USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1077 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 76 TYR OH : rot 130:sc= 0.609 USER MOD Set 1.2: A 103 HIS : no HE2:sc= -3.7! C(o=-12!,f=-24!) USER MOD Set 1.3: A 104 CYS SG : rot -150:sc= -0.105 USER MOD Set 1.4: A 107 ASN : amide:sc= -8.48! C(o=-12!,f=-18!) USER MOD Set 2.1: A 100 MET CE :methyl -170:sc= -0.807 (180deg=-0.55) USER MOD Set 2.2: A 114 MET CE :methyl 147:sc= -0.309 (180deg=-1.32) USER MOD Set 3.1: A 89 THR OG1 : rot 180:sc= 0.0154 USER MOD Set 3.2: A 92 ASN : amide:sc= -0.0489 K(o=-0.027,f=-2) USER MOD Set 3.3: A 95 LYS NZ :NH3+ 170:sc= 0.00661 (180deg=0) USER MOD Set 4.1: A 69 LYS NZ :NH3+ -158:sc= -0.0467 (180deg=-0.418) USER MOD Set 4.2: A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 27:sc= 1.17 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 CYS SG : rot 119:sc= 0.188 USER MOD Single : A 23 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.066) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HD1:sc= -3.38 K(o=-3.4,f=-2) USER MOD Single : A 30 CYS SG : rot 180:sc= -1.36 USER MOD Single : A 32 SER OG : rot 180:sc= 0.00909 USER MOD Single : A 35 CYS SG : rot -100:sc=-0.00605 USER MOD Single : A 37 MET CE :methyl 135:sc= -0.677 (180deg=-2.24!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -179:sc= -0.363 (180deg=-0.373) USER MOD Single : A 53 GLN : amide:sc= -0.0314 K(o=-0.031,f=-0.84) USER MOD Single : A 57 ASN : amide:sc= -0.972 K(o=-0.97,f=-2!) USER MOD Single : A 58 GLN : amide:sc= -3.06 K(o=-3.1,f=-4.7!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 156:sc= 1.07 (180deg=0.659) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.157) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= -0.381 K(o=-0.38,f=-5.4!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 10:sc= 0.608 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 133:sc= -0.568 USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 ASN : amide:sc= -0.672 K(o=-0.67,f=0) USER MOD Single : A 130 SER OG : rot -72:sc= 1.08 USER MOD Single : A 132 MET CE :methyl 150:sc= -3.81! (180deg=-7.08!) USER MOD Single : A 140 THR OG1 : rot -175:sc= -1.98 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 18:sc= 0.558 USER MOD ----------------------------------------------------------------- ATOM 108 N ILE A 11 10.813 -4.320 4.851 1.00 0.00 N ATOM 109 CA ILE A 11 10.865 -3.131 4.008 1.00 0.00 C ATOM 110 C ILE A 11 12.263 -2.925 3.435 1.00 0.00 C ATOM 111 O ILE A 11 13.259 -3.000 4.155 1.00 0.00 O ATOM 112 CB ILE A 11 10.451 -1.870 4.788 1.00 0.00 C ATOM 113 CG1 ILE A 11 9.043 -2.039 5.364 1.00 0.00 C ATOM 114 CG2 ILE A 11 10.517 -0.645 3.888 1.00 0.00 C ATOM 115 CD1 ILE A 11 8.710 -1.039 6.450 1.00 0.00 C ATOM 0 HA ILE A 11 10.160 -3.291 3.192 1.00 0.00 H new ATOM 0 HB ILE A 11 11.147 -1.728 5.615 1.00 0.00 H new ATOM 0 HG12 ILE A 11 8.316 -1.943 4.558 1.00 0.00 H new ATOM 0 HG13 ILE A 11 8.942 -3.047 5.766 1.00 0.00 H new ATOM 0 HG21 ILE A 11 10.221 0.239 4.454 1.00 0.00 H new ATOM 0 HG22 ILE A 11 11.536 -0.517 3.521 1.00 0.00 H new ATOM 0 HG23 ILE A 11 9.841 -0.777 3.043 1.00 0.00 H new ATOM 0 HD11 ILE A 11 7.697 -1.218 6.812 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.414 -1.149 7.274 1.00 0.00 H new ATOM 0 HD13 ILE A 11 8.778 -0.028 6.047 1.00 0.00 H new ATOM 127 N THR A 12 12.330 -2.662 2.133 1.00 