USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 961 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 122 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 126 GLN : amide:sc= -0.164 K(o=-0.16,f=-2!) USER MOD Set 2.1: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 104 MET CE :methyl 176:sc= -2.3 (180deg=-2.34) USER MOD Set 3.1: A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.1: A 41 SER OG : rot 161:sc= -0.0712 USER MOD Set 4.2: A 56 GLN : amide:sc= -0.0397 K(o=-0.11,f=-1.6) USER MOD Single : A 12 LYS NZ :NH3+ 143:sc= 0 (180deg=-0.0236) USER MOD Single : A 14 HIS : no HD1:sc= -3.38! C(o=-3.4!,f=-4.4!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.0464 K(o=-0.046,f=-1.7!) USER MOD Single : A 31 HIS : no HE2:sc= -4.45! C(o=-4.4!,f=-4.1!) USER MOD Single : A 36 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00534) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0.0337 USER MOD Single : A 46 GLN : amide:sc= -3.12! C(o=-3.1!,f=-3.8!) USER MOD Single : A 55 GLN : amide:sc= -7.17! C(o=-7.2!,f=-16!) USER MOD Single : A 58 ASN : amide:sc= -0.943! C(o=-0.94!,f=-3.9!) USER MOD Single : A 60 LYS NZ :NH3+ 150:sc= -0.519 (180deg=-1.86!) USER MOD Single : A 62 CYS SG : rot -76:sc= 0.553 USER MOD Single : A 69 ASN : amide:sc= -0.28 K(o=-0.28,f=-2) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc=-0.00306 X(o=-0.0031,f=-0.0031) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.322) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl -119:sc= -4.03 (180deg=-4.36!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot 108:sc= -1.29 USER MOD Single : A 98 GLN : amide:sc= -0.519 K(o=-0.52,f=-1.6) USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 66:sc= 0.035 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl -169:sc= -0.873 (180deg=-1.13) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N ILE A 8 16.622 -3.216 9.140 1.00 0.00 N ATOM 67 CA ILE A 8 15.249 -2.726 9.147 1.00 0.00 C ATOM 68 C ILE A 8 14.436 -3.353 8.020 1.00 0.00 C ATOM 69 O ILE A 8 14.817 -3.312 6.849 1.00 0.00 O ATOM 70 CB ILE A 8 15.197 -1.193 9.012 1.00 0.00 C ATOM 71 CG1 ILE A 8 15.702 -0.528 10.294 1.00 0.00 C ATOM 72 CG2 ILE A 8 13.780 -0.737 8.695 1.00 0.00 C ATOM 73 CD1 ILE A 8 15.331 0.934 10.403 1.00 0.00 C ATOM 0 HA ILE A 8 14.817 -3.012 10.106 1.00 0.00 H new ATOM 0 HB ILE A 8 15.847 -0.894 8.190 1.00 0.00 H new ATOM 0 HG12 ILE A 8 15.298 -1.062 11.154 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.787 -0.624 10.340 1.00 0.00 H new ATOM 0 HG21 ILE A 8 13.759 0.349 8.603 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.454 -1.187 7.757 1.00 0.00 H new ATOM 0 HG23 ILE A 8 13.110 -1.046 9.498 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.722 1.340 11.336 1.00 0.00 H new ATOM 0 HD12 ILE A 8 15.758 1.481 9.562 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.246 1.036 10.389 1.00 0.00 H new ATOM 85 N PRO A 9 13.287 -3.947 8.377 1.00 0.00 N ATOM 86 CA PRO A 9 12.395 -4.591 7.409 1.00 0.00 C ATOM 87 C PRO A 9 11.704 -3.584 6.497 1.00 0.00 C ATOM 88 O PRO A 9 10.949 -2.730 6.960 1.00 0.00 O ATOM 89 CB PRO A 9 11.368 -5.304 8.293 1.00 0.00 C ATOM 90 CG PRO A 9 11.365 -4.532 9.567 1.00 0.00 C ATOM 91 CD PRO A 9 12.771 -4.033 9.753 1.00 0.00 C ATOM 0 HA PRO A 9 12.936 -5.257 6.737 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.381 -5.308 7.830 1.00 0.00 H new ATOM 0 HB3 PRO A 9 11.645 -6.345 8.461 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.660 -3.702 9.519 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.060 -5.161 10.404 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.791 -3.064 10.251 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.363 -4.716 10.362 1.00 0.00 H new ATOM 99 N GLU A 10 11.968 -3.690 5.198 1.00 0.00 N ATOM 100 CA GLU A 10 11.370 -2.787 4.222 1.00 0.00 C ATOM 101 C GLU A 10 10.899 -3.553 2.989 1.00 0.00 C ATOM 102 O GLU A 10 11.581 -4.458 2.508 1.00 0.00 O ATOM 103 CB GLU A 10 12.374 -1.707 3.812 1.00 0.00 C ATOM 104 CG GLU A 10 12.686 -0.714 4.919 1.00 0.00 C ATOM 105 CD GLU A 10 13.695 0.335 4.494 1.00 0.00 C ATOM 106 OE1 GLU A 10 13.782 0.617 3.281 1.00 0.00 O ATOM 107 OE2 GLU A 10 14.398 0.874 5.375 1.00 0.00 O ATOM 0 H GLU A 10 12.591 -4.391 4.798 1.00 0.00 H new ATOM 0 HA GLU A 10 10.505 -2.313 4.686 1.00 0.00 H new ATOM 0 HB2 GLU A 10 13.300 -2.186 3.493 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.982 -1.166 2.951 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.765 -0.222 5.231 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.069 -1.251 5.786 1.00 0.00 H new ATOM 114 N LEU A 11 9.728 -3.183 2.483 1.00 0.00 N ATOM 115 CA LEU A 11 9.163 -3.835 1.306 1.00 0.00 C ATOM 116 C LEU A 11 9.483 -3.046 0.040 1.00 0.00 C ATOM 117 O LEU A 11 9.504 -1.815 0.052 1.00 0.00 O ATOM 118 CB LEU A 11 7.648 -3.984 1.459 1.00 0.00 C ATOM 119 CG LEU A 11 7.163 -5.289 2.091 1.00 0.00 C ATOM 120 CD1 LEU A 11 5.864 -5.064 2.848 1.00 0.00 C ATOM 121 CD2 LEU A 11 6.983 -6.362 1.027 1.00 0.00 C ATOM 0 H LEU A 11 9.151 -2.435 2.869 1.00 0.00 H new ATOM 0 HA LEU A 11 9.612 -4.824 1.218 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.280 -3.153 2.061 1.00 0.00 H new ATOM 0 HB3 LEU A 11 7.192 -3.889 0.473 1.00 0.00 H new ATOM 0 HG LEU A 11 7.918 -5.630 2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.534 -6.003 3.291 1.00 0.00 H new ATOM 0 HD12 LEU A 11 6.025 -4.328 3.636 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.101 -4.699 2.161 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.637 -7.284 1.495 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.247 -6.029 0.295 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.935 -6.543 0.528 1.00 0.00 H new ATOM 133 N LYS A 12 9.729 -3.763 -1.051 1.00 0.00 N ATOM 134 CA LYS A 12 10.045 -3.131 -2.327 1.00 0.00 C ATOM 135 C LYS A 12 9.209 -3.731 -3.452 1.00 0.00 C ATOM 136 O LYS A 12 9.461 -4.852 -3.896 1.00 0.00 O ATOM 137 CB LYS A 12 11.534 -3.288 -2.643 1.00 0.00 C ATOM 138 CG LYS A 12 12.444 -2.915 -1.486 1.00 0.00 C ATOM 139 CD LYS A 12 12.778 -1.433 -1.494 1.00 0.00 C ATOM 140 CE LYS A 12 14.026 -1.147 -2.315 1.00 0.00 C ATOM 141 NZ LYS A 12 14.149 0.298 -2.654 1.00 0.00 N ATOM 0 H LYS A 12 9.716 -4.783 -1.077 1.00 0.00 H new ATOM 0 HA LYS A 12 9.808 -2.070 -2.248 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.729 -4.322 -2.929 1.00 0.00 H new ATOM 0 HB3 LYS A 12 11.782 -2.667 -3.504 1.00 0.00 H new ATOM 0 HG2 LYS A 12 11.961 -3.175 -0.544 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.364 -3.496 -1.544 1.00 0.00 H new ATOM 0 HD2 LYS A 12 11.937 -0.872 -1.901 1.00 0.00 H new ATOM 0 HD3 LYS A 12 12.927 -1.087 -0.471 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.907 -1.466 -1.759 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.999 -1.734 -3.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.150 0.578 -2.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 13.775 0.463 -3.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 13.608 0.863 -1.968 1.00 0.00 H new ATOM 155 N ASP A 13 8.215 -2.979 -3.911 1.00 0.00 N ATOM 156 CA ASP A 13 7.343 -3.436 -4.987 1.00 0.00 C ATOM 157 C ASP A 13 6.436 -2.308 -5.468 1.00 0.00 C ATOM 158 O ASP A 13 6.035 -1.444 -4.688 1.00 0.00 O ATOM 159 CB ASP A 13 6.498 -4.622 -4.519 1.00 0.00 C ATOM 160 CG ASP A 13 7.230 -5.943 -4.655 1.00 0.00 C ATOM 161 OD1 ASP A 13 7.487 -6.363 -5.802 1.00 0.00 O ATOM 162 OD2 ASP A 13 7.543 -6.558 -3.614 1.00 0.00 O ATOM 0 H ASP A 13 7.993 -2.050 -3.555 1.00 0.00 H new ATOM 0 HA ASP A 13 7.971 -3.753 -5.820 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.213 -4.473 -3.477 1.00 0.00 H new ATOM 0 HB3 ASP A 13 5.576 -4.659 -5.099 1.00 0.00 H new ATOM 167 N HIS A 14 6.117 -2.321 -6.758 1.00 0.00 N ATOM 168 CA HIS A 14 5.257 -1.299 -7.344 1.00 0.00 C ATOM 169 C HIS A 14 3.851 -1.841 -7.581 1.00 0.00 C ATOM 170 O HIS A 14 3.640 -2.689 -8.450 1.00 0.00 O ATOM 171 CB HIS A 14 5.851 -0.796 -8.660 1.00 0.00 C ATOM 172 CG HIS A 14 4.869 -0.058 -9.517 1.00 0.00 C ATOM 173 ND1 HIS A 14 4.379 -0.561 -10.704 1.00 0.00 N ATOM 174 CD2 HIS A 14 4.284 1.152 -9.353 1.00 0.00 C ATOM 175 CE1 HIS A 14 3.537 0.308 -11.233 1.00 0.00 C ATOM 176 NE2 HIS A 14 3.461 1.356 -10.433 1.00 0.00 N ATOM 0 H HIS A 14 6.441 -3.028 -7.418 1.00 0.00 H new ATOM 0 HA HIS A 14 5.193 -0.468 -6.642 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.694 -0.141 -8.442 1.00 0.00 H new ATOM 0 HB3 HIS A 14 6.243 -1.645 -9.220 1.00 0.00 H new ATOM 0 HD2 HIS A 14 4.436 1.830 -8.527 1.00 0.00 H new ATOM 0 HE1 HIS A 14 3.001 0.183 -12.162 1.00 0.00 H new ATOM 0 HE2 HIS A 14 2.885 2.183 -10.592 1.00 0.00 H new ATOM 185 N LEU A 15 2.893 -1.349 -6.804 1.00 0.00 N ATOM 186 CA LEU A 15 1.507 -1.785 -6.928 1.00 0.00 C ATOM 187 C LEU A 15 0.764 -0.948 -7.965 1.00 0.00 C ATOM 188 O LEU A 15 1.359 -0.109 -8.642 1.00 0.00 O ATOM 189 CB LEU A 15 0.798 -1.689 -5.576 1.00 0.00 C ATOM 190 CG LEU A 15 1.582 -2.205 -4.369 1.00 0.00 C ATOM 191 CD1 LEU A 15 1.168 -1.464 -3.107 1.00 0.00 C ATOM 192 CD2 LEU A 15 1.378 -3.703 -4.201 1.00 0.00 C ATOM 0 H LEU A 15 3.051 -0.647 -6.081 1.00 0.00 H new ATOM 0 HA LEU A 15 1.507 -2.824 -7.258 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.540 -0.645 -5.397 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.139 -2.243 -5.639 1.00 0.00 H new ATOM 0 HG LEU A 15 2.642 -2.020 -4.543 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.736 -1.845 -2.258 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.367 -0.399 -3.229 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.104 -1.616 -2.928 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.943 -4.053 -3.337 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.319 -3.911 -4.050 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.725 -4.220 -5.095 1.00 0.00 H new ATOM 204 N ARG A 16 -0.539 -1.182 -8.083 1.00 0.00 N ATOM 205 CA ARG A 16 -1.363 -0.449 -9.037 1.00 0.00 C ATOM 206 C ARG A 16 -1.772 0.908 -8.472 1.00 0.00 C ATOM 207 O ARG A 16 -2.494 0.985 -7.478 1.00 0.00 O ATOM 208 CB ARG A 16 -2.609 -1.261 -9.395 1.00 0.00 C ATOM 209 CG ARG A 16 -2.333 -2.412 -10.348 1.00 0.00 C ATOM 210 CD ARG A 16 -2.366 -1.956 -11.798 1.00 0.00 C ATOM 211 NE ARG A 16 -1.059 -1.491 -12.255 1.00 0.00 N ATOM 212 CZ ARG A 16 -0.082 -2.305 -12.638 1.00 0.00 C ATOM 213 NH1 ARG A 16 -0.263 -3.618 -12.620 1.00 0.00 N ATOM 214 NH2 ARG A 16 1.080 -1.806 -13.041 1.00 0.00 N ATOM 0 H ARG A 16 -1.047 -1.873 -7.530 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.773 -0.285 -9.939 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -3.050 -1.656 -8.480 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -3.348 -0.598 -9.844 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -1.358 -2.845 -10.124 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -3.073 -3.197 -10.196 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -2.699 -2.780 -12.430 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -3.096 -1.154 -11.909 1.00 0.00 H new ATOM 0 HE ARG A 16 -0.887 -0.486 -12.281 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -1.155 -4.006 -12.311 1.00 0.00 H new ATOM 0 HH12 ARG A 16 0.489 -4.241 -12.915 1.00 0.00 H new ATOM 0 HH21 ARG A 16 1.223 -0.796 -13.057 1.00 0.00 H new ATOM 0 HH22 ARG A 16 1.830 -2.432 -13.335 1.00 0.00 H new ATOM 228 N ILE A 17 -1.304 1.975 -9.112 1.00 0.00 N ATOM 229 CA ILE A 17 -1.622 3.328 -8.674 1.00 0.00 C ATOM 230 C ILE A 17 -2.463 4.060 -9.714 1.00 0.00 C ATOM 231 O ILE A 17 -2.071 4.175 -10.875 1.00 0.00 O ATOM 232 CB ILE A 17 -0.345 4.144 -8.396 1.00 0.00 C ATOM 233 CG1 ILE A 17 0.300 3.691 -7.084 1.00 0.00 C ATOM 234 CG2 ILE A 17 -0.666 5.630 -8.350 1.00 0.00 C ATOM 235 CD1 ILE A 17 1.593 4.409 -6.767 1.00 0.00 C ATOM 0 H ILE A 17 -0.704 1.928 -9.935 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.193 3.234 -7.750 1.00 0.00 H new ATOM 0 HB ILE A 17 0.364 3.971 -9.206 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.405 3.851 -6.268 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.492 2.619 -7.134 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.246 6.193 -8.153 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.085 5.941 -9.307 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.389 5.822 -7.557 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.994 4.038 -5.824 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.314 4.228 -7.564 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.404 5.479 -6.684 1.00 0.00 H new ATOM 247 N PHE A 18 -3.620 4.555 -9.289 1.00 0.00 N ATOM 248 CA PHE A 18 -4.518 5.277 -10.184 1.00 0.00 C ATOM 249 C PHE A 18 -5.020 6.561 -9.530 1.00 0.00 C ATOM 250 O PHE A 18 -5.462 6.553 -8.380 1.00 0.00 O ATOM 251 CB PHE A 18 -5.703 4.392 -10.575 1.00 0.00 C ATOM 252 CG PHE A 18 -6.798 5.137 -11.283 1.00 0.00 C ATOM 253 CD1 PHE A 18 -6.508 5.982 -12.342 1.00 0.00 C ATOM 254 CD2 PHE A 18 -8.119 4.992 -10.890 1.00 0.00 C ATOM 255 CE1 PHE A 18 -7.513 6.669 -12.996 1.00 0.00 C ATOM 256 CE2 PHE A 18 -9.129 5.675 -11.541 1.00 0.00 C ATOM 257 CZ PHE A 18 -8.826 6.515 -12.594 1.00 0.00 C ATOM 0 H PHE A 18 -3.959 4.470 -8.331 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.960 5.542 -11.082 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -5.348 3.586 -11.217 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -6.112 3.928 -9.677 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.483 6.105 -12.660 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -8.362 4.338 -10.066 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -7.273 7.325 -13.820 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -10.155 5.552 -11.226 1.00 0.00 H new ATOM 0 HZ PHE A 18 -9.614 7.051 -13.103 1.00 0.00 H new ATOM 267 N ARG A 19 -4.949 7.662 -10.270 1.00 0.00 N ATOM 268 CA ARG A 19 -5.394 8.954 -9.763 1.00 0.00 C ATOM 269 C ARG A 19 -6.351 9.624 -10.745 1.00 0.00 C ATOM 270 O ARG A 19 -5.942 10.358 -11.645 1.00 0.00 O ATOM 271 CB ARG A 19 -4.194 9.865 -9.502 1.00 0.00 C ATOM 272 CG ARG A 19 -3.215 9.306 -8.482 1.00 0.00 C ATOM 273 CD ARG A 19 -3.717 9.507 -7.060 1.00 0.00 C ATOM 274 NE ARG A 19 -3.844 10.921 -6.720 1.00 0.00 N ATOM 275 CZ ARG A 19 -2.814 11.696 -6.398 1.00 0.00 C ATOM 276 NH1 ARG A 19 -1.586 11.196 -6.375 1.00 0.00 N ATOM 277 NH2 ARG A 19 -3.011 12.974 -6.101 1.00 0.00 N ATOM 0 H ARG A 19 -4.587 7.685 -11.223 1.00 0.00 H new ATOM 0 HA ARG A 19 -5.923 8.784 -8.825 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -3.668 10.037 -10.441 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -4.553 10.834 -9.155 