USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1197 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: B 85 ASN : amide:sc= 0.612 K(o=0.95,f=-4.2!) USER MOD Set 1.2: B 89 LYS NZ :NH3+ 138:sc= 0.334 (180deg=-0.0224) USER MOD Set 2.1: B 35 LYS NZ :NH3+ -178:sc= 1.96 (180deg=0.936) USER MOD Set 2.2: B 39 GLN : amide:sc=-0.00134 K(o=2,f=-5.2) USER MOD Set 3.1: B 17 HIS : no HE2:sc= 0.165 K(o=-0.4,f=-2.9!) USER MOD Set 3.2: B 20 SER OG : rot 180:sc= -0.564 USER MOD Set 4.1: B 18 LYS NZ :NH3+ -178:sc= 0.545 (180deg=0.0611) USER MOD Set 4.2: B 19 TYR OH : rot 178:sc= 1.31 USER MOD Set 5.1: A 82 MET CE :methyl 176:sc= 0 (180deg=-0.0145) USER MOD Set 5.2: B 71 GLN : amide:sc= 1.17 K(o=1.2,f=-0.014) USER MOD Set 6.1: A 28 THR OG1 : rot 180:sc= 0.279 USER MOD Set 6.2: A 69 ASN : amide:sc= 0.651 K(o=0.93,f=-2.9!) USER MOD Set 7.1: A 17 HIS : no HE2:sc= 1.25 K(o=1.7,f=-10!) USER MOD Set 7.2: A 27 HIS : no HE2:sc= 0.407 K(o=1.7,f=-8.6!) USER MOD Single : A 3 SER OG : rot -40:sc= -0.462 USER MOD Single : A 7 GLN : amide:sc= 0.905 K(o=0.91,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 142:sc= -0.192 (180deg=-1.24) USER MOD Single : A 19 TYR OH : rot -170:sc= 1.19 USER MOD Single : A 20 SER OG : rot -102:sc= 1.07 USER MOD Single : A 30 SER OG : rot 73:sc= 1.11 USER MOD Single : A 31 LYS NZ :NH3+ 156:sc= 0.693 (180deg=0.302) USER MOD Single : A 32 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0495) USER MOD Single : A 35 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0634) USER MOD Single : A 39 GLN : amide:sc= -0.24 X(o=-0.24,f=-0.24) USER MOD Single : A 40 LYS NZ :NH3+ 145:sc= 0.0254 (180deg=-0.0371) USER MOD Single : A 55 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0142) USER MOD Single : A 57 MET CE :methyl 167:sc= 0 (180deg=-0.173) USER MOD Single : A 63 ASN : amide:sc= 0.675 K(o=0.67,f=-0.12) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 GLN : amide:sc= 0.933 K(o=0.93,f=-0.016) USER MOD Single : A 71 GLN : amide:sc= 1.22 K(o=1.2,f=0) USER MOD Single : A 73 TYR OH : rot 155:sc= 1.08 USER MOD Single : A 75 THR OG1 : rot 76:sc= 0.916 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : B 3 SER OG : rot 28:sc= 0.633 USER MOD Single : B 7 GLN : amide:sc= 0.118 K(o=0.12,f=-0.47) USER MOD Single : B 27 HIS : no HD1:sc= -0.083 X(o=-0.083,f=0) USER MOD Single : B 28 THR OG1 : rot 27:sc= 1.03 USER MOD Single : B 30 SER OG : rot -65:sc= 0.861 USER MOD Single : B 31 LYS NZ :NH3+ -174:sc=-0.00357 (180deg=-0.0823) USER MOD Single : B 32 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0577) USER MOD Single : B 40 LYS NZ :NH3+ -134:sc= 0.0555 (180deg=-0.0241) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl -165:sc= -0.0328 (180deg=-0.306) USER MOD Single : B 69 ASN : amide:sc= 0.435 K(o=0.43,f=-3.7!) USER MOD Single : B 73 TYR OH : rot 156:sc= 1.14 USER MOD Single : B 75 THR OG1 : rot 79:sc= 1.15 USER MOD Single : B 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -9.723 -3.822 -5.729 1.00 0.00 N ATOM 31 CA SER A 3 -8.472 -4.010 -6.436 1.00 0.00 C ATOM 32 C SER A 3 -7.448 -2.881 -6.222 1.00 0.00 C ATOM 33 O SER A 3 -6.277 -3.205 -5.998 1.00 0.00 O ATOM 34 CB SER A 3 -8.740 -4.357 -7.911 1.00 0.00 C ATOM 35 OG SER A 3 -9.769 -3.577 -8.494 1.00 0.00 O ATOM 0 HA SER A 3 -7.971 -4.869 -5.989 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.822 -4.219 -8.482 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.006 -5.411 -7.986 1.00 0.00 H new ATOM 0 HG SER A 3 -10.496 -3.460 -7.848 1.00 0.00 H new ATOM 41 N PRO A 4 -7.813 -1.583 -6.268 1.00 0.00 N ATOM 42 CA PRO A 4 -6.855 -0.508 -6.058 1.00 0.00 C ATOM 43 C PRO A 4 -6.186 -0.579 -4.690 1.00 0.00 C ATOM 44 O PRO A 4 -4.980 -0.378 -4.594 1.00 0.00 O ATOM 45 CB PRO A 4 -7.624 0.806 -6.234 1.00 0.00 C ATOM 46 CG PRO A 4 -8.813 0.399 -7.099 1.00 0.00 C ATOM 47 CD PRO A 4 -9.112 -1.006 -6.585 1.00 0.00 C ATOM 0 HA PRO A 4 -6.041 -0.589 -6.778 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -7.944 1.217 -5.277 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -7.014 1.568 -6.720 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -9.662 1.071 -6.968 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -8.565 0.401 -8.160 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -9.754 -0.975 -5.705 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -9.632 -1.598 -7.338 1.00 0.00 H new ATOM 55 N LEU A 5 -6.945 -0.855 -3.625 1.00 0.00 N ATOM 56 CA LEU A 5 -6.342 -0.963 -2.306 1.00 0.00 C ATOM 57 C LEU A 5 -5.700 -2.338 -2.160 1.00 0.00 C ATOM 58 O LEU A 5 -4.571 -2.449 -1.676 1.00 0.00 O ATOM 59 CB LEU A 5 -7.370 -0.690 -1.202 1.00 0.00 C ATOM 60 CG LEU A 5 -6.717 -0.732 0.192 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.606 0.309 0.362 1.00 0.00 C ATOM 62 CD2 LEU A 5 -7.757 -0.458 1.275 1.00 0.00 C ATOM 0 H LEU A 5 -7.954 -1.004 -3.653 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.567 -0.204 -2.200 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.829 0.286 -1.362 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.169 -1.430 -1.254 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.289 -1.730 0.287 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.184 0.231 1.364 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.824 0.130 -0.376 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -6.018 1.308 0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.280 -0.491 2.254 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.195 0.528 1.118 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.540 -1.215 1.227 1.00 0.00 H new ATOM 74 N ASP A 6 -6.418 -3.384 -2.590 1.00 0.00 N ATOM 75 CA ASP A 6 -5.975 -4.765 -2.463 1.00 0.00 C ATOM 76 C ASP A 6 -4.555 -4.923 -2.992 1.00 0.00 C ATOM 77 O ASP A 6 -3.729 -5.539 -2.327 1.00 0.00 O ATOM 78 CB ASP A 6 -6.904 -5.739 -3.197 1.00 0.00 C ATOM 79 CG ASP A 6 -8.341 -5.752 -2.687 1.00 0.00 C ATOM 80 OD1 ASP A 6 -8.563 -5.313 -1.538 1.00 0.00 O ATOM 81 OD2 ASP A 6 -9.199 -6.211 -3.471 1.00 0.00 O ATOM 0 H ASP A 6 -7.329 -3.287 -3.038 1.00 0.00 H new ATOM 0 HA ASP A 6 -6.000 -5.009 -1.401 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -6.911 -5.485 -4.257 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -6.493 -6.745 -3.113 1.00 0.00 H new ATOM 86 N GLN A 7 -4.250 -4.363 -4.169 1.00 0.00 N ATOM 87 CA GLN A 7 -2.899 -4.487 -4.707 1.00 0.00 C ATOM 88 C GLN A 7 -1.860 -3.808 -3.805 1.00 0.00 C ATOM 89 O GLN A 7 -0.739 -4.295 -3.689 1.00 0.00 O ATOM 90 CB GLN A 7 -2.842 -3.993 -6.157 1.00 0.00 C ATOM 91 CG GLN A 7 -3.018 -2.476 -6.279 1.00 0.00 C ATOM 92 CD GLN A 7 -3.369 -2.072 -7.703 1.00 0.00 C ATOM 93 OE1 GLN A 7 -2.562 -1.490 -8.419 1.00 0.00 O ATOM 94 NE2 GLN A 7 -4.588 -2.393 -8.127 1.00 0.00 N ATOM 0 H GLN A 7 -4.902 -3.835 -4.749 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.636 -5.545 -4.720 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -1.886 -4.279 -6.595 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.620 -4.491 -6.736 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -3.804 -2.143 -5.600 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -2.099 -1.976 -5.973 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -5.234 -2.877 -7.503 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -4.877 -2.155 -9.076 1.00 0.00 H new ATOM 103 N ALA A 8 -2.213 -2.697 -3.152 1.00 0.00 N ATOM 104 CA ALA A 8 -1.282 -1.964 -2.307 1.00 0.00 C ATOM 105 C ALA A 8 -1.009 -2.725 -1.010 1.00 0.00 C ATOM 106 O ALA A 8 0.151 -2.950 -0.663 1.00 0.00 O ATOM 107 CB ALA A 8 -1.809 -0.560 -2.033 1.00 0.00 C ATOM 0 H ALA A 8 -3.146 -2.288 -3.197 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.333 -1.869 -2.834 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -1.102 -0.023 -1.400 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -1.930 -0.026 -2.976 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -2.772 -0.625 -1.527 1.00 0.00 H new ATOM 113 N ILE A 9 -2.059 -3.155 -0.299 1.00 0.00 N ATOM 114 CA ILE A 9 -1.845 -4.022 0.863 1.00 0.00 C ATOM 115 C ILE A 9 -1.119 -5.301 0.415 1.00 0.00 C ATOM 116 O ILE A 9 -0.170 -5.742 1.061 1.00 0.00 O ATOM 117 CB ILE A 9 -3.120 -4.244 1.704 1.00 0.00 C ATOM 118 CG1 ILE A 9 -4.271 -4.903 0.934 1.00 0.00 C ATOM 119 CG2 ILE A 9 -3.560 -2.902 2.309 1.00 0.00 C ATOM 120 CD1 ILE A 9 -5.475 -5.212 1.832 1.00 0.00 C ATOM 0 H ILE A 9 -3.033 -2.926 -0.499 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.188 -3.517 1.572 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.866 -4.953 2.492 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.585 -4.246 0.123 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.916 -5.826 0.476 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.461 -3.049 2.905 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.765 -2.511 2.944 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.767 -2.192 1.508 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.262 -5.677 1.238 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.170 -5.892 2.628 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.850 -4.287 2.269 1.00 0.00 H new ATOM 132 N GLY A 10 -1.503 -5.837 -0.747 1.00 0.00 N ATOM 133 CA GLY A 10 -0.812 -6.913 -1.438 1.00 0.00 C ATOM 134 C GLY A 10 0.687 -6.645 -1.574 1.00 0.00 C ATOM 135 O GLY A 10 1.489 -7.534 -1.311 1.00 0.00 O ATOM 0 H GLY A 10 -2.334 -5.517 -1.245 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.964 -7.847 -0.897 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.247 -7.044 -2.429 1.00 0.00 H new ATOM 139 N LEU A 11 1.078 -5.435 -1.979 1.00 0.00 N ATOM 140 CA LEU A 11 2.474 -5.039 -2.126 1.00 0.00 C ATOM 141 C LEU A 11 3.202 -5.217 -0.792 1.00 0.00 C ATOM 142 O LEU A 11 4.139 -6.007 -0.687 1.00 0.00 O ATOM 143 CB LEU A 11 2.535 -3.586 -2.642 1.00 0.00 C ATOM 144 CG LEU A 11 3.857 -3.128 -3.277 1.00 0.00 C ATOM 145 CD1 LEU A 11 5.065 -3.327 -2.362 1.00 0.00 C ATOM 146 CD2 LEU A 11 4.065 -3.763 -4.653 1.00 0.00 C ATOM 0 H LEU A 11 0.420 -4.693 -2.217 1.00 0.00 H new ATOM 0 HA LEU A 11 2.979 -5.672 -2.856 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.742 -3.454 -3.378 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.311 -2.920 -1.808 1.00 0.00 H new ATOM 0 HG LEU A 11 3.773 -2.051 -3.421 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.966 -2.984 -2.870 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.925 -2.755 -1.445 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.166 -4.384 -2.118 1.00 0.00 H new ATOM 0 HD21 LEU A 11 5.009 -3.418 -5.074 1.00 0.00 H new ATOM 0 HD22 LEU A 11 4.087 -4.848 -4.553 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.247 -3.476 -5.314 1.00 0.00 H new ATOM 158 N LEU A 12 2.757 -4.492 0.237 1.00 0.00 N ATOM 159 CA LEU A 12 3.301 -4.559 1.590 1.00 0.00 C ATOM 160 C LEU A 12 3.429 -6.007 2.065 1.00 0.00 C ATOM 161 O LEU A 12 4.474 -6.407 2.589 1.00 0.00 O ATOM 162 CB LEU A 12 2.344 -3.795 2.519 1.00 0.00 C ATOM 163 CG LEU A 12 2.403 -2.280 2.287 1.00 0.00 C ATOM 164 CD1 LEU A 12 1.048 -1.608 2.535 1.00 0.00 C ATOM 165 CD2 LEU A 12 3.408 -1.684 3.261 1.00 0.00 C ATOM 0 H LEU A 12 1.989 -3.826 0.147 1.00 0.00 H new ATOM 0 HA LEU A 12 4.297 -4.117 1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.325 -4.147 2.358 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.596 -4.013 3.557 1.00 0.00 H new ATOM 0 HG LEU A 12 2.688 -2.109 1.249 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.136 -0.536 2.359 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.304 -2.027 1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.739 -1.782 3.566 1.00 0.00 H new ATOM 0 HD21 LEU A 12 3.464 -0.606 3.111 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.092 -1.893 4.283 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.389 -2.126 3.087 1.00 0.00 H new ATOM 177 N ILE A 13 2.350 -6.773 1.894 1.00 0.00 N ATOM 178 CA ILE A 13 2.262 -8.169 2.292 1.00 0.00 C ATOM 179 C ILE A 13 3.331 -8.977 1.566 1.00 0.00 C ATOM 180 O ILE A 13 4.120 -9.671 2.207 1.00 0.00 O ATOM 181 CB ILE A 13 0.846 -8.690 1.967 1.00 0.00 C ATOM 182 CG1 ILE A 13 -0.213 -8.134 2.936 1.00 0.00 C ATOM 183 CG2 ILE A 13 0.770 -10.220 1.889 1.00 0.00 C ATOM 184 CD1 ILE A 13 -0.354 -8.976 4.203 1.00 0.00 C ATOM 0 H ILE A 13 1.493 -6.425 1.463 1.00 0.00 H new ATOM 0 HA ILE A 13 2.435 -8.272 3.363 1.00 0.00 H new ATOM 0 HB ILE A 13 0.619 -8.313 0.970 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.053 -7.113 3.211 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.176 -8.087 2.427 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.251 -10.522 1.658 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.440 -10.578 1.108 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.067 -10.648 2.846 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.114 -8.537 4.849 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.648 -9.991 3.935 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.599 -9.002 4.731 1.00 0.00 H new ATOM 196 N GLY A 14 3.325 -8.895 0.237 1.00 0.00 N ATOM 197 CA GLY A 14 4.200 -9.636 -0.647 1.00 0.00 C ATOM 198 C GLY A 14 5.651 -9.346 -0.310 1.00 0.00 C ATOM 199 O GLY A 14 6.444 -10.273 -0.163 1.00 0.00 O ATOM 0 H GLY A 14 2.682 -8.284 -0.266 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.004 -10.704 -0.554 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.998 -9.364 -1.683 1.00 0.00 H new ATOM 203 N ILE A 15 5.995 -8.062 -0.153 1.00 0.00 N ATOM 204 CA ILE A 15 7.333 -7.687 0.262 1.00 0.00 C ATOM 205 C ILE A 15 7.654 -8.409 1.566 1.00 0.00 C ATOM 206 O ILE A 15 8.615 -9.174 1.631 1.00 0.00 O ATOM 207 CB ILE A 15 7.448 -6.151 0.333 1.00 0.00 C ATOM 208 CG1 ILE A 15 7.836 -5.650 -1.068 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.457 -5.693 1.391 1.00 0.00 C ATOM 210 CD1 ILE A 15 7.984 -4.131 -1.145 1.00 0.00 C ATOM 0 H ILE A 15 5.363 -7.277 -0.308 1.00 0.00 H new ATOM 0 HA ILE A 15 8.085 -7.998 -0.463 1.00 0.00 H new ATOM 0 HB ILE A 15 6.492 -5.726 0.638 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.775 -6.116 -1.366 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.080 -5.972 -1.784 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.503 -4.604 1.403 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.146 -6.054 2.371 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.442 -6.095 1.153 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.259 -3.843 -2.160 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.039 -3.659 -0.877 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.761 -3.806 -0.453 1.00 0.00 H new ATOM 222 N PHE A 16 6.833 -8.192 2.594 1.00 0.00 N ATOM 223 CA PHE A 16 7.131 -8.723 3.910 1.00 0.00 C ATOM 224 C PHE A 16 7.367 -10.233 3.841 1.00 0.00 C ATOM 225 O PHE A 16 8.404 -10.731 4.269 1.00 0.00 O ATOM 226 CB PHE A 16 5.987 -8.381 4.863 1.00 0.00 C ATOM 227 CG PHE A 16 6.312 -8.685 6.304 1.00 0.00 C ATOM 228 CD1 PHE A 16 6.092 -9.972 6.822 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.943 -7.712 7.097 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.433 -10.252 8.152 1.00 0.00 C ATOM 231 CE2 PHE A 16 7.229 -7.976 8.444 1.00 0.00 C ATOM 232 CZ PHE A 16 6.942 -9.239 8.981 1.00 0.00 C ATOM 0 H PHE A 16 5.967 -7.657 2.535 1.00 0.00 H new ATOM 0 HA PHE A 16 8.047 -8.268 4.287 1.00 0.00 H new ATOM 0 HB2 PHE A 16 5.744 -7.323 4.766 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.098 -8.940 4.571 1.00 0.00 H new ATOM 0 HD1 PHE A 16 5.662 -10.742 6.198 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.209 -6.757 6.668 1.00 0.00 H new ATOM 0 HE1 PHE A 16 6.304 -11.251 8.541 1.00 0.00 H new ATOM 0 HE2 PHE A 16 7.669 -7.210 9.065 1.00 0.00 H new ATOM 0 HZ PHE A 16 7.112 -9.432 10.030 1.00 0.00 H new ATOM 242 N HIS A 17 6.401 -10.957 3.274 1.00 0.00 N ATOM 243 CA HIS A 17 6.414 -12.409 3.258 1.00 0.00 C ATOM 244 C HIS A 17 7.506 -12.964 2.349 1.00 0.00 C ATOM 245 O HIS A 17 8.026 -14.036 2.640 1.00 0.00 O ATOM 246 CB HIS A 17 5.019 -12.958 2.946 1.00 0.00 C ATOM 247 CG HIS A 17 4.067 -12.658 4.074 1.00 0.00 C ATOM 248 ND1 HIS A 17 3.531 -11.422 4.343 1.00 0.00 N ATOM 249 CD2 HIS A 17 3.861 -13.444 5.178 1.00 0.00 C ATOM 250 CE1 HIS A 17 3.015 -11.465 5.582 1.00 0.00 C ATOM 251 NE2 HIS A 17 3.180 -12.680 6.133 1.00 0.00 N ATOM 0 H HIS A 17 5.589 -10.546 2.814 1.00 0.00 H new ATOM 0 HA HIS A 17 6.672 -12.761 4.257 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.647 -12.516 2.022 1.00 0.00 H new ATOM 0 HB3 HIS A 17 5.073 -14.035 2.785 1.00 0.00 H new ATOM 0 HD1 HIS A 17 3.526 -10.618 3.716 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.170 -14.473 5.291 1.00 0.00 H new ATOM 0 HE1 HIS A 17 2.531 -10.633 6.071 1.00 0.00 H new ATOM 259 N LYS A 18 7.903 -12.247 1.292 1.00 0.00 N ATOM 260 CA LYS A 18 9.086 -12.624 0.525 1.00 0.00 C ATOM 261 C LYS A 18 10.290 -12.678 1.473 1.00 0.00 C ATOM 262 O LYS A 18 10.980 -13.696 1.563 1.00 0.00 O ATOM 263 CB LYS A 18 9.303 -11.622 -0.620 1.00 0.00 C ATOM 264 CG LYS A 18 10.466 -11.996 -1.549 1.00 0.00 C ATOM 265 CD LYS A 18 10.957 -10.814 -2.402 1.00 0.00 C ATOM 266 CE LYS A 18 9.904 -10.224 -3.352 1.00 0.00 C ATOM 267 NZ LYS A 18 8.979 -9.297 -2.675 1.00 0.00 N ATOM 0 H LYS A 18 7.425 -11.412 0.954 1.00 0.00 H new ATOM 0 HA LYS A 18 8.956 -13.609 0.076 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.388 -11.550 -1.208 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.489 -10.635 -0.198 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.295 -12.374 -0.951 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.152 -12.806 -2.207 1.00 0.00 H new ATOM 0 HD2 LYS A 18 11.308 -10.025 -1.737 1.00 0.00 H new ATOM 0 HD3 LYS A 18 11.815 -11.140 -2.990 1.00 0.00 H new ATOM 0 HE2 LYS A 18 10.407 -9.699 -4.164 1.00 0.00 H new ATOM 0 HE3 LYS A 18 9.333 -11.035 -3.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 8.761 -8.501 -3.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.100 -9.798 -2.