0.00 N ATOM 128 CA THR A 12 13.605 -2.443 1.463 1.00 0.00 C ATOM 129 C THR A 12 13.574 -1.171 0.623 1.00 0.00 C ATOM 130 O THR A 12 12.742 -1.028 -0.273 1.00 0.00 O ATOM 131 CB THR A 12 13.974 -3.633 0.557 1.00 0.00 C ATOM 132 OG1 THR A 12 13.743 -4.866 1.249 1.00 0.00 O ATOM 133 CG2 THR A 12 15.431 -3.553 0.126 1.00 0.00 C ATOM 0 H THR A 12 11.516 -2.596 1.522 1.00 0.00 H new ATOM 0 HA THR A 12 14.359 -2.341 2.244 1.00 0.00 H new ATOM 0 HB THR A 12 13.345 -3.593 -0.333 1.00 0.00 H new ATOM 0 HG1 THR A 12 13.978 -5.618 0.666 1.00 0.00 H new ATOM 0 HG21 THR A 12 15.669 -4.404 -0.513 1.00 0.00 H new ATOM 0 HG22 THR A 12 15.597 -2.627 -0.425 1.00 0.00 H new ATOM 0 HG23 THR A 12 16.073 -3.571 1.007 1.00 0.00 H new ATOM 141 N TYR A 13 14.484 -0.251 0.919 1.00 0.00 N ATOM 142 CA TYR A 13 14.560 1.011 0.192 1.00 0.00 C ATOM 143 C TYR A 13 15.500 0.895 -1.004 1.00 0.00 C ATOM 144 O TYR A 13 16.679 0.577 -0.853 1.00 0.00 O ATOM 145 CB TYR A 13 15.033 2.131 1.120 1.00 0.00 C ATOM 146 CG TYR A 13 14.187 2.286 2.363 1.00 0.00 C ATOM 147 CD1 TYR A 13 12.931 2.878 2.303 1.00 0.00 C ATOM 148 CD2 TYR A 13 14.642 1.842 3.599 1.00 0.00 C ATOM 149 CE1 TYR A 13 12.154 3.022 3.436 1.00 0.00 C ATOM 150 CE2 TYR A 13 13.872 1.981 4.736 1.00 0.00 C ATOM 151 CZ TYR A 13 12.628 2.572 4.650 1.00 0.00 C ATOM 152 OH TYR A 13 11.858 2.713 5.782 1.00 0.00 O ATOM 0 H TYR A 13 15.180 -0.355 1.657 1.00 0.00 H new ATOM 0 HA TYR A 13 13.562 1.250 -0.175 1.00 0.00 H new ATOM 0 HB2 TYR A 13 16.064 1.936 1.415 1.00 0.00 H new ATOM 0 HB3 TYR A 13 15.031 3.072 0.570 1.00 0.00 H new ATOM 0 HD1 TYR A 13 12.556 3.232 1.354 1.00 0.00 H new ATOM 0 HD2 TYR A 13 15.616 1.380 3.671 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.180 3.485 3.371 1.00 0.00 H new ATOM 0 HE2 TYR A 13 14.241 1.629 5.688 1.00 0.00 H new ATOM 0 HH TYR A 13 10.910 2.731 5.533 1.00 0.00 H new ATOM 162 N VAL A 14 14.967 1.157 -2.194 1.00 0.00 N ATOM 163 CA VAL A 14 15.757 1.085 -3.417 1.00 0.00 C ATOM 164 C VAL A 14 15.704 2.401 -4.184 1.00 0.00 C ATOM 165 O VAL A 14 14.654 3.039 -4.274 1.00 0.00 O ATOM 166 CB VAL A 14 15.268 -0.052 -4.334 1.00 0.00 C ATOM 167 CG1 VAL A 14 16.050 -0.059 -5.639 1.00 0.00 C ATOM 168 CG2 VAL A 14 15.383 -1.394 -3.627 1.00 0.00 C ATOM 0 H VAL A 14 13.992 1.421 -2.336 1.00 0.00 H new ATOM 0 HA VAL A 14 16.786 0.884 -3.118 1.00 0.00 H new ATOM 0 HB VAL A 14 14.217 0.120 -4.568 1.00 0.00 H new ATOM 0 HG11 VAL A 14 15.691 -0.869 -6.274 1.00 0.00 H new ATOM 0 HG12 VAL A 14 15.911 0.893 -6.151 1.00 0.00 H new ATOM 0 HG13 VAL A 14 17.109 -0.206 -5.428 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.033 -2.186 -4.290 1.00 0.00 H new ATOM 0 HG22 VAL A 14 16.424 -1.577 -3.361 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.774 -1.382 -2.723 1.00 0.00 H new ATOM 178 N LYS A 15 16.843 2.803 -4.738 1.00 0.00 N ATOM 179 CA LYS A 15 16.927 4.043 -5.501 1.00 0.00 C ATOM 180 C LYS A 15 16.815 3.770 -6.997 1.00 0.00 C ATOM 181 O LYS A 15 17.575 2.977 -7.552 1.00 0.00 O ATOM 182 CB LYS A 15 18.244 4.762 -5.200 1.00 0.00 C ATOM 183 CG LYS A 15 18.380 6.102 -5.902 1.00 0.00 C ATOM 184 CD LYS A 15 19.234 7.069 -5.098 1.00 0.00 C ATOM 185 CE LYS A 15 20.710 6.709 -5.182 1.00 0.00 C ATOM 186 NZ LYS A 15 21.449 7.109 -3.953 1.00 0.00 N ATOM 0 H LYS A 15 17.721 2.288 -4.673 1.00 0.00 H new ATOM 0 HA LYS A 15 16.095 4.681 -5.203 1.00 0.00 H new ATOM 0 HB2 LYS A 15 18.327 4.915 -4.124 1.00 0.00 H new ATOM 0 HB3 LYS A 15 19.074 4.121 -5.496 1.00 0.00 H new ATOM 0 HG2 LYS A 15 18.824 5.955 -6.886 1.00 0.00 H new ATOM 0 HG3 LYS A 15 17.391 6.533 -6.060 1.00 0.00 H new ATOM 0 HD2 LYS A 15 19.084 8.083 -5.468 1.00 0.00 H new ATOM 0 HD3 LYS A 15 18.914 7.059 -4.056 1.00 0.00 H new ATOM 0 HE2 LYS A 15 20.814 5.635 -5.335 1.00 0.00 H new ATOM 0 HE3 LYS A 15 21.154 7.198 -6.