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -3.061 8.243 -8.668 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -2.247 9.793 -8.600 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -4.684 9.018 -6.944 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -3.031 9.026 -6.362 1.00 0.00 H new ATOM 0 HE ARG A 19 -4.775 11.337 -6.730 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -1.431 10.214 -6.605 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.797 11.793 -6.128 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.954 13.362 -6.120 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.220 13.568 -5.854 1.00 0.00 H new ATOM 291 N PRO A 20 -7.655 9.365 -10.571 1.00 0.00 N ATOM 292 CA PRO A 20 -8.696 9.933 -11.433 1.00 0.00 C ATOM 293 C PRO A 20 -8.866 11.434 -11.225 1.00 0.00 C ATOM 294 O PRO A 20 -9.734 12.060 -11.834 1.00 0.00 O ATOM 295 CB PRO A 20 -9.961 9.187 -11.000 1.00 0.00 C ATOM 296 CG PRO A 20 -9.692 8.769 -9.596 1.00 0.00 C ATOM 297 CD PRO A 20 -8.214 8.499 -9.520 1.00 0.00 C ATOM 0 HA PRO A 20 -8.457 9.818 -12.490 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -10.840 9.829 -11.060 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -10.151 8.325 -11.640 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.983 9.550 -8.894 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.265 7.879 -9.337 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.810 8.747 -8.538 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -7.987 7.448 -9.702 1.00 0.00 H new ATOM 432 N TYR A 28 -2.642 3.639 -15.137 1.00 0.00 N ATOM 433 CA TYR A 28 -1.497 3.202 -14.346 1.00 0.00 C ATOM 434 C TYR A 28 -0.208 3.298 -15.155 1.00 0.00 C ATOM 435 O TYR A 28 -0.185 2.991 -16.347 1.00 0.00 O ATOM 436 CB TYR A 28 -1.704 1.766 -13.862 1.00 0.00 C ATOM 437 CG TYR A 28 -3.013 1.554 -13.136 1.00 0.00 C ATOM 438 CD1 TYR A 28 -4.193 1.345 -13.837 1.00 0.00 C ATOM 439 CD2 TYR A 28 -3.068 1.561 -11.747 1.00 0.00 C ATOM 440 CE1 TYR A 28 -5.391 1.151 -13.178 1.00 0.00 C ATOM 441 CE2 TYR A 28 -4.261 1.367 -11.079 1.00 0.00 C ATOM 442 CZ TYR A 28 -5.420 1.163 -11.799 1.00 0.00 C ATOM 443 OH TYR A 28 -6.612 0.969 -11.138 1.00 0.00 O ATOM 0 HA TYR A 28 -1.411 3.861 -13.482 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -1.660 1.093 -14.718 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.883 1.493 -13.200 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.174 1.334 -14.917 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -2.162 1.721 -11.181 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -6.300 0.991 -13.739 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -4.287 1.375 -9.999 1.00 0.00 H new ATOM 0 HH TYR A 28 -6.459 1.006 -10.171 1.00 0.00 H new ATOM 453 N ARG A 29 0.865 3.726 -14.498 1.00 0.00 N ATOM 454 CA ARG A 29 2.159 3.864 -15.155 1.00 0.00 C ATOM 455 C ARG A 29 3.249 3.147 -14.363 1.00 0.00 C ATOM 456 O ARG A 29 3.113 2.928 -13.160 1.00 0.00 O ATOM 457 CB ARG A 29 2.519 5.342 -15.315 1.00 0.00 C ATOM 458 CG ARG A 29 3.378 5.630 -16.536 1.00 0.00 C ATOM 459 CD ARG A 29 4.290 6.825 -16.306 1.00 0.00 C ATOM 460 NE ARG A 29 5.566 6.434 -15.713 1.00 0.00 N ATOM 461 CZ ARG A 29 6.588 7.267 -15.553 1.00 0.00 C ATOM 462 NH1 ARG A 29 6.484 8.531 -15.940 1.00 0.00 N ATOM 463 NH2 ARG A 29 7.717 6.837 -15.005 1.00 0.00 N ATOM 0 H ARG A 29 0.864 3.983 -13.511 1.00 0.00 H new ATOM 0 HA ARG A 29 2.088 3.406 -16.141 1.00 0.00 H new ATOM 0 HB2 ARG A 29 1.601 5.926 -15.381 1.00 0.00 H new ATOM 0 HB3 ARG A 29 3.047 5.678 -14.422 1.00 0.00 H new ATOM 0 HG2 ARG A 29 3.979 4.753 -16.774 1.00 0.00 H new ATOM 0 HG3 ARG A 29 2.737 5.821 -17.397 1.00 0.00 H new ATOM 0 HD2 ARG A 29 4.471 7.331 -17.255 1.00 0.00 H new ATOM 0 HD3 ARG A 29 3.791 7.541 -15.653 1.00 0.00 H new ATOM 0 HE ARG A 29 5.679 5.468 -15.405 1.00 0.00 H new ATOM 0 HH11 ARG A 29 5.618 8.866 -16.362 1.00 0.00 H new ATOM 0 HH12 ARG A 29 7.270 9.169 -15.816 1.00 0.00 H new ATOM 0 HH21 ARG A 29 7.801 5.865 -14.706 1.00 0.00 H new ATOM 0 HH22 ARG A 29 8.501 7.478 -14.883 1.00 0.00 H new ATOM 477 N GLN A 30 4.329 2.784 -15.048 1.00 0.00 N ATOM 478 CA GLN A 30 5.441 2.091 -14.409 1.00 0.00 C ATOM 479 C GLN A 30 6.139 2.996 -13.399 1.00 0.00 C ATOM 480 O GLN A 30 6.978 3.820 -13.764 1.00 0.00 O ATOM 481 CB GLN A 30 6.444 1.613 -15.460 1.00 0.00 C ATOM 482 CG GLN A 30 7.433 0.585 -14.935 1.00 0.00 C ATOM 483 CD GLN A 30 8.153 -0.153 -16.046 1.00 0.00 C ATOM 484 OE1 GLN A 30 7.745 -0.102 -17.207 1.00 0.00 O ATOM 485 NE2 GLN A 30 9.231 -0.845 -15.696 1.00 0.00 N ATOM 0 H GLN A 30 4.457 2.958 -16.045 1.00 0.00 H new ATOM 0 HA GLN A 30 5.040 1.227 -13.879 1.00 0.00 H new ATOM 0 HB2 GLN A 30 5.899 1.184 -16.301 1.00 0.00 H new ATOM 0 HB3 GLN A 30 6.995 2.473 -15.842 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.166 1.083 -14.300 1.00 0.00 H new ATOM 0 HG3 GLN A 30 6.905 -0.134 -14.309 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.534 -0.860 -14.722 1.00 0.00 H new ATOM 0 HE22 GLN A 30 9.756 -1.362 -16.401 1.00 0.00 H new ATOM 494 N HIS A 31 5.786 2.838 -12.127 1.00 0.00 N ATOM 495 CA HIS A 31 6.378 3.641 -11.063 1.00 0.00 C ATOM 496 C HIS A 31 7.034 2.752 -10.012 1.00 0.00 C ATOM 497 O HIS A 31 6.863 1.533 -10.022 1.00 0.00 O ATOM 498 CB HIS A 31 5.314 4.524 -10.410 1.00 0.00 C ATOM 499 CG HIS A 31 4.861 5.658 -11.278 1.00 0.00 C ATOM 500 ND1 HIS A 31 4.660 6.936 -10.802 1.00 0.00 N ATOM 501 CD2 HIS A 31 4.570 5.700 -12.599 1.00 0.00 C ATOM 502 CE1 HIS A 31 4.264 7.715 -11.793 1.00 0.00 C ATOM 503 NE2 HIS A 31 4.202 6.989 -12.894 1.00 0.00 N ATOM 0 H HIS A 31 5.093 2.161 -11.808 1.00 0.00 H new ATOM 0 HA HIS A 31 7.145 4.276 -11.505 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.452 3.909 -10.151 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.710 4.927 -9.478 1.00 0.00 H new ATOM 0 HD1 HIS A 31 4.796 7.234 -9.836 1.00 0.00 H new ATOM 0 HD2 HIS A 31 4.618 4.873 -13.292 1.00 0.00 H new ATOM 0 HE1 HIS A 31 4.031 8.767 -11.716 1.00 0.00 H new ATOM 512 N TRP A 32 7.785 3.369 -9.107 1.00 0.00 N ATOM 513 CA TRP A 32 8.468 2.633 -8.049 1.00 0.00 C ATOM 514 C TRP A 32 7.914 3.009 -6.680 1.00 0.00 C ATOM 515 O TRP A 32 7.832 4.188 -6.334 1.00 0.00 O ATOM 516 CB TRP A 32 9.972 2.906 -8.098 1.00 0.00 C ATOM 517 CG TRP A 32 10.741 2.184 -7.034 1.00 0.00 C ATOM 518 CD1 TRP A 32 11.558 2.741 -6.091 1.00 0.00 C ATOM 519 CD2 TRP A 32 10.768 0.770 -6.806 1.00 0.00 C ATOM 520 NE1 TRP A 32 12.090 1.759 -5.291 1.00 0.00 N ATOM 521 CE2 TRP A 32 11.620 0.542 -5.708 1.00 0.00 C ATOM 522 CE3 TRP A 32 10.153 -0.323 -7.420 1.00 0.00 C ATOM 523 CZ2 TRP A 32 11.873 -0.736 -5.216 1.00 0.00 C ATOM 524 CZ3 TRP A 32 10.404 -1.591 -6.931 1.00 0.00 C ATOM 525 CH2 TRP A 32 11.257 -1.789 -5.837 1.00 0.00 C ATOM 0 H TRP A 32 7.937 4.377 -9.084 1.00 0.00 H new ATOM 0 HA TRP A 32 8.294 1.569 -8.210 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.356 2.613 -9.075 1.00 0.00 H new ATOM 0 HB3 TRP A 32 10.143 3.978 -7.996 1.00 0.00 H new ATOM 0 HD1 TRP A 32 11.756 3.798 -5.989 1.00 0.00 H new ATOM 0 HE1 TRP A 32 12.731 1.912 -4.513 1.00 0.00 H new ATOM 0 HE3 TRP A 32 9.493 -0.180 -8.262 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.532 -0.891 -4.374 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 9.935 -2.443 -7.400 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.432 -2.792 -5.477 1.00 0.00 H new ATOM 536 N VAL A 33 7.534 2.000 -5.902 1.00 0.00 N ATOM 537 CA VAL A 33 6.988 2.226 -4.569 1.00 0.00 C ATOM 538 C VAL A 33 7.816 1.509 -3.508 1.00 0.00 C ATOM 539 O VAL A 33 8.451 0.491 -3.783 1.00 0.00 O ATOM 540 CB VAL A 33 5.527 1.749 -4.472 1.00 0.00 C ATOM 541 CG1 VAL A 33 4.987 1.965 -3.066 1.00 0.00 C ATOM 542 CG2 VAL A 33 4.664 2.466 -5.499 1.00 0.00 C ATOM 0 H VAL A 33 7.594 1.018 -6.172 1.00 0.00 H new ATOM 0 HA VAL A 33 7.024 3.301 -4.390 1.00 0.00 H new ATOM 0 HB VAL A 33 5.496 0.681 -4.687 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.954 1.622 -3.017 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.591 1.402 -2.354 1.00 0.00 H new ATOM 0 HG13 VAL A 33 5.030 3.026 -2.819 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.635 2.117 -5.417 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.699 3.540 -5.317 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.039 2.255 -6.500 1.00 0.00 H new ATOM 552 N VAL A 34 7.805 2.048 -2.293 1.00 0.00 N ATOM 553 CA VAL A 34 8.554 1.459 -1.189 1.00 0.00 C ATOM 554 C VAL A 34 7.861 1.717 0.145 1.00 0.00 C ATOM 555 O VAL A 34 7.561 2.860 0.490 1.00 0.00 O ATOM 556 CB VAL A 34 9.989 2.015 -1.124 1.00 0.00 C ATOM 557 CG1 VAL A 34 10.723 1.461 0.088 1.00 0.00 C ATOM 558 CG2 VAL A 34 10.742 1.695 -2.406 1.00 0.00 C ATOM 0 H VAL A 34 7.286 2.891 -2.048 1.00 0.00 H new ATOM 0 HA VAL A 34 8.596 0.385 -1.373 1.00 0.00 H new ATOM 0 HB VAL A 34 9.936 3.099 -1.021 1.00 0.00 H new ATOM 0 HG11 VAL A 34 11.735 1.865 0.117 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.192 1.746 0.996 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.768 0.374 0.020 1.00 0.00 H new ATOM 0 HG21 VAL A 34 11.754 2.095 -2.343 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.787 0.614 -2.542 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.226 2.146 -3.253 1.00 0.00 H new ATOM 568 N PHE A 35 7.608 0.646 0.890 1.00 0.00 N ATOM 569 CA PHE A 35 6.949 0.755 2.186 1.00 0.00 C ATOM 570 C PHE A 35 7.975 0.806 3.315 1.00 0.00 C ATOM 571 O PHE A 35 8.862 -0.043 3.403 1.00 0.00 O ATOM 572 CB PHE A 35 5.998 -0.423 2.400 1.00 0.00 C ATOM 573 CG PHE A 35 5.494 -0.540 3.810 1.00 0.00 C ATOM 574 CD1 PHE A 35 4.759 0.485 4.384 1.00 0.00 C ATOM 575 CD2 PHE A 35 5.756 -1.674 4.562 1.00 0.00 C ATOM 576 CE1 PHE A 35 4.294 0.381 5.681 1.00 0.00 C ATOM 577 CE2 PHE A 35 5.293 -1.784 5.859 1.00 0.00 C ATOM 578 CZ PHE A 35 4.562 -0.755 6.420 1.00 0.00 C ATOM 0 H PHE A 35 7.849 -0.307 0.618 1.00 0.00 H new ATOM 0 HA PHE A 35 6.376 1.682 2.197 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.147 -0.320 1.726 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.510 -1.346 2.128 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.547 1.376 3.811 1.00 0.00 H new ATOM 0 HD2 PHE A 35 6.329 -2.481 4.129 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.722 1.187 6.116 1.00 0.00 H new ATOM 0 HE2 PHE A 35 5.502 -2.674 6.434 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.201 -0.838 7.434 1.00 0.00 H new ATOM 588 N LYS A 36 7.847 1.809 4.178 1.00 0.00 N ATOM 589 CA LYS A 36 8.761 1.973 5.302 1.00 0.00 C ATOM 590 C LYS A 36 8.054 1.688 6.623 1.00 0.00 C ATOM 591 O LYS A 36 6.829 1.768 6.712 1.00 0.00 O ATOM 592 CB LYS A 36 9.337 3.391 5.315 1.00 0.00 C ATOM 593 CG LYS A 36 10.358 3.622 6.415 1.00 0.00 C ATOM 594 CD LYS A 36 11.618 2.803 6.187 1.00 0.00 C ATOM 595 CE LYS A 36 12.844 3.496 6.762 1.00 0.00 C ATOM 596 NZ LYS A 36 12.757 3.643 8.241 1.00 0.00 N ATOM 0 H LYS A 36 7.119 2.521 4.120 1.00 0.00 H new ATOM 0 HA LYS A 36 9.575 1.258 5.184 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.802 3.594 4.350 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.521 4.105 5.432 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.614 4.681 6.459 1.00 0.00 H new ATOM 0 HG3 LYS A 36 9.922 3.359 7.379 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.504 1.822 6.647 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.759 2.639 5.119 1.00 0.00 H new ATOM 0 HE2 LYS A 36 13.737 2.926 6.506 1.00 0.00 H new ATOM 0 HE3 LYS A 36 12.952 4.480 6.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 13.633 4.074 8.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 11.949 4.251 8.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 12.628 2.707 8.676 1.00 0.00 H new ATOM 610 N GLU A 37 8.834 1.356 7.647 1.00 0.00 N ATOM 611 CA GLU A 37 8.281 1.060 8.964 1.00 0.00 C ATOM 612 C GLU A 37 7.007 1.862 9.211 1.00 0.00 C ATOM 613 O GLU A 37 5.930 1.296 9.401 1.00 0.00 O ATOM 614 CB GLU A 37 9.310 1.367 10.054 1.00 0.00 C ATOM 615 CG GLU A 37 10.470 0.386 10.089 1.00 0.00 C ATOM 616 CD GLU A 37 11.084 0.259 11.470 1.00 0.00 C ATOM 617 OE1 GLU A 37 10.887 1.177 12.293 1.00 0.00 O ATOM 618 OE2 GLU A 37 11.762 -0.758 11.727 1.00 0.00 O ATOM 0 H GLU A 37 9.850 1.285 7.590 1.00 0.00 H new ATOM 0 HA GLU A 37 8.034 -0.001 8.997 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.700 2.373 9.900 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.812 1.363 11.024 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.123 -0.593 9.758 1.00 0.00 H new ATOM 0 HG3 GLU A 37 11.235 0.709 9.383 1.00 0.00 H new ATOM 625 N THR A 38 7.137 3.185 9.208 1.00 0.00 N ATOM 626 CA THR A 38 5.998 4.066 9.434 1.00 0.00 C ATOM 627 C THR A 38 5.922 5.151 8.366 1.00 0.00 C ATOM 628 O THR A 38 5.202 6.138 8.519 1.00 0.00 O ATOM 629 CB THR A 38 6.069 4.731 10.822 1.00 0.00 C ATOM 630 OG1 THR A 38 7.432 4.995 11.169 1.00 0.00 O ATOM 631 CG2 THR A 38 5.433 3.843 11.881 1.00 0.00 C ATOM 0 H THR A 38 8.020 3.670 9.051 1.00 0.00 H new ATOM 0 HA THR A 38 5.103 3.446 9.382 1.00 0.00 H new ATOM 0 HB THR A 38 5.517 5.670 10.779 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.469 5.419 12.052 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.495 4.334 12.852 1.00 0.00 H new ATOM 0 HG22 THR A 38 4.387 3.668 11.629 1.00 0.00 H new ATOM 0 HG23 THR A 38 5.961 2.890 11.921 1.00 0.00 H new ATOM 639 N THR A 39 6.668 4.962 7.283 1.00 0.00 N ATOM 640 CA THR A 39 6.685 5.925 6.189 1.00 0.00 C ATOM 641 C THR A 39 6.384 5.249 4.856 1.00 0.00 C ATOM 642 O THR A 39 6.458 4.025 4.739 1.00 0.00 O ATOM 643 CB THR A 39 8.046 6.641 6.092 1.00 0.00 C ATOM 644 OG1 THR A 39 8.655 6.711 7.386 1.00 0.00 O ATOM 645 CG2 THR A 39 7.880 8.044 5.528 1.00 0.00 C ATOM 0 H THR A 39 7.269 4.150 7.140 1.00 0.00 H new ATOM 0 HA THR A 39 5.910 6.660 6.404 1.00 0.00 H new ATOM 0 HB THR A 39 8.686 6.069 5.420 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.520 7.166 7.316 1.00 0.00 H new ATOM 0 HG21 THR A 39 8.854 8.530 5.469 1.00 0.00 H new ATOM 0 HG22 THR A 39 7.442 7.986 4.531 1.00 0.00 H new ATOM 0 HG23 THR A 39 7.225 8.623 6.179 1.00 0.00 H new ATOM 653 N LEU A 40 6.045 6.052 3.854 1.00 0.00 N ATOM 654 CA LEU A 40 5.733 5.531 2.528 1.00 0.00 C ATOM 655 C LEU A 40 6.002 6.580 1.453 1.00 0.00 C ATOM 656 O LEU A 40 5.581 7.730 1.576 1.00 0.00 O ATOM 657 CB LEU A 40 4.272 5.083 2.465 1.00 0.00 C ATOM 658 CG LEU A 40 3.940 4.022 1.415 1.00 0.00 C ATOM 659 CD1 LEU A 40 2.683 3.260 1.805 1.00 0.00 C ATOM 660 CD2 LEU A 40 3.774 4.662 0.044 1.00 0.00 C ATOM 0 H LEU A 40 5.979 7.067 3.934 1.00 0.00 H new ATOM 0 HA LEU A 40 6.378 4.673 2.341 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.989 