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 9.423 -8.937 -1.806 1.00 0.00 H new ATOM 281 N TYR A 19 10.537 -11.576 2.184 1.00 0.00 N ATOM 282 CA TYR A 19 11.675 -11.489 3.087 1.00 0.00 C ATOM 283 C TYR A 19 11.557 -12.508 4.221 1.00 0.00 C ATOM 284 O TYR A 19 12.459 -13.321 4.383 1.00 0.00 O ATOM 285 CB TYR A 19 11.890 -10.042 3.534 1.00 0.00 C ATOM 286 CG TYR A 19 12.553 -9.217 2.448 1.00 0.00 C ATOM 287 CD1 TYR A 19 13.930 -9.371 2.204 1.00 0.00 C ATOM 288 CD2 TYR A 19 11.768 -8.492 1.538 1.00 0.00 C ATOM 289 CE1 TYR A 19 14.485 -8.896 1.004 1.00 0.00 C ATOM 290 CE2 TYR A 19 12.307 -8.071 0.314 1.00 0.00 C ATOM 291 CZ TYR A 19 13.661 -8.306 0.032 1.00 0.00 C ATOM 292 OH TYR A 19 14.174 -7.962 -1.181 1.00 0.00 O ATOM 0 H TYR A 19 9.962 -10.734 2.149 1.00 0.00 H new ATOM 0 HA TYR A 19 12.588 -11.768 2.562 1.00 0.00 H new ATOM 0 HB2 TYR A 19 10.931 -9.595 3.797 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.507 -10.026 4.432 1.00 0.00 H new ATOM 0 HD1 TYR A 19 14.559 -9.853 2.938 1.00 0.00 H new ATOM 0 HD2 TYR A 19 10.743 -8.257 1.782 1.00 0.00 H new ATOM 0 HE1 TYR A 19 15.547 -8.985 0.829 1.00 0.00 H new ATOM 0 HE2 TYR A 19 11.682 -7.568 -0.409 1.00 0.00 H new ATOM 0 HH TYR A 19 13.518 -7.426 -1.674 1.00 0.00 H new ATOM 302 N SER A 20 10.456 -12.537 4.972 1.00 0.00 N ATOM 303 CA SER A 20 10.250 -13.566 5.987 1.00 0.00 C ATOM 304 C SER A 20 10.496 -14.968 5.415 1.00 0.00 C ATOM 305 O SER A 20 11.243 -15.761 5.989 1.00 0.00 O ATOM 306 CB SER A 20 8.837 -13.434 6.549 1.00 0.00 C ATOM 307 OG SER A 20 8.653 -12.123 7.035 1.00 0.00 O ATOM 0 H SER A 20 9.696 -11.861 4.896 1.00 0.00 H new ATOM 0 HA SER A 20 10.969 -13.425 6.794 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.102 -13.654 5.774 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.682 -14.157 7.350 1.00 0.00 H new ATOM 0 HG SER A 20 8.728 -12.123 8.012 1.00 0.00 H new ATOM 313 N GLY A 21 9.901 -15.252 4.253 1.00 0.00 N ATOM 314 CA GLY A 21 10.051 -16.503 3.532 1.00 0.00 C ATOM 315 C GLY A 21 11.520 -16.860 3.315 1.00 0.00 C ATOM 316 O GLY A 21 11.905 -18.006 3.541 1.00 0.00 O ATOM 0 H GLY A 21 9.284 -14.592 3.780 1.00 0.00 H new ATOM 0 HA2 GLY A 21 9.561 -17.303 4.086 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.549 -16.429 2.568 1.00 0.00 H new ATOM 398 N HIS A 27 4.937 -14.533 9.504 1.00 0.00 N ATOM 399 CA HIS A 27 4.385 -13.197 9.714 1.00 0.00 C ATOM 400 C HIS A 27 5.279 -12.383 10.653 1.00 0.00 C ATOM 401 O HIS A 27 4.809 -11.514 11.387 1.00 0.00 O ATOM 402 CB HIS A 27 2.952 -13.330 10.246 1.00 0.00 C ATOM 403 CG HIS A 27 2.138 -14.342 9.475 1.00 0.00 C ATOM 404 ND1 HIS A 27 2.180 -14.539 8.112 1.00 0.00 N ATOM 405 CD2 HIS A 27 1.406 -15.365 10.017 1.00 0.00 C ATOM 406 CE1 HIS A 27 1.484 -15.658 7.845 1.00 0.00 C ATOM 407 NE2 HIS A 27 0.988 -16.194 8.972 1.00 0.00 N ATOM 0 HA HIS A 27 4.353 -12.654 8.770 1.00 0.00 H new ATOM 0 HB2 HIS A 27 2.984 -13.619 11.296 1.00 0.00 H new ATOM 0 HB3 HIS A 27 2.459 -12.359 10.197 1.00 0.00 H new ATOM 0 HD1 HIS A 27 2.652 -13.945 7.431 1.00 0.00 H new ATOM 0 HD2 HIS A 27 1.190 -15.506 11.066 1.00 0.00 H new ATOM 0 HE1 HIS A 27 1.343 -16.070 6.857 1.00 0.00 H new ATOM 415 N THR A 28 6.579 -12.672 10.653 1.00 0.00 N ATOM 416 CA THR A 28 7.596 -11.990 11.435 1.00 0.00 C ATOM 417 C THR A 28 8.875 -12.007 10.592 1.00 0.00 C ATOM 418 O THR A 28 8.978 -12.821 9.673 1.00 0.00 O ATOM 419 CB THR A 28 7.670 -12.627 12.834 1.00 0.00 C ATOM 420 OG1 THR A 28 6.472 -12.304 13.529 1.00 0.00 O ATOM 421 CG2 THR A 28 8.842 -12.120 13.673 1.00 0.00 C ATOM 0 H THR A 28 6.964 -13.423 10.080 1.00 0.00 H new ATOM 0 HA THR A 28 7.382 -10.942 11.645 1.00 0.00 H new ATOM 0 HB THR A 28 7.806 -13.699 12.692 1.00 0.00 H new ATOM 0 HG1 THR A 28 6.496 -12.701 14.424 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.832 -12.611 14.646 1.00 0.00 H new ATOM 0 HG22 THR A 28 9.779 -12.344 13.163 1.00 0.00 H new ATOM 0 HG23 THR A 28 8.752 -11.042 13.810 1.00 0.00 H new ATOM 429 N LEU A 29 9.779 -11.047 10.807 1.00 0.00 N ATOM 430 CA LEU A 29 10.904 -10.784 9.916 1.00 0.00 C ATOM 431 C LEU A 29 12.077 -10.271 10.760 1.00 0.00 C ATOM 432 O LEU A 29 11.858 -9.464 11.662 1.00 0.00 O ATOM 433 CB LEU A 29 10.395 -9.740 8.906 1.00 0.00 C ATOM 434 CG LEU A 29 11.101 -9.629 7.551 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.223 -8.760 6.647 1.00 0.00 C ATOM 436 CD2 LEU A 29 12.473 -8.970 7.653 1.00 0.00 C ATOM 0 H LEU A 29 9.747 -10.425 11.615 1.00 0.00 H new ATOM 0 HA LEU A 29 11.260 -11.665 9.382 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.342 -9.949 8.715 1.00 0.00 H new ATOM 0 HB3 LEU A 29 10.444 -8.763 9.386 1.00 0.00 H new ATOM 0 HG LEU A 29 11.248 -10.636 7.159 1.00 0.00 H new ATOM 0 HD11 LEU A 29 10.695 -8.658 5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.245 -9.228 6.531 1.00 0.00 H new ATOM 0 HD13 LEU A 29 10.102 -7.774 7.096 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.926 -8.918 6.663 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.364 -7.963 8.055 1.00 0.00 H new ATOM 0 HD23 LEU A 29 13.111 -9.557 8.314 1.00 0.00 H new ATOM 448 N SER A 30 13.303 -10.754 10.528 1.00 0.00 N ATOM 449 CA SER A 30 14.454 -10.370 11.346 1.00 0.00 C ATOM 450 C SER A 30 15.023 -9.001 10.957 1.00 0.00 C ATOM 451 O SER A 30 14.725 -8.470 9.891 1.00 0.00 O ATOM 452 CB SER A 30 15.530 -11.460 11.315 1.00 0.00 C ATOM 453 OG SER A 30 16.421 -11.261 12.398 1.00 0.00 O ATOM 0 H SER A 30 13.521 -11.412 9.780 1.00 0.00 H new ATOM 0 HA SER A 30 14.100 -10.271 12.372 1.00 0.00 H new ATOM 0 HB2 SER A 30 15.069 -12.446 11.383 1.00 0.00 H new ATOM 0 HB3 SER A 30 16.073 -11.426 10.370 1.00 0.00 H new ATOM 0 HG SER A 30 15.979 -11.513 13.236 1.00 0.00 H new ATOM 459 N LYS A 31 15.860 -8.424 11.823 1.00 0.00 N ATOM 460 CA LYS A 31 16.300 -7.037 11.701 1.00 0.00 C ATOM 461 C LYS A 31 17.285 -6.797 10.550 1.00 0.00 C ATOM 462 O LYS A 31 17.069 -5.926 9.708 1.00 0.00 O ATOM 463 CB LYS A 31 16.782 -6.508 13.058 1.00 0.00 C ATOM 464 CG LYS A 31 17.982 -7.229 13.697 1.00 0.00 C ATOM 465 CD LYS A 31 18.323 -6.593 15.056 1.00 0.00 C ATOM 466 CE LYS A 31 17.333 -7.001 16.155 1.00 0.00 C ATOM 467 NZ LYS A 31 17.465 -6.166 17.361 1.00 0.00 N ATOM 0 H LYS A 31 16.251 -8.910 12.630 1.00 0.00 H new ATOM 0 HA LYS A 31 15.433 -6.443 11.413 1.00 0.00 H new ATOM 0 HB2 LYS A 31 17.041 -5.456 12.940 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.947 -6.554 13.757 1.00 0.00 H new ATOM 0 HG2 LYS A 31 17.752 -8.286 13.830 1.00 0.00 H new ATOM 0 HG3 LYS A 31 18.845 -7.172 13.034 1.00 0.00 H new ATOM 0 HD2 LYS A 31 19.330 -6.888 15.350 1.00 0.00 H new ATOM 0 HD3 LYS A 31 18.325 -5.508 14.956 1.00 0.00 H new ATOM 0 HE2 LYS A 31 16.316 -6.924 15.772 1.00 0.00 H new ATOM 0 HE3 LYS A 31 17.496 -8.046 16.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 16.571 -6.178 17.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 18.228 -6.540 17.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 17.690 -5.189 17.084 1.00 0.00 H new ATOM 481 N LYS A 32 18.368 -7.571 10.465 1.00 0.00 N ATOM 482 CA LYS A 32 19.302 -7.416 9.353 1.00 0.00 C ATOM 483 C LYS A 32 18.587 -7.738 8.034 1.00 0.00 C ATOM 484 O LYS A 32 18.809 -7.091 7.010 1.00 0.00 O ATOM 485 CB LYS A 32 20.545 -8.279 9.593 1.00 0.00 C ATOM 486 CG LYS A 32 21.598 -8.092 8.493 1.00 0.00 C ATOM 487 CD LYS A 32 22.862 -8.893 8.830 1.00 0.00 C ATOM 488 CE LYS A 32 23.904 -8.814 7.708 1.00 0.00 C ATOM 489 NZ LYS A 32 24.381 -7.436 7.490 1.00 0.00 N ATOM 0 H LYS A 32 18.616 -8.296 11.138 1.00 0.00 H new ATOM 0 HA LYS A 32 19.647 -6.384 9.284 1.00 0.00 H new ATOM 0 HB2 LYS A 32 20.981 -8.025 10.559 1.00 0.00 H new ATOM 0 HB3 LYS A 32 20.254 -9.328 9.641 1.00 0.00 H new ATOM 0 HG2 LYS A 32 21.196 -8.420 7.534 1.00 0.00 H new ATOM 0 HG3 LYS A 32 21.844 -7.035 8.391 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.296 -8.515 9.756 1.00 0.00 H new ATOM 0 HD3 LYS A 32 22.596 -9.935 9.005 1.00 0.00 H new ATOM 0 HE2 LYS A 32 24.750 -9.455 7.954 1.00 0.00 H new ATOM 0 HE3 LYS A 32 23.471 -9.198 6.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 25.155 -7.442 6.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 23.599 -6.851 7.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 24.725 -7.042 8.389 1.00 0.00 H new ATOM 503 N GLU A 33 17.688 -8.724 8.066 1.00 0.00 N ATOM 504 CA GLU A 33 16.866 -9.039 6.917 1.00 0.00 C ATOM 505 C GLU A 33 15.965 -7.857 6.548 1.00 0.00 C ATOM 506 O GLU A 33 15.847 -7.534 5.371 1.00 0.00 O ATOM 507 CB GLU A 33 16.067 -10.311 7.177 1.00 0.00 C ATOM 508 CG GLU A 33 15.328 -10.692 5.895 1.00 0.00 C ATOM 509 CD GLU A 33 14.569 -11.982 6.095 1.00 0.00 C ATOM 510 OE1 GLU A 33 13.452 -11.890 6.647 1.00 0.00 O ATOM 511 OE2 GLU A 33 15.144 -13.026 5.723 1.00 0.00 O ATOM 0 H GLU A 33 17.518 -9.313 8.881 1.00 0.00 H new ATOM 0 HA GLU A 33 17.512 -9.223 6.059 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.731 -11.119 7.485 1.00 0.00 H new ATOM 0 HB3 GLU A 33 15.358 -10.153 7.990 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.639 -9.896 5.613 1.00 0.00 H new ATOM 0 HG3 GLU A 33 16.039 -10.803 5.076 1.00 0.00 H new ATOM 518 N LEU A 34 15.342 -7.205 7.534 1.00 0.00 N ATOM 519 CA LEU A 34 14.612 -5.961 7.320 1.00 0.00 C ATOM 520 C LEU A 34 15.531 -4.970 6.608 1.00 0.00 C ATOM 521 O LEU A 34 15.130 -4.359 5.619 1.00 0.00 O ATOM 522 CB LEU A 34 14.042 -5.426 8.649 1.00 0.00 C ATOM 523 CG LEU A 34 13.414 -4.022 8.619 1.00 0.00 C ATOM 524 CD1 LEU A 34 14.462 -2.905 8.472 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.318 -3.918 7.551 1.00 0.00 C ATOM 0 H LEU A 34 15.332 -7.528 8.501 1.00 0.00 H new ATOM 0 HA LEU A 34 13.747 -6.129 6.679 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.287 -6.128 9.002 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.845 -5.423 9.386 1.00 0.00 H new ATOM 0 HG LEU A 34 12.943 -3.872 9.590 1.00 0.00 H new ATOM 0 HD11 LEU A 34 13.962 -1.937 8.457 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.154 -2.943 9.313 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.013 -3.043 7.542 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.897 -2.913 7.559 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.745 -4.125 6.570 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.532 -4.642 7.765 1.00 0.00 H new ATOM 537 N LYS A 35 16.775 -4.811 7.067 1.00 0.00 N ATOM 538 CA LYS A 35 17.689 -3.934 6.351 1.00 0.00 C ATOM 539 C LYS A 35 17.804 -4.362 4.882 1.00 0.00 C ATOM 540 O LYS A 35 17.716 -3.512 3.999 1.00 0.00 O ATOM 541 CB LYS A 35 19.051 -3.816 7.047 1.00 0.00 C ATOM 542 CG LYS A 35 19.799 -2.613 6.458 1.00 0.00 C ATOM 543 CD LYS A 35 21.121 -2.339 7.179 1.00 0.00 C ATOM 544 CE LYS A 35 21.641 -0.938 6.826 1.00 0.00 C ATOM 545 NZ LYS A 35 21.818 -0.753 5.374 1.00 0.00 N ATOM 0 H LYS A 35 17.157 -5.261 7.899 1.00 0.00 H new ATOM 0 HA LYS A 35 17.271 -2.928 6.366 1.00 0.00 H new ATOM 0 HB2 LYS A 35 18.917 -3.689 8.121 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.630 -4.729 6.903 1.00 0.00 H new ATOM 0 HG2 LYS A 35 19.995 -2.792 5.401 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.165 -1.729 6.519 1.00 0.00 H new ATOM 0 HD2 LYS A 35 20.979 -2.421 8.257 1.00 0.00 H new ATOM 0 HD3 LYS A 35 21.859 -3.090 6.897 1.00 0.00 H new ATOM 0 HE2 LYS A 35 20.944 -0.189 7.203 1.00 0.00 H new ATOM 0 HE3 LYS A 35 22.593 -0.769 7.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 22.326 0.137 5.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 22.366 -1.547 4.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 20.887 -0.718 4.912 1.00 0.00 H new ATOM 559 N GLU A 36 17.954 -5.661 4.606 1.00 0.00 N ATOM 560 CA GLU A 36 17.977 -6.167 3.232 1.00 0.00 C ATOM 561 C GLU A 36 16.699 -5.756 2.477 1.00 0.00 C ATOM 562 O GLU A 36 16.781 -5.210 1.379 1.00 0.00 O ATOM 563 CB GLU A 36 18.208 -7.693 3.209 1.00 0.00 C ATOM 564 CG GLU A 36 19.175 -8.120 2.092 1.00 0.00 C ATOM 565 CD GLU A 36 18.704 -7.743 0.689 1.00 0.00 C ATOM 566 OE1 GLU A 36 17.889 -8.513 0.137 1.00 0.00 O ATOM 567 OE2 GLU A 36 19.186 -6.706 0.183 1.00 0.00 O ATOM 0 H GLU A 36 18.062 -6.382 5.319 1.00 0.00 H new ATOM 0 HA GLU A 36 18.818 -5.712 2.708 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.605 -8.013 4.172 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.253 -8.201 3.074 1.00 0.00 H new ATOM 0 HG2 GLU A 36 20.148 -7.663 2.273 1.00 0.00 H new ATOM 0 HG3 GLU A 36 19.316 -9.200 2.140 1.00 0.00 H new ATOM 574 N LEU A 37 15.522 -5.988 3.075 1.00 0.00 N ATOM 575 CA LEU A 37 14.230 -5.554 2.547 1.00 0.00 C ATOM 576 C LEU A 37 14.310 -4.091 2.142 1.00 0.00 C ATOM 577 O LEU A 37 13.963 -3.742 1.018 1.00 0.00 O ATOM 578 CB LEU A 37 13.102 -5.828 3.570 1.00 0.00 C ATOM 579 CG LEU A 37 11.675 -5.357 3.206 1.00 0.00 C ATOM 580 CD1 LEU A 37 10.660 -6.082 4.104 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.428 -3.859 3.441 1.00 0.00 C ATOM 0 H LEU A 37 15.445 -6.494 3.958 1.00 0.00 H new ATOM 0 HA LEU A 37 13.985 -6.130 1.655 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.065 -6.902 3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.381 -5.356 4.512 1.00 0.00 H new ATOM 0 HG LEU A 37 11.564 -5.574 2.144 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.652 -5.754 3.852 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.741 -7.158 3.949 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.867 -5.849 5.149 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.404 -3.611 3.161 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.583 -3.626 4.494 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.121 -3.276 2.835 1.00 0.00 H new ATOM 593 N ILE A 38 14.782 -3.228 3.040 1.00 0.00 N ATOM 594 CA ILE A 38 14.900 -1.816 2.731 1.00 0.00 C ATOM 595 C ILE A 38 15.844 -1.612 1.553 1.00 0.00 C ATOM 596 O ILE A 38 15.436 -1.044 0.546 1.00 0.00 O ATOM 597 CB ILE A 38 15.280 -1.014 3.984 1.00 0.00 C ATOM 598 CG1 ILE A 38 14.074 -1.074 4.937 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.641 0.444 3.661 1.00 0.00 C ATOM 600 CD1 ILE A 38 14.307 -0.300 6.227 1.00 0.00 C ATOM 0 H ILE A 38 15.085 -3.485 3.979 1.00 0.00 H new ATOM 0 HA ILE A 38 13.932 -1.425 2.416 1.00 0.00 H new ATOM 0 HB ILE A 38 16.171 -1.447 4.439 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.196 -0.673 4.431 1.00 0.00 H new ATOM 0 HG13 ILE A 38 13.857 -2.115 5.177 1.00 0.00 H new ATOM 0 HG21 ILE A 38 15.902 0.967 4.581 1.00 0.00 H new ATOM 0 HG22 ILE A 38 16.490 0.466 2.978 1.00 0.00 H new ATOM 0 HG23 ILE A 38 14.787 0.935 3.194 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.424 -0.376 6.862 1.00 0.00 H new ATOM 0 HD12 ILE A 38 15.168 -0.716 6.751 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.496 0.748 5.994 1.00 0.00 H new ATOM 612 N GLN A 39 17.090 -2.074 1.658 1.00 0.00 N ATOM 613 CA GLN A 39 18.077 -1.828 0.619 1.00 0.00 C ATOM 614 C GLN A 39 17.591 -2.292 -0.754 1.00 0.00 C ATOM 615 O GLN A 39 17.882 -1.629 -1.751 1.00 0.00 O ATOM 616 CB GLN A 39 19.422 -2.480 0.972 1.00 0.00 C ATOM 617 CG GLN A 39 20.074 -1.909 2.238 1.00 0.00 C ATOM 618 CD GLN A 39 20.205 -0.394 2.197 1.00 0.00 C ATOM 619 OE1 GLN A 39 21.027 0.146 1.466 1.00 0.00 O ATOM 620 NE2 GLN A 39 19.390 0.311 2.976 1.00 0.00 N ATOM 0 H GLN A 39 17.434 -2.617 2.450 1.00 0.00 H new ATOM 0 HA GLN A 39 18.222 -0.749 0.563 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.272 -3.552 1.104 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.107 -2.354 0.134 1.00 0.00 H new ATOM 0 HG2 GLN A 39 19.482 -2.195 3.108 1.00 0.00 H new ATOM 0 HG3 GLN A 39 21.062 -2.352 2.365 1.00 0.00 H new ATOM 0 HE21 GLN A 39 18.716 -0.167 3.574 1.00 0.00 H new ATOM 0 HE22 GLN A 39 19.439 1.330 2.976 1.00 0.00 H new ATOM 629 N LYS A 40 16.872 -3.415 -0.817 1.00 0.00 N ATOM 630 CA LYS A 40 16.392 -3.940 -2.081 1.00 0.00 C ATOM 631 C LYS A 40 15.138 -3.200 -2.538 1.00 0.00 C ATOM 632 O LYS A 40 15.098 -2.698 -3.657 1.00 0.00 O ATOM 633 CB LYS A 40 16.153 -5.449 -1.930 1.00 0.00 C ATOM 634 CG LYS A 40 15.904 -6.172 -3.263 1.00 0.00 C ATOM 635 CD LYS A 40 17.069 -6.088 -4.263 1.00 0.00 C ATOM 636 CE LYS A 40 18.425 -6.492 -3.665 1.00 0.00 C ATOM 637 NZ LYS A 40 18.379 -7.819 -3.026 1.00 0.00 N ATOM 0 H LYS A 40 16.613 -3.973 -0.003 1.00 0.00 H new ATOM 0 HA LYS A 40 17.141 -3.782 -2.857 1.00 0.00 H new ATOM 0 HB2 LYS A 40 17.017 -5.897 -1.440 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.296 -5.608 -1.275 1.00 0.00 H new ATOM 0 HG2 LYS A 40 15.693 -7.222 -3.058 1.00 0.00 H new ATOM 0 HG3 LYS A 40 15.012 -5.752 -3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 40 16.852 -6.731 -5.116 1.00 0.00 H new ATOM 0 HD3 LYS A 40 17.138 -5.068 -4.642 1.00 0.00 H new ATOM 0 HE2 LYS A 40 19.180 -6.495 -4.451 1.00 0.00 H new ATOM 0 HE3 LYS A 40 18.732 -5.748 -2.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 19.288 -8.304 -3.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 18.201 -7.708 -2.