.354 1.00 0.00 H new ATOM 0 HE3 LYS A 4 6.306 10.401 -5.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 8.253 11.145 -6.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 8.398 11.689 -4.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 9.226 10.293 -5.278 1.00 0.00 H new ATOM 65 N THR A 5 4.924 8.996 -0.627 1.00 0.00 N ATOM 66 CA THR A 5 3.530 8.951 -1.024 1.00 0.00 C ATOM 67 C THR A 5 3.251 9.967 -2.096 1.00 0.00 C ATOM 68 O THR A 5 4.083 10.808 -2.409 1.00 0.00 O ATOM 69 CB THR A 5 2.568 9.273 0.130 1.00 0.00 C ATOM 70 OG1 THR A 5 2.847 10.581 0.654 1.00 0.00 O ATOM 71 CG2 THR A 5 2.637 8.259 1.230 1.00 0.00 C ATOM 0 H THR A 5 5.154 9.752 0.018 1.00 0.00 H new ATOM 0 HA THR A 5 3.364 7.931 -1.371 1.00 0.00 H new ATOM 0 HB THR A 5 1.557 9.245 -0.276 1.00 0.00 H new ATOM 0 HG1 THR A 5 2.694 10.585 1.622 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.939 8.532 2.021 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.374 7.277 0.837 1.00 0.00 H new ATOM 0 HG23 THR A 5 3.649 8.229 1.634 1.00 0.00 H new ATOM 79 N ALA A 6 2.037 9.942 -2.574 1.00 0.00 N ATOM 80 CA ALA A 6 1.583 10.859 -3.589 1.00 0.00 C ATOM 81 C ALA A 6 1.311 12.227 -2.995 1.00 0.00 C ATOM 82 O ALA A 6 1.268 13.223 -3.714 1.00 0.00 O ATOM 83 CB ALA A 6 0.334 10.319 -4.268 1.00 0.00 C ATOM 0 H ALA A 6 1.326 9.278 -2.268 1.00 0.00 H new ATOM 0 HA ALA A 6 2.371 10.961 -4.335 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.002 11.022 -5.032 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.558 9.358 -4.732 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.455 10.189 -3.528 1.00 0.00 H new ATOM 89 N ASN A 7 1.128 12.289 -1.678 1.00 0.00 N ATOM 90 CA ASN A 7 0.853 13.574 -1.053 1.00 0.00 C ATOM 91 C ASN A 7 2.153 14.305 -0.794 1.00 0.00 C ATOM 92 O ASN A 7 2.214 15.536 -0.896 1.00 0.00 O ATOM 93 CB ASN A 7 -0.009 13.490 0.246 1.00 0.00 C ATOM 94 CG ASN A 7 0.751 13.133 1.521 1.00 0.00 C ATOM 95 OD1 ASN A 7 1.337 13.995 2.163 1.00 0.00 O ATOM 96 ND2 ASN A 7 0.654 11.907 1.957 1.00 0.00 N ATOM 0 H ASN A 7 1.164 11.492 -1.043 1.00 0.00 H new ATOM 0 HA ASN A 7 0.242 14.134 -1.761 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -0.503 14.450 0.396 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -0.793 12.749 0.093 1.00 0.00 H new ATOM 0 HD21 ASN A 7 1.072 11.649 2.851 1.00 0.00 H new ATOM 0 HD22 ASN A 7 0.161 11.206 1.404 1.00 0.00 H new ATOM 103 N GLY A 8 3.202 13.552 -0.482 1.00 0.00 N ATOM 104 CA GLY A 8 4.490 14.164 -0.277 1.00 0.00 C ATOM 105 C GLY A 8 5.136 13.719 1.002 1.00 0.00 C ATOM 106 O GLY A 8 5.918 14.451 1.602 1.00 0.00 O ATOM 0 H GLY A 8 3.179 12.538 -0.369 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.143 13.920 -1.115 1.00 0.00 H new ATOM 0 HA3 GLY A 8 4.377 15.248 -0.266 1.00 0.00 H new ATOM 110 N THR A 9 4.804 12.539 1.445 1.00 0.00 N ATOM 111 CA THR A 9 5.398 12.011 2.625 1.00 0.00 C ATOM 112 C THR A 9 6.486 11.054 2.225 1.00 0.00 C ATOM 113 O THR A 9 6.212 9.926 1.820 1.00 0.00 O ATOM 114 CB THR A 9 4.351 11.282 3.478 1.00 0.00 C ATOM 115 OG1 THR A 9 3.179 12.110 3.573 1.00 0.00 O ATOM 116 CG2 THR A 9 4.890 11.019 4.879 1.00 0.00 C ATOM 0 H THR A 9 4.121 11.927 0.999 1.00 0.00 H new ATOM 0 HA THR A 9 5.812 12.826 3.219 1.00 0.00 H new ATOM 0 HB THR A 9 4.111 10.327 3.011 1.00 0.00 H new ATOM 0 HG1 THR A 9 2.566 11.734 4.239 1.00 0.00 H new ATOM 0 HG21 THR A 9 4.133 10.501 5.469 1.00 0.00 H new ATOM 0 HG22 THR A 9 5.785 10.401 4.814 1.00 0.00 H new ATOM 0 HG23 THR A 9 5.137 11.967 5.357 1.00 0.00 H new ATOM 124 N ALA A 10 7.690 11.529 2.263 1.00 0.00 N ATOM 125 CA ALA A 10 8.827 10.716 1.990 1.00 0.00 C ATOM 126 C ALA A 10 9.326 10.160 3.298 1.00 0.00 C ATOM 127 O ALA A 10 9.583 10.918 4.250 1.00 0.00 O ATOM 128 CB ALA A 10 9.916 11.523 1.294 1.00 0.00 C ATOM 0 H ALA A 10 7.911 12.499 2.486 1.00 0.00 H new ATOM 0 HA ALA A 10 8.552 9.902 1.319 1.00 0.00 H new ATOM 0 HB1 ALA A 10 10.774 10.881 1.096 1.00 0.00 H new ATOM 0 HB2 ALA A 10 9.532 11.916 0.353 1.00 0.00 H new ATOM 0 HB3 ALA A 10 10.222 12.350 1.935 1.00 0.00 H new ATOM 134 N ILE A 11 9.389 8.870 3.381 1.00 0.00 N ATOM 135 CA ILE A 11 9.877 8.201 4.570 1.00 0.00 C ATOM 136 C ILE A 11 11.334 7.840 4.356 1.00 0.00 C ATOM 137 O ILE A 11 11.637 7.086 3.444 1.00 0.00 O ATOM 138 CB ILE A 11 9.106 6.890 4.854 1.00 0.00 C ATOM 139 CG1 ILE A 11 7.599 7.129 4.944 1.00 0.00 C ATOM 140 CG2 ILE A 11 9.607 6.259 6.156 1.00 0.00 C ATOM 141 CD1 ILE A 11 6.817 5.843 5.048 1.00 0.00 C ATOM 0 H ILE A 11 9.106 8.239 2.631 1.00 0.00 H new ATOM 0 HA ILE A 11 9.741 8.877 5.414 1.00 0.00 H new ATOM 0 HB ILE A 11 9.290 6.211 4.021 1.00 0.00 H new ATOM 0 HG12 ILE A 11 7.384 7.753 5.812 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.269 7.682 4.065 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.059 5.337 6.348 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.670 6.037 6.067 1.00 0.00 H new ATOM 0 HG23 ILE A 11 9.449 6.953 6.981 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.752 6.069 5.109 1.00 0.00 H new ATOM 0 HD12 ILE A 11 7.008 5.229 4.168 1.00 0.00 H new ATOM 0 HD13 ILE A 11 7.125 5.301 5.942 1.00 0.00 H new ATOM 153 N PRO A 12 12.253 8.387 5.165 1.00 0.00 N ATOM 154 CA PRO A 12 13.684 8.084 5.055 1.00 0.00 C ATOM 155 C PRO A 12 14.015 6.694 5.621 1.00 0.00 C ATOM 156 O PRO A 12 13.163 6.032 6.242 1.00 0.00 O ATOM 157 CB PRO A 12 14.329 9.169 5.918 1.00 0.00 C ATOM 158 CG PRO A 12 13.300 9.493 6.944 1.00 0.00 C ATOM 159 CD PRO A 12 11.973 9.345 6.258 1.00 0.00 C ATOM 0 HA PRO A 12 14.031 8.072 4.022 1.00 0.00 H new ATOM 0 HB2 PRO A 12 15.250 8.813 6.379 1.00 0.00 H new ATOM 0 HB3 PRO A 12 14.587 10.046 5.325 1.00 0.00 H new ATOM 0 HG2 PRO A 12 13.375 8.820 7.798 1.00 0.00 H new ATOM 0 HG3 PRO A 12 13.433 10.506 7.324 1.00 0.00 H new ATOM 0 HD2 PRO A 12 11.210 8.966 6.938 1.00 0.00 H new ATOM 0 HD3 PRO A 12 11.612 10.299 5.873 1.00 0.00 H new ATOM 167 N ILE A 13 15.247 6.259 5.406 1.00 0.00 N ATOM 168 CA ILE A 13 15.703 4.976 5.894 1.00 0.00 C ATOM 169 C ILE A 13 15.760 5.000 7.412 1.00 0.00 C ATOM 170 O ILE A 13 16.375 5.885 8.007 1.00 0.00 O ATOM 171 CB ILE A 13 17.101 4.601 5.333 1.00 0.00 C ATOM 172 CG1 ILE A 13 17.071 4.573 3.808 1.00 0.00 C ATOM 173 CG2 ILE A 13 17.544 3.243 5.874 1.00 0.00 C ATOM 174 CD1 ILE A 13 18.411 4.292 3.164 1.00 0.00 C ATOM 0 H ILE A 13 15.952 6.786 4.891 1.00 0.00 H new ATOM 0 HA ILE A 13 14.993 4.223 5.552 1.00 0.00 H new ATOM 0 HB ILE A 13 17.817 5.357 5.656 1.00 0.00 H new ATOM 0 HG12 ILE A 13 16.359 3.814 3.484 1.00 0.00 H new ATOM 0 HG13 ILE A 13 16.701 5.532 3.446 1.00 0.00 H new ATOM 0 HG21 ILE A 13 18.526 2.994 5.472 1.00 0.00 H new ATOM 0 HG22 ILE A 13 17.597 3.285 6.962 1.00 0.00 H new ATOM 0 HG23 ILE A 13 16.825 2.480 5.575 1.00 0.00 H new ATOM 0 HD11 ILE A 13 18.300 4.290 2.080 1.00 0.00 H new ATOM 0 HD12 ILE A 13 19.123 5.064 3.454 1.00 0.00 H new ATOM 0 HD13 ILE A 13 18.776 3.319 3.493 1.00 0.00 H new ATOM 186 N GLY A 14 15.131 4.033 8.017 1.00 0.00 N ATOM 187 CA GLY A 14 15.076 3.973 9.463 1.00 0.00 C ATOM 188 C GLY A 14 13.715 3.576 9.957 1.00 0.00 C ATOM 189 O GLY A 14 13.478 3.469 11.171 1.00 0.00 O ATOM 0 H GLY A 14 14.647 3.273 7.539 1.00 0.00 H new ATOM 0 HA2 GLY A 14 15.816 3.259 9.825 1.00 0.00 H new ATOM 0 HA3 GLY A 14 15.343 4.945 9.877 1.00 0.00 H new ATOM 193 N GLY A 15 12.822 3.340 9.026 1.00 0.00 N ATOM 194 CA GLY A 15 11.484 2.979 9.367 1.00 0.00 C ATOM 195 C GLY A 15 10.635 4.205 9.509 1.00 0.00 C ATOM 196 O GLY A 15 11.157 5.326 9.529 1.00 0.00 O ATOM 0 H GLY A 15 13.008 3.394 8.024 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.069 2.328 8.598 1.00 0.00 H new ATOM 0 HA3 GLY A 15 11.479 2.415 10.300 1.00 0.00 H new ATOM 200 N GLY A 16 9.362 4.033 9.597 1.00 0.00 N ATOM 201 CA GLY A 16 8.497 5.159 9.757 1.00 0.00 C ATOM 202 C GLY A 16 7.133 4.852 9.263 1.00 0.00 C ATOM 203 O GLY A 16 6.814 3.686 9.024 1.00 0.00 O ATOM 0 H GLY A 16 8.894 3.128 9.561 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.452 5.442 10.809 1.00 0.00 H new ATOM 0 HA3 GLY A 16 8.901 6.013 9.214 1.00 0.00 H new ATOM 207 N SER A 17 6.337 5.859 9.077 1.00 0.00 N ATOM 208 CA SER A 17 4.994 5.674 8.649 1.00 0.00 C ATOM 209 C SER A 17 4.528 6.871 7.836 1.00 0.00 C ATOM 210 O SER A 17 4.976 8.000 8.071 1.00 0.00 O ATOM 211 CB SER A 17 4.093 5.424 9.867 1.00 0.00 C ATOM 212 OG SER A 17 4.192 6.467 10.830 1.00 0.00 O ATOM 0 H SER A 17 6.605 6.833 9.219 1.00 0.00 H new ATOM 0 HA SER A 17 4.934 4.800 8.001 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.058 5.332 9.539 1.00 0.00 H new ATOM 0 HB3 SER A 17 4.366 4.476 10.331 1.00 0.00 H new ATOM 0 HG SER A 17 3.602 6.270 11.587 1.00 0.00 H new ATOM 218 N ALA A 18 3.680 6.628 6.872 1.00 0.00 N ATOM 219 CA ALA A 18 3.147 7.666 6.049 1.00 0.00 C ATOM 220 C ALA A 18 1.668 7.487 5.957 1.00 0.00 C ATOM 221 O ALA A 18 1.136 6.409 6.297 1.00 0.00 O ATOM 222 CB ALA A 18 3.755 7.622 4.662 1.00 0.00 C ATOM 0 H ALA A 18 3.341 5.695 6.639 1.00 0.00 H new ATOM 0 HA ALA A 18 3.386 8.633 6.491 1.00 0.00 H new ATOM 0 HB1 ALA A 18 3.333 8.422 4.054 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.835 7.752 4.734 1.00 0.00 H new ATOM 0 HB3 ALA A 18 3.535 6.660 4.199 1.00 0.00 H new ATOM 228 N ASN A 19 1.001 8.509 5.534 1.00 0.00 N ATOM 229 CA ASN A 19 -0.418 8.472 5.368 1.00 0.00 C ATOM 230 C ASN A 19 -0.694 8.672 3.907 1.00 0.00 C ATOM 231 O ASN A 19 -0.468 9.748 3.353 1.00 0.00 O ATOM 232 CB ASN A 19 -1.101 9.571 6.204 1.00 0.00 C ATOM 233 CG ASN A 19 -0.711 9.526 7.677 1.00 0.00 C ATOM 234 OD1 ASN A 19 -1.365 8.896 8.499 1.00 0.00 O ATOM 235 ND2 ASN A 19 0.368 10.173 8.007 1.00 0.00 N ATOM 0 H ASN A 19 1.428 9.403 5.291 1.00 0.00 H new ATOM 0 HA ASN A 19 -0.818 7.518 5.712 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -0.840 10.547 5.794 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -2.183 9.467 6.117 1.00 0.00 H new ATOM 0 HD21 ASN A 19 0.692 10.165 8.974 1.00 0.00 H new ATOM 0 HD22 ASN A 19 0.890 10.688 7.299 1.00 0.00 H new ATOM 242 N VAL A 20 -1.091 7.634 3.268 1.00 0.00 N ATOM 243 CA VAL A 20 -1.382 7.678 1.851 1.00 0.00 C ATOM 244 C VAL A 20 -2.876 8.006 1.700 1.00 0.00 C ATOM 245 O VAL A 20 -3.669 7.657 2.568 1.00 0.00 O ATOM 246 CB VAL A 20 -1.024 6.321 1.137 1.00 0.00 C ATOM 247 CG1 VAL A 20 -0.145 5.449 2.001 1.00 0.00 C ATOM 248 CG2 VAL A 20 -2.234 5.589 0.583 1.00 0.00 C ATOM 0 H VAL A 20 -1.229 6.719 3.698 1.00 0.00 H new ATOM 0 HA VAL A 20 -0.771 8.442 1.370 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.436 6.584 0.258 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.080 4.522 1.473 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.784 5.975 2.222 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -0.663 5.220 2.932 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.912 4.664 0.105 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.923 5.358 1.396 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.737 6.220 -0.150 1.00 0.00 H new ATOM 258 N TYR A 21 -3.252 8.664 0.636 1.00 0.00 N ATOM 259 CA TYR A 21 -4.628 9.066 0.441 1.00 0.00 C ATOM 260 C TYR A 21 -5.069 8.700 -0.929 1.00 0.00 C ATOM 261 O TYR A 21 -4.638 9.293 -1.898 1.00 0.00 O ATOM 262 CB TYR A 21 -4.808 10.562 0.677 1.00 0.00 C ATOM 263 CG TYR A 21 -4.733 10.963 2.122 1.00 0.00 C ATOM 264 CD1 TYR A 21 -3.517 11.118 2.763 1.00 0.00 C ATOM 265 CD2 TYR A 21 -5.889 11.194 2.843 1.00 0.00 C ATOM 266 CE1 TYR A 21 -3.455 11.491 4.085 1.00 0.00 C ATOM 267 CE2 TYR A 21 -5.840 11.565 4.167 1.00 0.00 C ATOM 268 CZ TYR A 21 -4.620 11.712 4.783 1.00 0.00 C ATOM 269 OH TYR A 21 -4.562 12.098 6.095 1.00 0.00 O ATOM 0 H TYR A 21 -2.622 8.937 -0.118 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.245 8.540 1.170 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -4.043 11.102 0.120 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -5.773 10.870 0.274 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.602 10.943 2.217 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -6.848 11.081 2.359 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -2.498 11.610 4.572 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.753 11.739 4.718 1.00 0.00 H new ATOM 0 HH TYR A 21 -5.471 12.214 6.442 1.00 0.00 H new ATOM 279 N VAL A 22 -5.958 7.777 -0.996 1.00 0.00 N ATOM 280 CA VAL A 22 -6.398 7.212 -2.246 1.00 0.00 C ATOM 281 C VAL A 22 -7.867 7.478 -2.489 1.00 0.00 C ATOM 282 O VAL A 22 -8.710 7.349 -1.593 1.00 0.00 O ATOM 283 CB VAL A 22 -6.084 5.699 -2.307 1.00 0.00 C ATOM 284 CG1 VAL A 22 -6.645 4.990 -1.113 1.00 0.00 C ATOM 285 CG2 VAL A 22 -6.570 5.056 -3.605 1.00 0.00 C ATOM 0 H VAL A 22 -6.416 7.377 -0.177 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.844 7.703 -3.046 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.999 5.597 -2.291 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -6.412 3.927 -1.178 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -6.206 5.403 -0.205 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -7.727 5.123 -1.086 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -6.326 3.994 -3.599 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -7.650 5.179 -3.690 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -6.082 5.535 -4.454 1.00 0.00 H new ATOM 295 N ASN A 23 -8.155 7.922 -3.661 1.00 0.00 N ATOM 296 CA ASN A 23 -9.502 8.220 -4.059 1.00 0.00 C ATOM 297 C ASN A 23 -10.072 7.083 -4.834 1.00 0.00 C ATOM 298 O ASN A 23 -9.489 6.615 -5.805 1.00 0.00 O ATOM 299 CB ASN A 23 -9.615 9.562 -4.816 1.00 0.00 C ATOM 300 CG ASN A 23 -8.547 9.758 -5.861 1.00 0.00 C ATOM 301 OD1 ASN A 23 -8.714 9.417 -7.024 1.00 0.00 O ATOM 302 ND2 ASN A 23 -7.431 10.317 -5.440 1.00 0.00 N ATOM 0 H ASN A 23 -7.459 8.094 -4.386 1.00 0.00 H new ATOM 0 HA ASN A 23 -10.097 8.346 -3.154 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -10.593 9.619 -5.293 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -9.563 10.380 -4.098 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -6.665 10.481 -6.093 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -7.333 10.586 -4.461 1.00 0.00 H new ATOM 309 N LEU A 24 -11.168 6.603 -4.349 1.00 0.00 N ATOM 310 CA LEU A 24 -11.860 5.487 -4.935 1.00 0.00 C ATOM 311 C LEU A 24 -13.084 6.004 -5.606 1.00 0.00 C ATOM 312 O LEU A 24 -13.516 7.132 -5.321 1.00 0.00 O ATOM 313 CB LEU A 24 -12.294 4.456 -3.866 1.00 0.00 C ATOM 314 CG LEU A 24 -11.208 3.770 -3.029 1.00 0.00 C ATOM 315 CD1 LEU A 24 -10.091 3.235 -3.898 1.00 0.00 C ATOM 316 CD2 LEU A 24 -10.694 4.664 -1.902 1.00 0.00 C ATOM 0 H LEU A 24 -11.623 6.978 -3.517 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.187 4.992 -5.636 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.975 4.958 -3.179 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -12.866 3.677 -4.370 1.00 0.00 H new ATOM 0 HG LEU A 24 -11.672 2.911 -2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.340 2.756 -3.271 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -10.494 2.507 -4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.633 4.057 -4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.927 4.134 -1.338 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.269 5.575 -2.325 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -11.519 4.923 -1.238 1.00 0.00 H new ATOM 328 N ALA A 25 -13.612 5.217 -6.507 1.00 0.00 N ATOM 329 CA ALA A 25 -14.850 5.514 -7.188 1.00 0.00 C ATOM 330 C ALA A 25 -15.944 5.760 -6.158 1.00 0.00 C ATOM 331 O ALA A 25 -16.217 4.904 -5.348 1.00 0.00 O ATOM 332 CB ALA A 25 -15.231 4.345 -8.074 1.00 0.00 C ATOM 0 H ALA A 25 -13.188 4.335 -6.795 1.00 0.00 H new ATOM 0 HA ALA A 25 -14.727 6.405 -7.804 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -16.166 4.568 -8.589 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.444 4.174 -8.809 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -15.358 3.451 -7.463 1.00 0.00 H new ATOM 338 N PRO A 26 -16.570 6.941 -6.177 1.00 0.00 N ATOM 339 CA PRO A 26 -17.603 7.316 -5.195 1.00 0.00 C ATOM 340 C PRO A 26 -18.949 6.616 -5.441 1.00 0.00 C ATOM 341 O PRO A 26 -19.928 6.847 -4.722 1.00 0.00 O ATOM 342 CB PRO A 26 -17.732 8.824 -5.390 1.00 0.00 C ATOM 343 CG PRO A 26 -17.344 9.052 -6.813 1.00 0.00 C ATOM 344 CD PRO A 26 -16.309 8.023 -7.143 1.00 0.00 C ATOM 0 HA PRO A 26 -17.328 7.021 -4.183 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -18.750 