4.697 3.444 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.652 5.959 2.276 1.00 0.00 H new ATOM 0 HG LEU A 40 4.768 3.315 1.366 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.462 2.509 1.046 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.838 2.770 2.766 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.846 3.954 1.883 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.538 3.892 -0.691 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.964 5.391 0.078 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.700 5.162 -0.239 1.00 0.00 H new ATOM 672 N SER A 41 6.704 6.174 0.400 1.00 0.00 N ATOM 673 CA SER A 41 7.030 7.080 -0.696 1.00 0.00 C ATOM 674 C SER A 41 7.128 6.321 -2.016 1.00 0.00 C ATOM 675 O SER A 41 7.125 5.090 -2.040 1.00 0.00 O ATOM 676 CB SER A 41 8.348 7.804 -0.412 1.00 0.00 C ATOM 677 OG SER A 41 8.315 8.444 0.852 1.00 0.00 O ATOM 0 H SER A 41 7.058 5.225 0.282 1.00 0.00 H new ATOM 0 HA SER A 41 6.230 7.816 -0.778 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.172 7.091 -0.441 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.537 8.542 -1.192 1.00 0.00 H new ATOM 0 HG SER A 41 9.230 8.630 1.148 1.00 0.00 H new ATOM 683 N TYR A 42 7.215 7.065 -3.113 1.00 0.00 N ATOM 684 CA TYR A 42 7.311 6.465 -4.438 1.00 0.00 C ATOM 685 C TYR A 42 8.053 7.387 -5.401 1.00 0.00 C ATOM 686 O TYR A 42 8.284 8.559 -5.103 1.00 0.00 O ATOM 687 CB TYR A 42 5.915 6.156 -4.984 1.00 0.00 C ATOM 688 CG TYR A 42 5.013 7.367 -5.059 1.00 0.00 C ATOM 689 CD1 TYR A 42 4.683 8.084 -3.916 1.00 0.00 C ATOM 690 CD2 TYR A 42 4.491 7.794 -6.274 1.00 0.00 C ATOM 691 CE1 TYR A 42 3.858 9.191 -3.980 1.00 0.00 C ATOM 692 CE2 TYR A 42 3.667 8.900 -6.348 1.00 0.00 C ATOM 693 CZ TYR A 42 3.353 9.595 -5.199 1.00 0.00 C ATOM 694 OH TYR A 42 2.532 10.697 -5.267 1.00 0.00 O ATOM 0 H TYR A 42 7.221 8.085 -3.111 1.00 0.00 H new ATOM 0 HA TYR A 42 7.873 5.535 -4.348 1.00 0.00 H new ATOM 0 HB2 TYR A 42 6.011 5.723 -5.980 1.00 0.00 H new ATOM 0 HB3 TYR A 42 5.445 5.402 -4.352 1.00 0.00 H new ATOM 0 HD1 TYR A 42 5.078 7.771 -2.961 1.00 0.00 H new ATOM 0 HD2 TYR A 42 4.734 7.252 -7.176 1.00 0.00 H new ATOM 0 HE1 TYR A 42 3.610 9.737 -3.081 1.00 0.00 H new ATOM 0 HE2 TYR A 42 3.271 9.219 -7.301 1.00 0.00 H new ATOM 0 HH TYR A 42 2.264 10.848 -6.197 1.00 0.00 H new ATOM 704 N TYR A 43 8.424 6.848 -6.557 1.00 0.00 N ATOM 705 CA TYR A 43 9.141 7.620 -7.565 1.00 0.00 C ATOM 706 C TYR A 43 8.712 7.212 -8.971 1.00 0.00 C ATOM 707 O TYR A 43 8.165 6.128 -9.177 1.00 0.00 O ATOM 708 CB TYR A 43 10.650 7.429 -7.405 1.00 0.00 C ATOM 709 CG TYR A 43 11.093 7.288 -5.966 1.00 0.00 C ATOM 710 CD1 TYR A 43 10.696 6.199 -5.200 1.00 0.00 C ATOM 711 CD2 TYR A 43 11.909 8.244 -5.373 1.00 0.00 C ATOM 712 CE1 TYR A 43 11.097 6.067 -3.884 1.00 0.00 C ATOM 713 CE2 TYR A 43 12.317 8.119 -4.059 1.00 0.00 C ATOM 714 CZ TYR A 43 11.908 7.029 -3.319 1.00 0.00 C ATOM 715 OH TYR A 43 12.311 6.901 -2.009 1.00 0.00 O ATOM 0 H TYR A 43 8.240 5.880 -6.819 1.00 0.00 H new ATOM 0 HA TYR A 43 8.897 8.673 -7.421 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.956 6.542 -7.959 1.00 0.00 H new ATOM 0 HB3 TYR A 43 11.165 8.279 -7.853 1.00 0.00 H new ATOM 0 HD1 TYR A 43 10.063 5.443 -5.640 1.00 0.00 H new ATOM 0 HD2 TYR A 43 12.230 9.099 -5.949 1.00 0.00 H new ATOM 0 HE1 TYR A 43 10.777 5.216 -3.301 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.952 8.870 -3.614 1.00 0.00 H new ATOM 0 HH TYR A 43 12.879 7.662 -1.766 1.00 0.00 H new ATOM 725 N LYS A 44 8.965 8.089 -9.937 1.00 0.00 N ATOM 726 CA LYS A 44 8.608 7.823 -11.325 1.00 0.00 C ATOM 727 C LYS A 44 9.231 6.516 -11.806 1.00 0.00 C ATOM 728 O LYS A 44 8.635 5.790 -12.602 1.00 0.00 O ATOM 729 CB LYS A 44 9.063 8.977 -12.221 1.00 0.00 C ATOM 730 CG LYS A 44 8.355 10.289 -11.930 1.00 0.00 C ATOM 731 CD LYS A 44 8.889 11.416 -12.798 1.00 0.00 C ATOM 732 CE LYS A 44 10.071 12.112 -12.141 1.00 0.00 C ATOM 733 NZ LYS A 44 10.704 13.107 -13.051 1.00 0.00 N ATOM 0 H LYS A 44 9.416 8.991 -9.783 1.00 0.00 H new ATOM 0 HA LYS A 44 7.523 7.732 -11.384 1.00 0.00 H new ATOM 0 HB2 LYS A 44 10.137 9.119 -12.099 1.00 0.00 H new ATOM 0 HB3 LYS A 44 8.893 8.706 -13.263 1.00 0.00 H new ATOM 0 HG2 LYS A 44 7.285 10.172 -12.102 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.482 10.547 -10.879 1.00 0.00 H new ATOM 0 HD2 LYS A 44 9.192 11.019 -13.767 1.00 0.00 H new ATOM 0 HD3 LYS A 44 8.096 12.140 -12.984 1.00 0.00 H new ATOM 0 HE2 LYS A 44 9.738 12.612 -11.231 1.00 0.00 H new ATOM 0 HE3 LYS A 44 10.811 11.369 -11.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 11.505 13.560 -12.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 11.044 12.626 -13.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 10.005 13.831 -13.314 1.00 0.00 H new ATOM 747 N SER A 45 10.431 6.222 -11.317 1.00 0.00 N ATOM 748 CA SER A 45 11.135 5.004 -11.699 1.00 0.00 C ATOM 749 C SER A 45 12.119 4.582 -10.612 1.00 0.00 C ATOM 750 O SER A 45 12.610 5.413 -9.849 1.00 0.00 O ATOM 751 CB SER A 45 11.876 5.211 -13.021 1.00 0.00 C ATOM 752 OG SER A 45 13.026 6.019 -12.840 1.00 0.00 O ATOM 0 H SER A 45 10.936 6.811 -10.655 1.00 0.00 H new ATOM 0 HA SER A 45 10.397 4.212 -11.825 1.00 0.00 H new ATOM 0 HB2 SER A 45 12.168 4.245 -13.433 1.00 0.00 H new ATOM 0 HB3 SER A 45 11.210 5.679 -13.746 1.00 0.00 H new ATOM 0 HG SER A 45 13.483 6.135 -13.699 1.00 0.00 H new ATOM 758 N GLN A 46 12.402 3.285 -10.550 1.00 0.00 N ATOM 759 CA GLN A 46 13.327 2.752 -9.556 1.00 0.00 C ATOM 760 C GLN A 46 14.696 3.412 -9.678 1.00 0.00 C ATOM 761 O GLN A 46 15.352 3.693 -8.675 1.00 0.00 O ATOM 762 CB GLN A 46 13.462 1.237 -9.715 1.00 0.00 C ATOM 763 CG GLN A 46 14.227 0.572 -8.583 1.00 0.00 C ATOM 764 CD GLN A 46 15.696 0.946 -8.573 1.00 0.00 C ATOM 765 OE1 GLN A 46 16.334 1.033 -9.622 1.00 0.00 O ATOM 766 NE2 GLN A 46 16.242 1.172 -7.383 1.00 0.00 N ATOM 0 H GLN A 46 12.005 2.584 -11.176 1.00 0.00 H new ATOM 0 HA GLN A 46 12.925 2.972 -8.567 1.00 0.00 H new ATOM 0 HB2 GLN A 46 12.467 0.797 -9.778 1.00 0.00 H new ATOM 0 HB3 GLN A 46 13.965 1.022 -10.658 1.00 0.00 H new ATOM 0 HG2 GLN A 46 13.778 0.854 -7.631 1.00 0.00 H new ATOM 0 HG3 GLN A 46 14.132 -0.510 -8.672 1.00 0.00 H new ATOM 0 HE21 GLN A 46 15.676 1.089 -6.538 1.00 0.00 H new ATOM 0 HE22 GLN A 46 17.227 1.429 -7.314 1.00 0.00 H new ATOM 775 N ASP A 47 15.122 3.656 -10.912 1.00 0.00 N ATOM 776 CA ASP A 47 16.414 4.284 -11.166 1.00 0.00 C ATOM 777 C ASP A 47 16.482 5.665 -10.522 1.00 0.00 C ATOM 778 O ASP A 47 17.410 5.965 -9.772 1.00 0.00 O ATOM 779 CB ASP A 47 16.664 4.395 -12.670 1.00 0.00 C ATOM 780 CG ASP A 47 17.978 5.081 -12.989 1.00 0.00 C ATOM 781 OD1 ASP A 47 19.005 4.703 -12.388 1.00 0.00 O ATOM 782 OD2 ASP A 47 17.979 5.996 -13.839 1.00 0.00 O ATOM 0 H ASP A 47 14.592 3.428 -11.753 1.00 0.00 H new ATOM 0 HA ASP A 47 17.189 3.658 -10.723 1.00 0.00 H new ATOM 0 HB2 ASP A 47 16.662 3.398 -13.110 1.00 0.00 H new ATOM 0 HB3 ASP A 47 15.847 4.949 -13.131 1.00 0.00 H new ATOM 787 N GLU A 48 15.493 6.502 -10.822 1.00 0.00 N ATOM 788 CA GLU A 48 15.443 7.852 -10.274 1.00 0.00 C ATOM 789 C GLU A 48 15.830 7.855 -8.798 1.00 0.00 C ATOM 790 O GLU A 48 16.722 8.593 -8.380 1.00 0.00 O ATOM 791 CB GLU A 48 14.043 8.445 -10.446 1.00 0.00 C ATOM 792 CG GLU A 48 13.728 8.856 -11.875 1.00 0.00 C ATOM 793 CD GLU A 48 14.163 10.276 -12.183 1.00 0.00 C ATOM 794 OE1 GLU A 48 15.354 10.476 -12.500 1.00 0.00 O ATOM 795 OE2 GLU A 48 13.312 11.186 -12.106 1.00 0.00 O ATOM 0 H GLU A 48 14.717 6.269 -11.441 1.00 0.00 H new ATOM 0 HA GLU A 48 16.159 8.465 -10.821 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.305 7.714 -10.116 1.00 0.00 H new ATOM 0 HB3 GLU A 48 13.943 9.315 -9.796 1.00 0.00 H new ATOM 0 HG2 GLU A 48 14.223 8.171 -12.564 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.656 8.763 -12.048 1.00 0.00 H new ATOM 802 N ALA A 49 15.153 7.023 -8.013 1.00 0.00 N ATOM 803 CA ALA A 49 15.426 6.928 -6.584 1.00 0.00 C ATOM 804 C ALA A 49 16.876 6.531 -6.328 1.00 0.00 C ATOM 805 O ALA A 49 17.507 5.843 -7.130 1.00 0.00 O ATOM 806 CB ALA A 49 14.480 5.931 -5.932 1.00 0.00 C ATOM 0 H ALA A 49 14.411 6.405 -8.343 1.00 0.00 H new ATOM 0 HA ALA A 49 15.262 7.910 -6.141 1.00 0.00 H new ATOM 0 HB1 ALA A 49 14.695 5.870 -4.865 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.450 6.258 -6.077 1.00 0.00 H new ATOM 0 HB3 ALA A 49 14.616 4.950 -6.386 1.00 0.00 H new ATOM 812 N PRO A 50 17.418 6.973 -5.184 1.00 0.00 N ATOM 813 CA PRO A 50 16.676 7.793 -4.221 1.00 0.00 C ATOM 814 C PRO A 50 16.399 9.197 -4.748 1.00 0.00 C ATOM 815 O PRO A 50 15.276 9.693 -4.663 1.00 0.00 O ATOM 816 CB PRO A 50 17.610 7.851 -3.010 1.00 0.00 C ATOM 817 CG PRO A 50 18.973 7.636 -3.572 1.00 0.00 C ATOM 818 CD PRO A 50 18.797 6.708 -4.742 1.00 0.00 C ATOM 0 HA PRO A 50 15.695 7.374 -3.999 1.00 0.00 H new ATOM 0 HB2 PRO A 50 17.539 8.812 -2.501 1.00 0.00 H new ATOM 0 HB3 PRO A 50 17.358 7.083 -2.278 1.00 0.00 H new ATOM 0 HG2 PRO A 50 19.419 8.580 -3.886 1.00 0.00 H new ATOM 0 HG3 PRO A 50 19.639 7.202 -2.826 1.00 0.00 H new ATOM 0 HD2 PRO A 50 19.519 6.916 -5.532 1.00 0.00 H new ATOM 0 HD3 PRO A 50 18.933 5.666 -4.452 1.00 0.00 H new ATOM 826 N GLY A 51 17.432 9.834 -5.293 1.00 0.00 N ATOM 827 CA GLY A 51 17.278 11.175 -5.826 1.00 0.00 C ATOM 828 C GLY A 51 16.284 12.003 -5.036 1.00 0.00 C ATOM 829 O GLY A 51 16.636 12.608 -4.023 1.00 0.00 O ATOM 0 H GLY A 51 18.372 9.445 -5.375 1.00 0.00 H new ATOM 0 HA2 GLY A 51 18.246 11.676 -5.825 1.00 0.00 H new ATOM 0 HA3 GLY A 51 16.952 11.115 -6.864 1.00 0.00 H new ATOM 833 N ASP A 52 15.040 12.032 -5.500 1.00 0.00 N ATOM 834 CA ASP A 52 13.991 12.792 -4.829 1.00 0.00 C ATOM 835 C ASP A 52 12.628 12.142 -5.043 1.00 0.00 C ATOM 836 O ASP A 52 12.173 11.952 -6.171 1.00 0.00 O ATOM 837 CB ASP A 52 13.969 14.233 -5.343 1.00 0.00 C ATOM 838 CG ASP A 52 12.791 15.021 -4.806 1.00 0.00 C ATOM 839 OD1 ASP A 52 12.863 15.480 -3.647 1.00 0.00 O ATOM 840 OD2 ASP A 52 11.796 15.178 -5.544 1.00 0.00 O ATOM 0 H ASP A 52 14.733 11.538 -6.338 1.00 0.00 H new ATOM 0 HA ASP A 52 14.207 12.798 -3.761 1.00 0.00 H new ATOM 0 HB2 ASP A 52 14.896 14.731 -5.059 1.00 0.00 H new ATOM 0 HB3 ASP A 52 13.932 14.227 -6.432 1.00 0.00 H new ATOM 845 N PRO A 53 11.959 11.792 -3.934 1.00 0.00 N ATOM 846 CA PRO A 53 10.638 11.157 -3.974 1.00 0.00 C ATOM 847 C PRO A 53 9.549 12.114 -4.446 1.00 0.00 C ATOM 848 O PRO A 53 9.462 13.250 -3.979 1.00 0.00 O ATOM 849 CB PRO A 53 10.397 10.749 -2.518 1.00 0.00 C ATOM 850 CG PRO A 53 11.228 11.692 -1.718 1.00 0.00 C ATOM 851 CD PRO A 53 12.440 11.989 -2.557 1.00 0.00 C ATOM 0 HA PRO A 53 10.607 10.323 -4.676 1.00 0.00 H new ATOM 0 HB2 PRO A 53 9.342 10.829 -2.254 1.00 0.00 H new ATOM 0 HB3 PRO A 53 10.692 9.715 -2.343 1.00 0.00 H new ATOM 0 HG2 PRO A 53 10.676 12.604 -1.493 1.00 0.00 H new ATOM 0 HG3 PRO A 53 11.513 11.248 -0.764 1.00 0.00 H new ATOM 0 HD2 PRO A 53 12.799 13.006 -2.398 1.00 0.00 H new ATOM 0 HD3 PRO A 53 13.266 11.319 -2.320 1.00 0.00 H new ATOM 859 N ILE A 54 8.721 11.649 -5.375 1.00 0.00 N ATOM 860 CA ILE A 54 7.636 12.464 -5.909 1.00 0.00 C ATOM 861 C ILE A 54 6.810 13.083 -4.786 1.00 0.00 C ATOM 862 O ILE A 54 6.347 14.218 -4.898 1.00 0.00 O ATOM 863 CB ILE A 54 6.708 11.639 -6.819 1.00 0.00 C ATOM 864 CG1 ILE A 54 7.496 11.055 -7.993 1.00 0.00 C ATOM 865 CG2 ILE A 54 5.558 12.499 -7.322 1.00 0.00 C ATOM 866 CD1 ILE A 54 6.845 9.838 -8.613 1.00 0.00 C ATOM 0 H ILE A 54 8.780 10.712 -5.774 1.00 0.00 H new ATOM 0 HA ILE A 54 8.097 13.257 -6.498 1.00 0.00 H new ATOM 0 HB ILE A 54 6.293 10.815 -6.238 1.00 0.00 H new ATOM 0 HG12 ILE A 54 7.615 11.823 -8.758 1.00 0.00 H new ATOM 0 HG13 ILE A 54 8.496 10.788 -7.652 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.911 11.902 -7.964 1.00 0.00 H new ATOM 0 HG22 ILE A 54 4.984 12.871 -6.474 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.954 13.341 -7.889 1.00 0.00 H new ATOM 0 HD11 ILE A 54 7.459 9.478 -9.439 1.00 0.00 H new ATOM 0 HD12 ILE A 54 6.751 9.054 -7.862 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.856 10.105 -8.985 1.00 0.00 H new ATOM 878 N GLN A 55 6.632 12.330 -3.706 1.00 0.00 N ATOM 879 CA GLN A 55 5.863 12.807 -2.562 1.00 0.00 C ATOM 880 C GLN A 55 5.916 11.803 -1.415 1.00 0.00 C ATOM 881 O GLN A 55 5.846 10.594 -1.632 1.00 0.00 O ATOM 882 CB GLN A 55 4.410 13.059 -2.968 1.00 0.00 C ATOM 883 CG GLN A 55 3.740 14.169 -2.173 1.00 0.00 C ATOM 884 CD GLN A 55 3.189 13.685 -0.847 1.00 0.00 C ATOM 885 OE1 GLN A 55 2.376 12.761 -0.798 1.00 0.00 O ATOM 886 NE2 GLN A 55 3.628 14.309 0.240 1.00 0.00 N ATOM 0 H GLN A 55 7.009 11.388 -3.599 1.00 0.00 H new ATOM 0 HA GLN A 55 6.306 13.743 -2.222 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.376 13.311 -4.028 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.841 12.138 -2.841 1.00 0.00 H new ATOM 0 HG2 GLN A 55 4.460 14.968 -1.993 1.00 0.00 H new ATOM 0 HG3 GLN A 55 2.930 14.597 -2.764 1.00 0.00 H new ATOM 0 HE21 GLN A 55 4.302 15.070 0.154 1.00 0.00 H new ATOM 0 HE22 GLN A 55 3.291 14.027 1.161 1.00 0.00 H new ATOM 895 N GLN A 56 6.040 12.314 -0.194 1.00 0.00 N ATOM 896 CA GLN A 56 6.103 11.462 0.987 1.00 0.00 C ATOM 897 C GLN A 56 5.034 11.856 2.001 1.00 0.00 C ATOM 898 O GLN A 56 4.767 13.041 2.209 1.00 0.00 O ATOM 899 CB GLN A 56 7.488 11.548 1.630 1.00 0.00 C ATOM 900 CG GLN A 56 8.629 11.325 0.650 1.00 0.00 C ATOM 901 CD GLN A 56 9.931 10.969 1.341 1.00 0.00 C ATOM 902 OE1 GLN A 56 10.155 9.817 1.712 1.00 0.00 O ATOM 903 NE2 GLN A 56 10.798 11.960 1.516 1.00 0.00 N ATOM 0 H GLN A 56 6.099 13.313 0.003 1.00 0.00 H new ATOM 0 HA GLN A 56 5.919 10.435 0.673 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.604 12.528 2.093 1.00 0.00 H new ATOM 0 HB3 GLN A 56 7.556 10.808 2.428 1.00 0.00 H new ATOM 0 HG2 GLN A 56 8.359 10.526 -0.041 1.00 0.00 H new ATOM 0 HG3 GLN A 56 8.773 12.227 0.055 1.00 0.00 H new ATOM 0 HE21 GLN A 56 10.570 12.900 1.192 1.00 0.00 H new ATOM 0 HE22 GLN A 56 11.692 11.781 1.974 1.00 0.00 H new ATOM 912 N LEU A 57 4.425 10.857 2.630 1.00 0.00 N ATOM 913 CA LEU A 57 3.383 11.099 3.622 1.00 0.00 C ATOM 914 C LEU A 57 3.542 10.164 4.817 1.00 0.00 C ATOM 915 O LEU A 57 3.973 9.021 4.670 1.00 0.00 O ATOM 916 CB LEU A 57 2.000 10.914 2.995 1.00 0.00 C ATOM 917 CG LEU A 57 1.826 11.466 1.580 1.00 0.00 C ATOM 918 CD1 LEU A 57 2.427 10.514 0.558 1.00 0.00 C ATOM 919 CD2 LEU A 57 0.355 11.713 1.281 1.00 0.00 C ATOM 0 H LEU A 57 4.635 9.872 2.471 1.00 0.00 H new ATOM 0 HA LEU A 57 3.481 12.127 3.972 1.00 0.00 H new ATOM 0 HB2 LEU A 57 1.770 9.849 2.979 