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 17.615 -8.383 -3.451 1.00 0.00 H new ATOM 651 N GLU A 41 14.097 -3.168 -1.702 1.00 0.00 N ATOM 652 CA GLU A 41 12.785 -2.680 -2.100 1.00 0.00 C ATOM 653 C GLU A 41 12.737 -1.155 -2.057 1.00 0.00 C ATOM 654 O GLU A 41 12.283 -0.512 -3.000 1.00 0.00 O ATOM 655 CB GLU A 41 11.698 -3.285 -1.202 1.00 0.00 C ATOM 656 CG GLU A 41 11.756 -4.818 -1.112 1.00 0.00 C ATOM 657 CD GLU A 41 11.655 -5.511 -2.467 1.00 0.00 C ATOM 658 OE1 GLU A 41 10.754 -5.127 -3.242 1.00 0.00 O ATOM 659 OE2 GLU A 41 12.471 -6.434 -2.687 1.00 0.00 O ATOM 0 H GLU A 41 14.145 -3.481 -0.732 1.00 0.00 H new ATOM 0 HA GLU A 41 12.598 -2.992 -3.127 1.00 0.00 H new ATOM 0 HB2 GLU A 41 11.792 -2.867 -0.200 1.00 0.00 H new ATOM 0 HB3 GLU A 41 10.720 -2.989 -1.580 1.00 0.00 H new ATOM 0 HG2 GLU A 41 12.690 -5.111 -0.632 1.00 0.00 H new ATOM 0 HG3 GLU A 41 10.945 -5.167 -0.473 1.00 0.00 H new ATOM 666 N LEU A 42 13.199 -0.564 -0.955 1.00 0.00 N ATOM 667 CA LEU A 42 13.285 0.879 -0.828 1.00 0.00 C ATOM 668 C LEU A 42 14.647 1.257 -1.403 1.00 0.00 C ATOM 669 O LEU A 42 15.541 1.660 -0.663 1.00 0.00 O ATOM 670 CB LEU A 42 13.125 1.329 0.635 1.00 0.00 C ATOM 671 CG LEU A 42 11.702 1.204 1.207 1.00 0.00 C ATOM 672 CD1 LEU A 42 11.220 -0.251 1.259 1.00 0.00 C ATOM 673 CD2 LEU A 42 11.672 1.807 2.617 1.00 0.00 C ATOM 0 H LEU A 42 13.521 -1.075 -0.133 1.00 0.00 H new ATOM 0 HA LEU A 42 12.480 1.381 -1.365 1.00 0.00 H new ATOM 0 HB2 LEU A 42 13.802 0.741 1.255 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.442 2.369 0.715 1.00 0.00 H new ATOM 0 HG LEU A 42 11.028 1.745 0.543 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.211 -0.286 1.670 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.216 -0.669 0.252 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.890 -0.834 1.892 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.666 1.722 3.028 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.372 1.270 3.257 1.00 0.00 H new ATOM 0 HD23 LEU A 42 11.956 2.858 2.569 1.00 0.00 H new ATOM 794 N ASP A 50 22.738 4.606 5.291 1.00 0.00 N ATOM 795 CA ASP A 50 22.732 3.352 6.040 1.00 0.00 C ATOM 796 C ASP A 50 22.661 3.559 7.552 1.00 0.00 C ATOM 797 O ASP A 50 21.924 2.852 8.232 1.00 0.00 O ATOM 798 CB ASP A 50 23.946 2.490 5.672 1.00 0.00 C ATOM 799 CG ASP A 50 25.283 3.150 5.996 1.00 0.00 C ATOM 800 OD1 ASP A 50 25.797 3.864 5.110 1.00 0.00 O ATOM 801 OD2 ASP A 50 25.764 2.929 7.128 1.00 0.00 O ATOM 0 HA ASP A 50 21.821 2.827 5.752 1.00 0.00 H new ATOM 0 HB2 ASP A 50 23.881 1.540 6.202 1.00 0.00 H new ATOM 0 HB3 ASP A 50 23.911 2.263 4.606 1.00 0.00 H new ATOM 806 N ALA A 51 23.403 4.535 8.073 1.00 0.00 N ATOM 807 CA ALA A 51 23.372 4.904 9.484 1.00 0.00 C ATOM 808 C ALA A 51 21.939 5.202 9.947 1.00 0.00 C ATOM 809 O ALA A 51 21.483 4.710 10.980 1.00 0.00 O ATOM 810 CB ALA A 51 24.282 6.114 9.705 1.00 0.00 C ATOM 0 H ALA A 51 24.049 5.097 7.519 1.00 0.00 H new ATOM 0 HA ALA A 51 23.735 4.067 10.080 1.00 0.00 H new ATOM 0 HB1 ALA A 51 24.264 6.396 10.758 1.00 0.00 H new ATOM 0 HB2 ALA A 51 25.302 5.860 9.415 1.00 0.00 H new ATOM 0 HB3 ALA A 51 23.930 6.949 9.100 1.00 0.00 H new ATOM 816 N GLU A 52 21.211 5.991 9.157 1.00 0.00 N ATOM 817 CA GLU A 52 19.823 6.315 9.439 1.00 0.00 C ATOM 818 C GLU A 52 18.993 5.039 9.329 1.00 0.00 C ATOM 819 O GLU A 52 18.141 4.770 10.175 1.00 0.00 O ATOM 820 CB GLU A 52 19.316 7.403 8.479 1.00 0.00 C ATOM 821 CG GLU A 52 20.284 8.588 8.342 1.00 0.00 C ATOM 822 CD GLU A 52 20.713 9.150 9.695 1.00 0.00 C ATOM 823 OE1 GLU A 52 19.820 9.665 10.402 1.00 0.00 O ATOM 824 OE2 GLU A 52 21.920 9.043 9.999 1.00 0.00 O ATOM 0 H GLU A 52 21.572 6.421 8.305 1.00 0.00 H new ATOM 0 HA GLU A 52 19.730 6.713 10.449 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.150 6.962 7.496 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.352 7.769 8.831 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.167 8.270 7.788 1.00 0.00 H new ATOM 0 HG3 GLU A 52 19.808 9.376 7.759 1.00 0.00 H new ATOM 831 N ILE A 53 19.261 4.236 8.295 1.00 0.00 N ATOM 832 CA ILE A 53 18.571 2.969 8.122 1.00 0.00 C ATOM 833 C ILE A 53 18.741 2.069 9.347 1.00 0.00 C ATOM 834 O ILE A 53 17.759 1.470 9.762 1.00 0.00 O ATOM 835 CB ILE A 53 18.952 2.257 6.814 1.00 0.00 C ATOM 836 CG1 ILE A 53 18.758 3.155 5.579 1.00 0.00 C ATOM 837 CG2 ILE A 53 18.139 0.962 6.663 1.00 0.00 C ATOM 838 CD1 ILE A 53 17.363 3.777 5.462 1.00 0.00 C ATOM 0 H ILE A 53 19.949 4.446 7.572 1.00 0.00 H new ATOM 0 HA ILE A 53 17.509 3.198 8.034 1.00 0.00 H new ATOM 0 HB ILE A 53 20.014 2.017 6.872 1.00 0.00 H new ATOM 0 HG12 ILE A 53 19.498 3.955 5.607 1.00 0.00 H new ATOM 0 HG13 ILE A 53 18.957 2.567 4.683 1.00 0.00 H new ATOM 0 HG21 ILE A 53 18.416 0.465 5.733 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.348 0.301 7.504 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.076 1.200 6.644 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.314 4.394 4.565 1.00 0.00 H new ATOM 0 HD12 ILE A 53 16.616 2.986 5.400 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.165 4.395 6.338 1.00 0.00 H new ATOM 850 N VAL A 54 19.932 1.950 9.944 1.00 0.00 N ATOM 851 CA VAL A 54 20.077 1.103 11.128 1.00 0.00 C ATOM 852 C VAL A 54 19.362 1.685 12.353 1.00 0.00 C ATOM 853 O VAL A 54 18.819 0.925 13.153 1.00 0.00 O ATOM 854 CB VAL A 54 21.524 0.669 11.416 1.00 0.00 C ATOM 855 CG1 VAL A 54 21.976 -0.342 10.354 1.00 0.00 C ATOM 856 CG2 VAL A 54 22.518 1.822 11.525 1.00 0.00 C ATOM 0 H VAL A 54 20.786 2.416 9.637 1.00 0.00 H new ATOM 0 HA VAL A 54 19.561 0.174 10.885 1.00 0.00 H new ATOM 0 HB VAL A 54 21.518 0.206 12.403 1.00 0.00 H new ATOM 0 HG11 VAL A 54 23.002 -0.650 10.558 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.323 -1.214 10.381 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.925 0.119 9.368 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.513 1.427 11.729 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.534 2.379 10.588 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.218 2.486 12.336 1.00 0.00 H new ATOM 866 N LYS A 55 19.301 3.012 12.502 1.00 0.00 N ATOM 867 CA LYS A 55 18.451 3.600 13.535 1.00 0.00 C ATOM 868 C LYS A 55 16.993 3.181 13.298 1.00 0.00 C ATOM 869 O LYS A 55 16.329 2.651 14.188 1.00 0.00 O ATOM 870 CB LYS A 55 18.632 5.125 13.567 1.00 0.00 C ATOM 871 CG LYS A 55 17.711 5.839 14.573 1.00 0.00 C ATOM 872 CD LYS A 55 17.803 5.314 16.016 1.00 0.00 C ATOM 873 CE LYS A 55 19.223 5.350 16.597 1.00 0.00 C ATOM 874 NZ LYS A 55 19.800 6.706 16.565 1.00 0.00 N ATOM 0 H LYS A 55 19.818 3.684 11.934 1.00 0.00 H new ATOM 0 HA LYS A 55 18.743 3.229 14.517 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.669 5.353 13.813 1.00 0.00 H new ATOM 0 HB3 LYS A 55 18.445 5.525 12.570 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.950 6.902 14.572 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.680 5.744 14.232 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.145 5.907 16.651 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.434 4.289 16.044 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.203 4.989 17.625 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.862 4.671 16.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.731 6.698 17.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 19.907 7.015 15.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 19.170 7.363 17.067 1.00 0.00 H new ATOM 888 N LEU A 56 16.506 3.394 12.076 1.00 0.00 N ATOM 889 CA LEU A 56 15.170 2.998 11.654 1.00 0.00 C ATOM 890 C LEU A 56 14.933 1.495 11.876 1.00 0.00 C ATOM 891 O LEU A 56 13.874 1.098 12.355 1.00 0.00 O ATOM 892 CB LEU A 56 14.975 3.479 10.207 1.00 0.00 C ATOM 893 CG LEU A 56 13.780 2.863 9.471 1.00 0.00 C ATOM 894 CD1 LEU A 56 13.190 3.870 8.477 1.00 0.00 C ATOM 895 CD2 LEU A 56 14.230 1.645 8.663 1.00 0.00 C ATOM 0 H LEU A 56 17.042 3.855 11.341 1.00 0.00 H new ATOM 0 HA LEU A 56 14.402 3.472 12.266 1.00 0.00 H new ATOM 0 HB2 LEU A 56 14.858 4.563 10.214 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.881 3.260 9.643 1.00 0.00 H new ATOM 0 HG LEU A 56 13.040 2.581 10.220 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.342 3.419 7.962 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.857 4.759 9.014 1.00 0.00 H new ATOM 0 HD13 LEU A 56 13.950 4.150 7.748 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.373 1.216 8.144 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.980 1.949 7.933 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.658 0.901 9.335 1.00 0.00 H new ATOM 907 N MET A 57 15.920 0.655 11.557 1.00 0.00 N ATOM 908 CA MET A 57 15.887 -0.783 11.773 1.00 0.00 C ATOM 909 C MET A 57 15.670 -1.042 13.258 1.00 0.00 C ATOM 910 O MET A 57 14.766 -1.788 13.624 1.00 0.00 O ATOM 911 CB MET A 57 17.201 -1.414 11.291 1.00 0.00 C ATOM 912 CG MET A 57 17.266 -2.933 11.488 1.00 0.00 C ATOM 913 SD MET A 57 18.886 -3.689 11.183 1.00 0.00 S ATOM 914 CE MET A 57 19.836 -3.044 12.580 1.00 0.00 C ATOM 0 H MET A 57 16.789 0.972 11.128 1.00 0.00 H new ATOM 0 HA MET A 57 15.073 -1.234 11.206 1.00 0.00 H new ATOM 0 HB2 MET A 57 17.335 -1.188 10.233 1.00 0.00 H new ATOM 0 HB3 MET A 57 18.032 -0.952 11.824 1.00 0.00 H new ATOM 0 HG2 MET A 57 16.963 -3.163 12.510 1.00 0.00 H new ATOM 0 HG3 MET A 57 16.536 -3.400 10.827 1.00 0.00 H new ATOM 0 HE1 MET A 57 20.774 -3.592 12.666 1.00 0.00 H new ATOM 0 HE2 MET A 57 20.047 -1.987 12.420 1.00 0.00 H new ATOM 0 HE3 MET A 57 19.260 -3.164 13.498 1.00 0.00 H new ATOM 924 N ASP A 58 16.493 -0.416 14.107 1.00 0.00 N ATOM 925 CA ASP A 58 16.351 -0.527 15.547 1.00 0.00 C ATOM 926 C ASP A 58 14.925 -0.162 15.956 1.00 0.00 C ATOM 927 O ASP A 58 14.279 -0.936 16.649 1.00 0.00 O ATOM 928 CB ASP A 58 17.404 0.316 16.274 1.00 0.00 C ATOM 929 CG ASP A 58 17.362 0.057 17.777 1.00 0.00 C ATOM 930 OD1 ASP A 58 17.765 -1.058 18.173 1.00 0.00 O ATOM 931 OD2 ASP A 58 16.935 0.979 18.504 1.00 0.00 O ATOM 0 H ASP A 58 17.268 0.176 13.809 1.00 0.00 H new ATOM 0 HA ASP A 58 16.528 -1.560 15.846 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.395 0.080 15.887 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.229 1.374 16.078 1.00 0.00 H new ATOM 936 N ASP A 59 14.410 0.981 15.489 1.00 0.00 N ATOM 937 CA ASP A 59 13.035 1.385 15.777 1.00 0.00 C ATOM 938 C ASP A 59 12.032 0.292 15.387 1.00 0.00 C ATOM 939 O ASP A 59 11.198 -0.096 16.203 1.00 0.00 O ATOM 940 CB ASP A 59 12.678 2.717 15.099 1.00 0.00 C ATOM 941 CG ASP A 59 13.521 3.896 15.580 1.00 0.00 C ATOM 942 OD1 ASP A 59 13.540 4.121 16.811 1.00 0.00 O ATOM 943 OD2 ASP A 59 14.112 4.571 14.710 1.00 0.00 O ATOM 0 H ASP A 59 14.928 1.641 14.909 1.00 0.00 H new ATOM 0 HA ASP A 59 12.969 1.533 16.855 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.800 2.610 14.021 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.626 2.936 15.280 1.00 0.00 H new ATOM 948 N LEU A 60 12.108 -0.204 14.147 1.00 0.00 N ATOM 949 CA LEU A 60 11.255 -1.285 13.661 1.00 0.00 C ATOM 950 C LEU A 60 11.332 -2.499 14.589 1.00 0.00 C ATOM 951 O LEU A 60 10.313 -2.960 15.103 1.00 0.00 O ATOM 952 CB LEU A 60 11.658 -1.676 12.225 1.00 0.00 C ATOM 953 CG LEU A 60 10.956 -0.824 11.155 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.814 -0.695 9.897 1.00 0.00 C ATOM 955 CD2 LEU A 60 9.631 -1.468 10.731 1.00 0.00 C ATOM 0 H LEU A 60 12.769 0.139 13.450 1.00 0.00 H new ATOM 0 HA LEU A 60 10.224 -0.932 13.652 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.737 -1.572 12.115 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.420 -2.727 12.059 1.00 0.00 H new ATOM 0 HG LEU A 60 10.787 0.157 11.600 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.290 -0.087 9.160 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.762 -0.221 10.150 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.003 -1.685 9.482 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.151 -0.848 9.973 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.823 -2.459 10.321 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.975 -1.555 11.597 1.00 0.00 H new ATOM 967 N ASP A 61 12.536 -3.039 14.778 1.00 0.00 N ATOM 968 CA ASP A 61 12.712 -4.282 15.511 1.00 0.00 C ATOM 969 C ASP A 61 12.402 -4.129 16.997 1.00 0.00 C ATOM 970 O ASP A 61 11.915 -5.077 17.601 1.00 0.00 O ATOM 971 CB ASP A 61 14.075 -4.931 15.235 1.00 0.00 C ATOM 972 CG ASP A 61 15.287 -4.172 15.772 1.00 0.00 C ATOM 973 OD1 ASP A 61 15.318 -3.887 16.988 1.00 0.00 O ATOM 974 OD2 ASP A 61 16.208 -3.938 14.959 1.00 0.00 O ATOM 0 H ASP A 61 13.403 -2.630 14.430 1.00 0.00 H new ATOM 0 HA ASP A 61 11.970 -4.983 15.129 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.075 -5.932 15.666 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.190 -5.048 14.157 1.00 0.00 H new ATOM 979 N ARG A 62 12.630 -2.950 17.586 1.00 0.00 N ATOM 980 CA ARG A 62 12.470 -2.717 19.020 1.00 0.00 C ATOM 981 C ARG A 62 11.143 -3.291 19.513 1.00 0.00 C ATOM 982 O ARG A 62 11.097 -3.980 20.532 1.00 0.00 O ATOM 983 CB ARG A 62 12.566 -1.215 19.319 1.00 0.00 C ATOM 984 CG ARG A 62 12.532 -0.893 20.820 1.00 0.00 C ATOM 985 CD ARG A 62 12.515 0.625 21.040 1.00 0.00 C ATOM 986 NE ARG A 62 13.663 1.268 20.380 1.00 0.00 N ATOM 987 CZ ARG A 62 13.614 2.258 19.475 1.00 0.00 C ATOM 988 NH1 ARG A 62 12.484 2.924 19.212 1.00 0.00 N ATOM 989 NH2 ARG A 62 14.715 2.585 18.797 1.00 0.00 N ATOM 0 H ARG A 62 12.934 -2.123 17.072 1.00 0.00 H new ATOM 0 HA ARG A 62 13.272 -3.228 19.553 1.00 0.00 H new ATOM 0 HB2 ARG A 62 13.489 -0.824 18.891 1.00 0.00 H new ATOM 0 HB3 ARG A 62 11.743 -0.699 18.825 1.00 0.00 H new ATOM 0 HG2 ARG A 62 11.650 -1.343 21.275 1.00 0.00 H new ATOM 0 HG3 ARG A 62 13.402 -1.329 21.312 1.00 0.00 H new ATOM 0 HD2 ARG A 62 11.587 1.042 20.650 1.00 0.00 H new ATOM 0 HD3 ARG A 62 12.537 0.841 22.108 1.00 0.00 H new ATOM 0 HE ARG A 62 14.589 0.927 20.636 1.00 0.00 H new ATOM 0 HH11 ARG A 62 11.624 2.685 19.706 1.00 0.00 H new ATOM 0 HH12 ARG A 62 12.482 3.671 18.518 1.00 0.00 H new ATOM 0 HH21 ARG A 62 15.587 2.084 18.968 1.00 0.00 H new ATOM 0 HH22 ARG A 62 14.685 3.336 18.108 1.00 0.00 H new ATOM 1003 N ASN A 63 10.071 -3.030 18.759 1.00 0.00 N ATOM 1004 CA ASN A 63 8.720 -3.442 19.111 1.00 0.00 C ATOM 1005 C ASN A 63 8.616 -4.946 19.397 1.00 0.00 C ATOM 1006 O ASN A 63 7.764 -5.345 20.188 1.00 0.00 O ATOM 1007 CB ASN A 63 7.741 -3.010 18.010 1.00 0.00 C ATOM 1008 CG ASN A 63 6.321 -2.753 18.521 1.00 0.00 C ATOM 1009 OD1 ASN A 63 5.699 -1.771 18.133 1.00 0.00 O ATOM 1010 ND2 ASN A 63 5.770 -3.607 19.379 1.00 0.00 N ATOM 0 H ASN A 63 10.124 -2.520 17.877 1.00 0.00 H new ATOM 0 HA ASN A 63 8.452 -2.941 20.041 1.00 0.00 H new ATOM 0 HB2 ASN A 63 8.117 -2.104 17.536 1.00 0.00 H new ATOM 0 HB3 ASN A 63 7.708 -3.782 17.241 1.00 0.00 H new ATOM 0 HD21 ASN A 63 4.822 -3.447 19.720 1.00 0.00 H new ATOM 0 HD22 ASN A 63 6.296 -4.422 19.696 1.00 0.00 H new ATOM 1017 N LYS A 64 9.445 -5.774 18.753 1.00 0.00 N ATOM 1018 CA LYS A 64 9.565 -7.201 19.045 1.00 0.00 C ATOM 1019 C LYS A 64 11.051 -7.581 19.153 1.00 0.00 C ATOM 1020 O LYS A 64 11.465 -8.641 18.681 1.00 0.00 O ATOM 1021 CB LYS A 64 8.812 -8.031 17.987 1.00 0.00 C ATOM 1022 CG LYS A 64 7.310 -7.725 17.887 1.00 0.00 C ATOM 1023 CD LYS A 64 6.526 -8.217 19.111 1.00 0.00 C ATOM 1024 CE LYS A 64 5.034 -7.916 18.934 1.00 0.00 C ATOM 1025 NZ LYS A 64 4.254 -8.370 20.097 1.00 0.00 N ATOM 0 H LYS A 64 10.061 -5.463 18.002 1.00 0.00 H new ATOM 0 HA LYS A 64 9.100 -7.425 20.005 1.00 0.00 H new ATOM 0 HB2 LYS A 64 9.271 -7.857 17.014 1.00 0.00 H new ATOM 0 HB3 LYS A 64 8.940 -9.089 18.215 1.00 0.00 H new ATOM 0 HG2 LYS A 64 7.168 -6.650 17.777 1.00 0.00 H new ATOM 0 HG3 LYS A 64 6.906 -8.193 16.989 1.00 0.00 H new ATOM 0 HD2 LYS A 64 6.676 -9.289 19.242 1.00 0.00 H new ATOM 0 HD3 LYS A 64 6.899 -7.730 20.012 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.891 -6.844 18.794 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.666 -8.407 18.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.248 -8.152 19.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.372 -9.397 20.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 4.590 -7.883 20.952 1.00 0.00 H new ATOM 1039 N ASP A 65 11.829 -6.722 19.827 1.00 0.00 N ATOM 1040 CA ASP A 65 13.258 -6.845 20.106 1.00 0.00 C ATOM 1041 C ASP A 65 14.102 -7.444 18.969 1.00 0.00 C ATOM 1042 O ASP A 65 14.729 -6.719 18.199 1.00 0.00 O ATOM 1043 CB ASP A 65 13.489 -7.501 21.481 1.00 0.00 C ATOM 1044 CG ASP A 65 12.716 -8.802 21.692 1.00 0.00 C ATOM 1045 OD1 ASP A 65 13.228 -9.849 21.241 1.00 0.00 O ATOM 1046 OD2 ASP A 65 11.624 -8.727 22.294 1.00 0.00 O ATOM 0 H ASP A 65 11.443 -5.862 20.218 1.00 0.00 H new ATOM 0 HA ASP A 65 13.646 -5.828 20.159 1.00 0.00 H new ATOM 0 HB2 ASP A 65 14.554 -7.701 21.602 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.207 -6.793 22.261 1.00 0.00 H new ATOM 1051 N GLN A 66 14.191 -8.770 18.906 1.00 0.00 N ATOM 1052 CA GLN A 66 15.016 -9.510 17.967 1.00 0.00 C ATOM 1053 C GLN A 66 14.475 -9.401 16.534 1.00 0.00 C ATOM 1054 O GLN A 66 15.255 -9.466 15.582 1.00 0.00 O ATOM 1055 CB GLN A 66 15.090 -10.967 18.456 1.00 0.00 C ATOM 1056 CG GLN A 66 15.899 -11.929 17.574 1.00 0.00 C ATOM 1057 CD GLN A 66 17.350 -11.507 17.382 1.00 0.00 C ATOM 1058 OE1 GLN A 66 18.232 -11.928 18.123 1.00 0.00 O ATOM 1059 NE2 GLN A 66 17.620 -10.684 16.374 1.00 0.00 N ATOM 0 H GLN A 66 13.668 -9.379 19.535 1.00 0.00 H new ATOM 0 HA GLN A 66 16.020 -9.088 17.931 1.00 0.00 H new ATOM 0 HB2 GLN A 66 15.521 -10.973 19.457 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.074 -11.353 18.544 1.00 0.00 H new ATOM 0 HG2 GLN A 66 15.875 -12.924 18.019 1.00 0.00 H new ATOM 0 HG3 GLN A 66 15.419 -12.004 16.598 1.00 0.00 H new ATOM 0 HE21 GLN A 66 16.867 -10.349 15.773 1.00 0.00 H new ATOM 0 HE22 GLN A 66 18.580 -10.387 16.201 1.00 0.00 H new ATOM 1068 N GLU A 67 13.154 -9.281 16.380 1.00 0.00 N ATOM 1069 CA GLU A 67 12.472 -9.327 15.092 1.00 0.00 C ATOM 1070 C GLU A 67 11.518 -8.136 14.974 1.00 0.00 C ATOM 1071 O GLU A 67 11.367 -7.367 15.916 1.00 0.00 O ATOM 1072 CB GLU A 67 11.650 -10.625 15.012 1.00 0.00 C ATOM 1073 CG GLU A 67 12.441 -11.923 15.231 1.00 0.00 C ATOM 1074 CD GLU A 67 13.353 -12.250 14.055 1.00 0.00 C ATOM 1075 OE1 GLU A 67 12.796 -12.616 12.998 1.00 0.00 O ATOM 1076 OE2 GLU A 67 14.586 -12.128 14.224 1.00 0.00 O ATOM 0 H GLU A 67 12.519 -9.146 17.166 1.00 0.00 H new ATOM 0 HA GLU A 67 13.207 -9.291 14.288 1.00 0.00 H new ATOM 0 HB2 GLU A 67 10.853 -10.576 15.754 1.00 0.00 H new ATOM 0 HB3 GLU A 67 11.172 -10.672 14.034 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.039 -11.833 16.138 1.00 0.00 H new ATOM 0 HG3 GLU A 67 11.746 -12.747 15.389 1.00 0.00 H new ATOM 1083 N VAL A 68 10.847 -8.013 13.827 1.00 0.00 N ATOM 1084 CA VAL A 68 9.709 -7.131 13.628 1.00 0.00 C ATOM 1085 C VAL A 68 8.560 -8.012 13.126 1.00 0.00 C ATOM 1086 O VAL A 68 8.746 -8.825 12.220 1.00 0.00 O ATOM 1087 CB VAL A 68 10.047 -5.947 12.699 1.00 0.00 C ATOM 1088 CG1 VAL A 68 10.482 -6.353 11.286 1.00 0.00 C ATOM 1089 CG2 VAL A 68 8.853 -4.988 12.612 1.00 0.00 C ATOM 0 H VAL A 68 11.092 -8.542 12.990 1.00 0.00 H new ATOM 0 HA VAL A 68 9.413 -6.645 14.558 1.00 0.00 H new ATOM 0 HB VAL A 68 10.908 -5.456 13.153 1.00 0.00 H new ATOM 0 HG11 VAL A 68 10.700 -5.459 10.701 1.00 0.00 H new ATOM 0 HG12 VAL A 68 11.375 -6.975 11.345 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.680 -6.914 10.806 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.102 -4.156 11.954 1.00 0.00 H new ATOM 0 HG22 VAL A 68 7.988 -5.519 12.214 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.619 -4.607 13.606 1.00 0.00 H new ATOM 1099 N ASN A 69 7.388 -7.904 13.758 1.00 0.00 N ATOM 1100 CA ASN A 69 6.202 -8.654 13.365 1.00 0.00 C ATOM 1101 C ASN A 69 5.468 -7.905 12.255 1.00 0.00 C ATOM 1102 O ASN A 69 5.524 -6.678 12.217 1.00 0.00 O ATOM 1103 CB ASN A 69 5.283 -8.852 14.569 1.00 0.00 C ATOM 1104 CG ASN A 69 4.010 -9.590 14.167 1.00 0.00 C ATOM 1105 OD1 ASN A 69 3.019 -8.973 13.780 1.00 0.00 O ATOM 1106 ND2 ASN A 69 4.047 -10.917 14.209 1.00 0.00 N ATOM 0 H ASN A 69 7.239 -7.290 14.559 1.00 0.00 H new ATOM 0 HA ASN A 69 6.502 -9.634 12.994 1.00 0.00 H new ATOM 0 HB2 ASN A 69 5.806 -9.415 15.342 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.026 -7.884 14.999 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.235 -11.459 13.914 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.887 -11.394 14.536 1.00 0.00 H new ATOM 1113 N PHE A 70 4.760 -8.625 11.380 1.00 0.00 N ATOM 1114 CA PHE A 70 3.991 -8.038 10.287 1.00 0.00 C ATOM 