9.163 -5.197 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -17.079 9.370 -4.708 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -18.208 8.957 -7.470 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -16.948 10.058 -6.950 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -16.406 7.674 -8.171 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -15.300 8.421 -7.035 1.00 0.00 H new ATOM 352 N VAL A 27 -18.973 5.783 -6.447 1.00 0.00 N ATOM 353 CA VAL A 27 -20.125 5.011 -6.829 1.00 0.00 C ATOM 354 C VAL A 27 -19.695 3.562 -6.951 1.00 0.00 C ATOM 355 O VAL A 27 -18.934 3.213 -7.856 1.00 0.00 O ATOM 356 CB VAL A 27 -20.687 5.448 -8.206 1.00 0.00 C ATOM 357 CG1 VAL A 27 -21.858 4.565 -8.595 1.00 0.00 C ATOM 358 CG2 VAL A 27 -21.102 6.907 -8.194 1.00 0.00 C ATOM 0 H VAL A 27 -18.163 5.618 -7.044 1.00 0.00 H new ATOM 0 HA VAL A 27 -20.899 5.158 -6.075 1.00 0.00 H new ATOM 0 HB VAL A 27 -19.896 5.335 -8.947 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -22.245 4.880 -9.564 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -21.527 3.528 -8.657 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -22.644 4.651 -7.844 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -21.492 7.182 -9.174 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -21.875 7.059 -7.440 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -20.238 7.529 -7.959 1.00 0.00 H new ATOM 368 N VAL A 28 -20.140 2.729 -6.048 1.00 0.00 N ATOM 369 CA VAL A 28 -19.781 1.323 -6.060 1.00 0.00 C ATOM 370 C VAL A 28 -20.967 0.546 -5.551 1.00 0.00 C ATOM 371 O VAL A 28 -21.326 0.660 -4.427 1.00 0.00 O ATOM 372 CB VAL A 28 -18.571 0.991 -5.140 1.00 0.00 C ATOM 373 CG1 VAL A 28 -18.018 -0.369 -5.467 1.00 0.00 C ATOM 374 CG2 VAL A 28 -17.485 2.019 -5.224 1.00 0.00 C ATOM 0 H VAL A 28 -20.759 2.998 -5.283 1.00 0.00 H new ATOM 0 HA VAL A 28 -19.501 1.062 -7.081 1.00 0.00 H new ATOM 0 HB VAL A 28 -18.944 0.996 -4.116 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -17.172 -0.585 -4.814 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -18.792 -1.122 -5.319 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -17.688 -0.388 -6.506 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -16.666 1.738 -4.562 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -17.119 2.079 -6.249 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -17.879 2.990 -4.922 1.00 0.00 H new ATOM 384 N ASN A 29 -21.571 -0.190 -6.387 1.00 0.00 N ATOM 385 CA ASN A 29 -22.760 -0.970 -6.040 1.00 0.00 C ATOM 386 C ASN A 29 -22.416 -2.415 -5.794 1.00 0.00 C ATOM 387 O ASN A 29 -21.416 -2.888 -6.280 1.00 0.00 O ATOM 388 CB ASN A 29 -23.810 -0.841 -7.146 1.00 0.00 C ATOM 389 CG ASN A 29 -23.207 -0.718 -8.523 1.00 0.00 C ATOM 390 OD1 ASN A 29 -22.975 -1.698 -9.204 1.00 0.00 O ATOM 391 ND2 ASN A 29 -22.930 0.506 -8.923 1.00 0.00 N ATOM 0 H ASN A 29 -21.277 -0.294 -7.358 1.00 0.00 H new ATOM 0 HA ASN A 29 -23.173 -0.571 -5.113 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -24.466 -1.711 -7.119 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -24.431 0.032 -6.949 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -22.504 0.660 -9.837 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -23.142 1.300 -8.319 1.00 0.00 H new ATOM 398 N VAL A 30 -23.220 -3.082 -4.959 1.00 0.00 N ATOM 399 CA VAL A 30 -23.070 -4.513 -4.666 1.00 0.00 C ATOM 400 C VAL A 30 -22.867 -5.333 -5.946 1.00 0.00 C ATOM 401 O VAL A 30 -23.756 -5.409 -6.808 1.00 0.00 O ATOM 402 CB VAL A 30 -24.292 -5.053 -3.853 1.00 0.00 C ATOM 403 CG1 VAL A 30 -24.322 -6.573 -3.836 1.00 0.00 C ATOM 404 CG2 VAL A 30 -24.235 -4.525 -2.419 1.00 0.00 C ATOM 0 H VAL A 30 -23.997 -2.643 -4.465 1.00 0.00 H new ATOM 0 HA VAL A 30 -22.175 -4.626 -4.053 1.00 0.00 H new ATOM 0 HB VAL A 30 -25.201 -4.701 -4.341 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -25.184 -6.914 -3.262 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -24.395 -6.947 -4.857 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -23.408 -6.950 -3.376 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -25.089 -4.904 -1.857 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -23.312 -4.858 -1.945 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -24.264 -3.435 -2.431 1.00 0.00 H new ATOM 414 N GLY A 31 -21.682 -5.904 -6.059 1.00 0.00 N ATOM 415 CA GLY A 31 -21.324 -6.701 -7.212 1.00 0.00 C ATOM 416 C GLY A 31 -20.375 -5.986 -8.149 1.00 0.00 C ATOM 417 O GLY A 31 -20.036 -6.497 -9.216 1.00 0.00 O ATOM 0 H GLY A 31 -20.946 -5.828 -5.357 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -20.864 -7.631 -6.876 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -22.229 -6.971 -7.756 1.00 0.00 H new ATOM 421 N GLN A 32 -19.961 -4.806 -7.754 1.00 0.00 N ATOM 422 CA GLN A 32 -18.977 -4.007 -8.473 1.00 0.00 C ATOM 423 C GLN A 32 -17.593 -4.559 -8.241 1.00 0.00 C ATOM 424 O GLN A 32 -17.442 -5.619 -7.619 1.00 0.00 O ATOM 425 CB GLN A 32 -19.060 -2.561 -8.023 1.00 0.00 C ATOM 426 CG GLN A 32 -19.652 -1.642 -9.074 1.00 0.00 C ATOM 427 CD GLN A 32 -18.606 -1.020 -9.960 1.00 0.00 C ATOM 428 OE1 GLN A 32 -18.819 -0.813 -11.145 1.00 0.00 O ATOM 429 NE2 GLN A 32 -17.530 -0.593 -9.372 1.00 0.00 N ATOM 0 H GLN A 32 -20.303 -4.357 -6.904 1.00 0.00 H new ATOM 0 HA GLN A 32 -19.190 -4.051 -9.541 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -19.664 -2.503 -7.117 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -18.061 -2.210 -7.763 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -20.354 -2.205 -9.689 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -20.221 -0.853 -8.582 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -17.381 -0.782 -8.381 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -16.834 -0.068 -9.901 1.00 0.00 H new ATOM 438 N ASN A 33 -16.593 -3.912 -8.782 1.00 0.00 N ATOM 439 CA ASN A 33 -15.236 -4.331 -8.562 1.00 0.00 C ATOM 440 C ASN A 33 -14.431 -3.111 -8.224 1.00 0.00 C ATOM 441 O ASN A 33 -13.930 -2.420 -9.109 1.00 0.00 O ATOM 442 CB ASN A 33 -14.656 -4.997 -9.800 1.00 0.00 C ATOM 443 CG ASN A 33 -13.460 -5.918 -9.492 1.00 0.00 C ATOM 444 OD1 ASN A 33 -13.232 -6.894 -10.197 1.00 0.00 O ATOM 445 ND2 ASN A 33 -12.693 -5.635 -8.450 1.00 0.00 N ATOM 0 H ASN A 33 -16.695 -3.091 -9.379 1.00 0.00 H new ATOM 0 HA ASN A 33 -15.207 -5.059 -7.752 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -15.437 -5.578 -10.291 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -14.341 -4.227 -10.505 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.898 -6.233 -8.224 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -12.897 -4.819 -7.873 1.00 0.00 H new ATOM 452 N LEU A 34 -14.327 -2.820 -6.970 1.00 0.00 N ATOM 453 CA LEU A 34 -13.592 -1.658 -6.563 1.00 0.00 C ATOM 454 C LEU A 34 -12.147 -2.032 -6.297 1.00 0.00 C ATOM 455 O LEU A 34 -11.861 -3.141 -5.839 1.00 0.00 O ATOM 456 CB LEU A 34 -14.208 -1.022 -5.339 1.00 0.00 C ATOM 457 CG LEU A 34 -13.653 0.350 -4.985 1.00 0.00 C ATOM 458 CD1 LEU A 34 -13.923 1.348 -6.102 1.00 0.00 C ATOM 459 CD2 LEU A 34 -14.186 0.836 -3.657 1.00 0.00 C ATOM 0 H LEU A 34 -14.737 -3.363 -6.210 1.00 0.00 H new ATOM 0 HA LEU A 34 -13.630 -0.926 -7.370 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.283 -0.934 -5.495 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.062 -1.688 -4.488 1.00 0.00 H new ATOM 0 HG LEU A 34 -12.572 0.259 -4.879 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -13.517 2.321 -5.826 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.448 1.004 -7.020 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -14.998 1.435 -6.260 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -13.769 1.818 -3.435 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.273 0.905 -3.704 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.901 0.135 -2.872 1.00 0.00 H new ATOM 471 N VAL A 35 -11.243 -1.132 -6.622 1.00 0.00 N ATOM 472 CA VAL A 35 -9.839 -1.362 -6.479 1.00 0.00 C ATOM 473 C VAL A 35 -9.188 -0.146 -5.883 1.00 0.00 C ATOM 474 O VAL A 35 -9.341 0.968 -6.388 1.00 0.00 O ATOM 475 CB VAL A 35 -9.176 -1.673 -7.849 1.00 0.00 C ATOM 476 CG1 VAL A 35 -7.713 -1.937 -7.685 1.00 0.00 C ATOM 477 CG2 VAL A 35 -9.852 -2.831 -8.566 1.00 0.00 C ATOM 0 H VAL A 35 -11.475 -0.212 -6.997 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.703 -2.223 -5.825 1.00 0.00 H new ATOM 0 HB VAL A 35 -9.304 -0.788 -8.473 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.271 -2.152 -8.658 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.231 -1.060 -7.253 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.569 -2.792 -7.024 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -9.353 -3.010 -9.518 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -9.789 -3.727 -7.949 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -10.899 -2.587 -8.745 1.00 0.00 H new ATOM 487 N VAL A 36 -8.498 -0.353 -4.807 1.00 0.00 N ATOM 488 CA VAL A 36 -7.751 0.670 -4.191 1.00 0.00 C ATOM 489 C VAL A 36 -6.362 0.613 -4.784 1.00 0.00 C ATOM 490 O VAL A 36 -5.503 -0.103 -4.285 1.00 0.00 O ATOM 491 CB VAL A 36 -7.669 0.429 -2.668 1.00 0.00 C ATOM 492 CG1 VAL A 36 -6.914 1.525 -2.000 1.00 0.00 C ATOM 493 CG2 VAL A 36 -9.051 0.257 -2.045 1.00 0.00 C ATOM 0 H VAL A 36 -8.444 -1.255 -4.333 1.00 0.00 H new ATOM 0 HA VAL A 36 -8.217 1.641 -4.356 1.00 0.00 H new ATOM 0 HB VAL A 36 -7.128 -0.504 -2.513 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -6.869 1.335 -0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -5.903 1.569 -2.404 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -7.417 2.475 -2.179 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -8.948 0.090 -0.973 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -9.642 1.156 -2.217 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -9.551 -0.598 -2.500 1.00 0.00 H new ATOM 503 N ASP A 37 -6.170 1.319 -5.864 1.00 0.00 N ATOM 504 CA ASP A 37 -4.894 1.322 -6.554 1.00 0.00 C ATOM 505 C ASP A 37 -3.923 2.205 -5.817 1.00 0.00 C ATOM 506 O ASP A 37 -4.124 3.410 -5.718 1.00 0.00 O ATOM 507 CB ASP A 37 -5.048 1.809 -7.997 1.00 0.00 C ATOM 508 CG ASP A 37 -3.743 1.764 -8.767 1.00 0.00 C ATOM 509 OD1 ASP A 37 -2.919 2.688 -8.631 1.00 0.00 O ATOM 510 OD2 ASP A 37 -3.520 0.797 -9.525 1.00 0.00 O ATOM 0 H ASP A 37 -6.883 1.907 -6.294 1.00 0.00 H new ATOM 0 HA ASP A 37 -4.515 0.300 -6.580 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -5.789 1.194 -8.508 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -5.429 2.830 -7.994 1.00 0.00 H new ATOM 515 N LEU A 38 -2.890 1.607 -5.284 1.00 0.00 N ATOM 516 CA LEU A 38 -1.893 2.335 -4.523 1.00 0.00 C ATOM 517 C LEU A 38 -0.704 2.657 -5.369 1.00 0.00 C ATOM 518 O LEU A 38 0.206 3.365 -4.954 1.00 0.00 O ATOM 519 CB LEU A 38 -1.466 1.539 -3.311 1.00 0.00 C ATOM 520 CG LEU A 38 -2.573 1.216 -2.332 1.00 0.00 C ATOM 521 CD1 LEU A 38 -2.023 0.497 -1.146 1.00 0.00 C ATOM 522 CD2 LEU A 38 -3.270 2.475 -1.908 1.00 0.00 C ATOM 0 H LEU A 38 -2.711 0.606 -5.361 1.00 0.00 H new ATOM 0 HA LEU A 38 -2.343 3.271 -4.190 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.017 0.605 -3.649 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.689 2.095 -2.786 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.297 0.566 -2.822 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.831 0.271 -0.450 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.553 -0.432 -1.469 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.283 1.125 -0.651 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.065 2.231 -1.203 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.554 3.144 -1.430 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.698 2.966 -2.782 1.00 0.00 H new ATOM 534 N SER A 39 -0.757 2.220 -6.582 1.00 0.00 N ATOM 535 CA SER A 39 0.309 2.407 -7.519 1.00 0.00 C ATOM 536 C SER A 39 0.245 3.817 -8.118 1.00 0.00 C ATOM 537 O SER A 39 1.040 4.206 -8.946 1.00 0.00 O ATOM 538 CB SER A 39 0.211 1.309 -8.554 1.00 0.00 C ATOM 539 OG SER A 39 0.214 0.058 -7.890 1.00 0.00 O ATOM 0 H SER A 39 -1.556 1.712 -6.961 1.00 0.00 H new ATOM 0 HA SER A 39 1.284 2.335 -7.037 1.00 0.00 H new ATOM 0 HB2 SER A 39 -0.700 1.423 -9.141 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.048 1.370 -9.250 1.00 0.00 H new ATOM 0 HG SER A 39 0.775 0.114 -7.089 1.00 0.00 H new ATOM 545 N THR A 40 -0.716 4.551 -7.671 1.00 0.00 N ATOM 546 CA THR A 40 -0.896 5.907 -8.039 1.00 0.00 C ATOM 547 C THR A 40 -0.867 6.785 -6.792 1.00 0.00 C ATOM 548 O THR A 40 -1.037 8.007 -6.863 1.00 0.00 O ATOM 549 CB THR A 40 -2.231 6.056 -8.800 1.00 0.00 C ATOM 550 OG1 THR A 40 -3.256 5.259 -8.151 1.00 0.00 O ATOM 551 CG2 THR A 40 -2.070 5.591 -10.232 1.00 0.00 C ATOM 0 H THR A 40 -1.420 4.209 -7.017 1.00 0.00 H new ATOM 0 HA THR A 40 -0.088 6.228 -8.696 1.00 0.00 H new ATOM 0 HB THR A 40 -2.523 7.106 -8.794 1.00 0.00 H new ATOM 0 HG1 THR A 40 -3.184 4.328 -8.449 1.00 0.00 H new ATOM 0 HG21 THR A 40 -3.018 5.701 -10.759 1.00 0.00 H new ATOM 0 HG22 THR A 40 -1.308 6.193 -10.727 1.00 0.00 H new ATOM 0 HG23 THR A 40 -1.768 4.544 -10.243 1.00 0.00 H new ATOM 559 N GLN A 41 -0.600 6.150 -5.641 1.00 0.00 N ATOM 560 CA GLN A 41 -0.661 6.841 -4.359 1.00 0.00 C ATOM 561 C GLN A 41 0.646 6.694 -3.594 1.00 0.00 C ATOM 562 O GLN A 41 0.928 7.471 -2.671 1.00 0.00 O ATOM 563 CB GLN A 41 -1.753 6.224 -3.490 1.00 0.00 C ATOM 564 CG GLN A 41 -3.032 5.894 -4.214 1.00 0.00 C ATOM 565 CD GLN A 41 -3.735 7.069 -4.844 1.00 0.00 C ATOM 566 OE1 GLN A 41 -3.659 8.205 -4.379 1.00 0.00 O ATOM 567 NE2 GLN A 41 -4.425 6.795 -5.906 1.00 0.00 N ATOM 0 H GLN A 41 -0.342 5.165 -5.579 1.00 0.00 H new ATOM 0 HA GLN A 41 -0.861 7.892 -4.567 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.364 5.312 -3.037 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -1.981 6.912 -2.676 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -2.812 5.163 -4.992 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -3.715 5.416 -3.512 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -4.461 5.838 -6.258 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.932 7.536 -6.390 1.00 0.00 H new ATOM 576 N ILE A 42 1.410 5.674 -3.929 1.00 0.00 N ATOM 577 CA ILE A 42 2.639 5.359 -3.218 1.00 0.00 C ATOM 578 C ILE A 42 3.732 5.053 -4.246 1.00 0.00 C ATOM 579 O ILE A 42 3.460 4.397 -5.266 1.00 0.00 O ATOM 580 CB ILE A 42 2.444 4.117 -2.294 1.00 0.00 C ATOM 581 CG1 ILE A 42 1.169 4.265 -1.442 1.00 0.00 C ATOM 582 CG2 ILE A 42 3.636 3.989 -1.377 1.00 0.00 C ATOM 583 CD1 ILE A 42 0.854 3.069 -0.572 1.00 0.00 C ATOM 0 H ILE A 42 1.200 5.040 -4.700 1.00 0.00 H new ATOM 0 HA ILE A 42 2.919 6.210 -2.598 1.00 0.00 H new ATOM 0 HB ILE A 42 2.348 3.229 -2.919 1.00 0.00 H new ATOM 0 HG12 ILE A 42 1.272 5.144 -0.806 1.00 0.00 H new ATOM 0 HG13 ILE A 42 0.324 4.449 -2.105 1.00 0.00 H new ATOM 0 HG21 ILE A 42 3.505 3.122 -0.729 1.00 0.00 H new ATOM 0 HG22 ILE A 42 4.541 3.864 -1.972 1.00 0.00 H new ATOM 0 HG23 ILE A 42 3.724 4.888 -0.767 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -0.059 3.260 -0.008 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.715 2.189 -1.200 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.678 2.895 0.119 1.00 0.00 H new ATOM 595 N PHE A 43 4.942 5.552 -4.010 1.00 0.00 N ATOM 596 CA PHE A 43 6.061 5.398 -4.954 1.00 0.00 C ATOM 597 C PHE A 43 7.352 5.207 -4.176 1.00 0.00 C ATOM 598 O PHE A 43 7.663 6.005 -3.296 1.00 0.00 O ATOM 599 CB PHE A 43 6.224 6.668 -5.804 1.00 0.00 C ATOM 600 CG PHE A 43 4.974 7.158 -6.465 1.00 0.00 C ATOM 601 CD1 PHE A 43 4.133 8.027 -5.794 1.00 0.00 C ATOM 602 CD2 PHE A 43 4.630 6.740 -7.729 1.00 0.00 C ATOM 603 CE1 PHE A 43 2.972 8.466 -6.369 1.00 0.00 C ATOM 604 CE2 PHE A 43 3.468 7.179 -8.323 1.00 0.00 C ATOM 605 CZ PHE A 43 2.631 8.044 -7.641 1.00 0.00 C ATOM 0 H PHE A 43 5.181 6.073 -3.166 1.00 0.00 H new ATOM 0 HA PHE A 43 5.853 4.540 -5.593 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.616 7.463 -5.169 1.00 0.00 H new ATOM 0 HB3 PHE A 43 6.972 6.477 -6.574 1.00 0.00 H new ATOM 0 HD1 PHE A 43 4.397 8.364 -4.802 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.278 6.060 -8.262 1.00 0.00 H new ATOM 0 HE1 PHE A 43 2.323 9.141 -5.831 1.00 0.00 H new ATOM 0 HE2 PHE A 43 3.211 6.849 -9.319 1.00 0.00 H new ATOM 0 HZ PHE A 43 1.716 8.388 -8.100 1.00 0.00 H new ATOM 615 N CYS A 44 8.118 4.216 -4.512 