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.263 11.389 3.642 1.00 0.00 H new ATOM 0 HG LEU A 57 2.354 12.417 1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.294 10.924 -0.443 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.491 10.388 0.760 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.928 9.547 0.624 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.250 12.106 0.270 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.196 10.776 1.365 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.045 12.434 1.994 1.00 0.00 H new ATOM 931 N ASN A 58 3.187 10.657 5.999 1.00 0.00 N ATOM 932 CA ASN A 58 3.289 9.864 7.219 1.00 0.00 C ATOM 933 C ASN A 58 2.030 9.029 7.431 1.00 0.00 C ATOM 934 O ASN A 58 0.980 9.552 7.806 1.00 0.00 O ATOM 935 CB ASN A 58 3.518 10.776 8.426 1.00 0.00 C ATOM 936 CG ASN A 58 2.312 11.641 8.735 1.00 0.00 C ATOM 937 OD1 ASN A 58 1.837 12.391 7.883 1.00 0.00 O ATOM 938 ND2 ASN A 58 1.811 11.540 9.961 1.00 0.00 N ATOM 0 H ASN A 58 2.826 11.601 6.138 1.00 0.00 H new ATOM 0 HA ASN A 58 4.139 9.189 7.115 1.00 0.00 H new ATOM 0 HB2 ASN A 58 3.758 10.167 9.298 1.00 0.00 H new ATOM 0 HB3 ASN A 58 4.381 11.415 8.237 1.00 0.00 H new ATOM 0 HD21 ASN A 58 1.000 12.098 10.228 1.00 0.00 H new ATOM 0 HD22 ASN A 58 2.237 10.905 10.635 1.00 0.00 H new ATOM 945 N LEU A 59 2.143 7.728 7.189 1.00 0.00 N ATOM 946 CA LEU A 59 1.014 6.818 7.353 1.00 0.00 C ATOM 947 C LEU A 59 0.411 6.946 8.749 1.00 0.00 C ATOM 948 O LEU A 59 -0.743 6.580 8.974 1.00 0.00 O ATOM 949 CB LEU A 59 1.457 5.375 7.107 1.00 0.00 C ATOM 950 CG LEU A 59 1.798 5.015 5.660 1.00 0.00 C ATOM 951 CD1 LEU A 59 2.580 3.712 5.605 1.00 0.00 C ATOM 952 CD2 LEU A 59 0.531 4.915 4.823 1.00 0.00 C ATOM 0 H LEU A 59 3.005 7.279 6.879 1.00 0.00 H new ATOM 0 HA LEU A 59 0.252 7.087 6.621 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.331 5.174 7.726 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.664 4.709 7.449 1.00 0.00 H new ATOM 0 HG LEU A 59 2.422 5.807 5.245 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.814 3.472 4.568 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.506 3.819 6.170 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.982 2.910 6.037 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.792 4.658 3.796 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.118 4.143 5.236 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.010 5.872 4.836 1.00 0.00 H new ATOM 964 N LYS A 60 1.199 7.469 9.682 1.00 0.00 N ATOM 965 CA LYS A 60 0.743 7.649 11.056 1.00 0.00 C ATOM 966 C LYS A 60 -0.389 8.669 11.124 1.00 0.00 C ATOM 967 O LYS A 60 -0.152 9.876 11.116 1.00 0.00 O ATOM 968 CB LYS A 60 1.903 8.099 11.945 1.00 0.00 C ATOM 969 CG LYS A 60 1.779 7.638 13.387 1.00 0.00 C ATOM 970 CD LYS A 60 1.010 8.641 14.230 1.00 0.00 C ATOM 971 CE LYS A 60 1.916 9.751 14.740 1.00 0.00 C ATOM 972 NZ LYS A 60 2.049 10.858 13.753 1.00 0.00 N ATOM 0 H LYS A 60 2.157 7.776 9.512 1.00 0.00 H new ATOM 0 HA LYS A 60 0.368 6.691 11.416 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.836 7.719 11.530 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.965 9.187 11.924 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.275 6.672 13.419 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.773 7.492 13.810 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.203 9.072 13.638 1.00 0.00 H new ATOM 0 HD3 LYS A 60 0.548 8.130 15.075 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.517 10.144 15.675 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.902 9.342 14.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.207 11.754 14.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.855 10.667 13.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.178 10.927 13.189 1.00 0.00 H new ATOM 986 N GLY A 61 -1.622 8.175 11.191 1.00 0.00 N ATOM 987 CA GLY A 61 -2.772 9.057 11.261 1.00 0.00 C ATOM 988 C GLY A 61 -3.767 8.803 10.146 1.00 0.00 C ATOM 989 O GLY A 61 -4.976 8.924 10.344 1.00 0.00 O ATOM 0 H GLY A 61 -1.845 7.180 11.198 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.268 8.926 12.223 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.435 10.093 11.214 1.00 0.00 H new ATOM 993 N CYS A 62 -3.258 8.450 8.971 1.00 0.00 N ATOM 994 CA CYS A 62 -4.111 8.180 7.818 1.00 0.00 C ATOM 995 C CYS A 62 -5.185 7.155 8.165 1.00 0.00 C ATOM 996 O CYS A 62 -5.221 6.633 9.279 1.00 0.00 O ATOM 997 CB CYS A 62 -3.271 7.678 6.643 1.00 0.00 C ATOM 998 SG CYS A 62 -2.857 5.921 6.729 1.00 0.00 S ATOM 0 H CYS A 62 -2.260 8.344 8.791 1.00 0.00 H new ATOM 0 HA CYS A 62 -4.601 9.111 7.533 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -3.812 7.868 5.716 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.348 8.256 6.597 1.00 0.00 H new ATOM 0 HG CYS A 62 -1.915 5.740 7.607 1.00 0.00 H new ATOM 1004 N GLU A 63 -6.060 6.874 7.205 1.00 0.00 N ATOM 1005 CA GLU A 63 -7.138 5.914 7.411 1.00 0.00 C ATOM 1006 C GLU A 63 -6.978 4.711 6.485 1.00 0.00 C ATOM 1007 O GLU A 63 -6.362 4.807 5.424 1.00 0.00 O ATOM 1008 CB GLU A 63 -8.496 6.578 7.173 1.00 0.00 C ATOM 1009 CG GLU A 63 -9.656 5.837 7.815 1.00 0.00 C ATOM 1010 CD GLU A 63 -9.468 5.639 9.307 1.00 0.00 C ATOM 1011 OE1 GLU A 63 -9.836 6.550 10.077 1.00 0.00 O ATOM 1012 OE2 GLU A 63 -8.953 4.573 9.703 1.00 0.00 O ATOM 0 H GLU A 63 -6.044 7.297 6.277 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.089 5.566 8.443 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -8.466 7.596 7.562 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.672 6.651 6.100 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.578 6.391 7.639 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.772 4.865 7.335 1.00 0.00 H new ATOM 1019 N VAL A 64 -7.539 3.577 6.896 1.00 0.00 N ATOM 1020 CA VAL A 64 -7.460 2.355 6.105 1.00 0.00 C ATOM 1021 C VAL A 64 -8.850 1.852 5.731 1.00 0.00 C ATOM 1022 O VAL A 64 -9.669 1.554 6.601 1.00 0.00 O ATOM 1023 CB VAL A 64 -6.710 1.244 6.862 1.00 0.00 C ATOM 1024 CG1 VAL A 64 -6.573 0.003 5.993 1.00 0.00 C ATOM 1025 CG2 VAL A 64 -5.346 1.738 7.319 1.00 0.00 C ATOM 0 H VAL A 64 -8.053 3.480 7.772 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.909 2.600 5.197 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.289 0.977 7.746 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -6.040 -0.771 6.545 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.563 -0.362 5.721 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.017 0.251 5.089 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -4.830 0.940 7.852 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.757 2.035 6.451 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.472 2.594 7.982 1.00 0.00 H new ATOM 1035 N VAL A 65 -9.110 1.758 4.431 1.00 0.00 N ATOM 1036 CA VAL A 65 -10.400 1.289 3.941 1.00 0.00 C ATOM 1037 C VAL A 65 -10.235 0.080 3.027 1.00 0.00 C ATOM 1038 O VAL A 65 -9.996 0.207 1.826 1.00 0.00 O ATOM 1039 CB VAL A 65 -11.147 2.398 3.177 1.00 0.00 C ATOM 1040 CG1 VAL A 65 -12.580 1.976 2.888 1.00 0.00 C ATOM 1041 CG2 VAL A 65 -11.114 3.701 3.961 1.00 0.00 C ATOM 0 H VAL A 65 -8.444 2.001 3.698 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.985 1.003 4.815 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.643 2.561 2.225 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.092 2.772 2.348 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -12.577 1.070 2.282 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.099 1.783 3.827 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -11.647 4.473 3.406 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.592 3.555 4.930 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.079 4.010 4.110 1.00 0.00 H new ATOM 1051 N PRO A 66 -10.365 -1.122 3.607 1.00 0.00 N ATOM 1052 CA PRO A 66 -10.235 -2.378 2.863 1.00 0.00 C ATOM 1053 C PRO A 66 -11.397 -2.607 1.903 1.00 0.00 C ATOM 1054 O PRO A 66 -12.490 -2.993 2.318 1.00 0.00 O ATOM 1055 CB PRO A 66 -10.232 -3.443 3.963 1.00 0.00 C ATOM 1056 CG PRO A 66 -10.964 -2.817 5.098 1.00 0.00 C ATOM 1057 CD PRO A 66 -10.650 -1.348 5.034 1.00 0.00 C ATOM 0 HA PRO A 66 -9.343 -2.390 2.236 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -10.724 -4.357 3.630 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -9.216 -3.714 4.249 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -12.037 -2.991 5.014 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -10.646 -3.243 6.050 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -11.489 -0.742 5.377 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.795 -1.092 5.660 1.00 0.00 H new ATOM 1065 N ASP A 67 -11.154 -2.366 0.619 1.00 0.00 N ATOM 1066 CA ASP A 67 -12.181 -2.548 -0.400 1.00 0.00 C ATOM 1067 C ASP A 67 -11.926 -3.815 -1.209 1.00 0.00 C ATOM 1068 O ASP A 67 -12.200 -3.865 -2.408 1.00 0.00 O ATOM 1069 CB ASP A 67 -12.226 -1.334 -1.331 1.00 0.00 C ATOM 1070 CG ASP A 67 -13.149 -0.246 -0.819 1.00 0.00 C ATOM 1071 OD1 ASP A 67 -14.359 -0.304 -1.122 1.00 0.00 O ATOM 1072 OD2 ASP A 67 -12.661 0.663 -0.115 1.00 0.00 O ATOM 0 H ASP A 67 -10.255 -2.044 0.260 1.00 0.00 H new ATOM 0 HA ASP A 67 -13.143 -2.647 0.103 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -11.220 -0.929 -1.445 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.556 -1.651 -2.320 1.00 0.00 H new ATOM 1077 N VAL A 68 -11.398 -4.839 -0.545 1.00 0.00 N ATOM 1078 CA VAL A 68 -11.106 -6.107 -1.202 1.00 0.00 C ATOM 1079 C VAL A 68 -12.386 -6.882 -1.496 1.00 0.00 C ATOM 1080 O VAL A 68 -13.349 -6.821 -0.733 1.00 0.00 O ATOM 1081 CB VAL A 68 -10.175 -6.983 -0.342 1.00 0.00 C ATOM 1082 CG1 VAL A 68 -8.957 -6.188 0.105 1.00 0.00 C ATOM 1083 CG2 VAL A 68 -10.926 -7.543 0.856 1.00 0.00 C ATOM 0 H VAL A 68 -11.164 -4.815 0.447 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.605 -5.869 -2.140 1.00 0.00 H new ATOM 0 HB VAL A 68 -9.830 -7.821 -0.948 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.311 -6.823 0.711 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.408 -5.841 -0.770 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.279 -5.330 0.695 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -10.253 -8.159 1.452 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.302 -6.722 1.466 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -11.762 -8.150 0.510 1.00 0.00 H new ATOM 1093 N ASN A 69 -12.388 -7.611 -2.606 1.00 0.00 N ATOM 1094 CA ASN A 69 -13.550 -8.399 -3.002 1.00 0.00 C ATOM 1095 C ASN A 69 -13.145 -9.828 -3.353 1.00 0.00 C ATOM 1096 O ASN A 69 -12.857 -10.137 -4.509 1.00 0.00 O ATOM 1097 CB ASN A 69 -14.251 -7.748 -4.196 1.00 0.00 C ATOM 1098 CG ASN A 69 -15.466 -8.533 -4.651 1.00 0.00 C ATOM 1099 OD1 ASN A 69 -15.468 -9.123 -5.732 1.00 0.00 O ATOM 1100 ND2 ASN A 69 -16.507 -8.544 -3.826 1.00 0.00 N ATOM 0 H ASN A 69 -11.598 -7.673 -3.248 1.00 0.00 H new ATOM 0 HA ASN A 69 -14.239 -8.433 -2.158 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -14.555 -6.736 -3.928 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -13.547 -7.661 -5.024 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -17.352 -9.056 -4.079 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -16.461 -8.041 -2.940 1.00 0.00 H new ATOM 1107 N VAL A 70 -13.126 -10.696 -2.346 1.00 0.00 N ATOM 1108 CA VAL A 70 -12.759 -12.092 -2.547 1.00 0.00 C ATOM 1109 C VAL A 70 -13.552 -12.709 -3.694 1.00 0.00 C ATOM 1110 O VAL A 70 -13.027 -13.516 -4.462 1.00 0.00 O ATOM 1111 CB VAL A 70 -12.991 -12.923 -1.272 1.00 0.00 C ATOM 1112 CG1 VAL A 70 -12.666 -14.388 -1.522 1.00 0.00 C ATOM 1113 CG2 VAL A 70 -12.163 -12.374 -0.120 1.00 0.00 C ATOM 0 H VAL A 70 -13.361 -10.456 -1.383 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.697 -12.108 -2.793 1.00 0.00 H new ATOM 0 HB VAL A 70 -14.044 -12.851 -0.999 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -12.836 -14.959 -0.609 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -13.307 -14.773 -2.316 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -11.622 -14.483 -1.820 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -12.339 -12.974 0.773 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -11.105 -12.414 -0.381 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -12.450 -11.341 0.074 1.00 0.00 H new ATOM 1123 N SER A 71 -14.819 -12.323 -3.806 1.00 0.00 N ATOM 1124 CA SER A 71 -15.686 -12.841 -4.857 1.00 0.00 C ATOM 1125 C SER A 71 -14.977 -12.814 -6.208 1.00 0.00 C ATOM 1126 O SER A 71 -15.083 -13.752 -6.996 1.00 0.00 O ATOM 1127 CB SER A 71 -16.978 -12.024 -4.930 1.00 0.00 C ATOM 1128 OG SER A 71 -17.912 -12.459 -3.957 1.00 0.00 O ATOM 0 H SER A 71 -15.268 -11.653 -3.181 1.00 0.00 H new ATOM 0 HA SER A 71 -15.931 -13.875 -4.615 1.00 0.00 H new ATOM 0 HB2 SER A 71 -16.754 -10.968 -4.777 1.00 0.00 H new ATOM 0 HB3 SER A 71 -17.415 -12.116 -5.925 1.00 0.00 H new ATOM 0 HG SER A 71 -18.728 -11.920 -4.023 1.00 0.00 H new ATOM 1134 N GLY A 72 -14.253 -11.729 -6.468 1.00 0.00 N ATOM 1135 CA GLY A 72 -13.537 -11.599 -7.724 1.00 0.00 C ATOM 1136 C GLY A 72 -12.033 -11.580 -7.534 1.00 0.00 C ATOM 1137 O GLY A 72 -11.315 -10.925 -8.289 1.00 0.00 O ATOM 0 H GLY A 72 -14.150 -10.938 -5.832 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -13.807 -12.427 -8.380 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -13.849 -10.682 -8.223 1.00 0.00 H new ATOM 1141 N GLN A 73 -11.557 -12.300 -6.523 1.00 0.00 N ATOM 1142 CA GLN A 73 -10.128 -12.361 -6.236 1.00 0.00 C ATOM 1143 C GLN A 73 -9.479 -10.991 -6.411 1.00 0.00 C ATOM 1144 O GLN A 73 -8.410 -10.871 -7.010 1.00 0.00 O ATOM 1145 CB GLN A 73 -9.446 -13.381 -7.149 1.00 0.00 C ATOM 1146 CG GLN A 73 -9.844 -14.819 -6.857 1.00 0.00 C ATOM 1147 CD GLN A 73 -9.208 -15.354 -5.588 1.00 0.00 C ATOM 1148 OE1 GLN A 73 -8.015 -15.659 -5.559 1.00 0.00 O ATOM 1149 NE2 GLN A 73 -10.003 -15.471 -4.531 1.00 0.00 N ATOM 0 H GLN A 73 -12.139 -12.849 -5.890 1.00 0.00 H new ATOM 0 HA GLN A 73 -10.004 -12.672 -5.199 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -9.689 -13.149 -8.186 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.365 -13.284 -7.046 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.929 -14.881 -6.770 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -9.555 -15.450 -7.698 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -10.986 -15.206 -4.600 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -9.631 -15.826 -3.650 1.00 0.00 H new ATOM 1158 N LYS A 74 -10.132 -9.961 -5.884 1.00 0.00 N ATOM 1159 CA LYS A 74 -9.619 -8.600 -5.980 1.00 0.00 C ATOM 1160 C LYS A 74 -9.314 -8.034 -4.597 1.00 0.00 C ATOM 1161 O LYS A 74 -9.994 -8.353 -3.621 1.00 0.00 O ATOM 1162 CB LYS A 74 -10.629 -7.702 -6.699 1.00 0.00 C ATOM 1163 CG LYS A 74 -10.165 -6.263 -6.848 1.00 0.00 C ATOM 1164 CD LYS A 74 -11.341 -5.309 -6.982 1.00 0.00 C ATOM 1165 CE LYS A 74 -10.877 -3.891 -7.279 1.00 0.00 C ATOM 1166 NZ LYS A 74 -11.904 -2.881 -6.901 1.00 0.00 N ATOM 0 H LYS A 74 -11.018 -10.043 -5.386 1.00 0.00 H new ATOM 0 HA LYS A 74 -8.693 -8.627 -6.554 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -10.830 -8.114 -7.688 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.571 -7.716 -6.150 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -9.564 -5.982 -5.983 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.523 -6.176 -7.724 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -12.000 -5.652 -7.780 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.924 -5.317 -6.061 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -9.953 -3.690 -6.737 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -10.650 -3.798 -8.