1115 C PHE A 70 3.160 -6.823 10.724 1.00 0.00 C ATOM 1116 O PHE A 70 3.245 -5.755 10.116 1.00 0.00 O ATOM 1117 CB PHE A 70 3.101 -9.110 9.647 1.00 0.00 C ATOM 1118 CG PHE A 70 2.230 -8.558 8.539 1.00 0.00 C ATOM 1119 CD1 PHE A 70 2.837 -8.060 7.372 1.00 0.00 C ATOM 1120 CD2 PHE A 70 0.860 -8.331 8.763 1.00 0.00 C ATOM 1121 CE1 PHE A 70 2.077 -7.360 6.422 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.099 -7.630 7.814 1.00 0.00 C ATOM 1123 CZ PHE A 70 0.711 -7.131 6.652 1.00 0.00 C ATOM 0 H PHE A 70 4.706 -9.643 11.414 1.00 0.00 H new ATOM 0 HA PHE A 70 4.703 -7.667 9.550 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.728 -9.907 9.248 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.468 -9.556 10.414 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.893 -8.217 7.206 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.393 -8.696 9.666 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.542 -6.999 5.517 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.957 -7.474 7.977 1.00 0.00 H new ATOM 0 HZ PHE A 70 0.130 -6.570 5.935 1.00 0.00 H new ATOM 1133 N GLN A 71 2.364 -6.967 11.788 1.00 0.00 N ATOM 1134 CA GLN A 71 1.509 -5.878 12.242 1.00 0.00 C ATOM 1135 C GLN A 71 2.358 -4.648 12.571 1.00 0.00 C ATOM 1136 O GLN A 71 2.041 -3.528 12.170 1.00 0.00 O ATOM 1137 CB GLN A 71 0.690 -6.336 13.455 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.333 -5.271 13.874 1.00 0.00 C ATOM 1139 CD GLN A 71 -1.074 -5.679 15.140 1.00 0.00 C ATOM 1140 OE1 GLN A 71 -2.244 -6.043 15.096 1.00 0.00 O ATOM 1141 NE2 GLN A 71 -0.397 -5.621 16.282 1.00 0.00 N ATOM 0 H GLN A 71 2.297 -7.820 12.343 1.00 0.00 H new ATOM 0 HA GLN A 71 0.815 -5.601 11.449 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.173 -7.266 13.217 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.359 -6.548 14.289 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.175 -4.321 14.039 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.048 -5.114 13.067 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.576 -5.314 16.283 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.850 -5.884 17.157 1.00 0.00 H new ATOM 1150 N GLU A 72 3.448 -4.863 13.306 1.00 0.00 N ATOM 1151 CA GLU A 72 4.328 -3.798 13.756 1.00 0.00 C ATOM 1152 C GLU A 72 5.046 -3.161 12.561 1.00 0.00 C ATOM 1153 O GLU A 72 5.213 -1.946 12.522 1.00 0.00 O ATOM 1154 CB GLU A 72 5.296 -4.336 14.818 1.00 0.00 C ATOM 1155 CG GLU A 72 4.625 -4.445 16.200 1.00 0.00 C ATOM 1156 CD GLU A 72 3.365 -5.307 16.233 1.00 0.00 C ATOM 1157 OE1 GLU A 72 3.523 -6.540 16.347 1.00 0.00 O ATOM 1158 OE2 GLU A 72 2.261 -4.725 16.152 1.00 0.00 O ATOM 0 H GLU A 72 3.743 -5.792 13.606 1.00 0.00 H new ATOM 0 HA GLU A 72 3.744 -3.007 14.226 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.662 -5.316 14.513 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.163 -3.679 14.886 1.00 0.00 H new ATOM 0 HG2 GLU A 72 5.347 -4.853 16.908 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.372 -3.443 16.546 1.00 0.00 H new ATOM 1165 N TYR A 73 5.428 -3.964 11.566 1.00 0.00 N ATOM 1166 CA TYR A 73 5.932 -3.478 10.290 1.00 0.00 C ATOM 1167 C TYR A 73 4.926 -2.509 9.658 1.00 0.00 C ATOM 1168 O TYR A 73 5.295 -1.377 9.345 1.00 0.00 O ATOM 1169 CB TYR A 73 6.301 -4.671 9.395 1.00 0.00 C ATOM 1170 CG TYR A 73 6.253 -4.448 7.894 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.420 -4.084 7.198 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.108 -4.839 7.171 1.00 0.00 C ATOM 1173 CE1 TYR A 73 7.456 -4.162 5.793 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.125 -4.853 5.767 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.305 -4.535 5.077 1.00 0.00 C ATOM 1176 OH TYR A 73 6.361 -4.685 3.724 1.00 0.00 O ATOM 0 H TYR A 73 5.394 -4.981 11.629 1.00 0.00 H new ATOM 0 HA TYR A 73 6.847 -2.904 10.432 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.309 -4.992 9.658 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.630 -5.496 9.636 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.289 -3.744 7.742 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.212 -5.130 7.700 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.370 -3.935 5.264 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.230 -5.108 5.218 1.00 0.00 H new ATOM 0 HH TYR A 73 5.661 -5.306 3.435 1.00 0.00 H new ATOM 1186 N ILE A 74 3.659 -2.912 9.496 1.00 0.00 N ATOM 1187 CA ILE A 74 2.662 -2.006 8.924 1.00 0.00 C ATOM 1188 C ILE A 74 2.528 -0.745 9.787 1.00 0.00 C ATOM 1189 O ILE A 74 2.555 0.367 9.263 1.00 0.00 O ATOM 1190 CB ILE A 74 1.292 -2.679 8.713 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.340 -3.931 7.818 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.324 -1.634 8.129 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.531 -3.641 6.325 1.00 0.00 C ATOM 0 H ILE A 74 3.308 -3.837 9.747 1.00 0.00 H new ATOM 0 HA ILE A 74 3.020 -1.723 7.934 1.00 0.00 H new ATOM 0 HB ILE A 74 0.948 -3.036 9.684 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.153 -4.573 8.157 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.415 -4.492 7.950 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.653 -2.091 7.972 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.227 -0.800 8.824 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.712 -1.271 7.177 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.553 -4.580 5.772 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.705 -3.027 5.965 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.471 -3.109 6.175 1.00 0.00 H new ATOM 1205 N THR A 75 2.391 -0.911 11.107 1.00 0.00 N ATOM 1206 CA THR A 75 2.288 0.206 12.045 1.00 0.00 C ATOM 1207 C THR A 75 3.428 1.200 11.800 1.00 0.00 C ATOM 1208 O THR A 75 3.209 2.401 11.618 1.00 0.00 O ATOM 1209 CB THR A 75 2.317 -0.316 13.494 1.00 0.00 C ATOM 1210 OG1 THR A 75 1.348 -1.325 13.680 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.037 0.798 14.508 1.00 0.00 C ATOM 0 H THR A 75 2.349 -1.827 11.553 1.00 0.00 H new ATOM 0 HA THR A 75 1.341 0.722 11.887 1.00 0.00 H new ATOM 0 HB THR A 75 3.319 -0.712 13.660 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.664 -2.160 13.277 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.067 0.387 15.517 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.793 1.577 14.411 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.052 1.223 14.318 1.00 0.00 H new ATOM 1219 N PHE A 76 4.659 0.686 11.771 1.00 0.00 N ATOM 1220 CA PHE A 76 5.839 1.492 11.541 1.00 0.00 C ATOM 1221 C PHE A 76 5.771 2.165 10.176 1.00 0.00 C ATOM 1222 O PHE A 76 6.058 3.348 10.080 1.00 0.00 O ATOM 1223 CB PHE A 76 7.112 0.657 11.673 1.00 0.00 C ATOM 1224 CG PHE A 76 8.360 1.504 11.520 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.877 1.766 10.236 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.898 2.173 12.636 1.00 0.00 C ATOM 1227 CE1 PHE A 76 9.956 2.648 10.077 1.00 0.00 C ATOM 1228 CE2 PHE A 76 9.946 3.093 12.468 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.473 3.335 11.187 1.00 0.00 C ATOM 0 H PHE A 76 4.856 -0.305 11.908 1.00 0.00 H new ATOM 0 HA PHE A 76 5.871 2.269 12.305 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.124 0.164 12.645 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.111 -0.129 10.917 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.441 1.287 9.372 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.504 1.978 13.623 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.390 2.799 9.099 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.348 3.615 13.324 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.274 4.048 11.057 1.00 0.00 H new ATOM 1239 N LEU A 77 5.397 1.449 9.113 1.00 0.00 N ATOM 1240 CA LEU A 77 5.230 2.069 7.802 1.00 0.00 C ATOM 1241 C LEU A 77 4.208 3.213 7.870 1.00 0.00 C ATOM 1242 O LEU A 77 4.410 4.263 7.260 1.00 0.00 O ATOM 1243 CB LEU A 77 4.864 1.018 6.747 1.00 0.00 C ATOM 1244 CG LEU A 77 6.057 0.108 6.396 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.574 -1.096 5.596 1.00 0.00 C ATOM 1246 CD2 LEU A 77 7.069 0.822 5.494 1.00 0.00 C ATOM 0 H LEU A 77 5.206 0.447 9.136 1.00 0.00 H new ATOM 0 HA LEU A 77 6.180 2.508 7.496 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.039 0.408 7.115 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.512 1.518 5.845 1.00 0.00 H new ATOM 0 HG LEU A 77 6.517 -0.177 7.342 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.423 -1.735 5.352 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.854 -1.661 6.188 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.100 -0.755 4.676 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.895 0.148 5.269 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.582 1.121 4.566 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.451 1.706 6.004 1.00 0.00 H new ATOM 1258 N GLY A 78 3.139 3.050 8.653 1.00 0.00 N ATOM 1259 CA GLY A 78 2.225 4.139 8.961 1.00 0.00 C ATOM 1260 C GLY A 78 2.967 5.324 9.570 1.00 0.00 C ATOM 1261 O GLY A 78 2.854 6.452 9.085 1.00 0.00 O ATOM 0 H GLY A 78 2.888 2.162 9.087 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.712 4.455 8.053 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.460 3.790 9.654 1.00 0.00 H new ATOM 1265 N ALA A 79 3.755 5.075 10.617 1.00 0.00 N ATOM 1266 CA ALA A 79 4.580 6.119 11.210 1.00 0.00 C ATOM 1267 C ALA A 79 5.511 6.756 10.171 1.00 0.00 C ATOM 1268 O ALA A 79 5.639 7.973 10.131 1.00 0.00 O ATOM 1269 CB ALA A 79 5.349 5.582 12.420 1.00 0.00 C ATOM 0 H ALA A 79 3.837 4.163 11.067 1.00 0.00 H new ATOM 0 HA ALA A 79 3.921 6.910 11.567 1.00 0.00 H new ATOM 0 HB1 ALA A 79 5.958 6.379 12.847 1.00 0.00 H new ATOM 0 HB2 ALA A 79 4.644 5.224 13.170 1.00 0.00 H new ATOM 0 HB3 ALA A 79 5.993 4.761 12.106 1.00 0.00 H new ATOM 1275 N LEU A 80 6.138 5.956 9.310 1.00 0.00 N ATOM 1276 CA LEU A 80 7.038 6.408 8.259 1.00 0.00 C ATOM 1277 C LEU A 80 6.303 7.383 7.335 1.00 0.00 C ATOM 1278 O LEU A 80 6.786 8.481 7.070 1.00 0.00 O ATOM 1279 CB LEU A 80 7.572 5.185 7.491 1.00 0.00 C ATOM 1280 CG LEU A 80 8.818 5.462 6.639 1.00 0.00 C ATOM 1281 CD1 LEU A 80 10.060 5.716 7.499 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.094 4.240 5.757 1.00 0.00 C ATOM 0 H LEU A 80 6.027 4.942 9.328 1.00 0.00 H new ATOM 0 HA LEU A 80 7.888 6.938 8.689 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.805 4.396 8.206 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.782 4.805 6.843 1.00 0.00 H new ATOM 0 HG LEU A 80 8.621 6.354 6.045 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.917 5.907 6.853 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.888 6.581 8.140 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.260 4.841 8.117 1.00 0.00 H new ATOM 0 HD21 LEU A 80 9.978 4.424 5.146 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.264 3.367 6.387 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.237 4.058 5.109 1.00 0.00 H new ATOM 1294 N ALA A 81 5.109 6.991 6.880 1.00 0.00 N ATOM 1295 CA ALA A 81 4.245 7.841 6.071 1.00 0.00 C ATOM 1296 C ALA A 81 3.952 9.153 6.811 1.00 0.00 C ATOM 1297 O ALA A 81 4.095 10.243 6.255 1.00 0.00 O ATOM 1298 CB ALA A 81 2.964 7.083 5.726 1.00 0.00 C ATOM 0 H ALA A 81 4.717 6.068 7.067 1.00 0.00 H new ATOM 0 HA ALA A 81 4.747 8.099 5.138 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.317 7.718 5.121 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.214 6.182 5.166 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.446 6.808 6.644 1.00 0.00 H new ATOM 1304 N MET A 82 3.556 9.048 8.082 1.00 0.00 N ATOM 1305 CA MET A 82 3.240 10.205 8.907 1.00 0.00 C ATOM 1306 C MET A 82 4.453 11.130 9.075 1.00 0.00 C ATOM 1307 O MET A 82 4.296 12.350 9.078 1.00 0.00 O ATOM 1308 CB MET A 82 2.672 9.738 10.253 1.00 0.00 C ATOM 1309 CG MET A 82 2.057 10.901 11.042 1.00 0.00 C ATOM 1310 SD MET A 82 1.074 10.429 12.488 1.00 0.00 S ATOM 1311 CE MET A 82 2.322 9.592 13.492 1.00 0.00 C ATOM 0 H MET A 82 3.447 8.156 8.564 1.00 0.00 H new ATOM 0 HA MET A 82 2.477 10.799 8.404 1.00 0.00 H new ATOM 0 HB2 MET A 82 1.915 8.973 10.083 1.00 0.00 H new ATOM 0 HB3 MET A 82 3.464 9.277 10.842 1.00 0.00 H new ATOM 0 HG2 MET A 82 2.861 11.560 11.370 1.00 0.00 H new ATOM 0 HG3 MET A 82 1.425 11.480 10.368 1.00 0.00 H new ATOM 0 HE1 MET A 82 1.887 9.305 14.449 1.00 0.00 H new ATOM 0 HE2 MET A 82 2.671 8.701 12.970 1.00 0.00 H new ATOM 0 HE3 MET A 82 3.163 10.265 13.663 1.00 0.00 H new ATOM 1321 N ILE A 83 5.649 10.554 9.221 1.00 0.00 N ATOM 1322 CA ILE A 83 6.910 11.271 9.360 1.00 0.00 C ATOM 1323 C ILE A 83 7.260 11.968 8.044 1.00 0.00 C ATOM 1324 O ILE A 83 7.658 13.131 8.069 1.00 0.00 O ATOM 1325 CB ILE A 83 8.017 10.315 9.852 1.00 0.00 C ATOM 1326 CG1 ILE A 83 7.774 9.973 11.336 1.00 0.00 C ATOM 1327 CG2 ILE A 83 9.416 10.931 9.689 1.00 0.00 C ATOM 1328 CD1 ILE A 83 8.531 8.720 11.787 1.00 0.00 C ATOM 0 H ILE A 83 5.765 9.541 9.246 1.00 0.00 H new ATOM 0 HA ILE A 83 6.814 12.050 10.116 1.00 0.00 H new ATOM 0 HB ILE A 83 7.977 9.411 9.244 1.00 0.00 H new ATOM 0 HG12 ILE A 83 8.078 10.818 11.954 1.00 0.00 H new ATOM 0 HG13 ILE A 83 6.707 9.826 11.500 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.167 10.227 10.047 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.596 11.151 8.637 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.477 11.853 10.268 1.00 0.00 H new ATOM 0 HD11 ILE A 83 8.322 8.528 12.839 1.00 0.00 H new ATOM 0 HD12 ILE A 83 8.209 7.866 11.191 1.00 0.00 H new ATOM 0 HD13 ILE A 83 9.602 8.873 11.652 1.00 0.00 H new ATOM 1340 N TYR A 84 7.105 11.288 6.900 1.00 0.00 N ATOM 1341 CA TYR A 84 7.234 11.942 5.599 1.00 0.00 C ATOM 1342 C TYR A 84 6.317 13.164 5.573 1.00 0.00 C ATOM 1343 O TYR A 84 6.747 14.259 5.217 1.00 0.00 O ATOM 1344 CB TYR A 84 6.904 10.978 4.448 1.00 0.00 C ATOM 1345 CG TYR A 84 7.759 9.729 4.299 1.00 0.00 C ATOM 1346 CD1 TYR A 84 9.057 9.648 4.845 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.289 8.685 3.480 1.00 0.00 C ATOM 1348 CE1 TYR A 84 9.884 8.552 4.545 1.00 0.00 C ATOM 1349 CE2 TYR A 84 8.116 7.588 3.183 1.00 0.00 C ATOM 1350 CZ TYR A 84 9.421 7.534 3.696 1.00 0.00 C ATOM 1351 OH TYR A 84 10.226 6.479 3.384 1.00 0.00 O ATOM 0 H TYR A 84 6.892 10.292 6.853 1.00 0.00 H new ATOM 0 HA TYR A 84 8.268 12.257 5.457 1.00 0.00 H new ATOM 0 HB2 TYR A 84 5.867 10.662 4.563 1.00 0.00 H new ATOM 0 HB3 TYR A 84 6.965 11.538 3.515 1.00 0.00 H new ATOM 0 HD1 TYR A 84 9.417 10.431 5.496 1.00 0.00 H new ATOM 0 HD2 TYR A 84 6.288 8.727 3.078 1.00 0.00 H new ATOM 0 HE1 TYR A 84 10.876 8.493 4.968 1.00 0.00 H new ATOM 0 HE2 TYR A 84 7.747 6.787 2.560 1.00 0.00 H new ATOM 0 HH TYR A 84 9.747 5.867 2.787 1.00 0.00 H new ATOM 1361 N ASN A 85 5.057 12.967 5.974 1.00 0.00 N ATOM 1362 CA ASN A 85 4.074 14.006 6.271 1.00 0.00 C ATOM 1363 C ASN A 85 3.562 14.736 5.033 1.00 0.00 C ATOM 1364 O ASN A 85 2.365 14.717 4.757 1.00 0.00 O ATOM 1365 CB ASN A 85 4.601 14.992 7.323 1.00 0.00 C ATOM 1366 CG ASN A 85 3.436 15.577 8.111 1.00 0.00 C ATOM 1367 OD1 ASN A 85 2.969 16.679 7.837 1.00 0.00 O ATOM 1368 ND2 ASN A 85 2.952 14.827 9.095 1.00 0.00 N ATOM 0 H ASN A 85 4.679 12.029 6.106 1.00 0.00 H new ATOM 0 HA ASN A 85 3.211 13.487 6.689 1.00 0.00 H new ATOM 0 HB2 ASN A 85 5.290 14.484 7.998 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.161 15.791 6.837 1.00 0.00 H new ATOM 0 HD21 ASN A 85 2.166 15.162 9.652 1.00 0.00 H new ATOM 0 HD22 ASN A 85 3.366 13.916 9.293 1.00 0.00 H new ATOM 1375 N GLU A 86 4.463 15.360 4.270 1.00 0.00 N ATOM 1376 CA GLU A 86 4.172 15.971 2.980 1.00 0.00 C ATOM 1377 C GLU A 86 3.330 15.006 2.146 1.00 0.00 C ATOM 1378 O GLU A 86 2.270 15.381 1.653 1.00 0.00 O ATOM 1379 CB GLU A 86 5.486 16.346 2.283 1.00 0.00 C ATOM 1380 CG GLU A 86 5.239 17.101 0.971 1.00 0.00 C ATOM 1381 CD GLU A 86 6.553 17.532 0.331 1.00 0.00 C ATOM 1382 OE1 GLU A 86 7.056 18.603 0.733 1.00 0.00 O ATOM 1383 OE2 GLU A 86 7.038 16.776 -0.539 1.00 0.00 O ATOM 0 H GLU A 86 5.441 15.454 4.544 1.00 0.00 H new ATOM 0 HA GLU A 86 3.597 16.888 3.110 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.088 16.963 2.950 1.00 0.00 H new ATOM 0 HB3 GLU A 86 6.061 15.442 2.080 1.00 0.00 H new ATOM 0 HG2 GLU A 86 4.686 16.465 0.280 1.00 0.00 H new ATOM 0 HG3 GLU A 86 4.620 17.977 1.163 1.00 0.00 H new ATOM 1390 N ALA A 87 3.783 13.750 2.074 1.00 0.00 N ATOM 1391 CA ALA A 87 3.090 12.628 1.451 1.00 0.00 C ATOM 1392 C ALA A 87 1.582 12.641 1.715 1.00 0.00 C ATOM 1393 O ALA A 87 0.802 12.398 0.798 1.00 0.00 O ATOM 1394 CB ALA A 87 3.708 11.320 1.954 1.00 0.00 C ATOM 0 H ALA A 87 4.684 13.480 2.468 1.00 0.00 H new ATOM 0 HA ALA A 87 3.214 12.717 0.372 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.196 10.475 1.493 1.00 0.00 H new ATOM 0 HB2 ALA A 87 4.765 11.292 1.690 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.603 11.261 3.037 1.00 0.00 H new ATOM 1400 N LEU A 88 1.170 12.914 2.958 1.00 0.00 N ATOM 1401 CA LEU A 88 -0.238 12.939 3.325 1.00 0.00 C ATOM 1402 C LEU A 88 -0.979 13.996 2.515 1.00 0.00 C ATOM 1403 O LEU A 88 -2.035 13.731 1.951 1.00 0.00 O ATOM 1404 CB LEU A 88 -0.415 13.180 4.833 1.00 0.00 C ATOM 1405 CG LEU A 88 0.387 12.228 5.736 1.00 0.00 C ATOM 1406 CD1 LEU A 88 0.024 12.520 7.195 1.00 0.00 C ATOM 1407 CD2 LEU A 88 0.111 10.754 5.423 1.00 0.00 C ATOM 0 H LEU A 88 1.804 13.122 3.729 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.667 11.964 3.094 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -0.123 14.205 5.060 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.473 13.088 5.080 1.00 0.00 H new ATOM 0 HG LEU A 88 1.448 12.400 5.554 1.00 0.00 H new ATOM 0 HD11 LEU A 88 0.584 11.853 7.850 1.00 0.00 H new ATOM 0 HD12 LEU A 88 0.273 13.554 7.432 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.044 12.361 7.343 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.702 10.124 6.088 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.948 10.543 5.569 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.383 10.545 4.388 1.00 0.00 H new ATOM 1479 N SER B 3 10.260 3.658 -5.130 1.00 0.00 N ATOM 1480 CA SER B 3 9.033 3.607 -5.902 1.00 0.00 C ATOM 1481 C SER B 3 8.133 2.396 -5.614 1.00 0.00 C ATOM 1482 O SER B 3 6.945 2.604 -5.360 1.00 0.00 O ATOM 1483 CB SER B 3 9.391 3.735 -7.385 1.00 0.00 C ATOM 1484 OG SER B 3 10.430 4.691 -7.511 1.00 0.00 O ATOM 0 HA SER B 3 8.413 4.447 -5.590 1.00 0.00 H new ATOM 0 HB2 SER B 3 9.711 2.772 -7.783 1.00 0.00 H new ATOM 0 HB3 SER B 3 8.519 4.044 -7.961 1.00 0.00 H new ATOM 0 HG SER B 3 