1.00 0.00 N ATOM 616 CA CYS A 44 9.336 3.950 -3.809 1.00 0.00 C ATOM 617 C CYS A 44 10.529 4.282 -4.682 1.00 0.00 C ATOM 618 O CYS A 44 10.454 4.214 -5.919 1.00 0.00 O ATOM 619 CB CYS A 44 9.385 2.511 -3.302 1.00 0.00 C ATOM 620 SG CYS A 44 8.062 2.078 -2.103 1.00 0.00 S ATOM 0 H CYS A 44 7.919 3.571 -5.277 1.00 0.00 H new ATOM 0 HA CYS A 44 9.374 4.593 -2.930 1.00 0.00 H new ATOM 0 HB2 CYS A 44 9.319 1.836 -4.156 1.00 0.00 H new ATOM 0 HB3 CYS A 44 10.353 2.338 -2.833 1.00 0.00 H new ATOM 625 N HIS A 45 11.610 4.650 -4.052 1.00 0.00 N ATOM 626 CA HIS A 45 12.800 5.098 -4.742 1.00 0.00 C ATOM 627 C HIS A 45 14.062 4.534 -4.123 1.00 0.00 C ATOM 628 O HIS A 45 14.273 4.596 -2.907 1.00 0.00 O ATOM 629 CB HIS A 45 12.863 6.649 -4.788 1.00 0.00 C ATOM 630 CG HIS A 45 12.573 7.348 -3.470 1.00 0.00 C ATOM 631 ND1 HIS A 45 13.531 7.829 -2.594 1.00 0.00 N ATOM 632 CD2 HIS A 45 11.377 7.674 -2.917 1.00 0.00 C ATOM 633 CE1 HIS A 45 12.897 8.415 -1.576 1.00 0.00 C ATOM 634 NE2 HIS A 45 11.589 8.350 -1.725 1.00 0.00 N ATOM 0 H HIS A 45 11.696 4.649 -3.036 1.00 0.00 H new ATOM 0 HA HIS A 45 12.739 4.720 -5.763 1.00 0.00 H new ATOM 0 HB2 HIS A 45 13.855 6.946 -5.128 1.00 0.00 H new ATOM 0 HB3 HIS A 45 12.151 7.004 -5.533 1.00 0.00 H new ATOM 0 HD1 HIS A 45 14.542 7.750 -2.706 1.00 0.00 H new ATOM 0 HD2 HIS A 45 10.410 7.443 -3.340 1.00 0.00 H new ATOM 0 HE1 HIS A 45 13.392 8.882 -0.738 1.00 0.00 H new ATOM 642 N ASN A 46 14.904 3.976 -4.941 1.00 0.00 N ATOM 643 CA ASN A 46 16.164 3.483 -4.429 1.00 0.00 C ATOM 644 C ASN A 46 17.254 4.478 -4.704 1.00 0.00 C ATOM 645 O ASN A 46 17.769 4.593 -5.813 1.00 0.00 O ATOM 646 CB ASN A 46 16.536 2.074 -4.900 1.00 0.00 C ATOM 647 CG ASN A 46 17.860 1.602 -4.279 1.00 0.00 C ATOM 648 OD1 ASN A 46 18.266 2.069 -3.186 1.00 0.00 O ATOM 649 ND2 ASN A 46 18.506 0.669 -4.918 1.00 0.00 N ATOM 0 H ASN A 46 14.755 3.849 -5.942 1.00 0.00 H new ATOM 0 HA ASN A 46 16.039 3.376 -3.351 1.00 0.00 H new ATOM 0 HB2 ASN A 46 15.740 1.379 -4.634 1.00 0.00 H new ATOM 0 HB3 ASN A 46 16.619 2.063 -5.987 1.00 0.00 H new ATOM 0 HD21 ASN A 46 19.372 0.293 -4.533 1.00 0.00 H new ATOM 0 HD22 ASN A 46 18.145 0.314 -5.804 1.00 0.00 H new ATOM 656 N ASP A 47 17.557 5.228 -3.673 1.00 0.00 N ATOM 657 CA ASP A 47 18.529 6.317 -3.692 1.00 0.00 C ATOM 658 C ASP A 47 19.947 5.786 -3.771 1.00 0.00 C ATOM 659 O ASP A 47 20.888 6.536 -4.008 1.00 0.00 O ATOM 660 CB ASP A 47 18.374 7.146 -2.412 1.00 0.00 C ATOM 661 CG ASP A 47 16.929 7.441 -2.096 1.00 0.00 C ATOM 662 OD1 ASP A 47 16.262 6.555 -1.533 1.00 0.00 O ATOM 663 OD2 ASP A 47 16.430 8.539 -2.404 1.00 0.00 O ATOM 0 H ASP A 47 17.123 5.100 -2.759 1.00 0.00 H new ATOM 0 HA ASP A 47 18.343 6.932 -4.573 1.00 0.00 H new ATOM 0 HB2 ASP A 47 18.825 6.610 -1.577 1.00 0.00 H new ATOM 0 HB3 ASP A 47 18.919 8.084 -2.520 1.00 0.00 H new ATOM 668 N TYR A 48 20.107 4.493 -3.558 1.00 0.00 N ATOM 669 CA TYR A 48 21.421 3.866 -3.628 1.00 0.00 C ATOM 670 C TYR A 48 21.352 2.678 -4.567 1.00 0.00 C ATOM 671 O TYR A 48 21.467 1.532 -4.131 1.00 0.00 O ATOM 672 CB TYR A 48 21.864 3.380 -2.258 1.00 0.00 C ATOM 673 CG TYR A 48 21.971 4.439 -1.206 1.00 0.00 C ATOM 674 CD1 TYR A 48 23.127 5.183 -1.063 1.00 0.00 C ATOM 675 CD2 TYR A 48 20.915 4.688 -0.346 1.00 0.00 C ATOM 676 CE1 TYR A 48 23.229 6.146 -0.091 1.00 0.00 C ATOM 677 CE2 TYR A 48 21.006 5.643 0.629 1.00 0.00 C ATOM 678 CZ TYR A 48 22.170 6.372 0.756 1.00 0.00 C ATOM 679 OH TYR A 48 22.275 7.324 1.737 1.00 0.00 O ATOM 0 H TYR A 48 19.345 3.853 -3.335 1.00 0.00 H new ATOM 0 HA TYR A 48 22.138 4.603 -3.989 1.00 0.00 H new ATOM 0 HB2 TYR A 48 21.161 2.621 -1.915 1.00 0.00 H new ATOM 0 HB3 TYR A 48 22.834 2.893 -2.360 1.00 0.00 H new ATOM 0 HD1 TYR A 48 23.961 5.004 -1.725 1.00 0.00 H new ATOM 0 HD2 TYR A 48 20.003 4.118 -0.447 1.00 0.00 H new ATOM 0 HE1 TYR A 48 24.136 6.723 0.008 1.00 0.00 H new ATOM 0 HE2 TYR A 48 20.174 5.825 1.293 1.00 0.00 H new ATOM 0 HH TYR A 48 21.440 7.360 2.248 1.00 0.00 H new ATOM 689 N PRO A 49 21.225 2.925 -5.870 1.00 0.00 N ATOM 690 CA PRO A 49 20.986 1.864 -6.853 1.00 0.00 C ATOM 691 C PRO A 49 22.181 0.952 -7.075 1.00 0.00 C ATOM 692 O PRO A 49 22.051 -0.114 -7.659 1.00 0.00 O ATOM 693 CB PRO A 49 20.665 2.640 -8.124 1.00 0.00 C ATOM 694 CG PRO A 49 21.390 3.929 -7.971 1.00 0.00 C ATOM 695 CD PRO A 49 21.317 4.258 -6.518 1.00 0.00 C ATOM 0 HA PRO A 49 20.197 1.188 -6.522 1.00 0.00 H new ATOM 0 HB2 PRO A 49 20.997 2.101 -9.012 1.00 0.00 H new ATOM 0 HB3 PRO A 49 19.592 2.799 -8.231 1.00 0.00 H new ATOM 0 HG2 PRO A 49 22.425 3.839 -8.301 1.00 0.00 H new ATOM 0 HG3 PRO A 49 20.930 4.712 -8.574 1.00 0.00 H new ATOM 0 HD2 PRO A 49 22.198 4.807 -6.185 1.00 0.00 H new ATOM 0 HD3 PRO A 49 20.450 4.877 -6.289 1.00 0.00 H new ATOM 703 N GLU A 50 23.329 1.355 -6.595 1.00 0.00 N ATOM 704 CA GLU A 50 24.522 0.576 -6.809 1.00 0.00 C ATOM 705 C GLU A 50 24.983 -0.030 -5.516 1.00 0.00 C ATOM 706 O GLU A 50 25.764 -0.985 -5.497 1.00 0.00 O ATOM 707 CB GLU A 50 25.642 1.437 -7.397 1.00 0.00 C ATOM 708 CG GLU A 50 26.064 2.585 -6.496 1.00 0.00 C ATOM 709 CD GLU A 50 27.210 3.384 -7.058 1.00 0.00 C ATOM 710 OE1 GLU A 50 27.033 4.075 -8.083 1.00 0.00 O ATOM 711 OE2 GLU A 50 28.315 3.334 -6.480 1.00 0.00 O ATOM 0 H GLU A 50 23.464 2.211 -6.057 1.00 0.00 H new ATOM 0 HA GLU A 50 24.283 -0.216 -7.518 1.00 0.00 H new ATOM 0 HB2 GLU A 50 26.508 0.805 -7.596 1.00 0.00 H new ATOM 0 HB3 GLU A 50 25.314 1.840 -8.355 1.00 0.00 H new ATOM 0 HG2 GLU A 50 25.212 3.246 -6.336 1.00 0.00 H new ATOM 0 HG3 GLU A 50 26.348 2.189 -5.521 1.00 0.00 H new ATOM 718 N THR A 51 24.488 0.493 -4.437 1.00 0.00 N ATOM 719 CA THR A 51 24.982 0.126 -3.175 1.00 0.00 C ATOM 720 C THR A 51 24.021 -0.840 -2.528 1.00 0.00 C ATOM 721 O THR A 51 24.412 -1.760 -1.828 1.00 0.00 O ATOM 722 CB THR A 51 25.124 1.387 -2.323 1.00 0.00 C ATOM 723 OG1 THR A 51 25.428 2.505 -3.183 1.00 0.00 O ATOM 724 CG2 THR A 51 26.247 1.222 -1.340 1.00 0.00 C ATOM 0 H THR A 51 23.735 1.181 -4.421 1.00 0.00 H new ATOM 0 HA THR A 51 25.954 -0.358 -3.270 1.00 0.00 H new ATOM 0 HB THR A 51 24.191 1.559 -1.786 1.00 0.00 H new ATOM 0 HG1 THR A 51 25.519 3.318 -2.643 1.00 0.00 H new ATOM 0 HG21 THR A 51 26.339 2.126 -0.738 1.00 0.00 H new ATOM 0 HG22 THR A 51 26.039 0.373 -0.689 1.00 0.00 H new ATOM 0 HG23 THR A 51 27.179 1.047 -1.878 1.00 0.00 H new ATOM 732 N ILE A 52 22.782 -0.674 -2.850 1.00 0.00 N ATOM 733 CA ILE A 52 21.712 -1.433 -2.292 1.00 0.00 C ATOM 734 C ILE A 52 20.875 -2.014 -3.419 1.00 0.00 C ATOM 735 O ILE A 52 20.607 -1.328 -4.402 1.00 0.00 O ATOM 736 CB ILE A 52 20.812 -0.536 -1.342 1.00 0.00 C ATOM 737 CG1 ILE A 52 21.472 -0.262 0.016 1.00 0.00 C ATOM 738 CG2 ILE A 52 19.458 -1.129 -1.121 1.00 0.00 C ATOM 739 CD1 ILE A 52 22.522 0.796 0.037 1.00 0.00 C ATOM 0 H ILE A 52 22.475 0.018 -3.533 1.00 0.00 H new ATOM 0 HA ILE A 52 22.127 -2.240 -1.689 1.00 0.00 H new ATOM 0 HB ILE A 52 20.701 0.413 -1.867 1.00 0.00 H new ATOM 0 HG12 ILE A 52 20.693 0.015 0.726 1.00 0.00 H new ATOM 0 HG13 ILE A 52 21.915 -1.191 0.375 1.00 0.00 H new ATOM 0 HG21 ILE A 52 18.879 -0.479 -0.465 1.00 0.00 H new ATOM 0 HG22 ILE A 52 18.944 -1.230 -2.077 1.00 0.00 H new ATOM 0 HG23 ILE A 52 19.562 -2.111 -0.660 1.00 0.00 H new ATOM 0 HD11 ILE A 52 22.914 0.899 1.049 1.00 0.00 H new ATOM 0 HD12 ILE A 52 23.331 0.519 -0.639 1.00 0.00 H new ATOM 0 HD13 ILE A 52 22.090 1.744 -0.283 1.00 0.00 H new ATOM 751 N THR A 53 20.510 -3.289 -3.295 1.00 0.00 N ATOM 752 CA THR A 53 19.642 -3.895 -4.272 1.00 0.00 C ATOM 753 C THR A 53 18.219 -3.424 -3.981 1.00 0.00 C ATOM 754 O THR A 53 17.827 -3.255 -2.808 1.00 0.00 O ATOM 755 CB THR A 53 19.727 -5.463 -4.273 1.00 0.00 C ATOM 756 OG1 THR A 53 19.083 -5.993 -5.439 1.00 0.00 O ATOM 757 CG2 THR A 53 19.067 -6.075 -3.030 1.00 0.00 C ATOM 0 H THR A 53 20.802 -3.905 -2.536 1.00 0.00 H new ATOM 0 HA THR A 53 19.958 -3.586 -5.268 1.00 0.00 H new ATOM 0 HB THR A 53 20.785 -5.724 -4.270 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.144 -6.971 -5.430 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.149 -7.161 -3.072 1.00 0.00 H new ATOM 0 HG22 THR A 53 19.568 -5.708 -2.134 1.00 0.00 H new ATOM 0 HG23 THR A 53 18.015 -5.791 -3.000 1.00 0.00 H new ATOM 765 N ASP A 54 17.488 -3.188 -5.012 1.00 0.00 N ATOM 766 CA ASP A 54 16.160 -2.645 -4.897 1.00 0.00 C ATOM 767 C ASP A 54 15.214 -3.795 -4.594 1.00 0.00 C ATOM 768 O ASP A 54 14.876 -4.580 -5.482 1.00 0.00 O ATOM 769 CB ASP A 54 15.748 -2.016 -6.242 1.00 0.00 C ATOM 770 CG ASP A 54 16.918 -1.495 -7.067 1.00 0.00 C ATOM 771 OD1 ASP A 54 17.573 -2.315 -7.774 1.00 0.00 O ATOM 772 OD2 ASP A 54 17.225 -0.299 -7.032 1.00 0.00 O ATOM 0 H ASP A 54 17.787 -3.364 -5.971 1.00 0.00 H new ATOM 0 HA ASP A 54 16.126 -1.889 -4.112 1.00 0.00 H new ATOM 0 HB2 ASP A 54 15.206 -2.759 -6.828 1.00 0.00 H new ATOM 0 HB3 ASP A 54 15.057 -1.195 -6.051 1.00 0.00 H new ATOM 777 N TYR A 55 14.739 -3.865 -3.383 1.00 0.00 N ATOM 778 CA TYR A 55 13.899 -4.962 -2.959 1.00 0.00 C ATOM 779 C TYR A 55 12.849 -4.478 -1.982 1.00 0.00 C ATOM 780 O TYR A 55 13.136 -3.672 -1.098 1.00 0.00 O ATOM 781 CB TYR A 55 14.778 -6.078 -2.340 1.00 0.00 C ATOM 782 CG TYR A 55 14.020 -7.209 -1.664 1.00 0.00 C ATOM 783 CD1 TYR A 55 13.096 -7.973 -2.356 1.00 0.00 C ATOM 784 CD2 TYR A 55 14.230 -7.496 -0.322 1.00 0.00 C ATOM 785 CE1 TYR A 55 12.402 -8.988 -1.734 1.00 0.00 C ATOM 786 CE2 TYR A 55 13.542 -8.512 0.310 1.00 0.00 C ATOM 787 CZ TYR A 55 12.630 -9.255 -0.401 1.00 0.00 C ATOM 788 OH TYR A 55 11.937 -10.271 0.225 1.00 0.00 O ATOM 0 H TYR A 55 14.919 -3.169 -2.660 1.00 0.00 H new ATOM 0 HA TYR A 55 13.377 -5.374 -3.822 1.00 0.00 H new ATOM 0 HB2 TYR A 55 15.403 -6.502 -3.126 1.00 0.00 H new ATOM 0 HB3 TYR A 55 15.448 -5.625 -1.609 1.00 0.00 H new ATOM 0 HD1 TYR A 55 12.916 -7.770 -3.401 1.00 0.00 H new ATOM 0 HD2 TYR A 55 14.946 -6.913 0.238 1.00 0.00 H new ATOM 0 HE1 TYR A 55 11.682 -9.572 -2.289 1.00 0.00 H new ATOM 0 HE2 TYR A 55 13.719 -8.721 1.355 1.00 0.00 H new ATOM 0 HH TYR A 55 12.216 -10.328 1.163 1.00 0.00 H new ATOM 798 N VAL A 56 11.636 -4.945 -2.154 1.00 0.00 N ATOM 799 CA VAL A 56 10.559 -4.569 -1.292 1.00 0.00 C ATOM 800 C VAL A 56 9.545 -5.705 -1.200 1.00 0.00 C ATOM 801 O VAL A 56 9.417 -6.508 -2.123 1.00 0.00 O ATOM 802 CB VAL A 56 9.857 -3.270 -1.780 1.00 0.00 C ATOM 803 CG1 VAL A 56 9.148 -3.469 -3.100 1.00 0.00 C ATOM 804 CG2 VAL A 56 8.917 -2.735 -0.724 1.00 0.00 C ATOM 0 H VAL A 56 11.375 -5.595 -2.896 1.00 0.00 H new ATOM 0 HA VAL A 56 10.977 -4.370 -0.305 1.00 0.00 H new ATOM 0 HB VAL A 56 10.634 -2.525 -1.949 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.672 -2.536 -3.402 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.870 -3.770 -3.859 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.390 -4.245 -2.992 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.438 -1.826 -1.089 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.155 -3.482 -0.503 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.479 -2.510 0.183 1.00 0.00 H new ATOM 814 N THR A 57 8.876 -5.785 -0.075 1.00 0.00 N ATOM 815 CA THR A 57 7.824 -6.757 0.159 1.00 0.00 C ATOM 816 C THR A 57 6.801 -6.174 1.143 1.00 0.00 C ATOM 817 O THR A 57 7.182 -5.507 2.086 1.00 0.00 O ATOM 818 CB THR A 57 8.427 -8.057 0.748 1.00 0.00 C ATOM 819 OG1 THR A 57 9.601 -7.717 1.499 1.00 0.00 O ATOM 820 CG2 THR A 57 8.783 -9.071 -0.333 1.00 0.00 C ATOM 0 H THR A 57 9.047 -5.168 0.719 1.00 0.00 H new ATOM 0 HA THR A 57 7.332 -6.988 -0.786 1.00 0.00 H new ATOM 0 HB THR A 57 7.677 -8.522 1.388 1.00 0.00 H new ATOM 0 HG1 THR A 57 9.993 -8.531 1.880 1.00 0.00 H new ATOM 0 HG21 THR A 57 9.202 -9.965 0.130 1.00 0.00 H new ATOM 0 HG22 THR A 57 7.886 -9.338 -0.891 1.00 0.00 H new ATOM 0 HG23 THR A 57 9.517 -8.636 -1.012 1.00 0.00 H new ATOM 828 N LEU A 58 5.534 -6.341 0.880 1.00 0.00 N ATOM 829 CA LEU A 58 4.515 -5.976 1.841 1.00 0.00 C ATOM 830 C LEU A 58 4.523 -7.007 2.949 1.00 0.00 C ATOM 831 O LEU A 58 4.275 -8.184 2.718 1.00 0.00 O ATOM 832 CB LEU A 58 3.125 -5.938 1.194 1.00 0.00 C ATOM 833 CG LEU A 58 1.929 -5.769 2.150 1.00 0.00 C ATOM 834 CD1 LEU A 58 1.948 -4.434 2.797 1.00 0.00 C ATOM 835 CD2 LEU A 58 0.610 -6.006 1.446 1.00 0.00 C ATOM 0 H LEU A 58 5.176 -6.728 0.007 1.00 0.00 H new ATOM 0 HA LEU A 58 4.731 -4.980 2.229 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.105 -5.120 0.474 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.985 -6.861 0.631 1.00 0.00 H new ATOM 0 HG LEU A 58 2.027 -6.527 2.927 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.093 -4.342 3.466 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.870 -4.319 3.368 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.896 -3.659 2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.209 -5.877 2.154 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.500 -5.292 0.630 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.588 -7.020 1.046 1.00 0.00 H new ATOM 847 N GLN A 59 4.866 -6.541 4.126 1.00 0.00 N ATOM 848 CA GLN A 59 4.922 -7.327 5.341 1.00 0.00 C ATOM 849 C GLN A 59 3.570 -7.936 5.676 1.00 0.00 C ATOM 850 O GLN A 59 3.469 -9.116 5.958 1.00 0.00 O ATOM 851 CB GLN A 59 5.325 -6.421 6.512 1.00 0.00 C ATOM 852 CG GLN A 59 5.313 -7.113 7.856 1.00 0.00 C ATOM 853 CD GLN A 59 6.511 -7.960 8.079 1.00 0.00 C ATOM 854 OE1 GLN A 59 6.557 -9.124 7.702 1.00 0.00 O ATOM 855 NE2 GLN A 59 7.467 -7.399 8.722 1.00 0.00 N ATOM 0 H GLN A 59 5.125 -5.565 4.272 1.00 0.00 H new ATOM 0 HA GLN A 59 5.647 -8.125 5.184 1.00 0.00 H new ATOM 0 HB2 GLN A 59 6.324 -6.027 6.326 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.648 -5.568 6.548 1.00 0.00 H new ATOM 0 HG2 GLN A 59 5.252 -6.363 8.645 1.00 0.00 H new ATOM 0 HG3 GLN A 59 4.418 -7.730 7.933 1.00 0.00 H new ATOM 0 HE21 GLN A 59 7.382 -6.426 9.015 1.00 0.00 H new ATOM 0 HE22 GLN A 59 8.313 -7.926 8.940 1.00 0.00 H new ATOM 864 N ARG A 60 2.564 -7.091 5.691 1.00 0.00 N ATOM 865 CA ARG A 60 1.224 -7.447 6.088 1.00 0.00 C ATOM 866 C ARG A 60 0.314 -6.295 5.781 1.00 0.00 C ATOM 867 O ARG A 60 0.786 -5.156 5.627 1.00 0.00 O ATOM 868 CB ARG A 60 1.158 -7.755 7.589 1.00 0.00 C ATOM 869 CG ARG A 60 1.741 -6.668 8.475 1.00 0.00 C ATOM 870 CD ARG A 60 1.239 -6.816 9.877 1.00 0.00 C ATOM 871 NE ARG A 60 1.633 -8.081 10.500 1.00 0.00 N ATOM 872 CZ ARG A 60 1.147 -8.543 11.657 1.00 0.00 C ATOM 873 NH1 ARG A 60 0.366 -7.760 12.422 1.00 0.00 N ATOM 874 NH2 ARG A 60 1.485 -9.755 12.071 1.00 0.00 N ATOM 0 H ARG A 60 2.660 -6.112 5.420 1.00 0.00 H new ATOM 0 HA ARG A 60 0.918 -8.339 5.542 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.117 -7.917 7.870 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.689 -8.688 7.781 1.00 0.00 H new ATOM 0 HG2 ARG A 60 2.829 -6.725 8.463 1.00 0.00 H new ATOM 0 HG3 ARG A 60 1.469 -5.687 8.086 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.615 -5.989 10.480 1.00 0.00 H new ATOM 0 HD3 ARG A 60 0.152 -6.742 9.876 1.00 0.00 H new ATOM 0 HE ARG A 60 2.328 -8.651 10.017 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.143 -6.812 12.120 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -0.004 -8.115 13.304 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.112 -10.330 11.508 1.00 0.00 H new ATOM 0 HH22 ARG A 60 1.118 -10.114 12.953 1.00 0.00 H new ATOM 888 N GLY A 61 -0.962 -6.564 5.700 1.00 0.00 N ATOM 889 CA GLY A 61 -1.896 -5.553 5.422 1.00 0.00 C ATOM 890 C GLY A 61 -3.094 -5.745 6.262 1.00 0.00 C ATOM 891 O GLY A 61 -3.435 -6.880 6.588 1.00 0.00 O ATOM 0 H GLY A 61 -1.363 -7.493 5.827 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -1.457 -4.574 5.615 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.171 -5.577 4.367 1.00 0.00 H new ATOM 895 N SER A 62 -3.701 -4.677 6.638 1.00 0.00 N ATOM 896 CA SER A 62 -4.840 -4.681 7.491 1.00 0.00 C ATOM 897 C SER A 62 -5.928 -3.796 6.894 1.00 0.00 C ATOM 898 O SER A 62 -5.617 -2.842 6.188 1.00 0.00 O ATOM 899 CB SER A 62 -4.383 -4.142 8.823 1.00 0.00 C ATOM 900 OG SER A 62 -3.374 -4.975 9.386 1.00 0.00 O ATOM 0 H SER A 62 -3.410 -3.742 6.351 1.00 0.00 H new ATOM 0 HA SER A 62 -5.255 -5.682 7.606 1.00 0.00 H new ATOM 0 HB2 SER A 62 -3.998 -3.130 8.698 1.00 0.00 H new ATOM 0 HB3 SER A 62 -5.231 -4.078 9.505 1.00 0.00 H new ATOM 0 HG SER A 62 -3.090 -4.607 10.249 1.00 0.00 H new ATOM 906 N ALA A 63 -7.173 -4.121 7.172 1.00 0.00 