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.550 -1.928 -7.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -12.778 -3.057 -7.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.103 -2.952 -5.883 1.00 0.00 H new ATOM 1180 N PHE A 75 -8.289 -7.193 -4.520 1.00 0.00 N ATOM 1181 CA PHE A 75 -7.894 -6.582 -3.255 1.00 0.00 C ATOM 1182 C PHE A 75 -7.356 -5.172 -3.477 1.00 0.00 C ATOM 1183 O PHE A 75 -6.387 -4.974 -4.211 1.00 0.00 O ATOM 1184 CB PHE A 75 -6.836 -7.441 -2.559 1.00 0.00 C ATOM 1185 CG PHE A 75 -7.091 -8.916 -2.673 1.00 0.00 C ATOM 1186 CD1 PHE A 75 -6.935 -9.568 -3.886 1.00 0.00 C ATOM 1187 CD2 PHE A 75 -7.487 -9.652 -1.567 1.00 0.00 C ATOM 1188 CE1 PHE A 75 -7.170 -10.926 -3.994 1.00 0.00 C ATOM 1189 CE2 PHE A 75 -7.723 -11.010 -1.669 1.00 0.00 C ATOM 1190 CZ PHE A 75 -7.563 -11.648 -2.884 1.00 0.00 C ATOM 0 H PHE A 75 -7.716 -6.918 -5.318 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.777 -6.518 -2.619 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -5.859 -7.215 -2.985 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -6.794 -7.168 -1.505 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -6.626 -9.009 -4.757 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -7.613 -9.159 -0.615 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -7.046 -11.422 -4.945 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -8.032 -11.572 -0.800 1.00 0.00 H new ATOM 0 HZ PHE A 75 -7.745 -12.709 -2.966 1.00 0.00 H new ATOM 1200 N CYS A 76 -7.990 -4.196 -2.838 1.00 0.00 N ATOM 1201 CA CYS A 76 -7.577 -2.803 -2.965 1.00 0.00 C ATOM 1202 C CYS A 76 -7.383 -2.166 -1.593 1.00 0.00 C ATOM 1203 O CYS A 76 -8.054 -2.531 -0.628 1.00 0.00 O ATOM 1204 CB CYS A 76 -8.613 -2.013 -3.766 1.00 0.00 C ATOM 1205 SG CYS A 76 -7.927 -0.612 -4.681 1.00 0.00 S ATOM 0 H CYS A 76 -8.793 -4.343 -2.226 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.624 -2.779 -3.494 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -9.104 -2.686 -4.468 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -9.381 -1.647 -3.085 1.00 0.00 H new ATOM 0 HG CYS A 76 -8.879 -0.008 -5.328 1.00 0.00 H new ATOM 1211 N ILE A 77 -6.460 -1.213 -1.514 1.00 0.00 N ATOM 1212 CA ILE A 77 -6.178 -0.525 -0.260 1.00 0.00 C ATOM 1213 C ILE A 77 -6.221 0.988 -0.441 1.00 0.00 C ATOM 1214 O ILE A 77 -5.228 1.607 -0.826 1.00 0.00 O ATOM 1215 CB ILE A 77 -4.801 -0.925 0.303 1.00 0.00 C ATOM 1216 CG1 ILE A 77 -4.641 -2.446 0.285 1.00 0.00 C ATOM 1217 CG2 ILE A 77 -4.630 -0.386 1.715 1.00 0.00 C ATOM 1218 CD1 ILE A 77 -3.251 -2.912 0.659 1.00 0.00 C ATOM 0 H ILE A 77 -5.895 -0.900 -2.303 1.00 0.00 H new ATOM 0 HA ILE A 77 -6.952 -0.825 0.446 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.026 -0.489 -0.328 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.361 -2.887 0.974 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.884 -2.817 -0.711 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.652 -0.677 2.100 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.706 0.701 1.701 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.409 -0.796 2.358 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -3.211 -4.001 0.625 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.528 -2.500 -0.045 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.012 -2.571 1.666 1.00 0.00 H new ATOM 1230 N LYS A 78 -7.377 1.580 -0.160 1.00 0.00 N ATOM 1231 CA LYS A 78 -7.550 3.022 -0.288 1.00 0.00 C ATOM 1232 C LYS A 78 -6.851 3.757 0.851 1.00 0.00 C ATOM 1233 O LYS A 78 -7.248 3.646 2.012 1.00 0.00 O ATOM 1234 CB LYS A 78 -9.038 3.378 -0.302 1.00 0.00 C ATOM 1235 CG LYS A 78 -9.306 4.872 -0.357 1.00 0.00 C ATOM 1236 CD LYS A 78 -10.608 5.232 0.337 1.00 0.00 C ATOM 1237 CE LYS A 78 -11.805 5.011 -0.574 1.00 0.00 C ATOM 1238 NZ LYS A 78 -13.066 4.834 0.199 1.00 0.00 N ATOM 0 H LYS A 78 -8.209 1.083 0.158 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.099 3.335 -1.230 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.509 2.901 -1.162 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.510 2.965 0.590 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -8.482 5.408 0.114 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.345 5.197 -1.397 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -10.720 4.630 1.239 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -10.577 6.275 0.652 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -11.909 5.860 -1.249 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -11.632 4.131 -1.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -13.874 5.137 -0.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.179 3.832 0.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -13.026 5.409 1.064 1.00 0.00 H new ATOM 1252 N LEU A 79 -5.810 4.509 0.512 1.00 0.00 N ATOM 1253 CA LEU A 79 -5.056 5.265 1.507 1.00 0.00 C ATOM 1254 C LEU A 79 -5.512 6.720 1.545 1.00 0.00 C ATOM 1255 O LEU A 79 -5.246 7.490 0.621 1.00 0.00 O ATOM 1256 CB LEU A 79 -3.558 5.195 1.201 1.00 0.00 C ATOM 1257 CG LEU A 79 -2.622 5.302 2.406 1.00 0.00 C ATOM 1258 CD1 LEU A 79 -2.828 4.125 3.347 1.00 0.00 C ATOM 1259 CD2 LEU A 79 -1.172 5.375 1.949 1.00 0.00 C ATOM 0 H LEU A 79 -5.468 4.612 -0.444 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.242 4.820 2.484 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.355 4.253 0.691 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.312 5.995 0.503 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.858 6.219 2.947 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.154 4.218 4.199 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.859 4.117 3.700 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.619 3.195 2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.520 5.451 2.819 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.922 4.476 1.386 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.034 6.251 1.315 1.00 0.00 H new ATOM 1271 N LEU A 80 -6.197 7.091 2.621 1.00 0.00 N ATOM 1272 CA LEU A 80 -6.688 8.455 2.782 1.00 0.00 C ATOM 1273 C LEU A 80 -5.818 9.235 3.762 1.00 0.00 C ATOM 1274 O LEU A 80 -5.755 8.909 4.948 1.00 0.00 O ATOM 1275 CB LEU A 80 -8.138 8.442 3.268 1.00 0.00 C ATOM 1276 CG LEU A 80 -9.208 8.301 2.185 1.00 0.00 C ATOM 1277 CD1 LEU A 80 -10.573 8.061 2.811 1.00 0.00 C ATOM 1278 CD2 LEU A 80 -9.236 9.537 1.299 1.00 0.00 C ATOM 0 H LEU A 80 -6.425 6.467 3.395 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.641 8.949 1.811 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.256 7.621 3.976 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.324 9.365 3.817 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.959 7.440 1.565 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -11.322 7.963 2.025 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -10.546 7.146 3.402 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.831 8.902 3.455 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -10.003 9.419 0.534 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.460 10.414 1.906 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.264 9.665 0.822 1.00 0.00 H new ATOM 1290 N VAL A 81 -5.149 10.268 3.260 1.00 0.00 N ATOM 1291 CA VAL A 81 -4.285 11.097 4.092 1.00 0.00 C ATOM 1292 C VAL A 81 -4.788 12.535 4.145 1.00 0.00 C ATOM 1293 O VAL A 81 -4.834 13.241 3.137 1.00 0.00 O ATOM 1294 CB VAL A 81 -2.834 11.091 3.574 1.00 0.00 C ATOM 1295 CG1 VAL A 81 -1.933 11.891 4.503 1.00 0.00 C ATOM 1296 CG2 VAL A 81 -2.328 9.665 3.424 1.00 0.00 C ATOM 0 H VAL A 81 -5.189 10.551 2.281 1.00 0.00 H new ATOM 0 HA VAL A 81 -4.307 10.670 5.095 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.815 11.564 2.592 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -0.912 11.876 4.122 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.286 12.921 4.554 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.955 11.450 5.500 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -1.302 9.680 3.057 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.360 9.164 4.391 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.959 9.128 2.716 1.00 0.00 H new ATOM 1306 N PRO A 82 -5.176 12.982 5.348 1.00 0.00 N ATOM 1307 CA PRO A 82 -5.683 14.341 5.563 1.00 0.00 C ATOM 1308 C PRO A 82 -4.592 15.396 5.413 1.00 0.00 C ATOM 1309 O PRO A 82 -3.464 15.206 5.867 1.00 0.00 O ATOM 1310 CB PRO A 82 -6.198 14.305 7.004 1.00 0.00 C ATOM 1311 CG PRO A 82 -5.411 13.223 7.660 1.00 0.00 C ATOM 1312 CD PRO A 82 -5.150 12.196 6.593 1.00 0.00 C ATOM 0 HA PRO A 82 -6.444 14.613 4.832 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -6.047 15.262 7.503 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -7.267 14.093 7.037 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.476 13.611 8.065 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -5.964 12.789 8.493 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -4.189 11.703 6.737 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -5.911 11.416 6.592 1.00 0.00 H new ATOM 1320 N SER A 83 -4.936 16.510 4.774 1.00 0.00 N ATOM 1321 CA SER A 83 -3.985 17.595 4.562 1.00 0.00 C ATOM 1322 C SER A 83 -4.650 18.951 4.781 1.00 0.00 C ATOM 1323 O SER A 83 -5.836 19.140 4.513 1.00 0.00 O ATOM 1324 CB SER A 83 -3.403 17.522 3.149 1.00 0.00 C ATOM 1325 OG SER A 83 -2.630 16.347 2.977 1.00 0.00 O ATOM 0 H SER A 83 -5.866 16.685 4.394 1.00 0.00 H new ATOM 0 HA SER A 83 -3.178 17.485 5.286 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.211 17.540 2.418 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.784 18.399 2.961 1.00 0.00 H new ATOM 0 HG SER A 83 -2.270 16.323 2.066 1.00 0.00 H new ATOM 1331 N PRO A 84 -3.867 19.918 5.281 1.00 0.00 N ATOM 1332 CA PRO A 84 -4.357 21.274 5.547 1.00 0.00 C ATOM 1333 C PRO A 84 -4.657 22.044 4.266 1.00 0.00 C ATOM 1334 O PRO A 84 -5.354 23.058 4.290 1.00 0.00 O ATOM 1335 CB PRO A 84 -3.198 21.928 6.304 1.00 0.00 C ATOM 1336 CG PRO A 84 -1.988 21.176 5.867 1.00 0.00 C ATOM 1337 CD PRO A 84 -2.443 19.764 5.625 1.00 0.00 C ATOM 0 HA PRO A 84 -5.296 21.266 6.101 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -3.115 22.987 6.062 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -3.340 21.858 7.382 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -1.565 21.610 4.961 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -1.211 21.210 6.630 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -1.883 19.294 4.816 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -2.308 19.141 6.509 1.00 0.00 H new ATOM 1345 N GLU A 85 -4.128 21.555 3.149 1.00 0.00 N ATOM 1346 CA GLU A 85 -4.340 22.198 1.858 1.00 0.00 C ATOM 1347 C GLU A 85 -5.544 21.594 1.140 1.00 0.00 C ATOM 1348 O GLU A 85 -6.225 22.270 0.371 1.00 0.00 O ATOM 1349 CB GLU A 85 -3.091 22.064 0.984 1.00 0.00 C ATOM 1350 CG GLU A 85 -3.012 20.745 0.234 1.00 0.00 C ATOM 1351 CD GLU A 85 -1.790 20.654 -0.658 1.00 0.00 C ATOM 1352 OE1 GLU A 85 -0.661 20.669 -0.124 1.00 0.00 O ATOM 1353 OE2 GLU A 85 -1.962 20.567 -1.892 1.00 0.00 O ATOM 0 H GLU A 85 -3.550 20.716 3.112 1.00 0.00 H new ATOM 0 HA GLU A 85 -4.538 23.255 2.036 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.071 22.883 0.265 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -2.206 22.169 1.611 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -2.996 19.924 0.951 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -3.910 20.621 -0.372 1.00 0.00 H new ATOM 1360 N GLY A 86 -5.798 20.315 1.397 1.00 0.00 N ATOM 1361 CA GLY A 86 -6.918 19.640 0.768 1.00 0.00 C ATOM 1362 C GLY A 86 -7.013 18.180 1.166 1.00 0.00 C ATOM 1363 O GLY A 86 -6.887 17.841 2.342 1.00 0.00 O ATOM 0 H GLY A 86 -5.248 19.734 2.030 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -7.843 20.148 1.039 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -6.820 19.712 -0.315 1.00 0.00 H new ATOM 1367 N MET A 87 -7.238 17.314 0.183 1.00 0.00 N ATOM 1368 CA MET A 87 -7.350 15.883 0.437 1.00 0.00 C ATOM 1369 C MET A 87 -6.583 15.082 -0.611 1.00 0.00 C ATOM 1370 O MET A 87 -6.741 15.303 -1.811 1.00 0.00 O ATOM 1371 CB MET A 87 -8.820 15.458 0.445 1.00 0.00 C ATOM 1372 CG MET A 87 -9.103 14.262 1.339 1.00 0.00 C ATOM 1373 SD MET A 87 -8.364 12.740 0.716 1.00 0.00 S ATOM 1374 CE MET A 87 -7.405 12.222 2.138 1.00 0.00 C ATOM 0 H MET A 87 -7.346 17.579 -0.796 1.00 0.00 H new ATOM 0 HA MET A 87 -6.914 15.678 1.415 1.00 0.00 H new ATOM 0 HB2 MET A 87 -9.431 16.299 0.773 1.00 0.00 H new ATOM 0 HB3 MET A 87 -9.126 15.220 -0.574 1.00 0.00 H new ATOM 0 HG2 MET A 87 -8.722 14.463 2.340 1.00 0.00 H new ATOM 0 HG3 MET A 87 -10.181 14.128 1.429 1.00 0.00 H new ATOM 0 HE1 MET A 87 -6.349 12.183 1.870 1.00 0.00 H new ATOM 0 HE2 MET A 87 -7.547 12.933 2.952 1.00 0.00 H new ATOM 0 HE3 MET A 87 -7.734 11.234 2.459 1.00 0.00 H new ATOM 1384 N SER A 88 -5.753 14.153 -0.149 1.00 0.00 N ATOM 1385 CA SER A 88 -4.959 13.323 -1.046 1.00 0.00 C ATOM 1386 C SER A 88 -5.205 11.842 -0.777 1.00 0.00 C ATOM 1387 O SER A 88 -4.930 11.345 0.315 1.00 0.00 O ATOM 1388 CB SER A 88 -3.471 13.641 -0.887 1.00 0.00 C ATOM 1389 OG SER A 88 -3.243 15.040 -0.912 1.00 0.00 O ATOM 0 H SER A 88 -5.613 13.956 0.842 1.00 0.00 H new ATOM 0 HA SER A 88 -5.263 13.544 -2.069 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.106 13.227 0.053 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.906 13.163 -1.687 1.00 0.00 H new ATOM 0 HG SER A 88 -2.285 15.217 -0.807 1.00 0.00 H new ATOM 1395 N GLU A 89 -5.726 11.142 -1.781 1.00 0.00 N ATOM 1396 CA GLU A 89 -6.010 9.718 -1.652 1.00 0.00 C ATOM 1397 C GLU A 89 -5.170 8.905 -2.632 1.00 0.00 C ATOM 1398 O GLU A 89 -4.720 9.420 -3.656 1.00 