10.956 4.713 -6.684 1.00 0.00 H new ATOM 1490 N PRO B 4 8.624 1.140 -5.665 1.00 0.00 N ATOM 1491 CA PRO B 4 7.738 -0.012 -5.609 1.00 0.00 C ATOM 1492 C PRO B 4 6.964 -0.119 -4.298 1.00 0.00 C ATOM 1493 O PRO B 4 5.817 -0.567 -4.328 1.00 0.00 O ATOM 1494 CB PRO B 4 8.601 -1.246 -5.883 1.00 0.00 C ATOM 1495 CG PRO B 4 10.002 -0.785 -5.488 1.00 0.00 C ATOM 1496 CD PRO B 4 9.994 0.689 -5.891 1.00 0.00 C ATOM 0 HA PRO B 4 6.956 0.087 -6.362 1.00 0.00 H new ATOM 0 HB2 PRO B 4 8.277 -2.103 -5.292 1.00 0.00 H new ATOM 0 HB3 PRO B 4 8.556 -1.545 -6.930 1.00 0.00 H new ATOM 0 HG2 PRO B 4 10.185 -0.913 -4.421 1.00 0.00 H new ATOM 0 HG3 PRO B 4 10.776 -1.345 -6.013 1.00 0.00 H new ATOM 0 HD2 PRO B 4 10.702 1.264 -5.294 1.00 0.00 H new ATOM 0 HD3 PRO B 4 10.282 0.813 -6.935 1.00 0.00 H new ATOM 1504 N LEU B 5 7.558 0.276 -3.165 1.00 0.00 N ATOM 1505 CA LEU B 5 6.802 0.404 -1.924 1.00 0.00 C ATOM 1506 C LEU B 5 6.069 1.745 -1.872 1.00 0.00 C ATOM 1507 O LEU B 5 4.893 1.791 -1.508 1.00 0.00 O ATOM 1508 CB LEU B 5 7.689 0.190 -0.693 1.00 0.00 C ATOM 1509 CG LEU B 5 6.854 0.218 0.603 1.00 0.00 C ATOM 1510 CD1 LEU B 5 5.760 -0.854 0.628 1.00 0.00 C ATOM 1511 CD2 LEU B 5 7.750 -0.024 1.815 1.00 0.00 C ATOM 0 H LEU B 5 8.548 0.509 -3.087 1.00 0.00 H new ATOM 0 HA LEU B 5 6.051 -0.386 -1.908 1.00 0.00 H new ATOM 0 HB2 LEU B 5 8.207 -0.766 -0.775 1.00 0.00 H new ATOM 0 HB3 LEU B 5 8.455 0.965 -0.653 1.00 0.00 H new ATOM 0 HG LEU B 5 6.388 1.203 0.637 1.00 0.00 H new ATOM 0 HD11 LEU B 5 5.205 -0.786 1.564 1.00 0.00 H new ATOM 0 HD12 LEU B 5 5.080 -0.699 -0.209 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.216 -1.841 0.547 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.148 -0.002 2.723 1.00 0.00 H new ATOM 0 HD22 LEU B 5 8.232 -0.998 1.723 1.00 0.00 H new ATOM 0 HD23 LEU B 5 8.512 0.754 1.866 1.00 0.00 H new ATOM 1523 N ASP B 6 6.767 2.837 -2.215 1.00 0.00 N ATOM 1524 CA ASP B 6 6.228 4.191 -2.115 1.00 0.00 C ATOM 1525 C ASP B 6 4.862 4.289 -2.785 1.00 0.00 C ATOM 1526 O ASP B 6 3.957 4.894 -2.222 1.00 0.00 O ATOM 1527 CB ASP B 6 7.176 5.230 -2.727 1.00 0.00 C ATOM 1528 CG ASP B 6 8.470 5.448 -1.949 1.00 0.00 C ATOM 1529 OD1 ASP B 6 8.584 4.907 -0.827 1.00 0.00 O ATOM 1530 OD2 ASP B 6 9.330 6.166 -2.504 1.00 0.00 O ATOM 0 H ASP B 6 7.723 2.801 -2.570 1.00 0.00 H new ATOM 0 HA ASP B 6 6.121 4.408 -1.052 1.00 0.00 H new ATOM 0 HB2 ASP B 6 7.426 4.921 -3.742 1.00 0.00 H new ATOM 0 HB3 ASP B 6 6.650 6.181 -2.804 1.00 0.00 H new ATOM 1535 N GLN B 7 4.695 3.691 -3.968 1.00 0.00 N ATOM 1536 CA GLN B 7 3.403 3.670 -4.644 1.00 0.00 C ATOM 1537 C GLN B 7 2.312 3.062 -3.752 1.00 0.00 C ATOM 1538 O GLN B 7 1.196 3.569 -3.708 1.00 0.00 O ATOM 1539 CB GLN B 7 3.515 2.934 -5.992 1.00 0.00 C ATOM 1540 CG GLN B 7 3.752 1.433 -5.788 1.00 0.00 C ATOM 1541 CD GLN B 7 4.095 0.669 -7.058 1.00 0.00 C ATOM 1542 OE1 GLN B 7 3.892 1.144 -8.170 1.00 0.00 O ATOM 1543 NE2 GLN B 7 4.610 -0.545 -6.887 1.00 0.00 N ATOM 0 H GLN B 7 5.442 3.216 -4.475 1.00 0.00 H new ATOM 0 HA GLN B 7 3.106 4.699 -4.847 1.00 0.00 H new ATOM 0 HB2 GLN B 7 2.602 3.085 -6.569 1.00 0.00 H new ATOM 0 HB3 GLN B 7 4.334 3.358 -6.574 1.00 0.00 H new ATOM 0 HG2 GLN B 7 4.561 1.300 -5.070 1.00 0.00 H new ATOM 0 HG3 GLN B 7 2.858 0.994 -5.345 1.00 0.00 H new ATOM 0 HE21 GLN B 7 4.764 -0.906 -5.945 1.00 0.00 H new ATOM 0 HE22 GLN B 7 4.851 -1.116 -7.697 1.00 0.00 H new ATOM 1552 N ALA B 8 2.617 1.968 -3.046 1.00 0.00 N ATOM 1553 CA ALA B 8 1.621 1.247 -2.267 1.00 0.00 C ATOM 1554 C ALA B 8 1.198 2.065 -1.053 1.00 0.00 C ATOM 1555 O ALA B 8 0.009 2.316 -0.865 1.00 0.00 O ATOM 1556 CB ALA B 8 2.143 -0.126 -1.857 1.00 0.00 C ATOM 0 H ALA B 8 3.553 1.565 -3.002 1.00 0.00 H new ATOM 0 HA ALA B 8 0.741 1.092 -2.891 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.381 -0.646 -1.276 1.00 0.00 H new ATOM 0 HB2 ALA B 8 2.379 -0.707 -2.749 1.00 0.00 H new ATOM 0 HB3 ALA B 8 3.043 -0.008 -1.253 1.00 0.00 H new ATOM 1562 N ILE B 9 2.159 2.510 -0.239 1.00 0.00 N ATOM 1563 CA ILE B 9 1.816 3.396 0.874 1.00 0.00 C ATOM 1564 C ILE B 9 1.133 4.656 0.318 1.00 0.00 C ATOM 1565 O ILE B 9 0.108 5.096 0.838 1.00 0.00 O ATOM 1566 CB ILE B 9 3.011 3.656 1.815 1.00 0.00 C ATOM 1567 CG1 ILE B 9 4.170 4.417 1.157 1.00 0.00 C ATOM 1568 CG2 ILE B 9 3.480 2.318 2.408 1.00 0.00 C ATOM 1569 CD1 ILE B 9 5.373 4.607 2.088 1.00 0.00 C ATOM 0 H ILE B 9 3.149 2.281 -0.324 1.00 0.00 H new ATOM 0 HA ILE B 9 1.095 2.907 1.529 1.00 0.00 H new ATOM 0 HB ILE B 9 2.663 4.317 2.609 1.00 0.00 H new ATOM 0 HG12 ILE B 9 4.490 3.878 0.265 1.00 0.00 H new ATOM 0 HG13 ILE B 9 3.815 5.394 0.829 1.00 0.00 H new ATOM 0 HG21 ILE B 9 4.325 2.492 3.075 1.00 0.00 H new ATOM 0 HG22 ILE B 9 2.664 1.862 2.968 1.00 0.00 H new ATOM 0 HG23 ILE B 9 3.785 1.650 1.602 1.00 0.00 H new ATOM 0 HD11 ILE B 9 6.157 5.152 1.562 1.00 0.00 H new ATOM 0 HD12 ILE B 9 5.066 5.172 2.968 1.00 0.00 H new ATOM 0 HD13 ILE B 9 5.752 3.633 2.396 1.00 0.00 H new ATOM 1581 N GLY B 10 1.646 5.171 -0.803 1.00 0.00 N ATOM 1582 CA GLY B 10 1.042 6.228 -1.597 1.00 0.00 C ATOM 1583 C GLY B 10 -0.433 5.961 -1.890 1.00 0.00 C ATOM 1584 O GLY B 10 -1.243 6.873 -1.786 1.00 0.00 O ATOM 0 H GLY B 10 2.530 4.845 -1.192 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.140 7.177 -1.069 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.585 6.329 -2.537 1.00 0.00 H new ATOM 1588 N LEU B 11 -0.797 4.729 -2.246 1.00 0.00 N ATOM 1589 CA LEU B 11 -2.175 4.337 -2.509 1.00 0.00 C ATOM 1590 C LEU B 11 -3.023 4.565 -1.256 1.00 0.00 C ATOM 1591 O LEU B 11 -3.987 5.330 -1.286 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.207 2.868 -2.970 1.00 0.00 C ATOM 1593 CG LEU B 11 -3.442 2.425 -3.768 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -4.768 2.770 -3.093 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -3.401 2.940 -5.209 1.00 0.00 C ATOM 0 H LEU B 11 -0.130 3.966 -2.361 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.598 4.948 -3.307 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.323 2.683 -3.580 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.125 2.232 -2.088 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.394 1.336 -3.794 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.594 2.426 -3.716 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -4.819 2.281 -2.120 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -4.839 3.850 -2.961 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.292 2.605 -5.740 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.369 4.030 -5.205 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.513 2.552 -5.709 1.00 0.00 H new ATOM 1607 N LEU B 12 -2.657 3.915 -0.146 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.356 4.054 1.128 1.00 0.00 C ATOM 1609 C LEU B 12 -3.515 5.530 1.491 1.00 0.00 C ATOM 1610 O LEU B 12 -4.606 5.965 1.873 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.591 3.324 2.250 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.839 1.810 2.320 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.262 1.041 1.128 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.226 1.234 3.602 1.00 0.00 C ATOM 0 H LEU B 12 -1.863 3.276 -0.110 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.343 3.604 1.023 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.523 3.497 2.114 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.867 3.768 3.207 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.922 1.685 2.306 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.474 -0.022 1.244 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.717 1.404 0.206 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.184 1.193 1.084 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.408 0.160 3.641 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.152 1.421 3.608 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.682 1.711 4.470 1.00 0.00 H new ATOM 1626 N ILE B 13 -2.421 6.285 1.380 1.00 0.00 N ATOM 1627 CA ILE B 13 -2.390 7.704 1.698 1.00 0.00 C ATOM 1628 C ILE B 13 -3.337 8.467 0.771 1.00 0.00 C ATOM 1629 O ILE B 13 -4.128 9.284 1.230 1.00 0.00 O ATOM 1630 CB ILE B 13 -0.944 8.226 1.607 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -0.058 7.597 2.697 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -0.933 9.746 1.774 1.00 0.00 C ATOM 1633 CD1 ILE B 13 1.433 7.712 2.362 1.00 0.00 C ATOM 0 H ILE B 13 -1.523 5.919 1.063 1.00 0.00 H new ATOM 0 HA ILE B 13 -2.735 7.863 2.720 1.00 0.00 H new ATOM 0 HB ILE B 13 -0.547 7.951 0.630 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -0.254 8.087 3.651 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -0.322 6.546 2.818 1.00 0.00 H new ATOM 0 HG21 ILE B 13 0.092 10.112 1.709 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.532 10.203 0.986 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.351 10.008 2.746 1.00 0.00 H new ATOM 0 HD11 ILE B 13 2.021 7.255 3.158 1.00 0.00 H new ATOM 0 HD12 ILE B 13 1.635 7.199 1.422 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.705 8.763 2.268 1.00 0.00 H new ATOM 1645 N GLY B 14 -3.258 8.198 -0.530 1.00 0.00 N ATOM 1646 CA GLY B 14 -4.055 8.841 -1.557 1.00 0.00 C ATOM 1647 C GLY B 14 -5.536 8.634 -1.280 1.00 0.00 C ATOM 1648 O GLY B 14 -6.286 9.606 -1.207 1.00 0.00 O ATOM 0 H GLY B 14 -2.614 7.502 -0.905 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -3.829 9.907 -1.589 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -3.800 8.432 -2.535 1.00 0.00 H new ATOM 1652 N ILE B 15 -5.950 7.373 -1.089 1.00 0.00 N ATOM 1653 CA ILE B 15 -7.315 7.047 -0.710 1.00 0.00 C ATOM 1654 C ILE B 15 -7.676 7.899 0.507 1.00 0.00 C ATOM 1655 O ILE B 15 -8.576 8.736 0.444 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.450 5.520 -0.493 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.759 4.870 -1.851 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.538 5.148 0.519 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -7.782 3.338 -1.815 1.00 0.00 C ATOM 0 H ILE B 15 -5.344 6.560 -1.195 1.00 0.00 H new ATOM 0 HA ILE B 15 -8.032 7.285 -1.496 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.510 5.155 -0.079 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.726 5.230 -2.204 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -7.014 5.196 -2.577 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.581 4.064 0.625 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.306 5.598 1.484 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.502 5.517 0.169 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -8.007 2.954 -2.810 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -6.809 2.967 -1.494 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.547 3.002 -1.115 1.00 0.00 H new ATOM 1671 N PHE B 16 -6.926 7.715 1.594 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.197 8.371 2.859 1.00 0.00 C ATOM 1673 C PHE B 16 -7.436 9.869 2.679 1.00 0.00 C ATOM 1674 O PHE B 16 -8.493 10.390 3.040 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.017 8.123 3.796 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.216 8.694 5.175 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -6.854 7.928 6.163 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -5.828 10.018 5.448 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.970 8.426 7.468 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -6.018 10.543 6.731 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.514 9.720 7.754 1.00 0.00 C ATOM 0 H PHE B 16 -6.111 7.102 1.614 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.109 7.955 3.287 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.847 7.049 3.877 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.118 8.556 3.358 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -7.255 6.956 5.918 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -5.386 10.626 4.672 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -7.407 7.818 8.246 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -5.784 11.578 6.933 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.545 10.087 8.769 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.441 10.569 2.132 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.478 12.014 2.100 1.00 0.00 C ATOM 1693 C HIS B 17 -7.456 12.529 1.046 1.00 0.00 C ATOM 1694 O HIS B 17 -7.931 13.657 1.165 1.00 0.00 O ATOM 1695 CB HIS B 17 -5.082 12.637 2.014 1.00 0.00 C ATOM 1696 CG HIS B 17 -5.045 13.991 2.687 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -5.950 15.010 2.490 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -4.277 14.339 3.768 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -5.706 15.958 3.409 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -4.691 15.597 4.212 1.00 0.00 N ATOM 0 H HIS B 17 -5.610 10.154 1.711 1.00 0.00 H new ATOM 0 HA HIS B 17 -6.871 12.352 3.059 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -4.356 11.974 2.484 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -4.790 12.739 0.969 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -6.676 15.039 1.774 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -3.488 13.743 4.202 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -6.252 16.886 3.492 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.794 11.725 0.030 1.00 0.00 N ATOM 1709 CA LYS B 18 -8.898 12.074 -0.850 1.00 0.00 C ATOM 1710 C LYS B 18 -10.170 12.154 -0.003 1.00 0.00 C ATOM 1711 O LYS B 18 -10.887 13.154 -0.046 1.00 0.00 O ATOM 1712 CB LYS B 18 -9.029 11.054 -1.990 1.00 0.00 C ATOM 1713 CG LYS B 18 -10.063 11.504 -3.034 1.00 0.00 C ATOM 1714 CD LYS B 18 -10.184 10.504 -4.195 1.00 0.00 C ATOM 1715 CE LYS B 18 -10.837 9.170 -3.804 1.00 0.00 C ATOM 1716 NZ LYS B 18 -12.214 9.355 -3.313 1.00 0.00 N ATOM 0 H LYS B 18 -7.325 10.847 -0.194 1.00 0.00 H new ATOM 0 HA LYS B 18 -8.719 13.040 -1.322 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -8.060 10.918 -2.471 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -9.320 10.086 -1.582 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.035 11.621 -2.554 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -9.781 12.481 -3.426 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -10.766 10.961 -4.996 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -9.190 10.307 -4.596 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -10.846 8.504 -4.666 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -10.239 8.685 -3.033 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -12.607 8.435 -3.028 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -12.208 9.998 -2.495 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -12.800 9.763 -4.069 1.00 0.00 H new ATOM 1730 N TYR B 19 -10.446 11.107 0.783 1.00 0.00 N ATOM 1731 CA TYR B 19 -11.626 11.099 1.638 1.00 0.00 C ATOM 1732 C TYR B 19 -11.594 12.232 2.660 1.00 0.00 C ATOM 1733 O TYR B 19 -12.595 12.927 2.800 1.00 0.00 O ATOM 1734 CB TYR B 19 -11.866 9.728 2.278 1.00 0.00 C ATOM 1735 CG TYR B 19 -12.421 8.732 1.283 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -13.777 8.783 0.920 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -11.553 7.876 0.590 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -14.221 8.095 -0.221 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -11.976 7.234 -0.581 1.00 0.00 C ATOM 1740 CZ TYR B 19 -13.302 7.380 -1.012 1.00 0.00 C ATOM 1741 OH TYR B 19 -13.676 6.878 -2.219 1.00 0.00 O ATOM 0 H TYR B 19 -9.872 10.266 0.841 1.00 0.00 H new ATOM 0 HA TYR B 19 -12.488 11.287 0.998 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -10.930 9.349 2.687 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -12.559 9.833 3.112 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -14.476 9.350 1.517 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -10.552 7.711 0.961 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -15.266 8.114 -0.491 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -11.284 6.630 -1.149 1.00 0.00 H new ATOM 0 HH TYR B 19 -12.908 6.442 -2.644 1.00 0.00 H new ATOM 1751 N SER B 20 -10.475 12.448 3.360 1.00 0.00 N ATOM 1752 CA SER B 20 -10.415 13.543 4.324 1.00 0.00 C ATOM 1753 C SER B 20 -10.620 14.889 3.609 1.00 0.00 C ATOM 1754 O SER B 20 -11.500 15.683 3.964 1.00 0.00 O ATOM 1755 CB SER B 20 -9.147 13.460 5.180 1.00 0.00 C ATOM 1756 OG SER B 20 -7.990 13.817 4.464 1.00 0.00 O ATOM 0 H SER B 20 -9.622 11.894 3.279 1.00 0.00 H new ATOM 0 HA SER B 20 -11.236 13.454 5.036 1.00 0.00 H new ATOM 0 HB2 SER B 20 -9.252 14.116 6.044 1.00 0.00 H new ATOM 0 HB3 SER B 20 -9.036 12.445 5.561 1.00 0.00 H new ATOM 0 HG SER B 20 -7.208 13.750 5.051 1.00 0.00 H new ATOM 1762 N GLY B 21 -9.840 15.102 2.548 1.00 0.00 N ATOM 1763 CA GLY B 21 -9.896 16.262 1.677 1.00 0.00 C ATOM 1764 C GLY B 21 -11.316 16.574 1.208 1.00 0.00 C ATOM 1765 O GLY B 21 -11.684 17.745 1.138 1.00 0.00 O ATOM 0 H GLY B 21 -9.121 14.436 2.265 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -9.492 17.127 2.203 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -9.259 16.091 0.809 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.333 14.882 8.456 1.00 0.00 N ATOM 1848 CA HIS B 27 -4.674 13.619 8.779 1.00 0.00 C ATOM 1849 C HIS B 27 -5.568 12.707 9.641 1.00 0.00 C ATOM 1850 O HIS B 27 -5.078 11.936 10.469 1.00 0.00 O ATOM 1851 CB HIS B 27 -3.317 13.914 9.436 1.00 0.00 C ATOM 1852 CG HIS B 27 -2.414 14.839 8.644 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -1.391 15.600 9.167 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -2.444 15.074 7.292 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -0.825 16.277 8.152 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -1.437 15.994 6.992 1.00 0.00 N ATOM 0 HA HIS B 27 -4.496 13.061 7.860 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.493 14.354 10.418 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -2.795 12.971 9.598 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -3.126 14.626 6.585 1.00 0.00 H new ATOM 0 HE1 HIS B 27 0.008 16.956 8.256 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -1.211 16.375 6.073 1.00 0.00 H new ATOM 1864 N THR B 28 -6.886 12.769 9.432 1.00 0.00 N ATOM 1865 CA THR B 28 -7.880 11.995 10.154 1.00 0.00 C ATOM 1866 C THR B 28 -9.124 11.876 9.270 1.00 0.00 C ATOM 1867 O THR B 28 -9.267 12.631 8.306 1.00 0.00 O ATOM 1868 CB THR B 28 -8.136 12.588 11.550 1.00 0.00 C ATOM 1869 OG1 THR B 28 -8.983 11.737 12.293 1.00 0.00 O ATOM 1870 CG2 THR B 28 -8.754 13.985 11.519 1.00 0.00 C ATOM 0 