N ATOM 907 CA ALA A 63 -8.330 -3.397 6.664 1.00 0.00 C ATOM 908 C ALA A 63 -9.079 -2.812 7.824 1.00 0.00 C ATOM 909 O ALA A 63 -8.983 -3.351 8.924 1.00 0.00 O ATOM 910 CB ALA A 63 -9.243 -4.346 5.933 1.00 0.00 C ATOM 0 H ALA A 63 -7.419 -4.911 7.769 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.998 -2.611 5.985 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -10.107 -3.800 5.555 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -8.706 -4.798 5.099 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.578 -5.127 6.615 1.00 0.00 H new ATOM 916 N TYR A 64 -9.825 -1.724 7.594 1.00 0.00 N ATOM 917 CA TYR A 64 -10.579 -1.026 8.629 1.00 0.00 C ATOM 918 C TYR A 64 -11.764 -0.286 7.989 1.00 0.00 C ATOM 919 O TYR A 64 -11.992 -0.403 6.778 1.00 0.00 O ATOM 920 CB TYR A 64 -9.705 -0.019 9.435 1.00 0.00 C ATOM 921 CG TYR A 64 -8.532 -0.651 10.146 1.00 0.00 C ATOM 922 CD1 TYR A 64 -8.670 -1.196 11.409 1.00 0.00 C ATOM 923 CD2 TYR A 64 -7.292 -0.742 9.526 1.00 0.00 C ATOM 924 CE1 TYR A 64 -7.611 -1.816 12.033 1.00 0.00 C ATOM 925 CE2 TYR A 64 -6.238 -1.349 10.133 1.00 0.00 C ATOM 926 CZ TYR A 64 -6.395 -1.893 11.392 1.00 0.00 C ATOM 927 OH TYR A 64 -5.335 -2.525 12.009 1.00 0.00 O ATOM 0 H TYR A 64 -9.919 -1.303 6.670 1.00 0.00 H new ATOM 0 HA TYR A 64 -10.934 -1.778 9.334 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -9.334 0.748 8.755 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -10.334 0.484 10.170 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -9.623 -1.134 11.914 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -7.163 -0.321 8.540 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -7.733 -2.239 13.019 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -5.282 -1.405 9.633 1.00 0.00 H new ATOM 0 HH TYR A 64 -4.550 -2.494 11.424 1.00 0.00 H new ATOM 937 N GLY A 65 -12.535 0.403 8.809 1.00 0.00 N ATOM 938 CA GLY A 65 -13.648 1.216 8.346 1.00 0.00 C ATOM 939 C GLY A 65 -14.740 0.412 7.688 1.00 0.00 C ATOM 940 O GLY A 65 -15.211 -0.588 8.228 1.00 0.00 O ATOM 0 H GLY A 65 -12.408 0.416 9.821 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -14.067 1.761 9.192 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -13.277 1.959 7.640 1.00 0.00 H new ATOM 944 N GLY A 66 -15.160 0.850 6.528 1.00 0.00 N ATOM 945 CA GLY A 66 -16.132 0.116 5.785 1.00 0.00 C ATOM 946 C GLY A 66 -15.478 -0.871 4.863 1.00 0.00 C ATOM 947 O GLY A 66 -16.130 -1.696 4.287 1.00 0.00 O ATOM 0 H GLY A 66 -14.840 1.711 6.085 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.798 -0.408 6.471 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -16.748 0.805 5.207 1.00 0.00 H new ATOM 951 N VAL A 67 -14.180 -0.818 4.788 1.00 0.00 N ATOM 952 CA VAL A 67 -13.408 -1.654 3.886 1.00 0.00 C ATOM 953 C VAL A 67 -13.414 -3.096 4.334 1.00 0.00 C ATOM 954 O VAL A 67 -13.568 -3.993 3.536 1.00 0.00 O ATOM 955 CB VAL A 67 -11.973 -1.134 3.803 1.00 0.00 C ATOM 956 CG1 VAL A 67 -11.059 -2.046 3.022 1.00 0.00 C ATOM 957 CG2 VAL A 67 -11.965 0.241 3.207 1.00 0.00 C ATOM 0 H VAL A 67 -13.611 -0.188 5.354 1.00 0.00 H new ATOM 0 HA VAL A 67 -13.869 -1.609 2.899 1.00 0.00 H new ATOM 0 HB VAL A 67 -11.585 -1.102 4.821 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.055 -1.622 2.999 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.028 -3.026 3.499 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -11.432 -2.150 2.003 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -10.940 0.607 3.150 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -12.394 0.206 2.206 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -12.555 0.912 3.831 1.00 0.00 H new ATOM 967 N LEU A 68 -13.280 -3.304 5.609 1.00 0.00 N ATOM 968 CA LEU A 68 -13.274 -4.644 6.129 1.00 0.00 C ATOM 969 C LEU A 68 -14.690 -5.204 6.316 1.00 0.00 C ATOM 970 O LEU A 68 -14.908 -6.419 6.311 1.00 0.00 O ATOM 971 CB LEU A 68 -12.438 -4.755 7.432 1.00 0.00 C ATOM 972 CG LEU A 68 -12.571 -3.674 8.523 1.00 0.00 C ATOM 973 CD1 LEU A 68 -13.949 -3.335 8.898 1.00 0.00 C ATOM 974 CD2 LEU A 68 -11.809 -4.078 9.739 1.00 0.00 C ATOM 0 H LEU A 68 -13.174 -2.569 6.308 1.00 0.00 H new ATOM 0 HA LEU A 68 -12.787 -5.265 5.377 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -12.680 -5.713 7.893 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -11.388 -4.797 7.142 1.00 0.00 H new ATOM 0 HG LEU A 68 -12.154 -2.770 8.080 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -13.937 -2.567 9.671 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -14.483 -2.962 8.024 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -14.452 -4.224 9.278 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -11.909 -3.308 10.504 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -12.203 -5.020 10.119 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -10.756 -4.202 9.484 1.00 0.00 H new ATOM 986 N SER A 69 -15.631 -4.311 6.478 1.00 0.00 N ATOM 987 CA SER A 69 -16.984 -4.673 6.798 1.00 0.00 C ATOM 988 C SER A 69 -17.948 -4.638 5.600 1.00 0.00 C ATOM 989 O SER A 69 -18.645 -5.617 5.323 1.00 0.00 O ATOM 990 CB SER A 69 -17.463 -3.818 7.964 1.00 0.00 C ATOM 991 OG SER A 69 -16.868 -4.237 9.182 1.00 0.00 O ATOM 0 H SER A 69 -15.478 -3.306 6.391 1.00 0.00 H new ATOM 0 HA SER A 69 -16.985 -5.722 7.094 1.00 0.00 H new ATOM 0 HB2 SER A 69 -17.219 -2.772 7.777 1.00 0.00 H new ATOM 0 HB3 SER A 69 -18.548 -3.882 8.045 1.00 0.00 H new ATOM 0 HG SER A 69 -17.190 -3.672 9.915 1.00 0.00 H new ATOM 997 N ASN A 70 -17.955 -3.551 4.881 1.00 0.00 N ATOM 998 CA ASN A 70 -18.880 -3.358 3.769 1.00 0.00 C ATOM 999 C ASN A 70 -18.250 -3.875 2.511 1.00 0.00 C ATOM 1000 O ASN A 70 -18.942 -4.203 1.546 1.00 0.00 O ATOM 1001 CB ASN A 70 -19.205 -1.864 3.583 1.00 0.00 C ATOM 1002 CG ASN A 70 -19.766 -1.192 4.822 1.00 0.00 C ATOM 1003 OD1 ASN A 70 -20.482 -1.796 5.609 1.00 0.00 O ATOM 1004 ND2 ASN A 70 -19.404 0.048 5.026 1.00 0.00 N ATOM 0 H ASN A 70 -17.324 -2.765 5.039 1.00 0.00 H new ATOM 0 HA ASN A 70 -19.802 -3.897 3.986 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -18.298 -1.341 3.279 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -19.922 -1.758 2.769 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -19.720 0.541 5.862 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -18.806 0.523 4.350 1.00 0.00 H new ATOM 1011 N PHE A 71 -16.938 -3.928 2.495 1.00 0.00 N ATOM 1012 CA PHE A 71 -16.257 -4.414 1.339 1.00 0.00 C ATOM 1013 C PHE A 71 -15.570 -5.723 1.616 1.00 0.00 C ATOM 1014 O PHE A 71 -15.411 -6.143 2.767 1.00 0.00 O ATOM 1015 CB PHE A 71 -15.267 -3.396 0.791 1.00 0.00 C ATOM 1016 CG PHE A 71 -15.837 -2.058 0.378 1.00 0.00 C ATOM 1017 CD1 PHE A 71 -15.929 -1.007 1.271 1.00 0.00 C ATOM 1018 CD2 PHE A 71 -16.258 -1.852 -0.917 1.00 0.00 C ATOM 1019 CE1 PHE A 71 -16.430 0.200 0.877 1.00 0.00 C ATOM 1020 CE2 PHE A 71 -16.764 -0.639 -1.319 1.00 0.00 C ATOM 1021 CZ PHE A 71 -16.851 0.389 -0.422 1.00 0.00 C ATOM 0 H PHE A 71 -16.335 -3.641 3.266 1.00 0.00 H new ATOM 0 HA PHE A 71 -17.016 -4.582 0.575 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -14.502 -3.222 1.548 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -14.768 -3.836 -0.072 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -15.601 -1.142 2.291 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -16.189 -2.660 -1.631 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -16.497 1.011 1.587 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -17.091 -0.499 -2.339 1.00 0.00 H new ATOM 0 HZ PHE A 71 -17.248 1.345 -0.730 1.00 0.00 H new ATOM 1031 N SER A 72 -15.254 -6.385 0.542 1.00 0.00 N ATOM 1032 CA SER A 72 -14.608 -7.626 0.503 1.00 0.00 C ATOM 1033 C SER A 72 -14.117 -7.888 -0.908 1.00 0.00 C ATOM 1034 O SER A 72 -14.774 -7.520 -1.872 1.00 0.00 O ATOM 1035 CB SER A 72 -15.599 -8.675 0.859 1.00 0.00 C ATOM 1036 OG SER A 72 -15.801 -8.773 2.269 1.00 0.00 O ATOM 0 H SER A 72 -15.465 -6.028 -0.390 1.00 0.00 H new ATOM 0 HA SER A 72 -13.767 -7.635 1.196 1.00 0.00 H new ATOM 0 HB2 SER A 72 -16.549 -8.454 0.373 1.00 0.00 H new ATOM 0 HB3 SER A 72 -15.260 -9.637 0.475 1.00 0.00 H new ATOM 0 HG SER A 72 -15.606 -7.909 2.688 1.00 0.00 H new ATOM 1042 N GLY A 73 -12.965 -8.434 -1.007 1.00 0.00 N ATOM 1043 CA GLY A 73 -12.424 -8.853 -2.264 1.00 0.00 C ATOM 1044 C GLY A 73 -11.140 -9.617 -2.052 1.00 0.00 C ATOM 1045 O GLY A 73 -11.168 -10.773 -1.645 1.00 0.00 O ATOM 0 H GLY A 73 -12.353 -8.610 -0.210 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -13.146 -9.480 -2.788 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.238 -7.984 -2.896 1.00 0.00 H new ATOM 1049 N THR A 74 -10.032 -8.941 -2.253 1.00 0.00 N ATOM 1050 CA THR A 74 -8.669 -9.472 -2.120 1.00 0.00 C ATOM 1051 C THR A 74 -7.668 -8.321 -2.191 1.00 0.00 C ATOM 1052 O THR A 74 -8.051 -7.175 -2.320 1.00 0.00 O ATOM 1053 CB THR A 74 -8.317 -10.521 -3.221 1.00 0.00 C ATOM 1054 OG1 THR A 74 -8.945 -10.201 -4.475 1.00 0.00 O ATOM 1055 CG2 THR A 74 -8.640 -11.945 -2.794 1.00 0.00 C ATOM 0 H THR A 74 -10.043 -7.959 -2.527 1.00 0.00 H new ATOM 0 HA THR A 74 -8.615 -9.979 -1.157 1.00 0.00 H new ATOM 0 HB THR A 74 -7.237 -10.470 -3.362 1.00 0.00 H new ATOM 0 HG1 THR A 74 -8.703 -10.876 -5.143 1.00 0.00 H new ATOM 0 HG21 THR A 74 -8.376 -12.634 -3.596 1.00 0.00 H new ATOM 0 HG22 THR A 74 -8.070 -12.195 -1.899 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.706 -12.028 -2.581 1.00 0.00 H new ATOM 1063 N VAL A 75 -6.414 -8.623 -2.077 1.00 0.00 N ATOM 1064 CA VAL A 75 -5.368 -7.637 -2.180 1.00 0.00 C ATOM 1065 C VAL A 75 -4.352 -8.112 -3.198 1.00 0.00 C ATOM 1066 O VAL A 75 -4.126 -9.325 -3.345 1.00 0.00 O ATOM 1067 CB VAL A 75 -4.719 -7.324 -0.789 1.00 0.00 C ATOM 1068 CG1 VAL A 75 -4.349 -8.588 -0.064 1.00 0.00 C ATOM 1069 CG2 VAL A 75 -3.496 -6.420 -0.909 1.00 0.00 C ATOM 0 H VAL A 75 -6.076 -9.570 -1.908 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.793 -6.693 -2.520 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.474 -6.790 -0.212 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.901 -8.338 0.898 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.243 -9.190 0.098 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -3.634 -9.154 -0.661 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -3.083 -6.233 0.082 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -2.744 -6.906 -1.530 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -3.786 -5.474 -1.365 1.00 0.00 H new ATOM 1079 N LYS A 76 -3.797 -7.187 -3.921 1.00 0.00 N ATOM 1080 CA LYS A 76 -2.891 -7.482 -4.969 1.00 0.00 C ATOM 1081 C LYS A 76 -1.592 -6.748 -4.764 1.00 0.00 C ATOM 1082 O LYS A 76 -1.576 -5.605 -4.303 1.00 0.00 O ATOM 1083 CB LYS A 76 -3.530 -7.076 -6.265 1.00 0.00 C ATOM 1084 CG LYS A 76 -2.763 -7.421 -7.511 1.00 0.00 C ATOM 1085 CD LYS A 76 -3.650 -7.185 -8.673 1.00 0.00 C ATOM 1086 CE LYS A 76 -3.062 -7.626 -9.969 1.00 0.00 C ATOM 1087 NZ LYS A 76 -3.992 -7.352 -11.082 1.00 0.00 N ATOM 0 H LYS A 76 -3.970 -6.190 -3.790 1.00 0.00 H new ATOM 0 HA LYS A 76 -2.667 -8.549 -4.983 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -4.513 -7.543 -6.325 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.690 -5.998 -6.247 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.864 -6.809 -7.587 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.439 -8.461 -7.484 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -4.592 -7.710 -8.513 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -3.883 -6.122 -8.732 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -2.118 -7.109 -10.141 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.838 -8.692 -9.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -4.342 -8.251 -11.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -4.794 -6.789 -10.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -3.496 -6.823 -11.827 1.00 0.00 H new ATOM 1101 N TYR A 77 -0.528 -7.404 -5.126 1.00 0.00 N ATOM 1102 CA TYR A 77 0.810 -6.888 -4.981 1.00 0.00 C ATOM 1103 C TYR A 77 1.648 -7.402 -6.129 1.00 0.00 C ATOM 1104 O TYR A 77 1.897 -8.596 -6.194 1.00 0.00 O ATOM 1105 CB TYR A 77 1.411 -7.407 -3.680 1.00 0.00 C ATOM 1106 CG TYR A 77 2.793 -6.871 -3.352 1.00 0.00 C ATOM 1107 CD1 TYR A 77 3.940 -7.470 -3.850 1.00 0.00 C ATOM 1108 CD2 TYR A 77 2.942 -5.769 -2.536 1.00 0.00 C ATOM 1109 CE1 TYR A 77 5.189 -6.975 -3.538 1.00 0.00 C ATOM 1110 CE2 TYR A 77 4.184 -5.270 -2.223 1.00 0.00 C ATOM 1111 CZ TYR A 77 5.301 -5.875 -2.726 1.00 0.00 C ATOM 1112 OH TYR A 77 6.539 -5.385 -2.410 1.00 0.00 O ATOM 0 H TYR A 77 -0.563 -8.335 -5.541 1.00 0.00 H new ATOM 0 HA TYR A 77 0.789 -5.798 -4.974 1.00 0.00 H new ATOM 0 HB2 TYR A 77 0.737 -7.157 -2.861 1.00 0.00 H new ATOM 0 HB3 TYR A 77 1.462 -8.495 -3.730 1.00 0.00 H new ATOM 0 HD1 TYR A 77 3.854 -8.335 -4.490 1.00 0.00 H new ATOM 0 HD2 TYR A 77 2.063 -5.287 -2.134 1.00 0.00 H new ATOM 0 HE1 TYR A 77 6.075 -7.451 -3.931 1.00 0.00 H new ATOM 0 HE2 TYR A 77 4.276 -4.405 -1.583 1.00 0.00 H new ATOM 0 HH TYR A 77 6.442 -4.603 -1.827 1.00 0.00 H new ATOM 1122 N SER A 78 2.034 -6.530 -7.045 1.00 0.00 N ATOM 1123 CA SER A 78 2.899 -6.895 -8.182 1.00 0.00 C ATOM 1124 C SER A 78 2.289 -8.081 -8.984 1.00 0.00 C ATOM 1125 O SER A 78 2.984 -9.015 -9.423 1.00 0.00 O ATOM 1126 CB SER A 78 4.326 -7.213 -7.657 1.00 0.00 C ATOM 1127 OG SER A 78 5.256 -7.488 -8.698 1.00 0.00 O ATOM 0 H SER A 78 1.763 -5.547 -7.032 1.00 0.00 H new ATOM 0 HA SER A 78 2.969 -6.056 -8.874 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.687 -6.369 -7.069 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.277 -8.071 -6.986 1.00 0.00 H new ATOM 0 HG SER A 78 4.884 -8.168 -9.298 1.00 0.00 H new ATOM 1133 N GLY A 79 0.983 -8.046 -9.138 1.00 0.00 N ATOM 1134 CA GLY A 79 0.301 -9.086 -9.860 1.00 0.00 C ATOM 1135 C GLY A 79 0.018 -10.318 -9.012 1.00 0.00 C ATOM 1136 O GLY A 79 -0.231 -11.397 -9.547 1.00 0.00 O ATOM 0 H GLY A 79 0.379 -7.310 -8.773 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.640 -8.694 -10.246 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.903 -9.376 -10.721 1.00 0.00 H new ATOM 1140 N SER A 80 0.094 -10.182 -7.703 1.00 0.00 N ATOM 1141 CA SER A 80 -0.256 -11.279 -6.820 1.00 0.00 C ATOM 1142 C SER A 80 -1.775 -11.248 -6.599 1.00 0.00 C ATOM 1143 O SER A 80 -2.457 -10.384 -7.135 1.00 0.00 O ATOM 1144 CB SER A 80 0.498 -11.167 -5.477 1.00 0.00 C ATOM 1145 OG SER A 80 0.387 -12.354 -4.702 1.00 0.00 O ATOM 0 H SER A 80 0.393 -9.330 -7.229 1.00 0.00 H new ATOM 0 HA SER A 80 0.034 -12.227 -7.273 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.550 -10.957 -5.669 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.103 -10.325 -4.909 1.00 0.00 H new ATOM 0 HG SER A 80 -0.064 -12.151 -3.856 1.00 0.00 H new ATOM 1151 N SER A 81 -2.280 -12.152 -5.830 1.00 0.00 N ATOM 1152 CA SER A 81 -3.693 -12.242 -5.577 1.00 0.00 C ATOM 1153 C SER A 81 -3.875 -13.055 -4.291 1.00 0.00 C ATOM 1154 O SER A 81 -3.812 -14.293 -4.296 1.00 0.00 O ATOM 1155 CB SER A 81 -4.397 -12.920 -6.773 1.00 0.00 C ATOM 1156 OG SER A 81 -5.820 -12.894 -6.651 1.00 0.00 O ATOM 0 H SER A 81 -1.725 -12.861 -5.350 1.00 0.00 H new ATOM 0 HA SER A 81 -4.137 -11.254 -5.456 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.105 -12.419 -7.696 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.060 -13.954 -6.851 1.00 0.00 H new ATOM 0 HG SER A 81 -6.223 -13.332 -7.430 1.00 0.00 H new ATOM 1162 N TYR A 82 -4.045 -12.365 -3.207 1.00 0.00 N ATOM 1163 CA TYR A 82 -4.107 -12.972 -1.897 1.00 0.00 C ATOM 1164 C TYR A 82 -5.216 -12.290 -1.088 1.00 0.00 C ATOM 1165 O TYR A 82 -5.637 -11.191 -1.451 1.00 0.00 O ATOM 1166 CB TYR A 82 -2.683 -12.914 -1.223 1.00 0.00 C ATOM 1167 CG TYR A 82 -2.029 -11.544 -1.183 1.00 0.00 C ATOM 1168 CD1 TYR A 82 -1.596 -10.923 -2.350 1.00 0.00 C ATOM 1169 CD2 TYR A 82 -1.848 -10.872 0.010 1.00 0.00 C ATOM 1170 CE1 TYR A 82 -1.032 -9.682 -2.332 1.00 0.00 C ATOM 1171 CE2 TYR A 82 -1.268 -9.621 0.037 1.00 0.00 C ATOM 1172 CZ TYR A 82 -0.871 -9.033 -1.142 1.00 0.00 C ATOM 1173 OH TYR A 82 -0.337 -7.776 -1.129 1.00 0.00 O ATOM 0 H TYR A 82 -4.147 -11.350 -3.198 1.00 0.00 H new ATOM 0 HA TYR A 82 -4.368 -14.029 -1.954 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -2.769 -13.285 -0.202 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -2.021 -13.597 -1.756 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -1.709 -11.437 -3.293 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -2.165 -11.332 0.934 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -0.715 -9.216 -3.253 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -1.127 -9.107 0.976 1.00 0.00 H new ATOM 0 HH TYR A 82 -0.864 -7.203 -0.534 1.00 0.00 H new ATOM 1183 N PRO A 83 -5.749 -12.933 -0.025 1.00 0.00 N ATOM 1184 CA PRO A 83 -6.891 -12.403 0.720 1.00 0.00 C ATOM 1185 C PRO A 83 -6.553 -11.149 1.498 1.00 0.00 C ATOM 1186 O PRO A 83 -5.431 -10.974 1.958 1.00 0.00 O ATOM 1187 CB PRO A 83 -7.276 -13.543 1.662 1.00 0.00 C ATOM 1188 CG PRO A 83 -6.024 -14.324 1.845 1.00 0.00 C ATOM 1189 CD PRO A 83 -5.268 -14.207 0.553 1.00 0.00 C ATOM 0 HA PRO A 83 -7.699 -12.102 0.053 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -7.647 -13.162 2.613 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -8.068 -14.159 1.235 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -5.438 -13.932 2.676 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -6.245 -15.366 2.074 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -4.191 -14.189 0.720 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -5.474 -15.049 -0.108 1.00 0.00 H new ATOM 1197 N PHE A 84 -7.514 -10.275 1.625 1.00 0.00 N ATOM 1198 CA PHE A 84 -7.322 -9.044 2.335 1.00 0.00 C ATOM 1199 C PHE A 84 -8.314 -8.940 3.481 1.00 0.00 C ATOM 1200 O PHE A 84 -9.504 -9.195 3.292 1.00 0.00 O ATOM 1201 CB PHE A 84 -7.470 -7.850 1.406 1.00 0.00 C ATOM 1202 CG PHE A 84 -7.086 -6.553 2.050 1.00 0.00 C ATOM 1203 CD1 PHE A 84 -5.759 -6.258 2.304 1.00 0.00 C ATOM 1204 CD2 PHE A 84 -8.041 -5.643 2.400 1.00 0.00 C ATOM 1205 CE1 PHE A 84 -5.401 -5.074 2.898 1.00 0.00 C ATOM 1206 CE2 PHE A 84 -7.693 -4.449 2.992 1.00 0.00 C ATOM 1207 CZ PHE A 84 -6.369 -4.166 3.242 1.00 0.00 C ATOM 0 H PHE A 84 -8.450 -10.398 1.239 1.00 0.00 H new ATOM 0 HA PHE A 84 -6.309 -9.039 2.738 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -6.852 -8.007 0.522 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -8.504 -7.788 1.066 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.994 -6.969 2.031 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -9.082 -5.862 2.211 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -4.361 -4.858 3.094 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -8.458 -3.735 3.260 1.00 0.00 H new ATOM 0 HZ PHE A 84 -6.094 -3.231 3.708 1.00 0.00 H new ATOM 1217 N PRO A 85 -7.837 -8.611 4.690 1.00 0.00 N ATOM 1218 CA PRO A 85 -6.407 -8.399 4.959 1.00 0.00 C ATOM 1219 C PRO A 85 -5.668 -9.747 4.980 1.00 0.00 C ATOM 1220 O PRO A 85 -6.253 -10.790 5.343 1.00 0.00 O ATOM 1221 CB PRO A 85 -6.418 -7.749 6.338 1.00 0.00 C ATOM 1222 CG PRO A 85 -7.646 -8.270 6.993 1.00 0.00 C ATOM 1223 CD PRO A 85 -8.662 -8.420 5.898 1.00 0.00 C ATOM 0 HA PRO A 85 -5.898 -7.793 4.209 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -5.525 -8.011 6.906 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.441 -6.662 6.263 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.453 -9.225 7.481 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -7.999 -7.584 7.763 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -9.320 -9.271 6.074 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -9.297 -7.538 5.816 1.00 0.00 H new ATOM 1231 N THR A 86 -4.416 -9.720 4.552 1.00 0.00 N ATOM 1232 CA THR A 86 -3.610 -10.929 4.402 1.00 0.00 C ATOM 1233 C THR A 86 -3.285 -11.561 5.777 1.00 0.00 C ATOM 1234 O THR A 86 -3.666 -11.037 6.836 1.00 0.00 O ATOM 1235 CB THR A 86 -2.284 -10.570 3.620 1.00 0.00 C ATOM 1236 OG1 THR A 86 -1.450 -11.728 3.392 1.00 0.00 O ATOM 1237 CG2 THR A 86 -1.478 -9.519 4.362 1.00 0.00 C ATOM 0 H THR A 86 -3.927 -8.862 4.298 1.00 0.00 H new ATOM 0 HA THR A 86 -4.178 -11.667 3.835 1.00 0.00 H new ATOM 0 HB THR A 86 -2.599 -10.177 2.654 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.643 -11.459 2.905 1.00 0.00 H new ATOM 0 HG21 THR A 86 -0.572 -9.292 3.801 1.00 0.00 H new ATOM 0 HG22 THR A 86 -2.074 -8.613 4.470 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.209 -9.896 5.348 1.00 0.00 H new ATOM 1245 N THR A 87 -2.514 -12.618 5.741 1.00 0.00 N ATOM 1246 CA THR A 87 -2.216 -13.409 6.901 1.00 0.00 C ATOM 1247 C THR A 87 -0.721 -13.490 7.110 1.00 0.00 C ATOM 1248 O THR A 87 -0.240 -13.923 8.170 1.00 0.00 O ATOM 1249 CB THR A 87 -2.782 -14.826 6.705 1.00 0.00 C ATOM 1250 OG1 THR A 87 -2.396 -15.298 5.397 1.00 0.00 O ATOM 1251 CG2 THR A 87 -4.298 -14.832 6.820 1.00 0.00 C ATOM 0 H THR A 87 -2.069 -12.957 4.888 1.00 0.00 H new ATOM 0 HA THR A 87 -2.670 -12.944 7.776 1.00 0.00 H new ATOM 0 HB THR A 87 -2.382 -15.478 7.482 1.00 0.00 H new ATOM 0 HG1 THR A 87 -2.749 -16.202 5.258 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.670 -15.847 6.677 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.589 -14.475 7.808 1.00 0.00 H new ATOM 0 HG23 THR A 87 -4.723 -14.179 6.058 1.00 0.00 H new ATOM 1259 N SER A 88 0.008 -13.073 6.105 1.00 0.00 N ATOM 1260 CA SER A 88 1.401 -13.078 6.136 1.00 0.00 C ATOM 1261 C SER A 88 1.870 -11.950 5.208 1.00 0.00 C ATOM 1262 O SER A 88 1.379 -10.834 5.324 1.00 0.00 O ATOM 1263 CB SER A 88 1.937 -14.477 5.728 1.00 0.00 C ATOM 1264 OG SER A 88 3.328 -14.612 5.988 1.00 0.00 O ATOM 0 H SER A 88 -0.386 -12.717 5.234 1.00 0.00 H new ATOM 0 HA SER A 88 1.793 -12.896 7.137 1.00 0.00 H new ATOM 0 HB2 SER A 88 1.390 -15.247 6.272 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.749 -14.642 4.667 1.00 0.00 H new ATOM 0 HG SER A 88 3.789 -14.884 5.167 1.00 0.00 H new ATOM 1270 N GLU A 89 2.686 -12.255 4.245 1.00 0.00 N ATOM 1271 CA GLU A 89 3.296 -11.244 3.415 1.00 0.00 C ATOM 1272 C GLU A 89 3.075 -11.506 1.930 1.00 0.00 C ATOM 1273 O GLU A 89 2.255 -12.357 1.551 1.00 0.00 O ATOM 1274 CB GLU A 89 4.787 -11.118 3.695 1.00 0.00 C ATOM 1275 CG GLU A 89 5.637 -12.245 3.199 1.00 0.00 C ATOM 1276 CD GLU A 89 5.531 -13.515 3.993 1.00 0.00 C ATOM 1277 OE1 GLU A 89 4.593 -14.307 3.740 1.00 0.00 O ATOM 1278 OE2 GLU A 89 6.376 -13.746 4.878 1.00 0.00 O ATOM 0 H GLU A 89 2.952 -13.210 4.007 1.00 0.00 H new ATOM 0 HA GLU A 89 2.806 -10.305 3.671 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.145 -10.192 3.246 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.929 -11.026 4.772 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.366 -12.457 2.165 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.678 -11.922 3.196 1.00 0.00 H new ATOM 1285 N THR A 90 3.779 -10.763 1.107 1.00 0.00 N ATOM 1286 CA THR A 90 3.711 -10.889 -0.332 1.00 0.00 C ATOM 1287 C THR A 90 4.872 -11.682 -0.906 1.00 0.00 C ATOM 1288 O THR A 90 5.815 -12.026 -0.181 1.00 0.00 O ATOM 1289 CB THR A 90 3.715 -9.500 -0.952 1.00 0.00 C ATOM 1290 OG1 THR A 90 4.865 -8.761 -0.496 1.00 0.00 O ATOM 1291 CG2 THR A 90 2.480 -8.796 -0.550 1.00 0.00 C ATOM 0 H THR A 90 4.426 -10.041 1.424 1.00 0.00 H new ATOM 0 HA THR A 90 2.793 -11.428 -0.568 1.00 0.00 H new ATOM 0 HB THR A 90 3.759 -9.583 -2.038 1.00 0.00 H new ATOM 0 HG1 THR A 90 5.331 -8.374 -1.266 1.00 0.00 H new ATOM 0 HG21 THR A 90 2.471 -7.798 -0.988 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.612 -9.354 -0.901 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.444 -8.715 0.536 1.00 0.00 H new ATOM 1299 N PRO A 91 4.802 -12.022 -2.212 1.00 0.00 N ATOM 1300 CA PRO A 91 5.927 -12.603 -2.945 1.00 0.00 C ATOM 1301 C PRO A 91 7.152 -11.669 -2.946 1.00 0.00 C ATOM 1302 O PRO A 91 7.058 -10.470 -2.620 1.00 0.00 O ATOM 1303 CB PRO A 91 5.378 -12.732 -4.378 1.00 0.00 C ATOM 1304 CG PRO A 91 4.197 -11.839 -4.425 1.00 0.00 C ATOM 1305 CD PRO A 91 3.599 -11.949 -3.074 1.00 0.00 C ATOM 0 HA PRO A 91 6.264 -13.542 -2.506 1.00 0.00 H new ATOM 0 HB2 PRO A 91 6.125 -12.435 -5.114 1.00 0.00 H new ATOM 0 HB3 PRO A 91 5.102 -13.762 -4.602 1.00 0.00 H new ATOM 0 HG2 PRO A 91 4.484 -10.812 -4.650 1.00 0.00 H new ATOM 0 HG3 PRO A 91 3.494 -12.150 -5.198 1.00 0.00 H new ATOM 0 HD2 PRO A 91 2.975 -11.089 -2.832 1.00 0.00 H new ATOM 0 HD3 PRO A 91 2.972 -12.835 -2.976 1.00 0.00 H new ATOM 1313 N ARG A 92 8.268 -12.230 -3.327 1.00 0.00 N ATOM 1314 CA ARG A 92 9.541 -11.548 -3.375 1.00 0.00 C ATOM 1315 C ARG A 92 9.584 -10.736 -4.661 1.00 0.00 C ATOM 1316 O ARG A 92 9.534 -11.297 -5.761 1.00 0.00 O ATOM 1317 CB ARG A 92 10.642 -12.630 -3.329 1.00 0.00 C ATOM 1318 CG ARG A 92 12.116 -12.191 -3.242 1.00 0.00 C ATOM 1319 CD ARG A 92 12.649 -11.578 -4.536 1.00 0.00 C ATOM 1320 NE ARG A 92 12.396 -12.439 -5.707 1.00 0.00 N ATOM 1321 CZ ARG A 92 13.206 -12.577 -6.765 1.00 0.00 C ATOM 1322 NH1 ARG A 92 14.433 -12.053 -6.762 1.00 0.00 N ATOM 1323 NH2 ARG A 92 12.790 -13.263 -7.816 1.00 0.00 N ATOM 0 H ARG A 92 8.322 -13.205 -3.623 1.00 0.00 H new ATOM 0 HA ARG A 92 9.690 -10.865 -2.539 1.00 0.00 H new ATOM 0 HB2 ARG A 92 10.438 -13.271 -2.471 1.00 0.00 H new ATOM 0 HB3 ARG A 92 10.534 -13.247 -4.221 1.00 0.00 H new ATOM 0 HG2 ARG A 92 12.223 -11.466 -2.435 1.00 0.00 H new ATOM 0 HG3 ARG A 92 12.728 -13.054 -2.979 1.00 0.00 H new ATOM 0 HD2 ARG A 92 12.182 -10.606 -4.695 1.00 0.00 H new ATOM 0 HD3 ARG A 92 13.721 -11.405 -4.439 1.00 0.00 H new ATOM 0 HE ARG A 92 11.529 -12.976 -5.711 1.00 0.00 H new ATOM 0 HH11 ARG A 92 14.766 -11.539 -5.946 1.00 0.00 H new ATOM 0 HH12 ARG A 92 15.038 -12.167 -7.575 1.00 0.00 H new ATOM 0 HH21 ARG A 92 11.860 -13.681 -7.816 1.00 0.00 H new ATOM 0 HH22 ARG A 92 13.399 -13.374 -8.626 1.00 0.00 H new ATOM 1337 N VAL A 93 9.690 -9.441 -4.516 1.00 0.00 N ATOM 1338 CA VAL A 93 9.650 -8.517 -5.640 1.00 0.00 C ATOM 1339 C VAL A 93 10.851 -7.577 -5.631 1.00 0.00 C ATOM 1340 O VAL A 93 11.166 -6.942 -4.613 1.00 0.00 O ATOM 1341 CB VAL A 93 8.315 -7.701 -5.652 1.00 0.00 C ATOM 1342 CG1 VAL A 93 8.315 -6.612 -6.727 1.00 0.00 C ATOM 1343 CG2 VAL A 93 7.137 -8.638 -5.870 1.00 0.00 C ATOM 0 H VAL A 93 9.808 -8.985 -3.611 1.00 0.00 H new ATOM 0 HA VAL A 93 9.695 -9.112 -6.552 1.00 0.00 H new ATOM 0 HB VAL A 93 8.224 -7.209 -4.684 1.00 0.00 H new ATOM 0 HG11 VAL A 93 7.369 -6.072 -6.698 1.00 0.00 H new ATOM 0 HG12 VAL A 93 9.135 -5.918 -6.542 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.441 -7.069 -7.708 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.211 -8.063 -5.877 1.00 0.00 H new ATOM 0 HG22 VAL A 93 7.252 -9.152 -6.824 1.00 0.00 H new ATOM 0 HG23 VAL A 93 7.102 -9.372 -5.065 1.00 0.00 H new ATOM 1353 N VAL A 94 11.511 -7.518 -6.752 1.00 0.00 N ATOM 1354 CA VAL A 94 12.669 -6.686 -6.958 1.00 0.00 C ATOM 1355 C VAL A 94 12.268 -5.505 -7.834 1.00 0.00 C ATOM 1356 O VAL A 94 11.502 -5.665 -8.789 1.00 0.00 O ATOM 1357 CB VAL A 94 13.799 -7.489 -7.682 1.00 0.00 C ATOM 1358 CG1 VAL A 94 15.034 -6.635 -7.938 1.00 0.00 C ATOM 1359 CG2 VAL A 94 14.182 -8.718 -6.890 1.00 0.00 C ATOM 0 H VAL A 94 11.253 -8.063 -7.575 1.00 0.00 H new ATOM 0 HA VAL A 94 13.041 -6.345 -5.992 1.00 0.00 H new ATOM 0 HB VAL A 94 13.396 -7.797 -8.647 1.00 0.00 H new ATOM 0 HG11 VAL A 94 15.792 -7.234 -8.442 1.00 0.00 H new ATOM 0 HG12 VAL A 94 14.765 -5.786 -8.566 1.00 0.00 H new ATOM 0 HG13 VAL A 94 15.429 -6.273 -6.989 1.00 0.00 H new ATOM 0 HG21 VAL A 94 14.969 -9.259 -7.415 1.00 0.00 H new ATOM 0 HG22 VAL A 94 14.542 -8.419 -5.905 1.00 0.00 H new ATOM 0 HG23 VAL A 94 13.311 -9.364 -6.777 1.00 0.00 H new ATOM 1369 N TYR A 95 12.746 -4.339 -7.503 1.00 0.00 N ATOM 1370 CA TYR A 95 12.516 -3.177 -8.322 1.00 0.00 C ATOM 1371 C TYR A 95 13.588 -3.098 -9.361 1.00 0.00 C ATOM 1372 O TYR A 95 14.752 -2.964 -9.048 1.00 0.00 O ATOM 1373 CB TYR A 95 12.485 -1.889 -7.494 1.00 0.00 C ATOM 1374 CG TYR A 95 11.110 -1.446 -7.062 1.00 0.00 C ATOM 1375 CD1 TYR A 95 10.236 -2.312 -6.432 1.00 0.00 C ATOM 1376 CD2 TYR A 95 10.682 -0.147 -7.306 1.00 0.00 C ATOM 1377 CE1 TYR A 95 8.976 -1.897 -6.053 1.00 0.00 C ATOM 1378 CE2 TYR A 95 9.426 0.274 -6.928 1.00 0.00 C ATOM 1379 CZ TYR A 95 8.579 -0.601 -6.303 1.00 0.00 C ATOM 1380 OH TYR A 95 7.334 -0.183 -5.926 1.00 0.00 O ATOM 0 H TYR A 95 13.302 -4.165 -6.666 1.00 0.00 H new ATOM 0 HA TYR A 95 11.539 -3.276 -8.795 1.00 0.00 H new ATOM 0 HB2 TYR A 95 13.101 -2.030 -6.606 1.00 0.00 H new ATOM 0 HB3 TYR A 95 12.943 -1.089 -8.076 1.00 0.00 H new ATOM 0 HD1 TYR A 95 10.544 -3.328 -6.234 1.00 0.00 H new ATOM 0 HD2 TYR A 95 11.346 0.546 -7.801 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.303 -2.585 -5.562 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.111 1.288 -7.124 1.00 0.00 H new ATOM 0 HH TYR A 95 6.874 0.212 -6.696 1.00 0.00 H new ATOM 1390 N ASN A 96 13.217 -3.200 -10.592 1.00 0.00 N ATOM 1391 CA ASN A 96 14.199 -3.129 -11.652 1.00 0.00 C ATOM 1392 C ASN A 96 14.205 -1.713 -12.193 1.00 0.00 C ATOM 1393 O ASN A 96 14.182 -1.479 -13.406 1.00 0.00 O ATOM 1394 CB ASN A 96 13.907 -4.142 -12.783 1.00 0.00 C ATOM 1395 CG ASN A 96 13.543 -5.543 -12.287 1.00 0.00 C ATOM 1396 OD1 ASN A 96 12.360 -5.884 -12.195 1.00 0.00 O ATOM 1397 ND2 ASN A 96 14.515 -6.330 -11.892 1.00 0.00 N ATOM 0 H ASN A 96 12.254 -3.332 -10.901 1.00 0.00 H new ATOM 0 HA ASN A 96 15.178 -3.389 -11.249 1.00 0.00 H new ATOM 0 HB2 ASN A 96 13.090 -3.761 -13.395 1.00 0.00 H new ATOM 0 HB3 ASN A 96 14.783 -4.213 -13.428 1.00 0.00 H new ATOM 0 HD21 ASN A 96 14.301 -7.246 -11.498 1.00 0.00 H new ATOM 0 HD22 ASN A 96 15.485 -6.026 -11.978 1.00 0.00 H new ATOM 1404 N SER A 97 14.203 -0.763 -11.283 1.00 0.00 N ATOM 1405 CA SER A 97 14.133 0.630 -11.612 1.00 0.00 C ATOM 1406 C SER A 97 14.817 1.472 -10.542 1.00 0.00 C ATOM 1407 O SER A 97 14.467 1.395 -9.368 1.00 0.00 O ATOM 1408 CB SER A 97 12.677 1.054 -11.730 1.00 0.00 C ATOM 1409 OG SER A 97 12.002 0.328 -12.754 1.00 0.00 O ATOM 0 H SER A 97 14.251 -0.947 -10.281 1.00 0.00 H new ATOM 0 HA SER A 97 14.644 0.786 -12.562 1.00 0.00 H new ATOM 0 HB2 SER A 97 12.172 0.895 -10.777 1.00 0.00 H new ATOM 0 HB3 SER A 97 12.624 2.121 -11.944 1.00 0.00 H new ATOM 0 HG SER A 97 11.104 0.085 -12.445 1.00 0.00 H new ATOM 1415 N ARG A 98 15.752 2.281 -10.958 1.00 0.00 N ATOM 1416 CA ARG A 98 16.482 3.150 -10.061 1.00 0.00 C ATOM 1417 C ARG A 98 15.975 4.570 -10.145 1.00 0.00 C ATOM 1418 O ARG A 98 16.681 5.493 -10.554 1.00 0.00 O ATOM 1419 CB ARG A 98 17.976 3.053 -10.312 1.00 0.00 C ATOM 1420 CG ARG A 98 18.403 3.168 -11.764 1.00 0.00 C ATOM 1421 CD ARG A 98 19.868 2.800 -11.898 1.00 0.00 C ATOM 1422 NE ARG A 98 20.117 1.446 -11.346 1.00 0.00 N ATOM 1423 CZ ARG A 98 21.271 0.770 -11.362 1.00 0.00 C ATOM 1424 NH1 ARG A 98 22.286 1.186 -12.099 1.00 0.00 N ATOM 1425 NH2 ARG A 98 21.380 -0.357 -10.663 1.00 0.00 N ATOM 0 H ARG A 98 16.035 2.360 -11.935 1.00 0.00 H new ATOM 0 HA ARG A 98 16.307 2.815 -9.039 1.00 0.00 H new ATOM 0 HB2 ARG A 98 18.474 3.837 -9.742 1.00 0.00 H new ATOM 0 HB3 ARG A 98 18.331 2.100 -9.921 1.00 0.00 H new ATOM 0 HG2 ARG A 98 17.795 2.510 -12.385 1.00 0.00 H new ATOM 0 HG3 ARG A 98 18.240 4.185 -12.121 1.00 0.00 H new ATOM 0 HD2 ARG A 98 20.162 2.831 -12.947 1.00 0.00 H new ATOM 0 HD3 ARG A 98 20.482 3.532 -11.373 1.00 0.00 H new ATOM 0 HE ARG A 98 19.323 0.980 -10.907 1.00 0.00 H new ATOM 0 HH11 ARG A 98 22.194 2.031 -12.663 1.00 0.00 H new ATOM 0 HH12 ARG A 98 23.161 0.662 -12.103 1.00 0.00 H new ATOM 0 HH21 ARG A 98 20.587 -0.699 -10.120 1.00 0.00 H new ATOM 0 HH22 ARG A 98 22.257 -0.879 -10.670 1.00 0.00 H new ATOM 1439 N THR A 99 14.748 4.731 -9.762 1.00 0.00 N ATOM 1440 CA THR A 99 14.069 5.984 -9.793 1.00 0.00 C ATOM 1441 C THR A 99 12.750 5.774 -9.061 1.00 0.00 C ATOM 1442 O THR A 99 12.443 4.629 -8.685 1.00 0.00 O ATOM 1443 CB THR A 99 13.853 6.452 -11.283 1.00 0.00 C ATOM 1444 OG1 THR A 99 13.223 7.747 -11.348 1.00 0.00 O ATOM 1445 CG2 THR A 99 13.016 5.454 -12.070 1.00 0.00 C ATOM 0 H THR A 99 14.173 3.967 -9.407 1.00 0.00 H new ATOM 0 HA THR A 99 14.645 6.772 -9.308 1.00 0.00 H new ATOM 0 HB THR A 99 14.845 6.515 -11.730 1.00 0.00 H new ATOM 0 HG1 THR A 99 13.106 8.007 -12.286 1.00 0.00 H new ATOM 0 HG21 THR A 99 12.889 5.811 -13.092 1.00 0.00 H new ATOM 0 HG22 THR A 99 13.520 4.487 -12.084 1.00 0.00 H new ATOM 0 HG23 THR A 99 12.039 5.347 -11.599 1.00 0.00 H new ATOM 1453 N ASP A 100 12.006 6.846 -8.835 1.00 0.00 N ATOM 1454 CA ASP A 100 10.719 6.787 -8.131 1.00 0.00 C ATOM 1455 C ASP A 100 9.714 5.986 -8.947 1.00 0.00 C ATOM 1456 O ASP A 100 9.165 6.484 -9.939 1.00 0.00 O ATOM 1457 CB ASP A 100 10.126 8.198 -7.895 1.00 0.00 C ATOM 1458 CG ASP A 100 10.927 9.097 -6.979 1.00 0.00 C ATOM 1459 OD1 ASP A 100 11.969 9.640 -7.412 1.00 0.00 O ATOM 1460 OD2 ASP A 100 10.499 9.330 -5.830 1.00 0.00 O ATOM 0 H ASP A 100 12.271 7.785 -9.132 1.00 0.00 H new ATOM 0 HA ASP A 100 10.905 6.312 -7.167 1.00 0.00 H new ATOM 0 HB2 ASP A 100 10.019 8.694 -8.860 1.00 0.00 H new ATOM 0 HB3 ASP A 100 9.124 8.087 -7.481 1.00 0.00 H new ATOM 1465 N LYS A 101 9.515 4.763 -8.577 1.00 0.00 N ATOM 1466 CA LYS A 101 8.568 3.905 -9.230 1.00 0.00 C ATOM 1467 C LYS A 101 7.418 3.617 -8.297 1.00 0.00 C ATOM 1468 O LYS A 101 7.624 3.412 -7.101 1.00 0.00 O ATOM 1469 CB LYS A 101 9.233 2.597 -9.662 1.00 0.00 C ATOM 1470 CG LYS A 101 9.204 2.379 -11.152 1.00 0.00 C ATOM 1471 CD LYS A 101 9.989 3.451 -11.863 1.00 0.00 C ATOM 1472 CE LYS A 101 9.813 3.374 -13.354 1.00 0.00 C ATOM 1473 NZ LYS A 101 10.138 2.039 -13.906 1.00 0.00 N ATOM 0 H LYS A 101 10.010 4.321 -7.802 1.00 0.00 H new ATOM 0 HA LYS A 101 8.194 4.410 -10.121 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.268 2.594 -9.321 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.733 1.763 -9.170 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.619 1.400 -11.389 1.00 0.00 H new ATOM 0 HG3 LYS A 101 8.173 2.382 -11.505 1.00 0.00 H new ATOM 0 HD2 LYS A 101 9.669 4.431 -11.509 1.00 0.00 H new ATOM 0 HD3 LYS A 101 11.046 3.352 -11.616 1.00 0.00 H new ATOM 0 HE2 LYS A 101 8.783 3.624 -13.606 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.448 4.122 -13.