0.00 O ATOM 1399 CB GLU A 89 -7.497 9.448 -1.892 1.00 0.00 C ATOM 1400 CG GLU A 89 -7.873 9.377 -3.363 1.00 0.00 C ATOM 1401 CD GLU A 89 -7.722 7.981 -3.936 1.00 0.00 C ATOM 1402 OE1 GLU A 89 -7.631 7.020 -3.144 1.00 0.00 O ATOM 1403 OE2 GLU A 89 -7.695 7.850 -5.178 1.00 0.00 O ATOM 0 H GLU A 89 -5.959 11.538 -2.691 1.00 0.00 H new ATOM 0 HA GLU A 89 -5.752 9.413 -0.638 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.770 8.509 -1.410 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.082 10.233 -1.414 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -8.904 9.707 -3.487 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.247 10.068 -3.928 1.00 0.00 H new ATOM 1410 N ILE A 90 -4.962 7.633 -2.310 1.00 0.00 N ATOM 1411 CA ILE A 90 -4.176 6.748 -3.161 1.00 0.00 C ATOM 1412 C ILE A 90 -4.792 5.354 -3.223 1.00 0.00 C ATOM 1413 O ILE A 90 -4.989 4.705 -2.195 1.00 0.00 O ATOM 1414 CB ILE A 90 -2.723 6.633 -2.665 1.00 0.00 C ATOM 1415 CG1 ILE A 90 -1.992 7.965 -2.846 1.00 0.00 C ATOM 1416 CG2 ILE A 90 -1.997 5.520 -3.406 1.00 0.00 C ATOM 1417 CD1 ILE A 90 -0.699 8.056 -2.066 1.00 0.00 C ATOM 0 H ILE A 90 -5.327 7.192 -1.466 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.177 7.188 -4.158 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.736 6.388 -1.603 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.779 8.112 -3.905 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.651 8.777 -2.537 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.971 5.451 -3.044 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.508 4.573 -3.231 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -1.991 5.737 -4.474 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.235 9.027 -2.242 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.907 7.941 -1.002 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.022 7.266 -2.391 1.00 0.00 H new ATOM 1429 N TYR A 91 -5.093 4.900 -4.434 1.00 0.00 N ATOM 1430 CA TYR A 91 -5.687 3.583 -4.630 1.00 0.00 C ATOM 1431 C TYR A 91 -4.623 2.554 -4.999 1.00 0.00 C ATOM 1432 O TYR A 91 -3.885 2.727 -5.970 1.00 0.00 O ATOM 1433 CB TYR A 91 -6.757 3.640 -5.723 1.00 0.00 C ATOM 1434 CG TYR A 91 -7.995 4.408 -5.318 1.00 0.00 C ATOM 1435 CD1 TYR A 91 -8.721 4.048 -4.190 1.00 0.00 C ATOM 1436 CD2 TYR A 91 -8.438 5.493 -6.064 1.00 0.00 C ATOM 1437 CE1 TYR A 91 -9.854 4.746 -3.817 1.00 0.00 C ATOM 1438 CE2 TYR A 91 -9.568 6.198 -5.698 1.00 0.00 C ATOM 1439 CZ TYR A 91 -10.273 5.821 -4.574 1.00 0.00 C ATOM 1440 OH TYR A 91 -11.400 6.519 -4.206 1.00 0.00 O ATOM 0 H TYR A 91 -4.936 5.424 -5.295 1.00 0.00 H new ATOM 0 HA TYR A 91 -6.151 3.279 -3.691 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -6.330 4.099 -6.614 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -7.042 2.624 -5.994 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -8.395 3.208 -3.594 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -7.889 5.790 -6.945 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -10.408 4.452 -2.938 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -9.898 7.040 -6.289 1.00 0.00 H new ATOM 0 HH TYR A 91 -11.557 7.246 -4.844 1.00 0.00 H new ATOM 1450 N LEU A 92 -4.549 1.483 -4.217 1.00 0.00 N ATOM 1451 CA LEU A 92 -3.575 0.424 -4.459 1.00 0.00 C ATOM 1452 C LEU A 92 -4.268 -0.924 -4.628 1.00 0.00 C ATOM 1453 O LEU A 92 -4.889 -1.435 -3.696 1.00 0.00 O ATOM 1454 CB LEU A 92 -2.571 0.354 -3.307 1.00 0.00 C ATOM 1455 CG LEU A 92 -1.911 1.675 -2.911 1.00 0.00 C ATOM 1456 CD1 LEU A 92 -1.290 1.566 -1.527 1.00 0.00 C ATOM 1457 CD2 LEU A 92 -0.863 2.077 -3.938 1.00 0.00 C ATOM 0 H LEU A 92 -5.152 1.325 -3.410 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.043 0.657 -5.382 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.080 -0.052 -2.432 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.787 -0.354 -3.577 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.678 2.449 -2.883 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.825 2.515 -1.261 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.064 1.325 -0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.535 0.780 -1.528 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.404 3.019 -3.640 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.097 1.304 -3.998 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.336 2.196 -4.913 1.00 0.00 H new ATOM 1469 N ARG A 93 -4.156 -1.496 -5.823 1.00 0.00 N ATOM 1470 CA ARG A 93 -4.770 -2.786 -6.113 1.00 0.00 C ATOM 1471 C ARG A 93 -3.709 -3.871 -6.268 1.00 0.00 C ATOM 1472 O ARG A 93 -2.907 -3.840 -7.203 1.00 0.00 O ATOM 1473 CB ARG A 93 -5.614 -2.697 -7.386 1.00 0.00 C ATOM 1474 CG ARG A 93 -6.319 -3.996 -7.741 1.00 0.00 C ATOM 1475 CD ARG A 93 -6.911 -3.944 -9.141 1.00 0.00 C ATOM 1476 NE ARG A 93 -7.600 -5.183 -9.491 1.00 0.00 N ATOM 1477 CZ ARG A 93 -8.253 -5.364 -10.633 1.00 0.00 C ATOM 1478 NH1 ARG A 93 -8.306 -4.391 -11.532 1.00 0.00 N ATOM 1479 NH2 ARG A 93 -8.854 -6.521 -10.879 1.00 0.00 N ATOM 0 H ARG A 93 -3.646 -1.086 -6.605 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.415 -3.050 -5.275 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.359 -1.911 -7.264 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.973 -2.402 -8.217 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -5.614 -4.824 -7.674 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.110 -4.191 -7.017 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -7.609 -3.110 -9.208 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -6.117 -3.754 -9.863 1.00 0.00 H new ATOM 0 HE ARG A 93 -7.578 -5.952 -8.821 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -7.844 -3.500 -11.347 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -8.808 -4.533 -12.408 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -8.815 -7.273 -10.191 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -9.355 -6.659 -11.757 1.00 0.00 H new ATOM 1493 N CYS A 94 -3.710 -4.828 -5.347 1.00 0.00 N ATOM 1494 CA CYS A 94 -2.747 -5.923 -5.380 1.00 0.00 C ATOM 1495 C CYS A 94 -3.175 -6.993 -6.379 1.00 0.00 C ATOM 1496 O CYS A 94 -4.256 -6.915 -6.962 1.00 0.00 O ATOM 1497 CB CYS A 94 -2.595 -6.538 -3.989 1.00 0.00 C ATOM 1498 SG CYS A 94 -1.786 -5.455 -2.787 1.00 0.00 S ATOM 0 H CYS A 94 -4.367 -4.868 -4.568 1.00 0.00 H new ATOM 0 HA CYS A 94 -1.785 -5.519 -5.697 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -3.582 -6.807 -3.613 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -2.023 -7.462 -4.073 1.00 0.00 H new ATOM 0 HG CYS A 94 -2.664 -5.026 -1.929 1.00 0.00 H new ATOM 1504 N GLN A 95 -2.319 -7.991 -6.572 1.00 0.00 N ATOM 1505 CA GLN A 95 -2.608 -9.076 -7.502 1.00 0.00 C ATOM 1506 C GLN A 95 -3.283 -10.241 -6.787 1.00 0.00 C ATOM 1507 O GLN A 95 -4.347 -10.704 -7.200 1.00 0.00 O ATOM 1508 CB GLN A 95 -1.321 -9.554 -8.177 1.00 0.00 C ATOM 1509 CG GLN A 95 -0.271 -10.057 -7.199 1.00 0.00 C ATOM 1510 CD GLN A 95 1.083 -10.260 -7.850 1.00 0.00 C ATOM 1511 OE1 GLN A 95 1.917 -9.354 -7.870 1.00 0.00 O ATOM 1512 NE2 GLN A 95 1.310 -11.453 -8.386 1.00 0.00 N ATOM 0 H GLN A 95 -1.420 -8.071 -6.097 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.290 -8.696 -8.263 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -1.564 -10.352 -8.879 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -0.900 -8.734 -8.759 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -0.173 -9.345 -6.379 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -0.606 -10.999 -6.765 1.00 0.00 H new ATOM 0 HE21 GLN A 95 0.591 -12.175 -8.347 1.00 0.00 H new ATOM 0 HE22 GLN A 95 2.204 -11.648 -8.837 1.00 0.00 H new ATOM 1521 N ASP A 96 -2.659 -10.711 -5.712 1.00 0.00 N ATOM 1522 CA ASP A 96 -3.200 -11.823 -4.938 1.00 0.00 C ATOM 1523 C ASP A 96 -3.282 -11.465 -3.458 1.00 0.00 C ATOM 1524 O ASP A 96 -2.732 -10.453 -3.023 1.00 0.00 O ATOM 1525 CB ASP A 96 -2.338 -13.071 -5.127 1.00 0.00 C ATOM 1526 CG ASP A 96 -2.757 -13.888 -6.334 1.00 0.00 C ATOM 1527 OD1 ASP A 96 -2.256 -13.608 -7.443 1.00 0.00 O ATOM 1528 OD2 ASP A 96 -3.585 -14.807 -6.168 1.00 0.00 O ATOM 0 H ASP A 96 -1.778 -10.339 -5.357 1.00 0.00 H new ATOM 0 HA ASP A 96 -4.207 -12.029 -5.300 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -1.295 -12.775 -5.237 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -2.401 -13.691 -4.233 1.00 0.00 H new ATOM 1533 N GLU A 97 -3.974 -12.301 -2.689 1.00 0.00 N ATOM 1534 CA GLU A 97 -4.129 -12.070 -1.258 1.00 0.00 C ATOM 1535 C GLU A 97 -2.770 -12.013 -0.566 1.00 0.00 C ATOM 1536 O GLU A 97 -2.606 -11.330 0.445 1.00 0.00 O ATOM 1537 CB GLU A 97 -4.986 -13.172 -0.631 1.00 0.00 C ATOM 1538 CG GLU A 97 -4.405 -14.565 -0.799 1.00 0.00 C ATOM 1539 CD GLU A 97 -5.473 -15.639 -0.865 1.00 0.00 C ATOM 1540 OE1 GLU A 97 -6.434 -15.571 -0.070 1.00 0.00 O ATOM 1541 OE2 GLU A 97 -5.348 -16.548 -1.712 1.00 0.00 O ATOM 0 H GLU A 97 -4.435 -13.143 -3.033 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.627 -11.110 -1.123 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.109 -12.965 0.432 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -5.980 -13.146 -1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -3.806 -14.597 -1.709 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.733 -14.777 0.033 1.00 0.00 H new ATOM 1548 N GLN A 98 -1.800 -12.735 -1.118 1.00 0.00 N ATOM 1549 CA GLN A 98 -0.456 -12.767 -0.553 1.00 0.00 C ATOM 1550 C GLN A 98 0.117 -11.359 -0.431 1.00 0.00 C ATOM 1551 O GLN A 98 0.619 -10.973 0.625 1.00 0.00 O ATOM 1552 CB GLN A 98 0.463 -13.632 -1.418 1.00 0.00 C ATOM 1553 CG GLN A 98 0.209 -15.123 -1.273 1.00 0.00 C ATOM 1554 CD GLN A 98 0.309 -15.595 0.165 1.00 0.00 C ATOM 1555 OE1 GLN A 98 0.939 -14.947 1.001 1.00 0.00 O ATOM 1556 NE2 GLN A 98 -0.314 -16.730 0.460 1.00 0.00 N ATOM 0 H GLN A 98 -1.920 -13.305 -1.955 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.519 -13.201 0.445 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.335 -13.350 -2.463 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.500 -13.421 -1.155 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -0.782 -15.358 -1.661 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.928 -15.671 -1.882 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.825 -17.235 -0.264 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.282 -17.097 1.411 1.00 0.00 H new ATOM 1565 N GLN A 99 0.039 -10.598 -1.517 1.00 0.00 N ATOM 1566 CA GLN A 99 0.551 -9.233 -1.531 1.00 0.00 C ATOM 1567 C GLN A 99 -0.333 -8.311 -0.698 1.00 0.00 C ATOM 1568 O GLN A 99 0.160 -7.521 0.107 1.00 0.00 O ATOM 1569 CB GLN A 99 0.641 -8.714 -2.967 1.00 0.00 C ATOM 1570 CG GLN A 99 1.489 -7.460 -3.109 1.00 0.00 C ATOM 1571 CD GLN A 99 2.086 -7.314 -4.495 1.00 0.00 C ATOM 1572 OE1 GLN A 99 1.368 -7.114 -5.475 1.00 0.00 O ATOM 1573 NE2 GLN A 99 3.408 -7.412 -4.584 1.00 0.00 N ATOM 0 H GLN A 99 -0.374 -10.903 -2.399 1.00 0.00 H new ATOM 0 HA GLN A 99 1.549 -9.242 -1.093 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.056 -9.497 -3.602 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -0.364 -8.506 -3.333 1.00 0.00 H new ATOM 0 HG2 GLN A 99 0.878 -6.585 -2.887 1.00 0.00 H new ATOM 0 HG3 GLN A 99 2.292 -7.483 -2.372 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.965 -7.578 -3.746 1.00 0.00 H new ATOM 0 HE22 GLN A 99 3.866 -7.321 -5.491 1.00 0.00 H new ATOM 1582 N TYR A 100 -1.642 -8.415 -0.899 1.00 0.00 N ATOM 1583 CA TYR A 100 -2.596 -7.589 -0.169 1.00 0.00 C ATOM 1584 C TYR A 100 -2.299 -7.607 1.328 1.00 0.00 C ATOM 1585 O TYR A 100 -2.088 -6.563 1.943 1.00 0.00 O ATOM 1586 CB TYR A 100 -4.024 -8.075 -0.423 1.00 0.00 C ATOM 1587 CG TYR A 100 -5.010 -7.636 0.635 1.00 0.00 C ATOM 1588 CD1 TYR A 100 -5.213 -6.289 0.909 1.00 0.00 C ATOM 1589 CD2 TYR A 100 -5.742 -8.569 1.361 1.00 0.00 C ATOM 1590 CE1 TYR A 100 -6.112 -5.884 1.875 1.00 0.00 C ATOM 1591 CE2 TYR A 100 -6.645 -8.173 2.328 1.00 0.00 C ATOM 1592 CZ TYR A 100 -6.826 -6.829 2.582 1.00 0.00 C ATOM 1593 OH TYR A 100 -7.725 -6.429 3.545 1.00 0.00 O ATOM 0 H TYR A 100 -2.067 -9.064 -1.562 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.499 -6.564 -0.528 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.357 -7.707 -1.393 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -4.024 -9.164 -0.478 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -4.658 -5.546 0.356 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -5.602 -9.622 1.165 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.256 -4.833 2.076 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.206 -8.911 2.882 1.00 0.00 H new ATOM 0 HH TYR A 100 -8.145 -7.217 3.948 1.00 0.00 H new ATOM 1603 N ALA A 101 -2.286 -8.804 1.906 1.00 0.00 N ATOM 1604 CA ALA A 101 -2.013 -8.961 3.330 1.00 0.00 C ATOM 1605 C ALA A 101 -0.696 -8.294 3.713 1.00 0.00 C ATOM 1606 O ALA A 101 -0.665 -7.400 4.559 1.00 0.00 O ATOM 1607 CB ALA A 101 -1.987 -10.435 3.703 1.00 0.00 C ATOM 0 H ALA A 101 -2.461 -9.678 1.411 1.00 0.00 H new ATOM 0 HA ALA A 101 -2.814 -8.471 3.884 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.782 -10.537 4.769 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.953 -10.885 3.474 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.207 -10.941 3.134 1.00 0.00 H new ATOM 1613 N ARG A 102 0.390 -8.734 3.086 1.00 0.00 N ATOM 1614 CA ARG A 102 1.710 -8.181 3.363 1.00 0.00 C ATOM 1615 C ARG A 102 1.645 -6.663 3.500 1.00 0.00 C ATOM 1616 O ARG A 102 1.920 -6.114 4.567 1.00 0.00 O ATOM 1617 CB ARG A 102 2.690 -8.562 2.252 1.00 0.00 C ATOM 1618 CG ARG A 102 3.247 -9.969 2.387 1.00 0.00 C ATOM 1619 CD ARG A 102 3.770 -10.492 1.058 1.00 0.00 C ATOM 1620 NE ARG A 102 4.287 -11.853 1.170 1.00 0.00 N ATOM 1621 CZ ARG A 102 4.692 -12.573 0.130 1.00 0.00 C ATOM 1622 NH1 ARG A 102 4.639 -12.065 -1.093 1.00 0.00 N ATOM 1623 NH2 ARG A 102 5.150 -13.805 0.313 1.00 0.00 N ATOM 0 H ARG A 102 0.382 -9.472 2.382 1.00 0.00 H new ATOM 0 HA ARG A 102 2.061 -8.599 4.306 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.188 -8.470 1.289 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.517 -7.852 2.249 1.00 0.00 H new ATOM 0 HG2 ARG A 102 4.051 -9.974 3.123 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.469 -10.635 2.760 1.00 0.00 H new ATOM 0 HD2 ARG A 102 2.969 -10.468 0.319 1.00 0.00 H new ATOM 0 HD3 ARG A 102 4.559 -9.833 0.695 1.00 0.00 H new ATOM 0 HE ARG A 102 4.340 -12.274 2.098 1.00 0.00 H new ATOM 0 HH11 ARG A 102 4.287 -11.119 -1.237 1.00 0.00 H new ATOM 0 HH12 ARG A 102 4.951 -12.620 -1.890 1.00 0.00 H new ATOM 0 HH21 ARG A 102 5.191 -14.199 1.253 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.461 -14.357 -0.486 1.00 0.00 H new ATOM 1637 N TRP A 103 1.280 -5.991 2.414 1.00 0.00 N ATOM 1638 CA TRP A 103 1.179 -4.536 2.414 1.00 0.00 C ATOM 1639 C TRP A 103 0.135 -4.062 3.419 1.00 0.00 C ATOM 1640 O TRP A 103 0.461 -3.383 4.392 1.00 0.00 O ATOM 1641 CB TRP A 103 0.825 -4.029 1.014 1.00 0.00 C ATOM 1642 CG TRP A 103 1.995 -4.007 0.077 1.00 0.00 C ATOM 1643 CD1 TRP A 103 2.449 -5.041 -0.691 1.00 0.00 C ATOM 1644 CD2 TRP A 103 2.859 -2.897 -0.188 1.00 0.00 C ATOM 1645 NE1 TRP A 103 3.544 -4.640 -1.418 1.00 0.00 N ATOM 1646 CE2 TRP A 103 3.815 -3.329 -1.129 1.00 0.00 C ATOM 1647 CE3 TRP A 103 2.918 -1.580 0.274 1.00 0.00 C ATOM 1648 CZ2 TRP A 103 4.816 -2.491 -1.611 1.00 0.00 C ATOM 1649 CZ3 TRP A 103 3.912 -0.749 -0.205 1.00 0.00 C ATOM 1650 CH2 TRP A 103 4.850 -1.206 -1.141 1.00 0.00 C ATOM 0 H TRP A 103 1.049 -6.430 1.523 1.00 0.00 H new ATOM 0 HA TRP A 103 2.147 -4.130 2.706 1.00 0.00 H new ATOM 0 HB2 TRP A 103 0.043 -4.661 0.593 1.00 0.00 H new ATOM 0 HB3 TRP A 103 0.413 -3.023 1.093 1.00 0.00 H new ATOM 0 HD1 TRP A 103 2.012 -6.028 -0.722 1.00 0.00 H new ATOM 0 HE1 TRP A 103 4.070 -5.224 -2.068 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.199 -1.218 0.993 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 5.541 -2.842 -2.