H THR B 28 -7.297 13.383 8.729 1.00 0.00 H new ATOM 0 HA THR B 28 -7.526 10.984 10.355 1.00 0.00 H new ATOM 0 HB THR B 28 -7.156 12.674 12.020 1.00 0.00 H new ATOM 0 HG1 THR B 28 -8.881 10.816 11.975 1.00 0.00 H new ATOM 0 HG21 THR B 28 -8.906 14.338 12.539 1.00 0.00 H new ATOM 0 HG22 THR B 28 -8.085 14.667 10.994 1.00 0.00 H new ATOM 0 HG23 THR B 28 -9.713 13.947 11.002 1.00 0.00 H new ATOM 1878 N LEU B 29 -9.983 10.906 9.585 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.302 10.708 8.991 1.00 0.00 C ATOM 1880 C LEU B 29 -12.325 10.612 10.125 1.00 0.00 C ATOM 1881 O LEU B 29 -11.964 10.283 11.252 1.00 0.00 O ATOM 1882 CB LEU B 29 -11.341 9.402 8.179 1.00 0.00 C ATOM 1883 CG LEU B 29 -10.415 9.366 6.953 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.287 7.919 6.460 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -10.964 10.208 5.801 1.00 0.00 C ATOM 0 H LEU B 29 -9.766 10.206 10.294 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.527 11.541 8.325 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -11.077 8.575 8.838 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -12.365 9.230 7.846 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.450 9.772 7.257 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -9.631 7.888 5.590 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.868 7.300 7.253 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -11.271 7.540 6.186 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -10.280 10.156 4.954 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -11.940 9.825 5.503 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -11.064 11.244 6.123 1.00 0.00 H new ATOM 1897 N SER B 30 -13.602 10.863 9.828 1.00 0.00 N ATOM 1898 CA SER B 30 -14.721 10.656 10.739 1.00 0.00 C ATOM 1899 C SER B 30 -15.437 9.335 10.411 1.00 0.00 C ATOM 1900 O SER B 30 -15.130 8.689 9.411 1.00 0.00 O ATOM 1901 CB SER B 30 -15.656 11.868 10.653 1.00 0.00 C ATOM 1902 OG SER B 30 -16.080 12.080 9.323 1.00 0.00 O ATOM 0 H SER B 30 -13.890 11.226 8.920 1.00 0.00 H new ATOM 0 HA SER B 30 -14.367 10.571 11.767 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.523 11.711 11.295 1.00 0.00 H new ATOM 0 HB3 SER B 30 -15.143 12.756 11.022 1.00 0.00 H new ATOM 0 HG SER B 30 -15.309 12.323 8.769 1.00 0.00 H new ATOM 1908 N LYS B 31 -16.393 8.921 11.251 1.00 0.00 N ATOM 1909 CA LYS B 31 -17.000 7.596 11.183 1.00 0.00 C ATOM 1910 C LYS B 31 -17.661 7.306 9.831 1.00 0.00 C ATOM 1911 O LYS B 31 -17.334 6.332 9.155 1.00 0.00 O ATOM 1912 CB LYS B 31 -17.965 7.396 12.369 1.00 0.00 C ATOM 1913 CG LYS B 31 -19.076 8.450 12.530 1.00 0.00 C ATOM 1914 CD LYS B 31 -19.894 8.162 13.796 1.00 0.00 C ATOM 1915 CE LYS B 31 -21.073 9.130 13.961 1.00 0.00 C ATOM 1916 NZ LYS B 31 -20.643 10.540 14.004 1.00 0.00 N ATOM 0 H LYS B 31 -16.766 9.504 12.000 1.00 0.00 H new ATOM 0 HA LYS B 31 -16.200 6.861 11.266 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -18.434 6.417 12.267 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -17.378 7.374 13.287 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -18.638 9.446 12.589 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -19.727 8.440 11.656 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -20.269 7.139 13.759 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -19.245 8.232 14.669 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -21.771 8.991 13.136 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -21.611 8.889 14.878 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -21.461 11.146 14.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -19.921 10.660 14.742 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -20.244 10.810 13.082 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.611 8.151 9.432 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.399 7.912 8.230 1.00 0.00 C ATOM 1932 C LYS B 32 -18.599 8.298 6.980 1.00 0.00 C ATOM 1933 O LYS B 32 -18.821 7.761 5.900 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.761 8.603 8.355 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.642 8.383 7.115 1.00 0.00 C ATOM 1936 CD LYS B 32 -23.083 8.872 7.330 1.00 0.00 C ATOM 1937 CE LYS B 32 -23.190 10.369 7.650 1.00 0.00 C ATOM 1938 NZ LYS B 32 -22.566 11.205 6.609 1.00 0.00 N ATOM 0 H LYS B 32 -18.852 9.009 9.928 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.612 6.849 8.118 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -21.278 8.225 9.237 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.611 9.672 8.507 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -21.206 8.907 6.264 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -21.654 7.322 6.864 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -23.666 8.659 6.434 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -23.532 8.303 8.145 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -24.240 10.643 7.753 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -22.713 10.569 8.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -22.750 12.208 6.813 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -21.540 11.036 6.597 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -22.968 10.961 5.681 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.631 9.198 7.128 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.659 9.498 6.090 1.00 0.00 C ATOM 1954 C GLU B 33 -15.826 8.243 5.796 1.00 0.00 C ATOM 1955 O GLU B 33 -15.648 7.858 4.640 1.00 0.00 O ATOM 1956 CB GLU B 33 -15.822 10.663 6.611 1.00 0.00 C ATOM 1957 CG GLU B 33 -14.758 11.195 5.654 1.00 0.00 C ATOM 1958 CD GLU B 33 -14.006 12.351 6.310 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -13.964 12.379 7.560 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -13.502 13.200 5.555 1.00 0.00 O ATOM 0 H GLU B 33 -17.501 9.743 7.981 1.00 0.00 H new ATOM 0 HA GLU B 33 -17.121 9.783 5.145 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.494 11.482 6.869 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.331 10.350 7.533 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -14.062 10.399 5.390 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -15.224 11.531 4.728 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.344 7.572 6.845 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.677 6.288 6.704 1.00 0.00 C ATOM 1969 C LEU B 34 -15.637 5.280 6.070 1.00 0.00 C ATOM 1970 O LEU B 34 -15.273 4.593 5.117 1.00 0.00 O ATOM 1971 CB LEU B 34 -14.119 5.847 8.068 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.531 4.427 8.141 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -14.616 3.341 8.136 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.497 4.171 7.040 1.00 0.00 C ATOM 0 H LEU B 34 -15.407 7.906 7.807 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.822 6.362 6.032 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.343 6.553 8.364 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -14.918 5.924 8.805 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.015 4.367 9.099 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -14.147 2.358 8.189 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -15.271 3.477 8.996 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -15.201 3.415 7.219 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.110 3.156 7.133 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.967 4.293 6.064 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.677 4.882 7.139 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.872 5.184 6.567 1.00 0.00 N ATOM 1987 CA LYS B 35 -17.867 4.309 5.955 1.00 0.00 C ATOM 1988 C LYS B 35 -17.932 4.574 4.443 1.00 0.00 C ATOM 1989 O LYS B 35 -17.865 3.639 3.652 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.226 4.532 6.640 1.00 0.00 C ATOM 1991 CG LYS B 35 -20.322 3.528 6.271 1.00 0.00 C ATOM 1992 CD LYS B 35 -19.963 2.120 6.750 1.00 0.00 C ATOM 1993 CE LYS B 35 -21.201 1.221 6.816 1.00 0.00 C ATOM 1994 NZ LYS B 35 -21.816 1.033 5.493 1.00 0.00 N ATOM 0 H LYS B 35 -17.202 5.697 7.384 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.589 3.264 6.091 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -19.078 4.502 7.720 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.577 5.534 6.394 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -21.268 3.837 6.717 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -20.466 3.522 5.191 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -19.228 1.681 6.076 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -19.499 2.176 7.735 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -20.923 0.251 7.228 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -21.931 1.659 7.496 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -22.670 0.447 5.587 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -22.074 1.959 5.095 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -21.140 0.561 4.860 1.00 0.00 H new ATOM 2008 N GLU B 36 -18.010 5.846 4.035 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.013 6.245 2.635 1.00 0.00 C ATOM 2010 C GLU B 36 -16.771 5.716 1.908 1.00 0.00 C ATOM 2011 O GLU B 36 -16.906 5.096 0.855 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.138 7.774 2.523 1.00 0.00 C ATOM 2013 CG GLU B 36 -18.478 8.240 1.099 1.00 0.00 C ATOM 2014 CD GLU B 36 -19.816 7.700 0.597 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -20.805 7.845 1.346 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -19.823 7.153 -0.527 1.00 0.00 O ATOM 0 H GLU B 36 -18.073 6.632 4.681 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.879 5.801 2.144 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -18.911 8.122 3.209 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.202 8.235 2.837 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -18.500 9.330 1.075 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -17.687 7.922 0.420 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.575 5.944 2.467 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.331 5.365 1.958 1.00 0.00 C ATOM 2025 C LEU B 37 -14.521 3.883 1.676 1.00 0.00 C ATOM 2026 O LEU B 37 -14.294 3.429 0.555 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.166 5.657 2.929 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.776 5.107 2.546 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.709 5.868 3.348 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.587 3.618 2.876 1.00 0.00 C ATOM 0 H LEU B 37 -15.446 6.537 3.287 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.066 5.833 1.010 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.083 6.738 3.042 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.431 5.254 3.906 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.685 5.235 1.467 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.720 5.490 3.088 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -10.765 6.931 3.112 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.884 5.724 4.414 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.587 3.303 2.578 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.712 3.464 3.948 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.328 3.029 2.336 1.00 0.00 H new ATOM 2042 N ILE B 38 -14.963 3.127 2.678 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.156 1.702 2.506 1.00 0.00 C ATOM 2044 C ILE B 38 -16.147 1.432 1.381 1.00 0.00 C ATOM 2045 O ILE B 38 -15.813 0.702 0.458 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.569 1.040 3.824 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -14.387 1.149 4.800 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -15.953 -0.429 3.592 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -14.724 0.550 6.158 1.00 0.00 C ATOM 0 H ILE B 38 -15.191 3.480 3.608 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.207 1.251 2.216 1.00 0.00 H new ATOM 0 HB ILE B 38 -16.442 1.542 4.241 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -13.520 0.638 4.381 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -14.111 2.196 4.922 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -16.244 -0.883 4.539 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -16.788 -0.481 2.893 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -15.100 -0.967 3.178 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -13.864 0.645 6.821 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -15.575 1.079 6.588 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -14.975 -0.504 6.039 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.359 1.982 1.431 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.350 1.625 0.428 1.00 0.00 C ATOM 2063 C GLN B 39 -17.906 2.015 -0.980 1.00 0.00 C ATOM 2064 O GLN B 39 -18.227 1.301 -1.929 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.739 2.190 0.757 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.268 1.843 2.158 1.00 0.00 C ATOM 2067 CD GLN B 39 -20.040 0.405 2.603 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -19.730 0.160 3.761 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -20.203 -0.573 1.721 1.00 0.00 N ATOM 0 H GLN B 39 -17.669 2.655 2.132 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.434 0.538 0.451 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.706 3.275 0.656 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -20.449 1.822 0.016 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -19.797 2.509 2.881 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -21.338 2.049 2.185 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -20.462 -0.354 0.759 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -20.070 -1.544 2.005 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.186 3.129 -1.139 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.796 3.584 -2.464 1.00 0.00 C ATOM 2080 C LYS B 40 -15.584 2.807 -2.984 1.00 0.00 C ATOM 2081 O LYS B 40 -15.537 2.479 -4.167 1.00 0.00 O ATOM 2082 CB LYS B 40 -16.605 5.106 -2.452 1.00 0.00 C ATOM 2083 CG LYS B 40 -16.613 5.670 -3.883 1.00 0.00 C ATOM 2084 CD LYS B 40 -16.578 7.207 -3.947 1.00 0.00 C ATOM 2085 CE LYS B 40 -17.684 7.899 -3.139 1.00 0.00 C ATOM 2086 NZ LYS B 40 -19.023 7.384 -3.470 1.00 0.00 N ATOM 0 H LYS B 40 -16.867 3.722 -0.373 1.00 0.00 H new ATOM 0 HA LYS B 40 -17.593 3.373 -3.177 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -17.399 5.572 -1.868 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -15.663 5.355 -1.964 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -15.754 5.274 -4.424 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -17.505 5.315 -4.398 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -15.610 7.552 -3.584 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -16.657 7.517 -4.989 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -17.496 7.758 -2.075 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -17.653 8.972 -3.329 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -19.678 8.181 -3.603 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -18.974 6.827 -4.347 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -19.364 6.780 -2.695 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.605 2.507 -2.123 1.00 0.00 N ATOM 2101 CA GLU B 41 -13.436 1.733 -2.520 1.00 0.00 C ATOM 2102 C GLU B 41 -13.762 0.234 -2.543 1.00 0.00 C ATOM 2103 O GLU B 41 -13.591 -0.433 -3.560 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.261 2.037 -1.575 1.00 0.00 C ATOM 2105 CG GLU B 41 -11.859 3.522 -1.569 1.00 0.00 C ATOM 2106 CD GLU B 41 -11.416 4.032 -2.936 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -10.637 3.311 -3.595 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -11.861 5.148 -3.289 1.00 0.00 O ATOM 0 H GLU B 41 -14.605 2.793 -1.144 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.145 2.021 -3.530 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.530 1.736 -0.563 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.401 1.435 -1.869 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.703 4.118 -1.222 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -11.050 3.669 -0.854 1.00 0.00 H new ATOM 2115 N LEU B 42 -14.198 -0.301 -1.403 1.00 0.00 N ATOM 2116 CA LEU B 42 -14.503 -1.706 -1.156 1.00 0.00 C ATOM 2117 C LEU B 42 -16.021 -1.899 -1.268 1.00 0.00 C ATOM 2118 O LEU B 42 -16.703 -2.210 -0.291 1.00 0.00 O ATOM 2119 CB LEU B 42 -13.992 -2.122 0.242 1.00 0.00 C ATOM 2120 CG LEU B 42 -12.493 -2.451 0.369 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -12.171 -3.822 -0.237 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -11.580 -1.370 -0.216 1.00 0.00 C ATOM 0 H LEU B 42 -14.357 0.274 -0.576 1.00 0.00 H new ATOM 0 HA LEU B 42 -14.004 -2.337 -1.891 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -14.223 -1.317 0.940 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -14.559 -2.996 0.564 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.285 -2.483 1.439 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -11.105 -4.025 -0.132 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -12.740 -4.592 0.283 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.438 -3.825 -1.294 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -10.539 -1.667 -0.092 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -11.798 -1.244 -1.277 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -11.753 -0.428 0.304 1.00 0.00 H new ATOM 2243 N ASP B 50 -22.786 -4.940 5.710 1.00 0.00 N ATOM 2244 CA ASP B 50 -22.858 -3.639 6.376 1.00 0.00 C ATOM 2245 C ASP B 50 -22.601 -3.751 7.874 1.00 0.00 C ATOM 2246 O ASP B 50 -21.818 -2.982 8.424 1.00 0.00 O ATOM 2247 CB ASP B 50 -24.218 -2.970 6.134 1.00 0.00 C ATOM 2248 CG ASP B 50 -24.365 -1.687 6.945 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -23.917 -0.639 6.434 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -24.918 -1.778 8.062 1.00 0.00 O ATOM 0 HA ASP B 50 -22.073 -3.020 5.941 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -24.330 -2.745 5.073 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -25.017 -3.662 6.399 1.00 0.00 H new ATOM 2255 N ALA B 51 -23.261 -4.711 8.523 1.00 0.00 N ATOM 2256 CA ALA B 51 -23.091 -4.943 9.954 1.00 0.00 C ATOM 2257 C ALA B 51 -21.609 -5.117 10.303 1.00 0.00 C ATOM 2258 O ALA B 51 -21.100 -4.532 11.262 1.00 0.00 O ATOM 2259 CB ALA B 51 -23.902 -6.172 10.373 1.00 0.00 C ATOM 0 H ALA B 51 -23.923 -5.344 8.074 1.00 0.00 H new ATOM 0 HA ALA B 51 -23.458 -4.076 10.502 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -23.775 -6.345 11.442 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -24.957 -6.003 10.156 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -23.553 -7.044 9.820 1.00 0.00 H new ATOM 2265 N GLU B 52 -20.903 -5.908 9.495 1.00 0.00 N ATOM 2266 CA GLU B 52 -19.492 -6.166 9.707 1.00 0.00 C ATOM 2267 C GLU B 52 -18.714 -4.886 9.428 1.00 0.00 C ATOM 2268 O GLU B 52 -17.789 -4.569 10.169 1.00 0.00 O ATOM 2269 CB GLU B 52 -18.999 -7.328 8.835 1.00 0.00 C ATOM 2270 CG GLU B 52 -19.624 -8.686 9.202 1.00 0.00 C ATOM 2271 CD GLU B 52 -21.136 -8.771 8.994 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -21.617 -8.192 7.994 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -21.791 -9.406 9.847 1.00 0.00 O ATOM 0 H GLU B 52 -21.297 -6.382 8.682 1.00 0.00 H new ATOM 0 HA GLU B 52 -19.329 -6.466 10.742 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -19.220 -7.106 7.791 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -17.915 -7.402 8.922 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -19.145 -9.464 8.607 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -19.402 -8.902 10.247 1.00 0.00 H new ATOM 2280 N ILE B 53 -19.094 -4.134 8.389 1.00 0.00 N ATOM 2281 CA ILE B 53 -18.469 -2.846 8.135 1.00 0.00 C ATOM 2282 C ILE B 53 -18.601 -1.927 9.351 1.00 0.00 C ATOM 2283 O ILE B 53 -17.602 -1.342 9.751 1.00 0.00 O ATOM 2284 CB ILE B 53 -18.971 -2.152 6.859 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -18.823 -2.988 5.577 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -18.189 -0.838 6.704 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -17.410 -3.530 5.353 1.00 0.00 C ATOM 0 H ILE B 53 -19.821 -4.396 7.723 1.00 0.00 H new ATOM 0 HA ILE B 53 -17.413 -3.054 7.961 1.00 0.00 H new ATOM 0 HB ILE B 53 -20.042 -1.991 6.979 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -19.521 -3.824 5.617 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -19.108 -2.376 4.721 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -18.523 -0.320 5.805 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -18.365 -0.205 7.574 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -17.124 -1.056 6.623 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -17.384 -4.109 4.430 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -16.709 -2.699 5.280 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -17.129 -4.169 6.190 1.00 0.00 H new ATOM 2299 N VAL B 54 -19.790 -1.758 9.941 1.00 0.00 N ATOM 2300 CA VAL B 54 -19.906 -0.851 11.085 1.00 0.00 C ATOM 2301 C VAL B 54 -19.103 -1.359 12.289 1.00 0.00 C ATOM 2302 O VAL B 54 -18.471 -0.557 12.976 1.00 0.00 O ATOM 2303 CB VAL B 54 -21.348 -0.441 11.433 1.00 0.00 C ATOM 2304 CG1 VAL B 54 -21.885 0.567 10.406 1.00 0.00 C ATOM 2305 CG2 VAL B 54 -22.317 -1.612 11.597 1.00 0.00 C ATOM 0 H VAL B 54 -20.655 -2.219 9.658 1.00 0.00 H new ATOM 0 HA VAL B 54 -19.448 0.087 10.770 1.00 0.00 H new ATOM 0 HB VAL B 54 -21.290 0.028 12.415 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -22.906 0.845 10.669 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -21.255 1.457 10.406 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -21.876 0.116 9.414 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -23.309 -1.232 11.841 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -22.364 -2.178 10.667 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -21.970 -2.262 12.400 1.00 0.00 H new ATOM 2315 N LYS B 55 -19.069 -2.674 12.535 1.00 0.00 N ATOM 2316 CA LYS B 55 -18.174 -3.217 13.557 1.00 0.00 C ATOM 2317 C LYS B 55 -16.718 -2.846 13.241 1.00 0.00 C ATOM 2318 O LYS B 55 -15.998 -2.326 14.089 1.00 0.00 O ATOM 2319 CB LYS B 55 -18.385 -4.733 13.690 1.00 0.00 C ATOM 2320 CG LYS B 55 -17.410 -5.423 14.660 1.00 0.00 C ATOM 2321 CD LYS B 55 -17.297 -4.778 16.051 1.00 0.00 C ATOM 2322 CE LYS B 55 -18.634 -4.723 16.797 1.00 0.00 C ATOM 2323 NZ LYS B 55 -18.467 -4.119 18.131 1.00 0.00 N ATOM 0 H LYS B 55 -19.639 -3.367 12.050 1.00 0.00 H new ATOM 0 HA LYS B 55 -18.410 -2.774 14.525 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -19.405 -4.918 14.025 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -18.285 -5.190 12.706 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -17.720 -6.461 14.783 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.420 -5.438 14.204 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -16.577 -5.339 16.648 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -16.905 -3.767 15.945 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -19.354 -4.144 16.219 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -19.041 -5.729 16.897 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -19.386 -4.092 18.618 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -17.797 -4.687 18.688 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -18.100 -3.151 18.030 1.00 0.00 H new ATOM 2337 N LEU B 56 -16.279 -3.085 12.009 1.00 0.00 N ATOM 2338 CA LEU B 56 -14.945 -2.731 11.549 1.00 0.00 C ATOM 2339 C LEU B 56 -14.680 -1.225 11.718 1.00 0.00 C ATOM 2340 O LEU B 56 -13.613 -0.838 12.185 1.00 0.00 O ATOM 2341 CB LEU B 56 -14.781 -3.265 10.119 1.00 0.00 C ATOM 2342 CG LEU B 56 -13.603 -2.683 9.329 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -13.021 -3.756 8.403 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -14.093 -1.541 8.440 1.00 0.00 C ATOM 0 H LEU B 56 -16.850 -3.536 11.294 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.174 -3.200 12.160 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -14.666 -4.348 10.165 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -15.700 -3.066 9.568 1.00 0.00 H new ATOM 0 HG LEU B 56 -12.853 -2.332 10.038 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.184 -3.339 7.843 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.674 -4.601 8.998 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -13.790 -4.093 7.708 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.253 -1.130 7.880 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -14.843 -1.917 7.745 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.533 -0.760 9.060 1.00 0.00 H new ATOM 2356 N MET B 57 -15.648 -0.371 11.383 1.00 0.00 N ATOM 2357 CA MET B 57 -15.563 1.072 11.560 1.00 0.00 C ATOM 2358 C MET B 57 -15.362 1.393 13.040 1.00 0.00 C ATOM 2359 O MET B 57 -14.487 2.186 13.385 1.00 0.00 O ATOM 2360 CB MET B 57 -16.806 1.746 10.962 1.00 0.00 C ATOM 2361 CG MET B 57 -16.835 3.268 11.162 1.00 0.00 C ATOM 2362 SD MET B 57 -17.312 3.882 12.801 1.00 0.00 S ATOM 2363 CE MET B 57 -19.007 3.273 12.945 1.00 0.00 C ATOM 0 H MET B 57 -16.531 -0.674 10.972 1.00 0.00 H new ATOM 0 HA MET B 57 -14.702 1.472 11.025 1.00 0.00 H new ATOM 0 HB2 MET B 57 -16.850 1.527 9.895 1.00 0.00 H new ATOM 0 HB3 MET B 57 -17.698 1.311 11.414 1.00 0.00 H new ATOM 0 HG2 MET B 57 -15.844 3.658 10.931 1.00 0.00 H new ATOM 0 HG3 MET B 57 -17.522 3.692 10.430 1.00 0.00 H new ATOM 0 HE1 MET B 57 -19.510 3.788 13.763 1.00 0.00 H new ATOM 0 HE2 MET B 57 -19.542 3.461 12.014 1.00 0.00 H new ATOM 0 HE3 MET B 57 -18.993 2.202 13.145 1.00 0.00 H new ATOM 2373 N ASP B 58 -16.139 0.754 13.917 1.00 0.00 N ATOM 2374 CA ASP B 58 -15.931 0.872 15.351 1.00 0.00 C ATOM 2375 C ASP B 58 -14.490 0.481 15.698 1.00 0.00 C ATOM 2376 O ASP B 58 -13.777 1.253 16.326 1.00 0.00 O ATOM 2377 CB ASP B 58 -16.980 0.059 16.120 1.00 0.00 C ATOM 2378 CG ASP B 58 -16.668 0.022 17.611 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -16.907 1.056 18.269 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -16.203 -1.047 18.065 1.00 0.00 O ATOM 0 H ASP B 58 -16.917 0.150 13.653 1.00 0.00 H new ATOM 0 HA ASP B 58 -16.066 1.908 15.660 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -17.967 0.494 15.964 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -17.014 -0.958 15.728 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.024 -0.688 15.255 1.00 0.00 N ATOM 2386 CA ASP B 59 -12.652 -1.126 15.511 1.00 0.00 C ATOM 2387 C ASP B 59 -11.604 -0.166 14.929 1.00 0.00 C ATOM 2388 O ASP B 59 -10.500 -0.078 15.461 1.00 0.00 O ATOM 2389 CB ASP B 59 -12.428 -2.555 15.007 1.00 0.00 C ATOM 2390 CG ASP B 59 -13.210 -3.586 15.816 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -12.963 -3.652 17.041 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -14.017 -4.311 15.193 1.00 0.00 O ATOM 0 H ASP B 59 -14.580 -1.351 14.715 1.00 0.00 H new ATOM 0 HA ASP B 59 -12.518 -1.116 16.593 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -12.724 -2.619 13.960 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -11.365 -2.791 15.053 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.924 0.550 13.848 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.090 1.618 13.311 1.00 0.00 C ATOM 2399 C LEU B 60 -11.072 2.818 14.266 1.00 0.00 C ATOM 2400 O LEU B 60 -10.000 3.229 14.717 1.00 0.00 O ATOM 2401 CB LEU B 60 -11.556 2.009 11.893 1.00 0.00 C ATOM 2402 CG LEU B 60 -10.903 1.157 10.793 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -11.799 1.012 9.561 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.600 1.807 10.318 1.00 0.00 C ATOM 0 H LEU B 60 -12.782 0.399 13.317 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.065 1.258 13.225 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.639 1.906 11.831 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -11.325 3.060 11.717 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.726 0.177 11.236 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -11.293 0.402 8.813 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.736 0.533 9.847 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.007 1.998 9.145 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.149 1.192 9.539 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.812 2.799 9.919 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.910 1.893 11.157 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.234 3.407 14.573 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.284 4.646 15.350 1.00 0.00 C ATOM 2418 C ASP B 61 -11.920 4.453 16.825 1.00 0.00 C ATOM 2419 O ASP B 61 -11.393 5.375 17.449 1.00 0.00 O ATOM 2420 CB ASP B 61 -13.586 5.431 15.130 1.00 0.00 C ATOM 2421 CG ASP B 61 -14.868 4.845 15.717 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -14.780 3.897 16.522 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -15.937 5.381 15.350 1.00 0.00 O ATOM 0 H ASP B 61 -13.147 3.046 14.296 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.492 5.281 14.953 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -13.451 6.430 15.545 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -13.731 5.549 14.056 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.130 3.243 17.352 1.00 0.00 N ATOM 2429 CA ARG B 62 -11.776 2.798 18.698 1.00 0.00 C ATOM 2430 C ARG B 62 -10.410 3.335 19.121 1.00 0.00 C ATOM 2431 O ARG B 62 -10.223 3.770 20.254 1.00 0.00 O ATOM 2432 CB ARG B 62 -11.762 1.262 18.690 1.00 0.00 C ATOM 2433 CG ARG B 62 -11.307 0.590 19.993 1.00 0.00 C ATOM 2434 CD ARG B 62 -10.945 -0.868 19.692 1.00 0.00 C ATOM 2435 NE ARG B 62 -9.716 -0.930 18.883 1.00 0.00 N ATOM 2436 CZ ARG B 62 -9.379 -1.882 18.002 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -10.178 -2.929 17.764 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -8.215 -1.770 17.354 1.00 0.00 N ATOM 0 H ARG B 62 -12.581 2.503 16.813 1.00 0.00 H new ATOM 0 HA ARG B 62 -12.505 3.177 19.414 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -12.766 0.910 18.453 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -11.109 0.928 17.884 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -10.447 1.115 20.409 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -12.100 0.636 20.739 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -10.804 -1.415 20.624 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -11.764 -1.351 19.160 1.00 0.00 H new ATOM 0 HE ARG B 62 -9.050 -0.167 19.006 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -11.066 -3.015 18.258 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -9.899 -3.640 17.088 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -7.605 -0.973 17.535 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -7.937 -2.482 16.679 1.00 0.00 H new ATOM 2517 N GLU B 67 -13.097 9.627 15.771 1.00 0.00 N ATOM 2518 CA GLU B 67 -12.272 9.851 14.594 1.00 0.00 C ATOM 2519 C GLU B 67 -11.417 8.610 14.328 1.00 0.00 C ATOM 2520 O GLU B 67 -11.182 7.809 15.229 1.00 0.00 O ATOM 2521 CB GLU B 67 -11.411 11.115 14.742 1.00 0.00 C ATOM 2522 CG GLU B 67 -10.297 11.010 15.797 1.00 0.00 C ATOM 2523 CD GLU B 67 -9.251 12.108 15.622 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -9.655 13.290 15.661 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -8.065 11.743 15.457 1.00 0.00 O ATOM 0 HA GLU B 67 -12.921 10.018 13.734 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -10.959 11.346 13.777 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -12.059 11.953 14.999 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -10.732 11.077 16.794 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -9.817 10.034 15.724 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.922 8.485 13.101 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.907 7.525 12.709 1.00 0.00 C ATOM 2534 C VAL B 68 -8.700 8.375 12.321 1.00 0.00 C ATOM 2535 O VAL B 68 -8.774 9.128 11.351 1.00 0.00 O ATOM 2536 CB VAL B 68 -10.394 6.681 11.520 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -9.376 5.577 11.214 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -11.764 6.044 11.779 1.00 0.00 C ATOM 0 H VAL B 68 -11.231 9.073 12.327 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.670 6.821 13.506 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.494 7.354 10.668 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.727 4.982 10.371 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -8.415 6.027 10.966 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -9.262 4.935 12.088 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -12.063 5.459 10.910 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -11.704 5.393 12.651 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -12.501 6.827 11.960 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.609 8.338 13.085 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.412 9.092 12.725 1.00 0.00 C ATOM 2550 C ASN B 69 -5.623 8.324 11.666 1.00 0.00 C ATOM 2551 O ASN B 69 -5.645 7.095 11.665 1.00 0.00 O ATOM 2552 CB ASN B 69 -5.547 9.324 13.968 1.00 0.00 C ATOM 2553 CG ASN B 69 -4.202 9.957 13.611 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -3.261 9.269 13.226 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -4.109 11.279 13.701 1.00 0.00 N ATOM 0 H ASN B 69 -7.530 7.800 13.948 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.703 10.060 12.318 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -6.079 9.970 14.666 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.379 8.375 14.477 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -3.239 11.748 13.447 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -4.907 11.826 14.024 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.910 9.039 10.791 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.068 8.458 9.751 1.00 0.00 C ATOM 2564 C PHE B 70 -3.248 7.242 10.211 1.00 0.00 C ATOM 2565 O PHE B 70 -3.335 6.169 9.613 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.162 9.550 9.173 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.193 9.012 8.147 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.689 8.525 6.924 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.864 8.739 8.522 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.856 7.788 6.069 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -0.039 7.981 7.678 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.531 7.510 6.450 1.00 0.00 C ATOM 0 H PHE B 70 -4.905 10.059 10.789 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.733 8.069 8.980 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.778 10.325 8.716 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.605 10.022 9.982 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.714 8.719 6.643 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.480 9.113 9.459 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.231 7.435 5.120 1.00 0.00 H new ATOM 0 HE2 PHE B 70 0.976 7.759 7.973 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.109 6.934 5.798 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.444 7.392 11.267 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.568 6.310 11.705 1.00 0.00 C ATOM 2584 C GLN B 71 -2.404 5.080 12.061 1.00 0.00 C ATOM 2585 O GLN B 71 -2.062 3.951 11.703 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.723 6.775 12.896 1.00 0.00 C ATOM 2587 CG GLN B 71 0.302 5.709 13.309 1.00 0.00 C ATOM 2588 CD GLN B 71 1.062 6.125 14.561 1.00 0.00 C ATOM 2589 OE1 GLN B 71 2.233 6.482 14.497 1.00 0.00 O ATOM 2590 NE2 GLN B 71 0.401 6.080 15.715 1.00 0.00 N ATOM 0 H GLN B 71 -2.384 8.243 11.827 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.890 6.036 10.897 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.205 7.699 12.637 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.375 7.001 13.740 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -0.208 4.762 13.489 1.00 0.00 H new ATOM 0 HG3 GLN B 71 1.005 5.543 12.493 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.573 5.778 15.733 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.868 6.347 16.581 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.506 5.304 12.774 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.383 4.242 13.235 1.00 0.00 C ATOM 2601 C GLU B 72 -5.097 3.594 12.047 1.00 0.00 C ATOM 2602 O GLU B 72 -5.264 2.377 12.028 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.343 4.782 14.302 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.648 4.915 15.670 1.00 0.00 C ATOM 2605 CD GLU B 72 -3.392 5.783 15.642 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -3.554 7.007 15.457 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -2.285 5.216 15.784 1.00 0.00 O ATOM 0 H GLU B 72 -3.814 6.237 13.048 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.799 3.454 13.710 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -5.725 5.754 13.991 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.201 4.116 14.392 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.354 