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 10.330 2.122 -14.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 10.978 1.660 -13.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 9.334 1.396 -13.757 1.00 0.00 H new ATOM 1487 N PRO A 102 6.186 3.629 -8.835 1.00 0.00 N ATOM 1488 CA PRO A 102 4.975 3.351 -8.069 1.00 0.00 C ATOM 1489 C PRO A 102 5.021 2.007 -7.374 1.00 0.00 C ATOM 1490 O PRO A 102 5.626 1.043 -7.881 1.00 0.00 O ATOM 1491 CB PRO A 102 3.868 3.343 -9.123 1.00 0.00 C ATOM 1492 CG PRO A 102 4.555 3.269 -10.432 1.00 0.00 C ATOM 1493 CD PRO A 102 5.869 3.937 -10.240 1.00 0.00 C ATOM 0 HA PRO A 102 4.833 4.087 -7.278 1.00 0.00 H new ATOM 0 HB2 PRO A 102 3.201 2.492 -8.983 1.00 0.00 H new ATOM 0 HB3 PRO A 102 3.256 4.242 -9.053 1.00 0.00 H new ATOM 0 HG2 PRO A 102 4.685 2.234 -10.747 1.00 0.00 H new ATOM 0 HG3 PRO A 102 3.973 3.767 -11.207 1.00 0.00 H new ATOM 0 HD2 PRO A 102 6.625 3.546 -10.921 1.00 0.00 H new ATOM 0 HD3 PRO A 102 5.807 5.011 -10.415 1.00 0.00 H new ATOM 1501 N TRP A 103 4.383 1.937 -6.251 1.00 0.00 N ATOM 1502 CA TRP A 103 4.350 0.734 -5.475 1.00 0.00 C ATOM 1503 C TRP A 103 3.154 -0.076 -5.963 1.00 0.00 C ATOM 1504 O TRP A 103 2.005 0.364 -5.823 1.00 0.00 O ATOM 1505 CB TRP A 103 4.245 1.097 -3.985 1.00 0.00 C ATOM 1506 CG TRP A 103 4.528 -0.034 -3.047 1.00 0.00 C ATOM 1507 CD1 TRP A 103 5.588 -0.884 -3.099 1.00 0.00 C ATOM 1508 CD2 TRP A 103 3.780 -0.401 -1.884 1.00 0.00 C ATOM 1509 NE1 TRP A 103 5.523 -1.776 -2.068 1.00 0.00 N ATOM 1510 CE2 TRP A 103 4.429 -1.504 -1.306 1.00 0.00 C ATOM 1511 CE3 TRP A 103 2.620 0.082 -1.284 1.00 0.00 C ATOM 1512 CZ2 TRP A 103 3.964 -2.126 -0.156 1.00 0.00 C ATOM 1513 CZ3 TRP A 103 2.155 -0.538 -0.136 1.00 0.00 C ATOM 1514 CH2 TRP A 103 2.829 -1.632 0.411 1.00 0.00 C ATOM 0 H TRP A 103 3.866 2.715 -5.842 1.00 0.00 H new ATOM 0 HA TRP A 103 5.256 0.139 -5.592 1.00 0.00 H new ATOM 0 HB2 TRP A 103 4.939 1.910 -3.773 1.00 0.00 H new ATOM 0 HB3 TRP A 103 3.242 1.474 -3.786 1.00 0.00 H new ATOM 0 HD1 TRP A 103 6.367 -0.857 -3.846 1.00 0.00 H new ATOM 0 HE1 TRP A 103 6.190 -2.528 -1.896 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.093 0.925 -1.706 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 4.483 -2.970 0.273 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 1.259 -0.170 0.342 1.00 0.00 H new ATOM 0 HH2 TRP A 103 2.441 -2.097 1.305 1.00 0.00 H new ATOM 1525 N PRO A 104 3.390 -1.231 -6.608 1.00 0.00 N ATOM 1526 CA PRO A 104 2.318 -2.000 -7.221 1.00 0.00 C ATOM 1527 C PRO A 104 1.483 -2.754 -6.194 1.00 0.00 C ATOM 1528 O PRO A 104 1.728 -3.939 -5.915 1.00 0.00 O ATOM 1529 CB PRO A 104 3.072 -2.971 -8.137 1.00 0.00 C ATOM 1530 CG PRO A 104 4.401 -3.161 -7.490 1.00 0.00 C ATOM 1531 CD PRO A 104 4.708 -1.883 -6.762 1.00 0.00 C ATOM 0 HA PRO A 104 1.601 -1.368 -7.746 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.540 -3.918 -8.231 1.00 0.00 H new ATOM 0 HB3 PRO A 104 3.177 -2.563 -9.142 1.00 0.00 H new ATOM 0 HG2 PRO A 104 4.380 -4.005 -6.800 1.00 0.00 H new ATOM 0 HG3 PRO A 104 5.167 -3.377 -8.234 1.00 0.00 H new ATOM 0 HD2 PRO A 104 5.173 -2.077 -5.795 1.00 0.00 H new ATOM 0 HD3 PRO A 104 5.399 -1.258 -7.328 1.00 0.00 H new ATOM 1539 N VAL A 105 0.462 -2.085 -5.666 1.00 0.00 N ATOM 1540 CA VAL A 105 -0.406 -2.663 -4.675 1.00 0.00 C ATOM 1541 C VAL A 105 -1.780 -2.146 -4.916 1.00 0.00 C ATOM 1542 O VAL A 105 -1.950 -0.993 -5.329 1.00 0.00 O ATOM 1543 CB VAL A 105 0.021 -2.307 -3.209 1.00 0.00 C ATOM 1544 CG1 VAL A 105 -0.924 -2.926 -2.185 1.00 0.00 C ATOM 1545 CG2 VAL A 105 1.409 -2.787 -2.940 1.00 0.00 C ATOM 0 H VAL A 105 0.223 -1.127 -5.921 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.353 -3.748 -4.769 1.00 0.00 H new ATOM 0 HB VAL A 105 -0.022 -1.222 -3.114 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.597 -2.658 -1.180 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.935 -2.552 -2.350 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -0.917 -4.011 -2.292 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.691 -2.532 -1.918 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.451 -3.869 -3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.100 -2.311 -3.636 1.00 0.00 H new ATOM 1555 N ALA A 106 -2.738 -2.977 -4.706 1.00 0.00 N ATOM 1556 CA ALA A 106 -4.094 -2.601 -4.852 1.00 0.00 C ATOM 1557 C ALA A 106 -4.950 -3.405 -3.949 1.00 0.00 C ATOM 1558 O ALA A 106 -4.771 -4.615 -3.822 1.00 0.00 O ATOM 1559 CB ALA A 106 -4.542 -2.770 -6.261 1.00 0.00 C ATOM 0 H ALA A 106 -2.598 -3.947 -4.425 1.00 0.00 H new ATOM 0 HA ALA A 106 -4.185 -1.548 -4.585 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -5.588 -2.475 -6.348 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -3.933 -2.145 -6.914 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.434 -3.814 -6.554 1.00 0.00 H new ATOM 1565 N LEU A 107 -5.856 -2.751 -3.302 1.00 0.00 N ATOM 1566 CA LEU A 107 -6.763 -3.430 -2.436 1.00 0.00 C ATOM 1567 C LEU A 107 -8.084 -3.595 -3.173 1.00 0.00 C ATOM 1568 O LEU A 107 -8.806 -2.632 -3.379 1.00 0.00 O ATOM 1569 CB LEU A 107 -7.000 -2.653 -1.125 1.00 0.00 C ATOM 1570 CG LEU A 107 -5.784 -2.079 -0.379 1.00 0.00 C ATOM 1571 CD1 LEU A 107 -6.210 -1.529 0.961 1.00 0.00 C ATOM 1572 CD2 LEU A 107 -4.713 -3.119 -0.195 1.00 0.00 C ATOM 0 H LEU A 107 -5.989 -1.741 -3.357 1.00 0.00 H new ATOM 0 HA LEU A 107 -6.335 -4.396 -2.168 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -7.673 -1.825 -1.348 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -7.527 -3.315 -0.438 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.368 -1.273 -0.983 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -5.342 -1.125 1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.945 -0.738 0.813 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.652 -2.327 1.558 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -3.868 -2.681 0.336 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.111 -3.953 0.383 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.383 -3.478 -1.170 1.00 0.00 H new ATOM 1584 N TYR A 108 -8.355 -4.767 -3.624 1.00 0.00 N ATOM 1585 CA TYR A 108 -9.612 -5.059 -4.291 1.00 0.00 C ATOM 1586 C TYR A 108 -10.688 -5.292 -3.251 1.00 0.00 C ATOM 1587 O TYR A 108 -10.842 -6.385 -2.757 1.00 0.00 O ATOM 1588 CB TYR A 108 -9.495 -6.305 -5.184 1.00 0.00 C ATOM 1589 CG TYR A 108 -8.647 -6.145 -6.420 1.00 0.00 C ATOM 1590 CD1 TYR A 108 -7.290 -5.902 -6.336 1.00 0.00 C ATOM 1591 CD2 TYR A 108 -9.216 -6.242 -7.679 1.00 0.00 C ATOM 1592 CE1 TYR A 108 -6.528 -5.760 -7.465 1.00 0.00 C ATOM 1593 CE2 TYR A 108 -8.457 -6.104 -8.819 1.00 0.00 C ATOM 1594 CZ TYR A 108 -7.112 -5.863 -8.706 1.00 0.00 C ATOM 1595 OH TYR A 108 -6.344 -5.722 -9.837 1.00 0.00 O ATOM 0 H TYR A 108 -7.723 -5.564 -3.550 1.00 0.00 H new ATOM 0 HA TYR A 108 -9.870 -4.208 -4.921 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -9.085 -7.120 -4.587 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -10.497 -6.606 -5.489 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -6.823 -5.823 -5.365 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -10.276 -6.430 -7.768 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -5.469 -5.567 -7.381 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -8.916 -6.185 -9.793 1.00 0.00 H new ATOM 0 HH TYR A 108 -6.909 -5.824 -10.631 1.00 0.00 H new ATOM 1605 N LEU A 109 -11.384 -4.266 -2.889 1.00 0.00 N ATOM 1606 CA LEU A 109 -12.458 -4.386 -1.936 1.00 0.00 C ATOM 1607 C LEU A 109 -13.750 -3.977 -2.562 1.00 0.00 C ATOM 1608 O LEU A 109 -13.894 -2.863 -3.012 1.00 0.00 O ATOM 1609 CB LEU A 109 -12.200 -3.609 -0.637 1.00 0.00 C ATOM 1610 CG LEU A 109 -11.258 -4.240 0.386 1.00 0.00 C ATOM 1611 CD1 LEU A 109 -11.564 -5.704 0.637 1.00 0.00 C ATOM 1612 CD2 LEU A 109 -9.829 -4.010 0.034 1.00 0.00 C ATOM 0 H LEU A 109 -11.232 -3.320 -3.239 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.516 -5.436 -1.650 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.800 -2.631 -0.904 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -13.160 -3.439 -0.150 1.00 0.00 H new ATOM 0 HG LEU A 109 -11.438 -3.731 1.333 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.864 -6.101 1.372 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -12.582 -5.803 1.014 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -11.466 -6.261 -0.295 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -9.190 -4.474 0.785 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.619 -4.449 -0.942 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -9.630 -2.939 0.000 1.00 0.00 H new ATOM 1624 N THR A 110 -14.674 -4.876 -2.587 1.00 0.00 N ATOM 1625 CA THR A 110 -15.913 -4.673 -3.235 1.00 0.00 C ATOM 1626 C THR A 110 -17.077 -4.874 -2.266 1.00 0.00 C ATOM 1627 O THR A 110 -16.994 -5.673 -1.350 1.00 0.00 O ATOM 1628 CB THR A 110 -15.970 -5.624 -4.439 1.00 0.00 C ATOM 1629 OG1 THR A 110 -16.062 -4.844 -5.618 1.00 0.00 O ATOM 1630 CG2 THR A 110 -17.093 -6.692 -4.353 1.00 0.00 C ATOM 0 H THR A 110 -14.581 -5.791 -2.146 1.00 0.00 H new ATOM 0 HA THR A 110 -16.002 -3.646 -3.589 1.00 0.00 H new ATOM 0 HB THR A 110 -15.053 -6.212 -4.448 1.00 0.00 H new ATOM 0 HG1 THR A 110 -16.494 -5.368 -6.324 1.00 0.00 H new ATOM 0 HG21 THR A 110 -17.064 -7.323 -5.242 1.00 0.00 H new ATOM 0 HG22 THR A 110 -16.942 -7.308 -3.466 1.00 0.00 H new ATOM 0 HG23 THR A 110 -18.062 -6.197 -4.291 1.00 0.00 H new ATOM 1638 N PRO A 111 -18.150 -4.103 -2.446 1.00 0.00 N ATOM 1639 CA PRO A 111 -19.316 -4.145 -1.577 1.00 0.00 C ATOM 1640 C PRO A 111 -19.989 -5.504 -1.586 1.00 0.00 C ATOM 1641 O PRO A 111 -20.403 -6.015 -2.646 1.00 0.00 O ATOM 1642 CB PRO A 111 -20.252 -3.098 -2.176 1.00 0.00 C ATOM 1643 CG PRO A 111 -19.783 -2.919 -3.564 1.00 0.00 C ATOM 1644 CD PRO A 111 -18.313 -3.132 -3.528 1.00 0.00 C ATOM 0 HA PRO A 111 -19.049 -3.955 -0.537 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -21.289 -3.434 -2.149 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -20.206 -2.162 -1.619 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -20.265 -3.631 -4.234 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -20.024 -1.922 -3.932 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -17.937 -3.517 -4.476 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -17.775 -2.206 -3.324 1.00 0.00 H new ATOM 1652 N VAL A 112 -20.029 -6.093 -0.406 1.00 0.00 N ATOM 1653 CA VAL A 112 -20.706 -7.358 -0.153 1.00 0.00 C ATOM 1654 C VAL A 112 -22.230 -7.259 -0.277 1.00 0.00 C ATOM 1655 O VAL A 112 -22.721 -7.000 -1.327 1.00 0.00 O ATOM 1656 CB VAL A 112 -20.293 -7.992 1.196 1.00 0.00 C ATOM 1657 CG1 VAL A 112 -18.951 -8.612 1.045 1.00 0.00 C ATOM 1658 CG2 VAL A 112 -20.227 -6.940 2.303 1.00 0.00 C ATOM 0 H VAL A 112 -19.583 -5.700 0.423 1.00 0.00 H new ATOM 0 HA VAL A 112 -20.369 -8.028 -0.944 1.00 0.00 H new ATOM 0 HB VAL A 112 -21.038 -8.739 1.470 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -18.650 -9.062 1.991 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -18.990 -9.381 0.273 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -18.227 -7.848 0.760 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -19.934 -7.415 3.239 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -19.494 -6.178 2.038 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -21.206 -6.475 2.422 1.00 0.00 H new ATOM 1668 N SER A 113 -22.953 -7.504 0.777 1.00 0.00 N ATOM 1669 CA SER A 113 -24.388 -7.392 0.744 1.00 0.00 C ATOM 1670 C SER A 113 -24.758 -6.236 1.623 1.00 0.00 C ATOM 1671 O SER A 113 -25.581 -5.387 1.281 1.00 0.00 O ATOM 1672 CB SER A 113 -25.035 -8.713 1.211 1.00 0.00 C ATOM 1673 OG SER A 113 -26.454 -8.670 1.171 1.00 0.00 O ATOM 0 H SER A 113 -22.571 -7.786 1.680 1.00 0.00 H new ATOM 0 HA SER A 113 -24.754 -7.212 -0.267 1.00 0.00 H new ATOM 0 HB2 SER A 113 -24.682 -9.529 0.580 1.00 0.00 H new ATOM 0 HB3 SER A 113 -24.710 -8.933 2.228 1.00 0.00 H new ATOM 0 HG SER A 113 -26.816 -9.529 1.474 1.00 0.00 H new ATOM 1679 N SER A 114 -24.043 -6.160 2.718 1.00 0.00 N ATOM 1680 CA SER A 114 -24.206 -5.212 3.724 1.00 0.00 C ATOM 1681 C SER A 114 -23.588 -3.855 3.372 1.00 0.00 C ATOM 1682 O SER A 114 -23.137 -3.122 4.246 1.00 0.00 O ATOM 1683 CB SER A 114 -23.530 -5.778 4.916 1.00 0.00 C ATOM 1684 OG SER A 114 -24.199 -6.927 5.411 1.00 0.00 O ATOM 0 H SER A 114 -23.288 -6.816 2.917 1.00 0.00 H new ATOM 0 HA SER A 114 -25.267 -5.020 3.885 1.00 0.00 H new ATOM 0 HB2 SER A 114 -22.503 -6.038 4.661 1.00 0.00 H new ATOM 0 HB3 SER A 114 -23.482 -5.021 5.699 1.00 0.00 H new ATOM 0 HG SER A 114 -23.722 -7.271 6.195 1.00 0.00 H new ATOM 1690 N ALA A 115 -23.562 -3.538 2.124 1.00 0.00 N ATOM 1691 CA ALA A 115 -23.029 -2.310 1.678 1.00 0.00 C ATOM 1692 C ALA A 115 -24.161 -1.456 1.159 1.00 0.00 C ATOM 1693 O ALA A 115 -25.101 -1.984 0.535 1.00 0.00 O ATOM 1694 CB ALA A 115 -22.007 -2.582 0.614 1.00 0.00 C ATOM 0 H ALA A 115 -23.917 -4.137 1.379 1.00 0.00 H new ATOM 0 HA ALA A 115 -22.537 -1.774 2.490 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -21.588 -1.639 0.262 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -21.210 -3.202 1.025 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -22.479 -3.103 -0.219 1.00 0.00 H new ATOM 1700 N GLY A 116 -24.118 -0.181 1.444 1.00 0.00 N ATOM 1701 CA GLY A 116 -25.163 0.709 1.014 1.00 0.00 C ATOM 1702 C GLY A 116 -24.931 2.109 1.513 1.00 0.00 C ATOM 1703 O GLY A 116 -24.709 2.328 2.724 1.00 0.00 O ATOM 0 H GLY A 116 -23.369 0.265 1.973 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -25.215 0.713 -0.075 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -26.124 0.346 1.377 1.00 0.00 H new ATOM 1707 N GLY A 117 -24.978 3.047 0.599 1.00 0.00 N ATOM 1708 CA GLY A 117 -24.699 4.432 0.892 1.00 0.00 C ATOM 1709 C GLY A 117 -23.264 4.630 1.290 1.00 0.00 C ATOM 1710 O GLY A 117 -22.407 3.905 0.802 1.00 0.00 O ATOM 0 H GLY A 117 -25.213 2.869 -0.378 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -24.923 5.043 0.017 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -25.351 4.774 1.695 1.00 0.00 H new ATOM 1714 N VAL A 118 -22.995 5.598 2.138 1.00 0.00 N ATOM 1715 CA VAL A 118 -21.633 5.908 2.555 1.00 0.00 C ATOM 1716 C VAL A 118 -20.893 4.686 3.125 1.00 0.00 C ATOM 1717 O VAL A 118 -21.171 4.190 4.225 1.00 0.00 O ATOM 1718 CB VAL A 118 -21.560 7.131 3.516 1.00 0.00 C ATOM 1719 CG1 VAL A 118 -22.422 6.938 4.761 1.00 0.00 C ATOM 1720 CG2 VAL A 118 -20.113 7.448 3.885 1.00 0.00 C ATOM 0 H VAL A 118 -23.707 6.194 2.560 1.00 0.00 H new ATOM 0 HA VAL A 118 -21.106 6.195 1.645 1.00 0.00 H new ATOM 0 HB VAL A 118 -21.969 7.988 2.981 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -22.339 7.816 5.401 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -23.462 6.801 4.466 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -22.081 6.058 5.307 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -20.088 