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 3.967 0.270 0.148 1.00 0.00 H new ATOM 0 HH2 TRP A 103 5.614 -0.531 -1.498 1.00 0.00 H new ATOM 1661 N MET A 104 -1.121 -4.424 3.176 1.00 0.00 N ATOM 1662 CA MET A 104 -2.212 -4.036 4.062 1.00 0.00 C ATOM 1663 C MET A 104 -1.768 -4.074 5.521 1.00 0.00 C ATOM 1664 O MET A 104 -1.693 -3.040 6.184 1.00 0.00 O ATOM 1665 CB MET A 104 -3.415 -4.959 3.859 1.00 0.00 C ATOM 1666 CG MET A 104 -4.550 -4.701 4.836 1.00 0.00 C ATOM 1667 SD MET A 104 -4.904 -2.945 5.043 1.00 0.00 S ATOM 1668 CE MET A 104 -6.273 -2.740 3.905 1.00 0.00 C ATOM 0 H MET A 104 -1.408 -4.985 2.374 1.00 0.00 H new ATOM 0 HA MET A 104 -2.501 -3.014 3.815 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.788 -4.838 2.842 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.089 -5.994 3.958 1.00 0.00 H new ATOM 0 HG2 MET A 104 -5.448 -5.210 4.486 1.00 0.00 H new ATOM 0 HG3 MET A 104 -4.296 -5.133 5.804 1.00 0.00 H new ATOM 0 HE1 MET A 104 -6.652 -1.720 3.971 1.00 0.00 H new ATOM 0 HE2 MET A 104 -5.933 -2.935 2.888 1.00 0.00 H new ATOM 0 HE3 MET A 104 -7.068 -3.440 4.163 1.00 0.00 H new ATOM 1678 N ALA A 105 -1.474 -5.273 6.015 1.00 0.00 N ATOM 1679 CA ALA A 105 -1.035 -5.444 7.394 1.00 0.00 C ATOM 1680 C ALA A 105 -0.032 -4.367 7.789 1.00 0.00 C ATOM 1681 O ALA A 105 -0.026 -3.897 8.926 1.00 0.00 O ATOM 1682 CB ALA A 105 -0.431 -6.827 7.588 1.00 0.00 C ATOM 0 H ALA A 105 -1.532 -6.140 5.480 1.00 0.00 H new ATOM 0 HA ALA A 105 -1.907 -5.346 8.041 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.107 -6.941 8.623 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -1.178 -7.586 7.356 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.426 -6.946 6.925 1.00 0.00 H new ATOM 1688 N GLY A 106 0.818 -3.979 6.842 1.00 0.00 N ATOM 1689 CA GLY A 106 1.815 -2.960 7.112 1.00 0.00 C ATOM 1690 C GLY A 106 1.199 -1.597 7.357 1.00 0.00 C ATOM 1691 O GLY A 106 1.441 -0.976 8.393 1.00 0.00 O ATOM 0 H GLY A 106 0.833 -4.353 5.893 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.402 -3.252 7.983 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.504 -2.898 6.270 1.00 0.00 H new ATOM 1695 N CYS A 107 0.402 -1.129 6.403 1.00 0.00 N ATOM 1696 CA CYS A 107 -0.249 0.171 6.519 1.00 0.00 C ATOM 1697 C CYS A 107 -1.088 0.248 7.790 1.00 0.00 C ATOM 1698 O CYS A 107 -1.109 1.273 8.471 1.00 0.00 O ATOM 1699 CB CYS A 107 -1.129 0.435 5.296 1.00 0.00 C ATOM 1700 SG CYS A 107 -0.218 0.525 3.737 1.00 0.00 S ATOM 0 H CYS A 107 0.191 -1.631 5.540 1.00 0.00 H new ATOM 0 HA CYS A 107 0.527 0.935 6.571 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -1.877 -0.355 5.222 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -1.667 1.371 5.444 1.00 0.00 H new ATOM 0 HG CYS A 107 -1.048 0.749 2.762 1.00 0.00 H new ATOM 1706 N ARG A 108 -1.780 -0.843 8.103 1.00 0.00 N ATOM 1707 CA ARG A 108 -2.623 -0.898 9.291 1.00 0.00 C ATOM 1708 C ARG A 108 -1.809 -0.613 10.549 1.00 0.00 C ATOM 1709 O ARG A 108 -2.315 -0.032 11.511 1.00 0.00 O ATOM 1710 CB ARG A 108 -3.292 -2.269 9.404 1.00 0.00 C ATOM 1711 CG ARG A 108 -4.543 -2.408 8.552 1.00 0.00 C ATOM 1712 CD ARG A 108 -5.133 -3.807 8.652 1.00 0.00 C ATOM 1713 NE ARG A 108 -5.318 -4.225 10.039 1.00 0.00 N ATOM 1714 CZ ARG A 108 -5.674 -5.454 10.395 1.00 0.00 C ATOM 1715 NH1 ARG A 108 -5.881 -6.381 9.470 1.00 0.00 N ATOM 1716 NH2 ARG A 108 -5.822 -5.758 11.678 1.00 0.00 N ATOM 0 H ARG A 108 -1.773 -1.700 7.550 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.392 -0.132 9.196 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -2.577 -3.038 9.112 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -3.550 -2.453 10.447 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.285 -1.676 8.871 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.303 -2.187 7.512 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -6.092 -3.834 8.134 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -4.477 -4.514 8.145 1.00 0.00 H new ATOM 0 HE ARG A 108 -5.165 -3.535 10.775 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -5.767 -6.151 8.483 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -6.154 -7.324 9.746 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -5.662 -5.047 12.392 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -6.095 -6.702 11.950 1.00 0.00 H new ATOM 1730 N LEU A 109 -0.546 -1.025 10.537 1.00 0.00 N ATOM 1731 CA LEU A 109 0.339 -0.814 11.677 1.00 0.00 C ATOM 1732 C LEU A 109 0.755 0.650 11.780 1.00 0.00 C ATOM 1733 O LEU A 109 0.553 1.292 12.810 1.00 0.00 O ATOM 1734 CB LEU A 109 1.579 -1.701 11.556 1.00 0.00 C ATOM 1735 CG LEU A 109 1.351 -3.202 11.741 1.00 0.00 C ATOM 1736 CD1 LEU A 109 2.432 -3.998 11.026 1.00 0.00 C ATOM 1737 CD2 LEU A 109 1.315 -3.558 13.220 1.00 0.00 C ATOM 0 H LEU A 109 -0.112 -1.507 9.750 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.205 -1.082 12.582 1.00 0.00 H new ATOM 0 HB2 LEU A 109 2.022 -1.539 10.573 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.310 -1.371 12.294 1.00 0.00 H new ATOM 0 HG LEU A 109 0.387 -3.460 11.302 1.00 0.00 H new ATOM 0 HD11 LEU A 109 2.253 -5.064 11.169 1.00 0.00 H new ATOM 0 HD12 LEU A 109 2.411 -3.766 9.961 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.408 -3.736 11.435 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.152 -4.630 13.332 1.00 0.00 H new ATOM 0 HD22 LEU A 109 2.263 -3.285 13.683 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.504 -3.015 13.705 1.00 0.00 H new ATOM 1749 N ALA A 110 1.336 1.172 10.705 1.00 0.00 N ATOM 1750 CA ALA A 110 1.777 2.561 10.672 1.00 0.00 C ATOM 1751 C ALA A 110 0.618 3.511 10.954 1.00 0.00 C ATOM 1752 O ALA A 110 0.791 4.541 11.604 1.00 0.00 O ATOM 1753 CB ALA A 110 2.411 2.882 9.327 1.00 0.00 C ATOM 0 H ALA A 110 1.512 0.653 9.845 1.00 0.00 H new ATOM 0 HA ALA A 110 2.524 2.698 11.454 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.736 3.923 9.317 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.271 2.232 9.166 1.00 0.00 H new ATOM 0 HB3 ALA A 110 1.681 2.722 8.533 1.00 0.00 H new ATOM 1759 N SER A 111 -0.564 3.158 10.459 1.00 0.00 N ATOM 1760 CA SER A 111 -1.751 3.982 10.653 1.00 0.00 C ATOM 1761 C SER A 111 -1.831 4.489 12.090 1.00 0.00 C ATOM 1762 O SER A 111 -2.045 5.678 12.330 1.00 0.00 O ATOM 1763 CB SER A 111 -3.012 3.186 10.311 1.00 0.00 C ATOM 1764 OG SER A 111 -4.181 3.915 10.644 1.00 0.00 O ATOM 0 H SER A 111 -0.725 2.307 9.921 1.00 0.00 H new ATOM 0 HA SER A 111 -1.680 4.841 9.986 1.00 0.00 H new ATOM 0 HB2 SER A 111 -3.019 2.948 9.247 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.005 2.238 10.849 1.00 0.00 H new ATOM 0 HG SER A 111 -4.242 4.713 10.078 1.00 0.00 H new ATOM 1770 N LYS A 112 -1.657 3.579 13.042 1.00 0.00 N ATOM 1771 CA LYS A 112 -1.708 3.932 14.456 1.00 0.00 C ATOM 1772 C LYS A 112 -0.327 4.331 14.967 1.00 0.00 C ATOM 1773 O LYS A 112 -0.187 4.820 16.087 1.00 0.00 O ATOM 1774 CB LYS A 112 -2.247 2.758 15.277 1.00 0.00 C ATOM 1775 CG LYS A 112 -3.636 2.309 14.856 1.00 0.00 C ATOM 1776 CD LYS A 112 -4.698 3.310 15.278 1.00 0.00 C ATOM 1777 CE LYS A 112 -6.069 2.659 15.379 1.00 0.00 C ATOM 1778 NZ LYS A 112 -7.129 3.648 15.719 1.00 0.00 N ATOM 0 H LYS A 112 -1.479 2.591 12.860 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.378 4.784 14.568 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.560 1.917 15.188 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.269 3.041 16.329 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.665 2.181 13.774 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.855 1.337 15.298 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.428 3.744 16.241 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.735 4.128 14.559 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -6.313 2.177 14.432 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.045 1.877 16.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -8.048 3.165 15.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -6.910 4.090 16.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -7.170 4.380 14.982 1.00 0.00 H new ATOM 1792 N GLY A 113 0.690 4.121 14.137 1.00 0.00 N ATOM 1793 CA GLY A 113 2.046 4.466 14.523 1.00 0.00 C ATOM 1794 C GLY A 113 2.924 3.244 14.708 1.00 0.00 C ATOM 1795 O GLY A 113 4.135 3.365 14.892 1.00 0.00 O ATOM 0 H GLY A 113 0.599 3.718 13.204 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.484 5.113 13.762 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.022 5.037 15.451 1.00 0.00 H new ATOM 1799 N ARG A 114 2.313 2.065 14.662 1.00 0.00 N ATOM 1800 CA ARG A 114 3.047 0.817 14.830 1.00 0.00 C ATOM 1801 C ARG A 114 3.838 0.478 13.570 1.00 0.00 C ATOM 1802 O ARG A 114 3.437 0.826 12.459 1.00 0.00 O ATOM 1803 CB ARG A 114 2.085 -0.325 15.163 1.00 0.00 C ATOM 1804 CG ARG A 114 1.432 -0.191 16.529 1.00 0.00 C ATOM 1805 CD ARG A 114 0.412 -1.294 16.769 1.00 0.00 C ATOM 1806 NE ARG A 114 0.277 -1.615 18.187 1.00 0.00 N ATOM 1807 CZ ARG A 114 -0.529 -2.563 18.653 1.00 0.00 C ATOM 1808 NH1 ARG A 114 -1.267 -3.280 17.816 1.00 0.00 N ATOM 1809 NH2 ARG A 114 -0.598 -2.796 19.957 1.00 0.00 N ATOM 0 H ARG A 114 1.311 1.948 14.510 1.00 0.00 H new ATOM 0 HA ARG A 114 3.747 0.945 15.655 1.00 0.00 H new ATOM 0 HB2 ARG A 114 1.307 -0.368 14.400 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.627 -1.270 15.120 1.00 0.00 H new ATOM 0 HG2 ARG A 114 2.197 -0.226 17.304 1.00 0.00 H new ATOM 0 HG3 ARG A 114 0.944 0.781 16.607 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -0.556 -0.985 16.373 1.00 0.00 H new ATOM 0 HD3 ARG A 114 0.710 -2.188 16.222 1.00 0.00 H new ATOM 0 HE ARG A 114 0.832 -1.082 18.857 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -1.216 -3.104 16.813 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -1.885 -4.007 18.176 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.032 -2.247 20.604 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -1.217 -3.524 20.313 1.00 0.00 H new ATOM 1823 N THR A 115 4.966 -0.203 13.750 1.00 0.00 N ATOM 1824 CA THR A 115 5.814 -0.588 12.629 1.00 0.00 C ATOM 1825 C THR A 115 5.613 -2.054 12.265 1.00 0.00 C ATOM 1826 O THR A 115 5.043 -2.823 13.039 1.00 0.00 O ATOM 1827 CB THR A 115 7.303 -0.347 12.943 1.00 0.00 C ATOM 1828 OG1 THR A 115 7.710 -1.167 14.044 1.00 0.00 O ATOM 1829 CG2 THR A 115 7.557 1.116 13.272 1.00 0.00 C ATOM 0 H THR A 115 5.313 -0.499 14.662 1.00 0.00 H new ATOM 0 HA THR A 115 5.523 0.036 11.784 1.00 0.00 H new ATOM 0 HB THR A 115 7.885 -0.610 12.060 1.00 0.00 H new ATOM 0 HG1 THR A 115 8.658 -1.009 14.236 1.00 0.00 H new ATOM 0 HG21 THR A 115 8.615 1.262 13.490 1.00 0.00 H new ATOM 0 HG22 THR A 115 7.274 1.735 12.421 1.00 0.00 H new ATOM 0 HG23 THR A 115 6.965 1.402 14.141 1.00 0.00 H new ATOM 1837 N MET A 116 6.087 -2.436 11.084 1.00 0.00 N ATOM 1838 CA MET A 116 5.960 -3.813 10.619 1.00 0.00 C ATOM 1839 C MET A 116 7.008 -4.707 11.276 1.00 0.00 C ATOM 1840 O MET A 116 6.856 -5.927 11.319 1.00 0.00 O ATOM 1841 CB MET A 116 6.102 -3.875 9.097 1.00 0.00 C ATOM 1842 CG MET A 116 6.666 -5.193 8.592 1.00 0.00 C ATOM 1843 SD MET A 116 6.632 -5.320 6.794 1.00 0.00 S ATOM 1844 CE MET A 116 7.812 -4.050 6.343 1.00 0.00 C ATOM 0 H MET A 116 6.562 -1.812 10.432 1.00 0.00 H new ATOM 0 HA MET A 116 4.971 -4.175 10.899 1.00 0.00 H new ATOM 0 HB2 MET A 116 5.125 -3.709 8.642 1.00 0.00 H new ATOM 0 HB3 MET A 116 6.749 -3.062 8.767 1.00 0.00 H new ATOM 0 HG2 MET A 116 7.693 -5.301 8.941 1.00 0.00 H new ATOM 0 HG3 MET A 116 6.095 -6.016 9.021 1.00 0.00 H new ATOM 0 HE1 MET A 116 7.760 -3.870 5.269 1.00 0.00 H new ATOM 0 HE2 MET A 116 7.578 -3.129 6.877 1.00 0.00 H new ATOM 0 HE3 MET A 116 8.818 -4.377 6.607 1.00 0.00 H new ATOM 1854 N ALA A 117 8.069 -4.091 11.786 1.00 0.00 N ATOM 1855 CA ALA A 117 9.140 -4.831 12.441 1.00 0.00 C ATOM 1856 C ALA A 117 8.601 -5.669 13.595 1.00 0.00 C ATOM 1857 O ALA A 117 8.990 -6.824 13.771 1.00 0.00 O ATOM 1858 CB ALA A 117 10.215 -3.875 12.938 1.00 0.00 C ATOM 0 H ALA A 117 8.210 -3.081 11.758 1.00 0.00 H new ATOM 0 HA ALA A 117 9.581 -5.508 11.709 1.00 0.00 H new ATOM 0 HB1 ALA A 117 11.009 -4.441 13.425 1.00 0.00 H new ATOM 0 HB2 ALA A 117 10.629 -3.322 12.094 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.778 -3.175 13.651 1.00 0.00 H new ATOM 1864 N ASP A 118 7.705 -5.081 14.380 1.00 0.00 N ATOM 1865 CA ASP A 118 7.112 -5.774 15.517 1.00 0.00 C ATOM 1866 C ASP A 118 6.490 -7.098 15.083 1.00 0.00 C ATOM 1867 O ASP A 118 5.900 -7.194 14.007 1.00 0.00 O ATOM 1868 CB ASP A 118 6.054 -4.893 16.184 1.00 0.00 C ATOM 1869 CG ASP A 118 5.881 -5.211 17.656 1.00 0.00 C ATOM 1870 OD1 ASP A 118 6.856 -5.676 18.283 1.00 0.00 O ATOM 1871 OD2 ASP A 118 4.769 -4.993 18.183 1.00 0.00 O ATOM 0 H ASP A 118 7.373 -4.125 14.249 1.00 0.00 H new ATOM 0 HA ASP A 118 7.904 -5.984 16.236 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.334 -3.846 16.072 1.00 0.00 H new ATOM 0 HB3 ASP A 118 5.101 -5.024 15.672 1.00 0.00 H new ATOM 1876 N SER A 119 6.626 -8.115 15.928 1.00 0.00 N ATOM 1877 CA SER A 119 6.081 -9.434 15.629 1.00 0.00 C ATOM 1878 C SER A 119 4.591 -9.348 15.313 1.00 0.00 C ATOM 1879 O SER A 119 4.085 -10.066 14.450 1.00 0.00 O ATOM 1880 CB SER A 119 6.310 -10.383 16.807 1.00 0.00 C ATOM 1881 OG SER A 119 7.570 -11.023 16.709 1.00 0.00 O ATOM 0 H SER A 119 7.109 -8.051 16.824 1.00 0.00 H new