5.336 16.386 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -4.383 3.921 16.031 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.479 4.381 11.038 1.00 0.00 N ATOM 2615 CA TYR B 73 -5.972 3.865 9.769 1.00 0.00 C ATOM 2616 C TYR B 73 -4.950 2.899 9.159 1.00 0.00 C ATOM 2617 O TYR B 73 -5.302 1.759 8.860 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.342 5.026 8.833 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.343 4.710 7.350 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.514 4.248 6.722 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.209 5.019 6.574 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.564 4.143 5.321 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.247 4.869 5.178 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.433 4.455 4.549 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.515 4.432 3.189 1.00 0.00 O ATOM 0 H TYR B 73 -5.453 5.400 11.084 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.885 3.292 9.931 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.333 5.387 9.108 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.645 5.845 9.009 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.374 3.974 7.316 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.308 5.372 7.054 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.474 3.822 4.837 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.365 5.072 4.589 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.823 5.013 2.810 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.689 3.321 8.991 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.667 2.435 8.430 1.00 0.00 C ATOM 2637 C ILE B 74 -2.535 1.171 9.291 1.00 0.00 C ATOM 2638 O ILE B 74 -2.592 0.055 8.776 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.303 3.138 8.277 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.333 4.386 7.375 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.267 2.129 7.753 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.510 4.095 5.881 1.00 0.00 C ATOM 0 H ILE B 74 -3.358 4.255 9.232 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.990 2.153 7.428 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.027 3.499 9.268 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.145 5.035 7.703 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.405 4.941 7.515 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.699 2.623 7.644 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.174 1.303 8.458 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.590 1.745 6.785 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.519 5.033 5.326 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.685 3.475 5.531 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.452 3.570 5.722 1.00 0.00 H new ATOM 2654 N THR B 75 -2.363 1.346 10.604 1.00 0.00 N ATOM 2655 CA THR B 75 -2.224 0.246 11.553 1.00 0.00 C ATOM 2656 C THR B 75 -3.369 -0.757 11.375 1.00 0.00 C ATOM 2657 O THR B 75 -3.151 -1.961 11.220 1.00 0.00 O ATOM 2658 CB THR B 75 -2.191 0.809 12.982 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.144 1.752 13.098 1.00 0.00 O ATOM 2660 CG2 THR B 75 -1.981 -0.288 14.027 1.00 0.00 C ATOM 0 H THR B 75 -2.316 2.267 11.040 1.00 0.00 H new ATOM 0 HA THR B 75 -1.290 -0.284 11.367 1.00 0.00 H new ATOM 0 HB THR B 75 -3.157 1.279 13.168 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.427 2.605 12.707 1.00 0.00 H new ATOM 0 HG21 THR B 75 -1.964 0.156 15.022 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.795 -1.010 13.965 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.033 -0.793 13.839 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.602 -0.249 11.380 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.782 -1.070 11.205 1.00 0.00 C ATOM 2670 C PHE B 76 -5.752 -1.761 9.847 1.00 0.00 C ATOM 2671 O PHE B 76 -6.037 -2.948 9.770 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.054 -0.243 11.370 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.296 -1.104 11.257 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.811 -1.420 9.985 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.807 -1.753 12.397 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -9.851 -2.352 9.858 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -9.810 -2.729 12.259 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.325 -3.035 10.988 1.00 0.00 C ATOM 0 H PHE B 76 -4.802 0.743 11.506 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.783 -1.837 11.980 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.042 0.255 12.340 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.082 0.539 10.611 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.404 -0.943 9.105 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.429 -1.501 13.377 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.288 -2.544 8.889 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.185 -3.244 13.131 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.085 -3.795 10.881 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.413 -1.054 8.766 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.261 -1.704 7.469 1.00 0.00 C ATOM 2690 C LEU B 77 -4.228 -2.829 7.545 1.00 0.00 C ATOM 2691 O LEU B 77 -4.415 -3.867 6.918 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.935 -0.693 6.363 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.181 0.078 5.896 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.754 1.180 4.927 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.174 -0.834 5.163 1.00 0.00 C ATOM 0 H LEU B 77 -5.242 -0.048 8.765 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.217 -2.154 7.203 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.188 0.013 6.727 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.493 -1.215 5.514 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.666 0.489 6.782 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.633 1.731 4.592 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -5.069 1.862 5.431 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.255 0.734 4.066 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -8.040 -0.251 4.849 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.692 -1.267 4.287 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.497 -1.632 5.831 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.175 -2.666 8.346 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.270 -3.759 8.660 1.00 0.00 C ATOM 2709 C GLY B 78 -3.027 -4.936 9.266 1.00 0.00 C ATOM 2710 O GLY B 78 -2.938 -6.057 8.766 1.00 0.00 O ATOM 0 H GLY B 78 -2.931 -1.780 8.789 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.754 -4.080 7.755 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.506 -3.415 9.357 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.796 -4.683 10.326 1.00 0.00 N ATOM 2715 CA ALA B 79 -4.629 -5.714 10.932 1.00 0.00 C ATOM 2716 C ALA B 79 -5.548 -6.373 9.895 1.00 0.00 C ATOM 2717 O ALA B 79 -5.653 -7.592 9.858 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.416 -5.150 12.120 1.00 0.00 C ATOM 0 H ALA B 79 -3.857 -3.772 10.780 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.974 -6.496 11.315 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -6.030 -5.938 12.556 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -4.721 -4.774 12.871 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -6.057 -4.337 11.779 1.00 0.00 H new ATOM 2724 N LEU B 80 -6.186 -5.588 9.026 1.00 0.00 N ATOM 2725 CA LEU B 80 -7.045 -6.080 7.955 1.00 0.00 C ATOM 2726 C LEU B 80 -6.251 -7.011 7.033 1.00 0.00 C ATOM 2727 O LEU B 80 -6.677 -8.121 6.721 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.624 -4.886 7.176 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.897 -5.224 6.388 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -10.097 -5.461 7.312 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.240 -4.050 5.466 1.00 0.00 C ATOM 0 H LEU B 80 -6.117 -4.571 9.050 1.00 0.00 H new ATOM 0 HA LEU B 80 -7.871 -6.652 8.377 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -7.843 -4.079 7.875 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -6.868 -4.513 6.485 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.703 -6.136 5.824 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -10.976 -5.697 6.713 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -9.881 -6.292 7.983 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.288 -4.562 7.898 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.144 -4.282 4.902 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.406 -3.154 6.064 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.415 -3.877 4.775 1.00 0.00 H new ATOM 2743 N ALA B 81 -5.069 -6.553 6.619 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.159 -7.304 5.774 1.00 0.00 C ATOM 2745 C ALA B 81 -3.776 -8.626 6.447 1.00 0.00 C ATOM 2746 O ALA B 81 -3.669 -9.655 5.786 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.955 -6.426 5.420 1.00 0.00 C ATOM 0 H ALA B 81 -4.716 -5.630 6.871 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.644 -7.574 4.836 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.269 -6.987 4.785 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.296 -5.538 4.889 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.441 -6.127 6.334 1.00 0.00 H new ATOM 2753 N MET B 82 -3.606 -8.608 7.773 1.00 0.00 N ATOM 2754 CA MET B 82 -3.329 -9.799 8.563 1.00 0.00 C ATOM 2755 C MET B 82 -4.553 -10.715 8.660 1.00 0.00 C ATOM 2756 O MET B 82 -4.425 -11.933 8.554 1.00 0.00 O ATOM 2757 CB MET B 82 -2.783 -9.374 9.935 1.00 0.00 C ATOM 2758 CG MET B 82 -1.922 -10.462 10.584 1.00 0.00 C ATOM 2759 SD MET B 82 -1.081 -9.922 12.094 1.00 0.00 S ATOM 2760 CE MET B 82 -0.133 -11.409 12.477 1.00 0.00 C ATOM 0 H MET B 82 -3.659 -7.754 8.328 1.00 0.00 H new ATOM 0 HA MET B 82 -2.566 -10.397 8.065 1.00 0.00 H new ATOM 0 HB2 MET B 82 -2.191 -8.466 9.822 1.00 0.00 H new ATOM 0 HB3 MET B 82 -3.616 -9.132 10.595 1.00 0.00 H new ATOM 0 HG2 MET B 82 -2.552 -11.320 10.817 1.00 0.00 H new ATOM 0 HG3 MET B 82 -1.176 -10.800 9.864 1.00 0.00 H new ATOM 0 HE1 MET B 82 0.447 -11.247 13.386 1.00 0.00 H new ATOM 0 HE2 MET B 82 -0.814 -12.247 12.626 1.00 0.00 H new ATOM 0 HE3 MET B 82 0.542 -11.633 11.651 1.00 0.00 H new ATOM 2770 N ILE B 83 -5.743 -10.138 8.846 1.00 0.00 N ATOM 2771 CA ILE B 83 -7.002 -10.874 8.841 1.00 0.00 C ATOM 2772 C ILE B 83 -7.152 -11.589 7.497 1.00 0.00 C ATOM 2773 O ILE B 83 -7.593 -12.737 7.458 1.00 0.00 O ATOM 2774 CB ILE B 83 -8.182 -9.944 9.190 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -8.124 -9.598 10.691 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -9.534 -10.595 8.857 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -8.982 -8.386 11.064 1.00 0.00 C ATOM 0 H ILE B 83 -5.857 -9.137 9.006 1.00 0.00 H new ATOM 0 HA ILE B 83 -7.002 -11.640 9.617 1.00 0.00 H new ATOM 0 HB ILE B 83 -8.095 -9.038 8.590 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -8.455 -10.461 11.269 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -7.089 -9.403 10.973 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -10.341 -9.910 9.117 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -9.577 -10.819 7.791 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -9.644 -11.518 9.427 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -8.897 -8.196 12.134 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -8.637 -7.512 10.511 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -10.024 -8.586 10.813 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.733 -10.952 6.399 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.616 -11.607 5.101 1.00 0.00 C ATOM 2791 C TYR B 84 -5.425 -12.580 5.086 1.00 0.00 C ATOM 2792 O TYR B 84 -4.510 -12.453 4.275 1.00 0.00 O ATOM 2793 CB TYR B 84 -6.512 -10.557 3.983 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.606 -9.501 3.921 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.916 -9.769 4.365 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -7.319 -8.258 3.323 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -9.924 -8.800 4.218 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.329 -7.293 3.171 1.00 0.00 C ATOM 2799 CZ TYR B 84 -9.635 -7.570 3.609 1.00 0.00 C ATOM 2800 OH TYR B 84 -10.624 -6.646 3.450 1.00 0.00 O ATOM 0 H TYR B 84 -6.466 -9.968 6.390 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.515 -12.196 4.921 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.554 -10.047 4.086 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.493 -11.081 3.027 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -9.146 -10.721 4.819 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -6.317 -8.046 2.980 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -10.923 -9.003 4.575 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -8.102 -6.339 2.718 1.00 0.00 H new ATOM 0 HH TYR B 84 -10.259 -5.848 3.013 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.463 -13.603 5.945 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.454 -14.650 6.059 1.00 0.00 C ATOM 2812 C ASN B 85 -4.043 -15.223 4.704 1.00 0.00 C ATOM 2813 O ASN B 85 -2.867 -15.483 4.479 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.955 -15.768 6.980 1.00 0.00 C ATOM 2815 CG ASN B 85 -3.920 -16.885 7.098 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -4.040 -17.923 6.457 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -2.892 -16.685 7.920 1.00 0.00 N ATOM 0 H ASN B 85 -6.231 -13.726 6.605 1.00 0.00 H new ATOM 0 HA ASN B 85 -3.565 -14.191 6.491 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -5.170 -15.361 7.968 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -5.889 -16.173 6.591 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -2.178 -17.406 8.029 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -2.818 -15.811 8.441 1.00 0.00 H new ATOM 2824 N GLU B 86 -5.003 -15.399 3.791 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.733 -15.835 2.427 1.00 0.00 C ATOM 2826 C GLU B 86 -3.629 -14.989 1.778 1.00 0.00 C ATOM 2827 O GLU B 86 -2.739 -15.524 1.121 1.00 0.00 O ATOM 2828 CB GLU B 86 -6.021 -15.764 1.597 1.00 0.00 C ATOM 2829 CG GLU B 86 -7.107 -16.706 2.134 1.00 0.00 C ATOM 2830 CD GLU B 86 -8.364 -16.634 1.272 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -9.200 -15.752 1.564 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -8.455 -17.450 0.330 1.00 0.00 O ATOM 0 H GLU B 86 -5.992 -15.241 3.983 1.00 0.00 H new ATOM 0 HA GLU B 86 -4.381 -16.866 2.459 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -6.396 -14.741 1.598 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -5.799 -16.021 0.561 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -6.731 -17.729 2.151 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -7.350 -16.439 3.162 1.00 0.00 H new ATOM 2839 N ALA B 87 -3.681 -13.668 1.968 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.681 -12.754 1.440 1.00 0.00 C ATOM 2841 C ALA B 87 -1.328 -13.020 2.098 1.00 0.00 C ATOM 2842 O ALA B 87 -0.320 -13.108 1.403 1.00 0.00 O ATOM 2843 CB ALA B 87 -3.137 -11.304 1.632 1.00 0.00 C ATOM 0 H ALA B 87 -4.423 -13.207 2.495 1.00 0.00 H new ATOM 0 HA ALA B 87 -2.565 -12.921 0.369 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -2.380 -10.629 1.233 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -4.078 -11.146 1.106 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.277 -11.104 2.694 1.00 0.00 H new ATOM 2849 N LEU B 88 -1.300 -13.160 3.432 1.00 0.00 N ATOM 2850 CA LEU B 88 -0.072 -13.499 4.150 1.00 0.00 C ATOM 2851 C LEU B 88 0.546 -14.777 3.573 1.00 0.00 C ATOM 2852 O LEU B 88 1.750 -14.854 3.344 1.00 0.00 O ATOM 2853 CB LEU B 88 -0.322 -13.732 5.650 1.00 0.00 C ATOM 2854 CG LEU B 88 -1.008 -12.623 6.458 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -1.271 -13.156 7.874 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -0.108 -11.392 6.572 1.00 0.00 C ATOM 0 H LEU B 88 -2.117 -13.043 4.032 1.00 0.00 H new ATOM 0 HA LEU B 88 0.602 -12.651 4.029 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -0.924 -14.635 5.749 1.00 0.00 H new ATOM 0 HB3 LEU B 88 0.641 -13.937 6.119 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.933 -12.340 5.955 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.759 -12.384 8.469 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -1.916 -14.033 7.819 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -0.325 -13.430 8.341 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.618 -10.621 7.149 1.00 0.00 H new ATOM 0 HD22 LEU B 88 0.821 -11.665 7.073 1.00 0.00 H new ATOM 0 HD23 LEU B 88 0.115 -11.011 5.575 1.00 0.00 H new ATOM 2868 N LYS B 89 -0.297 -15.795 3.391 1.00 0.00 N ATOM 2869 CA LYS B 89 0.090 -17.118 2.937 1.00 0.00 C ATOM 2870 C LYS B 89 0.630 -17.055 1.508 1.00 0.00 C ATOM 2871 O LYS B 89 1.665 -17.647 1.206 1.00 0.00 O ATOM 2872 CB LYS B 89 -1.135 -18.035 3.047 1.00 0.00 C ATOM 2873 CG LYS B 89 -0.772 -19.523 2.961 1.00 0.00 C ATOM 2874 CD LYS B 89 -2.026 -20.411 2.887 1.00 0.00 C ATOM 2875 CE LYS B 89 -3.077 -20.102 3.964 1.00 0.00 C ATOM 2876 NZ LYS B 89 -2.514 -20.146 5.325 1.00 0.00 N ATOM 0 H LYS B 89 -1.299 -15.711 3.563 1.00 0.00 H new ATOM 0 HA LYS B 89 0.892 -17.518 3.557 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -1.643 -17.843 3.992 1.00 0.00 H new ATOM 0 HB3 LYS B 89 -1.839 -17.791 2.251 1.00 0.00 H new ATOM 0 HG2 LYS B 89 -0.151 -19.696 2.082 1.00 0.00 H new ATOM 0 HG3 LYS B 89 -0.178 -19.804 3.831 1.00 0.00 H new ATOM 0 HD2 LYS B 89 -2.483 -20.295 1.904 1.00 0.00 H new ATOM 0 HD3 LYS B 89 -1.725 -21.455 2.977 1.00 0.00 H new ATOM 0 HE2 LYS B 89 -3.502 -19.115 3.781 1.00 0.00 H new ATOM 0 HE3 LYS B 89 -3.894 -20.820 3.888 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 -2.888 -19.351 5.881 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 -2.778 -21.042 5.781 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 -1.478 -20.076 5.274 1.00 0.00 H new ATOM 2890 N GLY B 90 -0.087 -16.362 0.620 1.00 0.00 N ATOM 2891 CA GLY B 90 0.252 -16.300 -0.791 1.00 0.00 C ATOM 2892 C GLY B 90 0.225 -17.691 -1.429 1.00 0.00 C ATOM 2893 O GLY B 90 -0.641 -18.498 -1.018 1.00 0.00 O ATOM 2894 OXT GLY B 90 1.057 -17.917 -2.334 1.00 0.00 O ATOM 0 H GLY B 90 -0.921 -15.829 0.867 1.00 0.00 H new ATOM 0 HA2 GLY B 90 -0.451 -15.646 -1.308 1.00 0.00 H new ATOM 0 HA3 GLY B 90 1.243 -15.861 -0.911 1.00 0.00 H new