8.306 4.557 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -19.667 6.586 4.381 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -19.549 7.679 2.981 1.00 0.00 H new ATOM 1730 N ALA A 119 -19.997 4.180 2.339 1.00 0.00 N ATOM 1731 CA ALA A 119 -19.224 3.035 2.720 1.00 0.00 C ATOM 1732 C ALA A 119 -17.816 3.436 3.102 1.00 0.00 C ATOM 1733 O ALA A 119 -17.201 2.812 3.973 1.00 0.00 O ATOM 1734 CB ALA A 119 -19.218 2.027 1.604 1.00 0.00 C ATOM 0 H ALA A 119 -19.778 4.547 1.413 1.00 0.00 H new ATOM 0 HA ALA A 119 -19.683 2.578 3.597 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -18.629 1.159 1.901 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -20.240 1.715 1.390 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -18.781 2.475 0.712 1.00 0.00 H new ATOM 1740 N ILE A 120 -17.312 4.481 2.478 1.00 0.00 N ATOM 1741 CA ILE A 120 -15.968 4.963 2.755 1.00 0.00 C ATOM 1742 C ILE A 120 -16.036 6.456 3.055 1.00 0.00 C ATOM 1743 O ILE A 120 -16.801 7.175 2.414 1.00 0.00 O ATOM 1744 CB ILE A 120 -14.989 4.717 1.554 1.00 0.00 C ATOM 1745 CG1 ILE A 120 -14.949 3.233 1.172 1.00 0.00 C ATOM 1746 CG2 ILE A 120 -13.593 5.192 1.900 1.00 0.00 C ATOM 1747 CD1 ILE A 120 -14.025 2.900 0.009 1.00 0.00 C ATOM 0 H ILE A 120 -17.814 5.018 1.771 1.00 0.00 H new ATOM 0 HA ILE A 120 -15.580 4.410 3.610 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.359 5.287 0.702 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -14.637 2.656 2.043 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -15.959 2.909 0.920 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -12.928 5.013 1.055 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -13.617 6.259 2.124 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -13.228 4.647 2.770 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -14.062 1.829 -0.190 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -14.346 3.445 -0.879 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -13.004 3.188 0.261 1.00 0.00 H new ATOM 1759 N LYS A 121 -15.270 6.905 4.022 1.00 0.00 N ATOM 1760 CA LYS A 121 -15.229 8.303 4.413 1.00 0.00 C ATOM 1761 C LYS A 121 -13.873 8.916 4.145 1.00 0.00 C ATOM 1762 O LYS A 121 -12.845 8.337 4.479 1.00 0.00 O ATOM 1763 CB LYS A 121 -15.575 8.452 5.884 1.00 0.00 C ATOM 1764 CG LYS A 121 -17.063 8.457 6.217 1.00 0.00 C ATOM 1765 CD LYS A 121 -17.701 9.853 6.064 1.00 0.00 C ATOM 1766 CE LYS A 121 -17.978 10.278 4.633 1.00 0.00 C ATOM 1767 NZ LYS A 121 -18.651 11.593 4.597 1.00 0.00 N ATOM 0 H LYS A 121 -14.650 6.307 4.568 1.00 0.00 H new ATOM 0 HA LYS A 121 -15.968 8.832 3.811 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -15.101 7.639 6.434 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -15.137 9.381 6.249 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -17.580 7.752 5.565 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -17.204 8.108 7.240 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -18.638 9.871 6.620 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -17.043 10.589 6.525 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -17.042 10.328 4.076 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -18.602 9.532 4.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -18.831 11.864 3.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -19.554 11.535 5.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -18.043 12.307 5.047 1.00 0.00 H new ATOM 1781 N ALA A 122 -13.884 10.093 3.557 1.00 0.00 N ATOM 1782 CA ALA A 122 -12.663 10.818 3.225 1.00 0.00 C ATOM 1783 C ALA A 122 -11.953 11.282 4.490 1.00 0.00 C ATOM 1784 O ALA A 122 -12.586 11.803 5.404 1.00 0.00 O ATOM 1785 CB ALA A 122 -12.988 12.010 2.347 1.00 0.00 C ATOM 0 H ALA A 122 -14.740 10.581 3.292 1.00 0.00 H new ATOM 0 HA ALA A 122 -11.999 10.145 2.682 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -12.070 12.545 2.105 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -13.461 11.666 1.427 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -13.667 12.678 2.877 1.00 0.00 H new ATOM 1791 N GLY A 123 -10.656 11.062 4.546 1.00 0.00 N ATOM 1792 CA GLY A 123 -9.873 11.465 5.698 1.00 0.00 C ATOM 1793 C GLY A 123 -9.880 10.415 6.791 1.00 0.00 C ATOM 1794 O GLY A 123 -9.256 10.593 7.850 1.00 0.00 O ATOM 0 H GLY A 123 -10.120 10.606 3.807 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -8.846 11.657 5.388 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.267 12.401 6.093 1.00 0.00 H new ATOM 1798 N SER A 124 -10.564 9.328 6.542 1.00 0.00 N ATOM 1799 CA SER A 124 -10.675 8.268 7.489 1.00 0.00 C ATOM 1800 C SER A 124 -9.723 7.144 7.080 1.00 0.00 C ATOM 1801 O SER A 124 -9.394 6.990 5.884 1.00 0.00 O ATOM 1802 CB SER A 124 -12.132 7.786 7.530 1.00 0.00 C ATOM 1803 OG SER A 124 -12.359 6.871 8.587 1.00 0.00 O ATOM 0 H SER A 124 -11.061 9.160 5.667 1.00 0.00 H new ATOM 0 HA SER A 124 -10.401 8.606 8.488 1.00 0.00 H new ATOM 0 HB2 SER A 124 -12.794 8.644 7.645 1.00 0.00 H new ATOM 0 HB3 SER A 124 -12.384 7.313 6.581 1.00 0.00 H new ATOM 0 HG SER A 124 -13.298 6.589 8.580 1.00 0.00 H new ATOM 1809 N LEU A 125 -9.254 6.404 8.068 1.00 0.00 N ATOM 1810 CA LEU A 125 -8.317 5.322 7.872 1.00 0.00 C ATOM 1811 C LEU A 125 -9.078 4.118 7.346 1.00 0.00 C ATOM 1812 O LEU A 125 -10.034 3.660 7.977 1.00 0.00 O ATOM 1813 CB LEU A 125 -7.612 5.022 9.232 1.00 0.00 C ATOM 1814 CG LEU A 125 -6.444 3.995 9.277 1.00 0.00 C ATOM 1815 CD1 LEU A 125 -6.903 2.578 9.055 1.00 0.00 C ATOM 1816 CD2 LEU A 125 -5.355 4.364 8.291 1.00 0.00 C ATOM 0 H LEU A 125 -9.520 6.543 9.043 1.00 0.00 H new ATOM 0 HA LEU A 125 -7.548 5.582 7.145 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -7.231 5.967 9.619 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -8.377 4.678 9.928 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.034 4.040 10.286 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -6.045 1.907 9.097 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -7.618 2.302 9.830 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -7.378 2.498 8.077 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.552 3.629 8.344 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.767 4.379 7.282 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -4.961 5.350 8.536 1.00 0.00 H new ATOM 1828 N ILE A 126 -8.665 3.613 6.214 1.00 0.00 N ATOM 1829 CA ILE A 126 -9.343 2.484 5.621 1.00 0.00 C ATOM 1830 C ILE A 126 -8.510 1.210 5.670 1.00 0.00 C ATOM 1831 O ILE A 126 -9.059 0.109 5.658 1.00 0.00 O ATOM 1832 CB ILE A 126 -9.772 2.748 4.165 1.00 0.00 C ATOM 1833 CG1 ILE A 126 -8.585 3.179 3.300 1.00 0.00 C ATOM 1834 CG2 ILE A 126 -10.909 3.757 4.106 1.00 0.00 C ATOM 1835 CD1 ILE A 126 -8.877 3.245 1.824 1.00 0.00 C ATOM 0 H ILE A 126 -7.866 3.961 5.684 1.00 0.00 H new ATOM 0 HA ILE A 126 -10.236 2.343 6.229 1.00 0.00 H new ATOM 0 HB ILE A 126 -10.144 1.810 3.751 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -8.246 4.159 3.634 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -7.762 2.484 3.464 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -11.193 3.925 3.067 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -11.766 3.372 4.658 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -10.584 4.698 4.550 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -7.980 3.559 1.289 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -9.185 2.261 1.470 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -9.677 3.963 1.643 1.00 0.00 H new ATOM 1847 N ALA A 127 -7.197 1.348 5.719 1.00 0.00 N ATOM 1848 CA ALA A 127 -6.320 0.198 5.730 1.00 0.00 C ATOM 1849 C ALA A 127 -4.950 0.593 6.223 1.00 0.00 C ATOM 1850 O ALA A 127 -4.648 1.772 6.336 1.00 0.00 O ATOM 1851 CB ALA A 127 -6.206 -0.398 4.335 1.00 0.00 C ATOM 0 H ALA A 127 -6.717 2.247 5.752 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.743 -0.549 6.401 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -5.542 -1.262 4.362 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -7.192 -0.708 3.990 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.801 0.349 3.652 1.00 0.00 H new ATOM 1857 N VAL A 128 -4.130 -0.384 6.493 1.00 0.00 N ATOM 1858 CA VAL A 128 -2.770 -0.191 6.974 1.00 0.00 C ATOM 1859 C VAL A 128 -1.905 -1.255 6.356 1.00 0.00 C ATOM 1860 O VAL A 128 -2.141 -2.441 6.559 1.00 0.00 O ATOM 1861 CB VAL A 128 -2.656 -0.291 8.534 1.00 0.00 C ATOM 1862 CG1 VAL A 128 -1.201 -0.286 8.985 1.00 0.00 C ATOM 1863 CG2 VAL A 128 -3.396 0.840 9.212 1.00 0.00 C ATOM 0 H VAL A 128 -4.385 -1.366 6.385 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.452 0.813 6.692 1.00 0.00 H new ATOM 0 HB VAL A 128 -3.112 -1.237 8.825 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.157 -0.356 10.072 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -0.681 -1.137 8.545 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.723 0.639 8.662 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -3.298 0.742 10.293 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -2.974 1.793 8.894 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -4.450 0.801 8.938 1.00 0.00 H new ATOM 1873 N LEU A 129 -0.978 -0.852 5.556 1.00 0.00 N ATOM 1874 CA LEU A 129 -0.067 -1.774 4.939 1.00 0.00 C ATOM 1875 C LEU A 129 1.335 -1.455 5.399 1.00 0.00 C ATOM 1876 O LEU A 129 1.633 -0.315 5.674 1.00 0.00 O ATOM 1877 CB LEU A 129 -0.162 -1.614 3.439 1.00 0.00 C ATOM 1878 CG LEU A 129 -1.561 -1.747 2.852 1.00 0.00 C ATOM 1879 CD1 LEU A 129 -1.523 -1.508 1.394 1.00 0.00 C ATOM 1880 CD2 LEU A 129 -2.157 -3.106 3.138 1.00 0.00 C ATOM 0 H LEU A 129 -0.824 0.125 5.307 1.00 0.00 H new ATOM 0 HA LEU A 129 -0.314 -2.799 5.215 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.234 -0.635 3.170 1.00 0.00 H new ATOM 0 HB3 LEU A 129 0.482 -2.358 2.970 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.195 -0.998 3.327 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.528 -1.605 0.983 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.147 -0.503 1.200 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -0.866 -2.239 0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -3.155 -3.164 2.704 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.526 -3.880 2.701 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -2.221 -3.256 4.216 1.00 0.00 H new ATOM 1892 N ILE A 130 2.182 -2.441 5.535 1.00 0.00 N ATOM 1893 CA ILE A 130 3.552 -2.164 5.922 1.00 0.00 C ATOM 1894 C ILE A 130 4.522 -2.769 4.914 1.00 0.00 C ATOM 1895 O ILE A 130 4.447 -3.939 4.599 1.00 0.00 O ATOM 1896 CB ILE A 130 3.914 -2.648 7.362 1.00 0.00 C ATOM 1897 CG1 ILE A 130 2.938 -2.103 8.409 1.00 0.00 C ATOM 1898 CG2 ILE A 130 5.319 -2.232 7.719 1.00 0.00 C ATOM 1899 CD1 ILE A 130 1.794 -3.038 8.718 1.00 0.00 C ATOM 0 H ILE A 130 1.961 -3.426 5.389 1.00 0.00 H new ATOM 0 HA ILE A 130 3.644 -1.078 5.929 1.00 0.00 H new ATOM 0 HB ILE A 130 3.842 -3.736 7.364 1.00 0.00 H new ATOM 0 HG12 ILE A 130 3.485 -1.896 9.329 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.535 -1.154 8.057 1.00 0.00 H new ATOM 0 HG21 ILE A 130 5.556 -2.577 8.726 1.00 0.00 H new ATOM 0 HG22 ILE A 130 6.020 -2.672 7.010 1.00 0.00 H new ATOM 0 HG23 ILE A 130 5.398 -1.146 7.680 1.00 0.00 H new ATOM 0 HD11 ILE A 130 1.145 -2.584 9.467 1.00 0.00 H new ATOM 0 HD12 ILE A 130 1.222 -3.226 7.809 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.187 -3.980 9.101 1.00 0.00 H new ATOM 1911 N LEU A 131 5.417 -1.970 4.440 1.00 0.00 N ATOM 1912 CA LEU A 131 6.380 -2.353 3.438 1.00 0.00 C ATOM 1913 C LEU A 131 7.741 -2.618 4.034 1.00 0.00 C ATOM 1914 O LEU A 131 8.205 -1.889 4.888 1.00 0.00 O ATOM 1915 CB LEU A 131 6.370 -1.279 2.349 1.00 0.00 C ATOM 1916 CG LEU A 131 7.664 -0.846 1.659 1.00 0.00 C ATOM 1917 CD1 LEU A 131 7.305 -0.052 0.434 1.00 0.00 C ATOM 1918 CD2 LEU A 131 8.540 0.052 2.518 1.00 0.00 C ATOM 0 H LEU A 131 5.510 -1.000 4.742 1.00 0.00 H new ATOM 0 HA LEU A 131 6.107 -3.305 2.984 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.691 -1.622 1.568 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.927 -0.385 2.787 1.00 0.00 H new ATOM 0 HG LEU A 131 8.219 -1.758 1.439 1.00 0.00 H new ATOM 0 HD11 LEU A 131 8.216 0.267 -0.073 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.712 -0.671 -0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 131 6.726 0.825 0.725 1.00 0.00 H new ATOM 0 HD21 LEU A 131 9.440 0.320 1.964 1.00 0.00 H new ATOM 0 HD22 LEU A 131 7.990 0.957 2.776 1.00 0.00 H new ATOM 0 HD23 LEU A 131 8.819 -0.476 3.430 1.00 0.00 H new ATOM 1930 N ARG A 132 8.341 -3.673 3.586 1.00 0.00 N ATOM 1931 CA ARG A 132 9.640 -4.113 4.018 1.00 0.00 C ATOM 1932 C ARG A 132 10.716 -3.617 3.069 1.00 0.00 C ATOM 1933 O ARG A 132 10.687 -3.928 1.869 1.00 0.00 O ATOM 1934 CB ARG A 132 9.674 -5.644 4.032 1.00 0.00 C ATOM 1935 CG ARG A 132 8.769 -6.303 5.046 1.00 0.00 C ATOM 1936 CD ARG A 132 9.272 -6.062 6.449 1.00 0.00 C ATOM 1937 NE ARG A 132 10.608 -6.629 6.646 1.00 0.00 N ATOM 1938 CZ ARG A 132 11.438 -6.347 7.659 1.00 0.00 C ATOM 1939 NH1 ARG A 132 11.049 -5.561 8.661 1.00 0.00 N ATOM 1940 NH2 ARG A 132 12.637 -6.901 7.678 1.00 0.00 N ATOM 0 H ARG A 132 7.927 -4.281 2.879 1.00 0.00 H new ATOM 0 HA ARG A 132 9.827 -3.714 5.015 1.00 0.00 H new ATOM 0 HB2 ARG A 132 9.404 -6.006 3.040 1.00 0.00 H new ATOM 0 HB3 ARG A 132 10.698 -5.966 4.221 1.00 0.00 H new ATOM 0 HG2 ARG A 132 7.757 -5.912 4.945 1.00 0.00 H new ATOM 0 HG3 ARG A 132 8.717 -7.374 4.852 1.00 0.00 H new ATOM 0 HD2 ARG A 132 9.297 -4.991 6.648 1.00 0.00 H new ATOM 0 HD3 ARG A 132 8.579 -6.503 7.166 1.00 0.00 H new ATOM 0 HE ARG A 132 10.936 -7.298 5.950 1.00 0.00 H new ATOM 0 HH11 ARG A 132 10.109 -5.165 8.663 1.00 0.00 H new ATOM 0 HH12 ARG A 132 11.691 -5.354 9.426 1.00 0.00 H new ATOM 0 HH21 ARG A 132 12.919 -7.533 6.929 1.00 0.00 H new ATOM 0 HH22 ARG A 132 13.281 -6.697 8.442 1.00 0.00 H new ATOM 1954 N GLN A 133 11.626 -2.840 3.585 1.00 0.00 N ATOM 1955 CA GLN A 133 12.795 -2.417 2.859 1.00 0.00 C ATOM 1956 C GLN A 133 13.943 -3.245 3.350 1.00 0.00 C ATOM 1957 O GLN A 133 14.273 -3.217 4.518 1.00 0.00 O ATOM 1958 CB GLN A 133 13.049 -0.916 3.061 1.00 0.00 C ATOM 1959 CG GLN A 133 12.090 -0.055 2.270 1.00 0.00 C ATOM 1960 CD GLN A 133 12.424 -0.034 0.785 1.00 0.00 C ATOM 1961 OE1 GLN A 133 13.124 0.845 0.310 1.00 0.00 O ATOM 1962 NE2 GLN A 133 11.989 -1.033 0.059 1.00 0.00 N ATOM 0 H GLN A 133 11.578 -2.476 4.537 1.00 0.00 H new ATOM 0 HA GLN A 133 12.662 -2.563 1.787 1.00 0.00 H new ATOM 0 HB2 GLN A 133 12.960 -0.675 4.120 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.072 -0.681 2.766 1.00 0.00 H new ATOM 0 HG2 GLN A 133 11.074 -0.426 2.407 1.00 0.00 H new ATOM 0 HG3 GLN A 133 12.113 0.963 2.660 1.00 0.00 H new ATOM 0 HE21 GLN A 133 11.405 -1.754 0.482 1.00 0.00 H new ATOM 0 HE22 GLN A 133 12.234 -1.090 -0.929 1.00 0.00 H new ATOM 1971 N THR A 134 14.473 -4.062 2.506 1.00 0.00 N ATOM 1972 CA THR A 134 15.549 -4.933 2.896 1.00 0.00 C ATOM 1973 C THR A 134 16.557 -4.998 1.766 1.00 0.00 C ATOM 1974 O THR A 134 16.176 -4.925 0.605 1.00 0.00 O ATOM 1975 CB THR A 134 14.983 -6.344 3.212 1.00 0.00 C ATOM 1976 OG1 THR A 134 13.921 -6.210 4.178 1.00 0.00 O ATOM 1977 CG2 THR A 134 16.058 -7.263 3.781 1.00 0.00 C ATOM 0 H THR A 134 14.182 -4.152 1.532 1.00 0.00 H new ATOM 0 HA THR A 134 16.041 -4.552 3.791 1.00 0.00 H new ATOM 0 HB THR A 134 14.615 -6.784 2.285 1.00 0.00 H new ATOM 0 HG1 THR A 134 13.554 -7.095 4.385 1.00 0.00 H new ATOM 0 HG21 THR A 134 15.626 -8.242 3.990 1.00 0.00 H new ATOM 0 HG22 THR A 134 16.866 -7.370 3.057 1.00 0.00 H new ATOM 0 HG23 THR A 134 16.452 -6.835 4.703 1.00 0.00 H new ATOM 1985 N ASN A 135 17.829 -5.086 2.090 1.00 0.00 N ATOM 1986 CA ASN A 135 18.829 -5.161 1.063 1.00 0.00 C ATOM 1987 C ASN A 135 19.943 -6.086 1.458 1.00 0.00 C ATOM 1988 O ASN A 135 20.102 -6.435 2.622 1.00 0.00 O ATOM 1989 CB ASN A 135 19.411 -3.800 0.697 1.00 0.00 C ATOM 1990 CG ASN A 135 20.305 -3.172 1.759 1.00 0.00 C ATOM 1991 OD1 ASN A 135 21.462 -3.512 1.847 1.00 0.00 O ATOM 1992 ND2 ASN A 135 19.846 -2.172 2.428 1.00 0.00 N ATOM 0 H ASN A 135 18.186 -5.107 3.045 1.00 0.00 H new ATOM 0 HA ASN A 135 18.320 -5.553 0.182 1.00 0.00 H new ATOM 0 HB2 ASN A 135 19.985 -3.903 -0.224 1.00 0.00 H new ATOM 0 HB3 ASN A 135 18.589 -3.116 0.485 1.00 0.00 H new ATOM 0 HD21 ASN A 135 20.462 -1.648 3.049 1.00 0.00 H new ATOM 0 HD22 ASN A 135 18.866 -1.904 2.337 1.00 0.00 H new ATOM 2083 N PHE A 142 14.471 -1.981 7.522 1.00 0.00 N ATOM 2084 CA PHE A 142 13.477 -1.205 8.182 1.00 0.00 C ATOM 2085 C PHE A 142 12.187 -1.309 7.407 1.00 0.00 C ATOM 2086 O PHE A 142 12.193 -1.623 6.206 1.00 0.00 O ATOM 2087 CB PHE A 142 13.917 0.241 8.301 1.00 0.00 C ATOM 2088 CG PHE A 142 15.175 0.427 9.101 1.00 0.00 C ATOM 2089 CD1 PHE A 142 15.178 0.212 10.471 1.00 0.00 C ATOM 2090 CD2 PHE A 142 16.345 0.833 8.491 1.00 0.00 C ATOM 2091 CE1 PHE A 142 16.325 0.400 11.210 1.00 0.00 C ATOM 2092 CE2 PHE A 142 17.494 1.020 9.225 1.00 0.00 C ATOM 2093 CZ PHE A 142 17.486 0.806 10.585 1.00 0.00 C ATOM 0 HA PHE A 142 13.327 -1.587 9.192 1.00 0.00 H new ATOM 0 HB2 PHE A 142 14.069 0.648 7.302 1.00 0.00 H new ATOM 0 HB3 PHE A 142 13.116 0.818 8.762 1.00 0.00 H new ATOM 0 HD1 PHE A 142 14.271 -0.106 10.964 1.00 0.00 H new ATOM 0 HD2 PHE A 142 16.359 1.006 7.425 1.00 0.00 H new ATOM 0 HE1 PHE A 142 16.316 0.230 12.276 1.00 0.00 H new ATOM 0 HE2 PHE A 142 18.403 1.335 8.734 1.00 0.00 H new ATOM 0 HZ PHE A 142 18.387 0.956 11.162 1.00 0.00 H new ATOM 2103 N GLN A 143 11.092 -1.077 8.050 1.00 0.00 N ATOM 2104 CA GLN A 143 9.853 -1.168 7.367 1.00 0.00 C ATOM 2105 C GLN A 143 9.070 0.102 7.528 1.00 0.00 C ATOM 2106 O GLN A 143 9.174 0.797 8.549 1.00 0.00 O ATOM 2107 CB GLN A 143 9.062 -2.409 7.772 1.00 0.00 C ATOM 2108 CG GLN A 143 8.509 -2.393 9.193 1.00 0.00 C ATOM 2109 CD GLN A 143 7.945 -3.744 9.597 1.00 0.00 C ATOM 2110 OE1 GLN A 143 8.411 -4.779 9.137 1.00 0.00 O ATOM 2111 NE2 GLN A 143 6.929 -3.758 10.417 1.00 0.00 N ATOM 0 H GLN A 143 11.032 -0.826 9.037 1.00 0.00 H new ATOM 0 HA GLN A 143 10.060 -1.289 6.304 1.00 0.00 H new ATOM 0 HB2 GLN A 143 8.231 -2.533 7.078 1.00 0.00 H new ATOM 0 HB3 GLN A 143 9.705 -3.282 7.659 1.00 0.00 H new ATOM 0 HG2 GLN A 143 9.300 -2.108 9.887 1.00 0.00 H new ATOM 0 HG3 GLN A 143 7.728 -1.636 9.270 1.00 0.00 H new ATOM 0 HE21 GLN A 143 6.560 -2.882 10.786 1.00 0.00 H new ATOM 0 HE22 GLN A 143 6.505 -4.645 10.688 1.00 0.00 H new ATOM 2120 N PHE A 144 8.333 0.431 6.517 1.00 0.00 N ATOM 2121 CA PHE A 144 7.590 1.651 6.495 1.00 0.00 C ATOM 2122 C PHE A 144 6.120 1.319 6.540 1.00 0.00 C ATOM 2123 O PHE A 144 5.666 0.423 5.825 1.00 0.00 O ATOM 2124 CB PHE A 144 7.893 2.459 5.219 1.00 0.00 C ATOM 2125 CG PHE A 144 9.361 2.772 4.939 1.00 0.00 C ATOM 2126 CD1 PHE A 144 10.312 2.780 5.945 1.00 0.00 C ATOM 2127 CD2 PHE A 144 9.772 3.064 3.652 1.00 0.00 C ATOM 2128 CE1 PHE A 144 11.635 3.067 5.670 1.00 0.00 C ATOM 2129 CE2 PHE A 144 11.088 3.351 3.372 1.00 0.00 C ATOM 2130 CZ PHE A 144 12.024 3.353 4.381 1.00 0.00 C ATOM 0 H PHE A 144 8.228 -0.141 5.679 1.00 0.00 H new ATOM 0 HA PHE A 144 7.874 2.256 7.356 1.00 0.00 H new ATOM 0 HB2 PHE A 144 7.493 1.911 4.366 1.00 0.00 H new ATOM 0 HB3 PHE A 144 7.349 3.402 5.276 1.00 0.00 H new ATOM 0 HD1 PHE A 144 10.015 2.559 6.960 1.00 0.00 H new ATOM 0 HD2 PHE A 144 9.047 3.067 2.852 1.00 0.00 H new ATOM 0 HE1 PHE A 144 12.364 3.067 6.467 1.00 0.00 H new ATOM 0 HE2 PHE A 144 11.387 3.575 2.359 1.00 0.00 H new ATOM 0 HZ PHE A 144 13.058 3.578 4.163 1.00 0.00 H new ATOM 2140 N VAL A 145 5.403 1.993 7.386 1.00 0.00 N ATOM 2141 CA VAL A 145 3.975 1.804 7.527 1.00 0.00 C ATOM 2142 C VAL A 145 3.251 2.737 6.581 1.00 0.00 C ATOM 2143 O VAL A 145 3.563 3.921 6.505 1.00 0.00 O ATOM 2144 CB VAL A 145 3.512 2.122 8.965 1.00 0.00 C ATOM 2145 CG1 VAL A 145 2.012 1.904 9.134 1.00 0.00 C ATOM 2146 CG2 VAL A 145 4.308 1.336 9.994 1.00 0.00 C ATOM 0 H VAL A 145 5.789 2.701 8.010 1.00 0.00 H new ATOM 0 HA VAL A 145 3.747 0.763 7.299 1.00 0.00 H new ATOM 0 HB VAL A 145 3.707 3.180 9.140 1.00 0.00 H new ATOM 0 HG11 VAL A 145 1.724 2.138 10.159 1.00 0.00 H new ATOM 0 HG12 VAL A 145 1.470 2.554 8.447 1.00 0.00 H new ATOM 0 HG13 VAL A 145 1.769 0.864 8.917 1.00 0.00 H new ATOM 0 HG21 VAL A 145 3.955 1.585 10.995 1.00 0.00 H new ATOM 0 HG22 VAL A 145 4.176 0.268 9.818 1.00 0.00 H new ATOM 0 HG23 VAL A 145 5.364 1.590 9.908 1.00 0.00 H new ATOM 2156 N TRP A 146 2.300 2.219 5.892 1.00 0.00 N ATOM 2157 CA TRP A 146 1.537 2.970 4.943 1.00 0.00 C ATOM 2158 C TRP A 146 0.099 2.903 5.332 1.00 0.00 C ATOM 2159 O TRP A 146 -0.597 1.909 5.081 1.00 0.00 O ATOM 2160 CB TRP A 146 1.763 2.446 3.516 1.00 0.00 C ATOM 2161 CG TRP A 146 3.205 2.439 3.166 1.00 0.00 C ATOM 2162 CD1 TRP A 146 4.062 1.405 3.324 1.00 0.00 C ATOM 2163 CD2 TRP A 146 3.981 3.521 2.643 1.00 0.00 C ATOM 2164 NE1 TRP A 146 5.317 1.790 2.962 1.00 0.00 N ATOM 2165 CE2 TRP A 146 5.290 3.060 2.529 1.00 0.00 C ATOM 2166 CE3 TRP A 146 3.704 4.829 2.261 1.00 0.00 C ATOM 2167 CZ2 TRP A 146 6.313 3.835 2.066 1.00 0.00 C ATOM 2168 CZ3 TRP A 146 4.744 5.611 1.787 1.00 0.00 C ATOM 2169 CH2 TRP A 146 6.034 5.107 1.694 1.00 0.00 C ATOM 0 H TRP A 146 2.019 1.241 5.968 1.00 0.00 H new ATOM 0 HA TRP A 146 1.861 4.011 4.948 1.00 0.00 H new ATOM 0 HB2 TRP A 146 1.361 1.437 3.429 1.00 0.00 H new ATOM 0 HB3 TRP A 146 1.218 3.069 2.807 1.00 0.00 H new ATOM 0 HD1 TRP A 146 3.792 0.423 3.683 1.00 0.00 H new ATOM 0 HE1 TRP A 146 6.150 1.203 3.012 1.00 0.00 H new ATOM 0 HE3 TRP A 146 2.702 5.225 2.332 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 7.318 3.445 1.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 4.548 6.629 1.485 1.00 0.00 H new ATOM 0 HH2 TRP A 146 6.826 5.738 1.320 1.00 0.00 H new ATOM 2180 N ASN A 147 -0.324 3.914 6.009 1.00 0.00 N ATOM 2181 CA ASN A 147 -1.677 4.024 6.442 1.00 0.00 C ATOM 2182 C ASN A 147 -2.477 4.483 5.269 1.00 0.00 C ATOM 2183 O ASN A 147 -2.241 5.575 4.745 1.00 0.00 O ATOM 2184 CB ASN A 147 -1.812 5.038 7.578 1.00 0.00 C ATOM 2185 CG ASN A 147 -1.009 4.706 8.813 1.00 0.00 C ATOM 2186 OD1 ASN A 147 -1.461 3.972 9.678 1.00 0.00 O ATOM 2187 ND2 ASN A 147 0.164 5.281 8.929 1.00 0.00 N ATOM 0 H ASN A 147 0.267 4.699 6.282 1.00 0.00 H new ATOM 0 HA ASN A 147 -2.027 3.062 6.815 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -1.504 6.017 7.212 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -2.863 5.117 7.854 1.00 0.00 H new ATOM 0 HD21 ASN A 147 0.730 5.121 9.762 1.00 0.00 H new ATOM 0 HD22 ASN A 147 0.510 5.888 8.186 1.00 0.00 H new ATOM 2194 N ILE A 148 -3.361 3.655 4.814 1.00 0.00 N ATOM 2195 CA ILE A 148 -4.149 3.976 3.670 1.00 0.00 C ATOM 2196 C ILE A 148 -5.405 4.722 4.126 1.00 0.00 C ATOM 2197 O ILE A 148 -6.179 4.218 4.956 1.00 0.00 O ATOM 2198 CB ILE A 148 -4.552 2.702 2.856 1.00 0.00 C ATOM 2199 CG1 ILE A 148 -3.345 1.773 2.571 1.00 0.00 C ATOM 2200 CG2 ILE A 148 -5.215 3.084 1.547 1.00 0.00 C ATOM 2201 CD1 ILE A 148 -2.143 2.454 1.925 1.00 0.00 C ATOM 0 H ILE A 148 -3.556 2.741 5.223 1.00 0.00 H new ATOM 0 HA ILE A 148 -3.551 4.604 3.010 1.00 0.00 H new ATOM 0 HB ILE A 148 -5.259 2.152 3.477 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -3.025 1.320 3.510 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -3.676 0.962 1.922 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -5.486 2.181 0.999 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -6.113 3.668 1.751 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -4.524 3.678 0.949 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -1.352 1.721 1.766 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -2.439 2.882 0.967 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -1.778 3.246 2.579 1.00 0.00 H new ATOM 2213 N TYR A 149 -5.567 5.923 3.638 1.00 0.00 N ATOM 2214 CA TYR A 149 -6.711 6.753 3.938 1.00 0.00 C ATOM 2215 C TYR A 149 -7.487 7.021 2.694 1.00 0.00 C ATOM 2216 O TYR A 149 -6.942 6.997 1.578 1.00 0.00 O ATOM 2217 CB TYR A 149 -6.275 8.098 4.504 1.00 0.00 C ATOM 2218 CG TYR A 149 -5.717 8.051 5.882 1.00 0.00 C ATOM 2219 CD1 TYR A 149 -4.411 7.710 6.104 1.00 0.00 C ATOM 2220 CD2 TYR A 149 -6.511 8.358 6.962 1.00 0.00 C ATOM 2221 CE1 TYR A 149 -3.903 7.663 7.374 1.00 0.00 C ATOM 2222 CE2 TYR A 149 -6.016 8.319 8.244 1.00 0.00 C ATOM 2223 CZ TYR A 149 -4.707 7.968 8.444 1.00 0.00 C ATOM 2224 OH TYR A 149 -4.202 7.906 9.721 1.00 0.00 O ATOM 0 H TYR A 149 -4.896 6.363 3.008 1.00 0.00 H new ATOM 0 HA TYR A 149 -7.319 6.220 4.669 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -5.526 8.529 3.840 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -7.131 8.772 4.498 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -3.772 7.475 5.266 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -7.542 8.635 6.800 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -2.871 7.386 7.534 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -6.651 8.562 9.083 1.00 0.00 H new ATOM 0 HH TYR A 149 -3.263 8.186 9.715 1.00 0.00 H new ATOM 2234 N ALA A 150 -8.744 7.286 2.873 1.00 0.00 N ATOM 2235 CA ALA A 150 -9.591 7.627 1.790 1.00 0.00 C ATOM 2236 C ALA A 150 -9.409 9.088 1.463 1.00 0.00 C ATOM 2237 O ALA A 150 -9.476 9.943 2.336 1.00 0.00 O ATOM 2238 CB ALA A 150 -11.017 7.347 2.131 1.00 0.00 C ATOM 0 H ALA A 150 -9.207 7.270 3.782 1.00 0.00 H new ATOM 0 HA ALA A 150 -9.326 7.023 0.922 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -11.652 7.615 1.287 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -11.137 6.286 2.353 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -11.305 7.934 3.003 1.00 0.00 H new ATOM 2244 N ASN A 151 -9.184 9.354 0.217 1.00 0.00 N ATOM 2245 CA ASN A 151 -8.944 10.708 -0.297 1.00 0.00 C ATOM 2246 C ASN A 151 -10.299 11.315 -0.624 1.00 0.00 C ATOM 2247 O ASN A 151 -10.458 12.522 -0.759 1.00 0.00 O ATOM 2248 CB ASN A 151 -8.172 10.559 -1.610 1.00 0.00 C ATOM 2249 CG ASN A 151 -7.482 11.788 -2.146 1.00 0.00 C ATOM 2250 OD1 ASN A 151 -8.105 12.673 -2.717 1.00 0.00 O ATOM 2251 ND2 ASN A 151 -6.186 11.754 -2.141 1.00 0.00 N ATOM 0 H ASN A 151 -9.157 8.635 -0.506 1.00 0.00 H new ATOM 0 HA ASN A 151 -8.399 11.323 0.419 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -7.420 9.782 -1.474 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -8.866 10.202 -2.371 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -5.655 12.479 -2.623 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -5.697 11.002 -1.655 1.00 0.00 H new ATOM 2258 N ASN A 152 -11.267 10.427 -0.724 1.00 0.00 N ATOM 2259 CA ASN A 152 -12.616 10.727 -1.159 1.00 0.00 C ATOM 2260 C ASN A 152 -13.580 9.716 -0.558 1.00 0.00 C ATOM 2261 O ASN A 152 -13.229 8.541 -0.404 1.00 0.00 O ATOM 2262 CB ASN A 152 -12.650 10.668 -2.699 1.00 0.00 C ATOM 2263 CG ASN A 152 -14.028 10.471 -3.303 1.00 0.00 C ATOM 2264 OD1 ASN A 152 -14.750 11.425 -3.584 1.00 0.00 O ATOM 2265 ND2 ASN A 152 -14.376 9.236 -3.543 1.00 0.00 N ATOM 0 H ASN A 152 -11.131 9.442 -0.497 1.00 0.00 H new ATOM 0 HA ASN A 152 -12.916 11.721 -0.827 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -12.226 11.592 -3.092 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -12.005 9.855 -3.031 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -15.276 9.035 -3.979 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -13.748 8.472 -3.295 1.00 0.00 H new ATOM 2272 N ASP A 153 -14.763 10.183 -0.217 1.00 0.00 N ATOM 2273 CA ASP A 153 -15.818 9.358 0.364 1.00 0.00 C ATOM 2274 C ASP A 153 -16.547 8.591 -0.743 1.00 0.00 C ATOM 2275 O ASP A 153 -16.705 9.084 -1.867 1.00 0.00 O ATOM 2276 CB ASP A 153 -16.822 10.214 1.174 1.00 0.00 C ATOM 2277 CG ASP A 153 -17.719 11.102 0.340 1.00 0.00 C ATOM 2278 OD1 ASP A 153 -17.305 12.210 -0.041 1.00 0.00 O ATOM 2279 OD2 ASP A 153 -18.868 10.725 0.092 1.00 0.00 O ATOM 0 H ASP A 153 -15.029 11.161 -0.335 1.00 0.00 H new ATOM 0 HA ASP A 153 -15.356 8.649 1.051 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -17.446 9.549 1.770 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -16.264 10.838 1.872 1.00 0.00 H new ATOM 2284 N VAL A 154 -16.957 7.399 -0.442 1.00 0.00 N ATOM 2285 CA VAL A 154 -17.590 6.520 -1.407 1.00 0.00 C ATOM 2286 C VAL A 154 -18.980 6.102 -0.949 1.00 0.00 C ATOM 2287 O VAL A 154 -19.184 5.797 0.240 1.00 0.00 O ATOM 2288 CB VAL A 154 -16.716 5.263 -1.650 1.00 0.00 C ATOM 2289 CG1 VAL A 154 -17.416 4.246 -2.516 1.00 0.00 C ATOM 2290 CG2 VAL A 154 -15.373 5.642 -2.248 1.00 0.00 C ATOM 0 H VAL A 154 -16.866 6.993 0.489 1.00 0.00 H new ATOM 0 HA VAL A 154 -17.690 7.073 -2.341 1.00 0.00 H new ATOM 0 HB VAL A 154 -16.544 4.800 -0.678 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -16.767 3.382 -2.660 1.00 0.00 H new ATOM 0 HG12 VAL A 154 -18.339 3.929 -2.031 1.00 0.00 H new ATOM 0 HG13 VAL A 154 -17.648 4.690 -3.484 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -14.779 4.742 -2.409 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -15.529 6.149 -3.200 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -14.845 6.308 -1.565 1.00 0.00 H new ATOM 2300 N VAL A 155 -19.920 6.068 -1.887 1.00 0.00 N ATOM 2301 CA VAL A 155 -21.283 5.691 -1.606 1.00 0.00 C ATOM 2302 C VAL A 155 -21.618 4.438 -2.428 1.00 0.00 C ATOM 2303 O VAL A 155 -21.176 4.288 -3.581 1.00 0.00 O ATOM 2304 CB VAL A 155 -22.279 6.810 -2.021 1.00 0.00 C ATOM 2305 CG1 VAL A 155 -23.628 6.684 -1.372 1.00 0.00 C ATOM 2306 CG2 VAL A 155 -21.698 8.204 -1.916 1.00 0.00 C ATOM 0 H VAL A 155 -19.748 6.304 -2.864 1.00 0.00 H new ATOM 0 HA VAL A 155 -21.376 5.513 -0.535 1.00 0.00 H new ATOM 0 HB VAL A 155 -22.454 6.648 -3.085 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -24.271 7.498 -1.708 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -24.077 5.730 -1.648 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -23.517 6.733 -0.289 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -22.447 8.934 -2.221 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -21.401 8.398 -0.885 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -20.827 8.285 -2.566 1.00 0.00 H new ATOM 2316 N VAL A 156 -22.348 3.547 -1.833 1.00 0.00 N ATOM 2317 CA VAL A 156 -22.791 2.334 -2.464 1.00 0.00 C ATOM 2318 C VAL A 156 -24.270 2.447 -2.842 1.00 0.00 C ATOM 2319 O VAL A 156 -25.139 2.310 -1.995 1.00 0.00 O ATOM 2320 CB VAL A 156 -22.568 1.109 -1.523 1.00 0.00 C ATOM 2321 CG1 VAL A 156 -23.164 -0.171 -2.103 1.00 0.00 C ATOM 2322 CG2 VAL A 156 -21.086 0.918 -1.245 1.00 0.00 C ATOM 0 H VAL A 156 -22.663 3.642 -0.868 1.00 0.00 H new ATOM 0 HA VAL A 156 -22.204 2.183 -3.370 1.00 0.00 H new ATOM 0 HB VAL A 156 -23.085 1.319 -0.587 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -22.986 -0.999 -1.416 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -24.237 -0.041 -2.245 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -22.695 -0.389 -3.063 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -20.947 0.060 -0.587 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -20.559 0.745 -2.183 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -20.688 1.812 -0.765 1.00 0.00 H new ATOM 2332 N PRO A 157 -24.569 2.715 -4.117 1.00 0.00 N ATOM 2333 CA PRO A 157 -25.955 2.817 -4.595 1.00 0.00 C ATOM 2334 C PRO A 157 -26.657 1.467 -4.588 1.00 0.00 C ATOM 2335 O PRO A 157 -27.889 1.399 -4.515 1.00 0.00 O ATOM 2336 CB PRO A 157 -25.808 3.311 -6.019 1.00 0.00 C ATOM 2337 CG PRO A 157 -24.427 2.943 -6.419 1.00 0.00 C ATOM 2338 CD PRO A 157 -23.599 2.983 -5.186 1.00 0.00 C ATOM 0 HA PRO A 157 -26.555 3.471 -3.962 1.00 0.00 H new ATOM 0 HB2 PRO A 157 -26.545 2.847 -6.675 1.00 0.00 H new ATOM 0 HB3 PRO A 157 -25.961 4.388 -6.080 1.00 0.00 H new ATOM 0 HG2 PRO A 157 -24.406 1.950 -6.867 1.00 0.00 H new ATOM 0 HG3 PRO A 157 -24.043 3.638 -7.166 1.00 0.00 H new ATOM 0 HD2 PRO A 157 -22.808 2.233 -5.208 1.00 0.00 H new ATOM 0 HD3 PRO A 157 -23.116 3.952 -5.057 1.00 0.00 H new ATOM 2346 N THR A 158 -25.836 0.406 -4.657 1.00 0.00 N ATOM 2347 CA THR A 158 -26.261 -0.983 -4.614 1.00 0.00 C ATOM 2348 C THR A 158 -27.461 -1.293 -5.526 1.00 0.00 C ATOM 2349 O THR A 158 -28.577 -1.521 -5.038 1.00 0.00 O ATOM 2350 CB THR A 158 -26.423 -1.538 -3.144 1.00 0.00 C ATOM 2351 OG1 THR A 158 -26.991 -2.842 -3.163 1.00 0.00 O ATOM 2352 CG2 THR A 158 -27.239 -0.623 -2.229 1.00 0.00 C ATOM 2353 OXT THR A 158 -27.272 -1.296 -6.757 1.00 0.00 O ATOM 0 H THR A 158 -24.825 0.507 -4.747 1.00 0.00 H new ATOM 0 HA THR A 158 -25.435 -1.548 -5.046 1.00 0.00 H new ATOM 0 HB THR A 158 -25.417 -1.578 -2.725 1.00 0.00 H new ATOM 0 HG1 THR A 158 -27.083 -3.172 -2.245 1.00 0.00 H new ATOM 0 HG21 THR A 158 -27.308 -1.069 -1.237 1.00 0.00 H new ATOM 0 HG22 THR A 158 -26.751 0.349 -2.157 1.00 0.00 H new ATOM 0 HG23 THR A 158 -28.240 -0.496 -2.640 1.00 0.00 H new