ATOM 0 HA SER A 119 6.599 -9.823 14.752 1.00 0.00 H new ATOM 0 HB2 SER A 119 6.253 -9.827 17.743 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.519 -11.133 16.833 1.00 0.00 H new ATOM 0 HG SER A 119 7.693 -11.623 17.474 1.00 0.00 H new ATOM 1887 N SER A 120 3.893 -8.464 16.019 1.00 0.00 N ATOM 1888 CA SER A 120 2.460 -8.285 15.817 1.00 0.00 C ATOM 1889 C SER A 120 2.127 -8.200 14.331 1.00 0.00 C ATOM 1890 O SER A 120 1.037 -8.583 13.905 1.00 0.00 O ATOM 1891 CB SER A 120 1.976 -7.023 16.533 1.00 0.00 C ATOM 1892 OG SER A 120 0.563 -7.005 16.638 1.00 0.00 O ATOM 0 H SER A 120 4.297 -7.861 16.736 1.00 0.00 H new ATOM 0 HA SER A 120 1.948 -9.151 16.237 1.00 0.00 H new ATOM 0 HB2 SER A 120 2.418 -6.974 17.528 1.00 0.00 H new ATOM 0 HB3 SER A 120 2.314 -6.141 15.990 1.00 0.00 H new ATOM 0 HG SER A 120 0.280 -6.189 17.101 1.00 0.00 H new ATOM 1898 N TYR A 121 3.073 -7.695 13.547 1.00 0.00 N ATOM 1899 CA TYR A 121 2.880 -7.557 12.109 1.00 0.00 C ATOM 1900 C TYR A 121 2.281 -8.828 11.514 1.00 0.00 C ATOM 1901 O TYR A 121 1.252 -8.787 10.838 1.00 0.00 O ATOM 1902 CB TYR A 121 4.210 -7.238 11.423 1.00 0.00 C ATOM 1903 CG TYR A 121 4.257 -7.653 9.970 1.00 0.00 C ATOM 1904 CD1 TYR A 121 3.598 -6.916 8.994 1.00 0.00 C ATOM 1905 CD2 TYR A 121 4.962 -8.783 9.573 1.00 0.00 C ATOM 1906 CE1 TYR A 121 3.637 -7.292 7.666 1.00 0.00 C ATOM 1907 CE2 TYR A 121 5.009 -9.165 8.246 1.00 0.00 C ATOM 1908 CZ TYR A 121 4.344 -8.417 7.297 1.00 0.00 C ATOM 1909 OH TYR A 121 4.388 -8.795 5.974 1.00 0.00 O ATOM 0 H TYR A 121 3.981 -7.375 13.883 1.00 0.00 H new ATOM 0 HA TYR A 121 2.184 -6.735 11.939 1.00 0.00 H new ATOM 0 HB2 TYR A 121 4.397 -6.166 11.492 1.00 0.00 H new ATOM 0 HB3 TYR A 121 5.016 -7.738 11.961 1.00 0.00 H new ATOM 0 HD1 TYR A 121 3.045 -6.033 9.279 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.482 -9.372 10.314 1.00 0.00 H new ATOM 0 HE1 TYR A 121 3.117 -6.709 6.921 1.00 0.00 H new ATOM 0 HE2 TYR A 121 5.563 -10.044 7.953 1.00 0.00 H new ATOM 0 HH TYR A 121 4.928 -9.607 5.884 1.00 0.00 H new ATOM 1919 N THR A 122 2.932 -9.958 11.772 1.00 0.00 N ATOM 1920 CA THR A 122 2.466 -11.242 11.263 1.00 0.00 C ATOM 1921 C THR A 122 1.042 -11.531 11.723 1.00 0.00 C ATOM 1922 O THR A 122 0.248 -12.114 10.985 1.00 0.00 O ATOM 1923 CB THR A 122 3.384 -12.393 11.718 1.00 0.00 C ATOM 1924 OG1 THR A 122 3.178 -13.540 10.886 1.00 0.00 O ATOM 1925 CG2 THR A 122 3.115 -12.757 13.170 1.00 0.00 C ATOM 0 H THR A 122 3.784 -10.010 12.331 1.00 0.00 H new ATOM 0 HA THR A 122 2.488 -11.178 10.175 1.00 0.00 H new ATOM 0 HB THR A 122 4.419 -12.062 11.630 1.00 0.00 H new ATOM 0 HG1 THR A 122 3.766 -14.267 11.180 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.775 -13.572 13.469 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.300 -11.889 13.803 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.077 -13.071 13.280 1.00 0.00 H new ATOM 1933 N SER A 123 0.724 -11.119 12.946 1.00 0.00 N ATOM 1934 CA SER A 123 -0.605 -11.336 13.506 1.00 0.00 C ATOM 1935 C SER A 123 -1.686 -10.873 12.534 1.00 0.00 C ATOM 1936 O SER A 123 -2.770 -11.452 12.474 1.00 0.00 O ATOM 1937 CB SER A 123 -0.748 -10.596 14.837 1.00 0.00 C ATOM 1938 OG SER A 123 -1.748 -11.191 15.646 1.00 0.00 O ATOM 0 H SER A 123 1.369 -10.633 13.569 1.00 0.00 H new ATOM 0 HA SER A 123 -0.730 -12.405 13.678 1.00 0.00 H new ATOM 0 HB2 SER A 123 0.205 -10.605 15.366 1.00 0.00 H new ATOM 0 HB3 SER A 123 -1.000 -9.552 14.651 1.00 0.00 H new ATOM 0 HG SER A 123 -1.819 -10.701 16.492 1.00 0.00 H new ATOM 1944 N GLU A 124 -1.381 -9.825 11.775 1.00 0.00 N ATOM 1945 CA GLU A 124 -2.326 -9.283 10.806 1.00 0.00 C ATOM 1946 C GLU A 124 -2.365 -10.141 9.545 1.00 0.00 C ATOM 1947 O GLU A 124 -3.431 -10.575 9.108 1.00 0.00 O ATOM 1948 CB GLU A 124 -1.953 -7.843 10.446 1.00 0.00 C ATOM 1949 CG GLU A 124 -2.556 -6.807 11.379 1.00 0.00 C ATOM 1950 CD GLU A 124 -2.372 -7.160 12.842 1.00 0.00 C ATOM 1951 OE1 GLU A 124 -2.970 -8.160 13.291 1.00 0.00 O ATOM 1952 OE2 GLU A 124 -1.628 -6.437 13.537 1.00 0.00 O ATOM 0 H GLU A 124 -0.487 -9.335 11.813 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.317 -9.291 11.260 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.868 -7.744 10.459 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -2.280 -7.636 9.427 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.098 -5.837 11.183 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.620 -6.706 11.165 1.00 0.00 H new ATOM 1959 N VAL A 125 -1.194 -10.380 8.963 1.00 0.00 N ATOM 1960 CA VAL A 125 -1.092 -11.186 7.752 1.00 0.00 C ATOM 1961 C VAL A 125 -1.933 -12.453 7.863 1.00 0.00 C ATOM 1962 O VAL A 125 -2.584 -12.863 6.902 1.00 0.00 O ATOM 1963 CB VAL A 125 0.368 -11.577 7.459 1.00 0.00 C ATOM 1964 CG1 VAL A 125 0.468 -12.315 6.133 1.00 0.00 C ATOM 1965 CG2 VAL A 125 1.260 -10.344 7.461 1.00 0.00 C ATOM 0 H VAL A 125 -0.302 -10.027 9.311 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.468 -10.574 6.932 1.00 0.00 H new ATOM 0 HB VAL A 125 0.711 -12.247 8.247 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.507 -12.583 5.943 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -0.139 -13.220 6.174 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.107 -11.672 5.330 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.288 -10.639 7.252 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.919 -9.647 6.695 1.00 0.00 H new ATOM 0 HG23 VAL A 125 1.212 -9.862 8.437 1.00 0.00 H new ATOM 1975 N GLN A 126 -1.916 -13.067 9.041 1.00 0.00 N ATOM 1976 CA GLN A 126 -2.677 -14.288 9.277 1.00 0.00 C ATOM 1977 C GLN A 126 -4.172 -13.994 9.336 1.00 0.00 C ATOM 1978 O GLN A 126 -4.944 -14.487 8.514 1.00 0.00 O ATOM 1979 CB GLN A 126 -2.225 -14.953 10.578 1.00 0.00 C ATOM 1980 CG GLN A 126 -0.714 -15.045 10.721 1.00 0.00 C ATOM 1981 CD GLN A 126 -0.140 -16.284 10.062 1.00 0.00 C ATOM 1982 OE1 GLN A 126 -0.853 -17.259 9.819 1.00 0.00 O ATOM 1983 NE2 GLN A 126 1.154 -16.253 9.768 1.00 0.00 N ATOM 0 H GLN A 126 -1.384 -12.739 9.847 1.00 0.00 H new ATOM 0 HA GLN A 126 -2.491 -14.968 8.446 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.628 -14.393 11.422 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -2.648 -15.956 10.630 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -0.257 -14.159 10.281 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -0.452 -15.047 11.779 1.00 0.00 H new ATOM 0 HE21 GLN A 126 1.707 -15.424 9.987 1.00 0.00 H new ATOM 0 HE22 GLN A 126 1.595 -17.058 9.323 1.00 0.00 H new ATOM 1992 N ALA A 127 -4.574 -13.188 10.313 1.00 0.00 N ATOM 1993 CA ALA A 127 -5.977 -12.827 10.477 1.00 0.00 C ATOM 1994 C ALA A 127 -6.615 -12.480 9.136 1.00 0.00 C ATOM 1995 O ALA A 127 -7.786 -12.780 8.900 1.00 0.00 O ATOM 1996 CB ALA A 127 -6.112 -11.662 11.446 1.00 0.00 C ATOM 0 H ALA A 127 -3.948 -12.773 11.003 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.503 -13.689 10.887 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -7.165 -11.403 11.559 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.702 -11.946 12.415 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.566 -10.802 11.059 1.00 0.00 H new ATOM 2002 N ILE A 128 -5.839 -11.846 8.264 1.00 0.00 N ATOM 2003 CA ILE A 128 -6.330 -11.458 6.947 1.00 0.00 C ATOM 2004 C ILE A 128 -6.543 -12.679 6.058 1.00 0.00 C ATOM 2005 O ILE A 128 -7.656 -12.942 5.601 1.00 0.00 O ATOM 2006 CB ILE A 128 -5.358 -10.491 6.246 1.00 0.00 C ATOM 2007 CG1 ILE A 128 -5.183 -9.218 7.078 1.00 0.00 C ATOM 2008 CG2 ILE A 128 -5.861 -10.153 4.851 1.00 0.00 C ATOM 2009 CD1 ILE A 128 -3.971 -8.402 6.686 1.00 0.00 C ATOM 0 H ILE A 128 -4.868 -11.590 8.445 1.00 0.00 H new ATOM 0 HA ILE A 128 -7.283 -10.953 7.102 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.388 -10.979 6.153 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -6.075 -8.601 6.975 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -5.103 -9.490 8.131 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -5.163 -9.469 4.369 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -5.940 -11.066 4.261 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.841 -9.681 4.922 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -3.910 -7.515 7.317 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.071 -9.002 6.816 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.058 -8.100 5.642 1.00 0.00 H new ATOM 2021 N LEU A 129 -5.469 -13.423 5.818 1.00 0.00 N ATOM 2022 CA LEU A 129 -5.538 -14.619 4.986 1.00 0.00 C ATOM 2023 C LEU A 129 -6.775 -15.446 5.321 1.00 0.00 C ATOM 2024 O LEU A 129 -7.530 -15.839 4.432 1.00 0.00 O ATOM 2025 CB LEU A 129 -4.278 -15.467 5.172 1.00 0.00 C ATOM 2026 CG LEU A 129 -2.980 -14.867 4.631 1.00 0.00 C ATOM 2027 CD1 LEU A 129 -1.775 -15.526 5.285 1.00 0.00 C ATOM 2028 CD2 LEU A 129 -2.914 -15.014 3.118 1.00 0.00 C ATOM 0 H LEU A 129 -4.540 -13.219 6.188 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.606 -14.303 3.945 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -4.149 -15.661 6.237 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.438 -16.431 4.689 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.964 -13.804 4.874 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.860 -15.087 4.888 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.815 -15.369 6.363 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.786 -16.595 5.073 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.983 -14.581 2.751 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.952 -16.071 2.853 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -3.759 -14.495 2.665 1.00 0.00 H new ATOM 2040 N ALA A 130 -6.977 -15.704 6.609 1.00 0.00 N ATOM 2041 CA ALA A 130 -8.124 -16.480 7.062 1.00 0.00 C ATOM 2042 C ALA A 130 -9.432 -15.762 6.745 1.00 0.00 C ATOM 2043 O ALA A 130 -10.259 -16.265 5.984 1.00 0.00 O ATOM 2044 CB ALA A 130 -8.020 -16.755 8.555 1.00 0.00 C ATOM 0 H ALA A 130 -6.361 -15.387 7.357 1.00 0.00 H new ATOM 0 HA ALA A 130 -8.122 -17.430 6.528 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -8.884 -17.336 8.879 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -7.108 -17.316 8.759 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -7.993 -15.810 9.098 1.00 0.00 H new ATOM 2050 N PHE A 131 -9.613 -14.585 7.333 1.00 0.00 N ATOM 2051 CA PHE A 131 -10.821 -13.799 7.115 1.00 0.00 C ATOM 2052 C PHE A 131 -11.281 -13.899 5.663 1.00 0.00 C ATOM 2053 O PHE A 131 -12.443 -14.197 5.387 1.00 0.00 O ATOM 2054 CB PHE A 131 -10.576 -12.334 7.484 1.00 0.00 C ATOM 2055 CG PHE A 131 -11.708 -11.422 7.104 1.00 0.00 C ATOM 2056 CD1 PHE A 131 -12.947 -11.545 7.711 1.00 0.00 C ATOM 2057 CD2 PHE A 131 -11.532 -10.444 6.139 1.00 0.00 C ATOM 2058 CE1 PHE A 131 -13.990 -10.707 7.364 1.00 0.00 C ATOM 2059 CE2 PHE A 131 -12.572 -9.603 5.788 1.00 0.00 C ATOM 2060 CZ PHE A 131 -13.803 -9.736 6.400 1.00 0.00 C ATOM 0 H PHE A 131 -8.938 -14.154 7.965 1.00 0.00 H new ATOM 0 HA PHE A 131 -11.606 -14.201 7.755 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -10.407 -12.262 8.558 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -9.664 -11.992 6.994 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -13.100 -12.304 8.464 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -10.572 -10.337 5.656 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -14.951 -10.812 7.846 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -12.422 -8.843 5.036 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.617 -9.082 6.125 1.00 0.00 H new ATOM 2070 N LEU A 132 -10.360 -13.648 4.739 1.00 0.00 N ATOM 2071 CA LEU A 132 -10.669 -13.710 3.315 1.00 0.00 C ATOM 2072 C LEU A 132 -11.334 -15.035 2.958 1.00 0.00 C ATOM 2073 O LEU A 132 -12.397 -15.061 2.338 1.00 0.00 O ATOM 2074 CB LEU A 132 -9.395 -13.527 2.488 1.00 0.00 C ATOM 2075 CG LEU A 132 -8.668 -12.193 2.660 1.00 0.00 C ATOM 2076 CD1 LEU A 132 -7.226 -12.306 2.192 1.00 0.00 C ATOM 2077 CD2 LEU A 132 -9.392 -11.090 1.901 1.00 0.00 C ATOM 0 H LEU A 132 -9.394 -13.400 4.950 1.00 0.00 H new ATOM 0 HA LEU A 132 -11.364 -12.903 3.085 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -8.703 -14.330 2.741 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -9.649 -13.646 1.435 1.00 0.00 H new ATOM 0 HG LEU A 132 -8.665 -11.937 3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -6.725 -11.347 2.322 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -6.712 -13.067 2.779 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -7.206 -12.586 1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -8.861 -10.148 2.034 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -9.426 -11.340 0.841 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -10.408 -10.991 2.284 1.00 0.00 H new ATOM 2089 N SER A 133 -10.703 -16.135 3.358 1.00 0.00 N ATOM 2090 CA SER A 133 -11.233 -17.464 3.079 1.00 0.00 C ATOM 2091 C SER A 133 -12.670 -17.590 3.574 1.00 0.00 C ATOM 2092 O SER A 133 -13.539 -18.104 2.868 1.00 0.00 O ATOM 2093 CB SER A 133 -10.359 -18.533 3.739 1.00 0.00 C ATOM 2094 OG SER A 133 -10.390 -19.743 3.002 1.00 0.00 O ATOM 0 H SER A 133 -9.824 -16.131 3.876 1.00 0.00 H new ATOM 0 HA SER A 133 -11.224 -17.613 1.999 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.332 -18.174 3.812 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.706 -18.714 4.756 1.00 0.00 H new ATOM 0 HG SER A 133 -9.823 -20.409 3.443 1.00 0.00 H new ATOM 2100 N LEU A 134 -12.914 -17.118 4.791 1.00 0.00 N ATOM 2101 CA LEU A 134 -14.246 -17.178 5.382 1.00 0.00 C ATOM 2102 C LEU A 134 -15.294 -16.626 4.420 1.00 0.00 C ATOM 2103 O LEU A 134 -16.351 -17.227 4.229 1.00 0.00 O ATOM 2104 CB LEU A 134 -14.279 -16.392 6.695 1.00 0.00 C ATOM 2105 CG LEU A 134 -13.210 -16.761 7.724 1.00 0.00 C ATOM 2106 CD1 LEU A 134 -13.280 -15.829 8.924 1.00 0.00 C ATOM 2107 CD2 LEU A 134 -13.369 -18.210 8.162 1.00 0.00 C ATOM 0 H LEU A 134 -12.207 -16.689 5.388 1.00 0.00 H new ATOM 0 HA LEU A 134 -14.480 -18.223 5.585 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -14.181 -15.331 6.463 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -15.259 -16.529 7.153 1.00 0.00 H new ATOM 0 HG LEU A 134 -12.231 -16.648 7.259 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -12.512 -16.107 9.646 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -13.116 -14.802 8.597 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -14.262 -15.909 9.390 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.600 -18.455 8.894 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -14.353 -18.349 8.609 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -13.268 -18.865 7.297 1.00 0.00 H new