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 22.451 6.847 -4.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 21.372 8.138 -3.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 21.042 6.622 -3.129 1.00 0.00 H new ATOM 200 N GLY A 16 15.864 4.435 -7.646 1.00 0.00 N ATOM 201 CA GLY A 16 15.672 4.251 -9.073 1.00 0.00 C ATOM 202 C GLY A 16 14.208 4.143 -9.451 1.00 0.00 C ATOM 203 O GLY A 16 13.330 4.531 -8.680 1.00 0.00 O ATOM 0 H GLY A 16 15.223 5.098 -7.209 1.00 0.00 H new ATOM 0 HA2 GLY A 16 16.122 5.088 -9.608 1.00 0.00 H new ATOM 0 HA3 GLY A 16 16.194 3.350 -9.394 1.00 0.00 H new ATOM 207 N ASP A 17 13.944 3.616 -10.642 1.00 0.00 N ATOM 208 CA ASP A 17 12.576 3.459 -11.122 1.00 0.00 C ATOM 209 C ASP A 17 11.760 2.595 -10.165 1.00 0.00 C ATOM 210 O ASP A 17 12.298 1.711 -9.498 1.00 0.00 O ATOM 211 CB ASP A 17 12.571 2.838 -12.520 1.00 0.00 C ATOM 212 CG ASP A 17 13.767 3.265 -13.347 1.00 0.00 C ATOM 213 OD1 ASP A 17 14.853 2.672 -13.172 1.00 0.00 O ATOM 214 OD2 ASP A 17 13.618 4.192 -14.170 1.00 0.00 O ATOM 0 H ASP A 17 14.659 3.290 -11.292 1.00 0.00 H new ATOM 0 HA ASP A 17 12.119 4.447 -11.171 1.00 0.00 H new ATOM 0 HB2 ASP A 17 12.563 1.752 -12.432 1.00 0.00 H new ATOM 0 HB3 ASP A 17 11.655 3.122 -13.038 1.00 0.00 H new ATOM 219 N LEU A 18 10.459 2.858 -10.102 1.00 0.00 N ATOM 220 CA LEU A 18 9.568 2.105 -9.226 1.00 0.00 C ATOM 221 C LEU A 18 8.821 1.027 -10.005 1.00 0.00 C ATOM 222 O LEU A 18 8.660 -0.097 -9.531 1.00 0.00 O ATOM 223 CB LEU A 18 8.570 3.047 -8.550 1.00 0.00 C ATOM 224 CG LEU A 18 7.374 2.380 -7.869 1.00 0.00 C ATOM 225 CD1 LEU A 18 7.843 1.371 -6.833 1.00 0.00 C ATOM 226 CD2 LEU A 18 6.474 3.427 -7.228 1.00 0.00 C ATOM 0 H LEU A 18 9.998 3.587 -10.647 1.00 0.00 H new ATOM 0 HA LEU A 18 10.175 1.619 -8.462 1.00 0.00 H new ATOM 0 HB2 LEU A 18 9.104 3.637 -7.805 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.194 3.744 -9.299 1.00 0.00 H new ATOM 0 HG LEU A 18 6.798 1.849 -8.627 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.978 0.907 -6.359 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.446 0.604 -7.319 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.442 1.878 -6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.628 2.935 -6.748 1.00 0.00 H new ATOM 0 HD22 LEU A 18 7.040 3.986 -6.482 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.109 4.111 -7.994 1.00 0.00 H new ATOM 238 N PHE A 19 8.368 1.378 -11.204 1.00 0.00 N ATOM 239 CA PHE A 19 7.639 0.441 -12.050 1.00 0.00 C ATOM 240 C PHE A 19 8.539 -0.113 -13.150 1.00 0.00 C ATOM 241 O PHE A 19 8.364 -1.246 -13.599 1.00 0.00 O ATOM 242 CB PHE A 19 6.418 1.124 -12.670 1.00 0.00 C ATOM 243 CG PHE A 19 5.798 2.164 -11.782 1.00 0.00 C ATOM 244 CD1 PHE A 19 5.276 1.817 -10.546 1.00 0.00 C ATOM 245 CD2 PHE A 19 5.736 3.489 -12.183 1.00 0.00 C ATOM 246 CE1 PHE A 19 4.704 2.772 -9.728 1.00 0.00 C ATOM 247 CE2 PHE A 19 5.166 4.449 -11.369 1.00 0.00 C ATOM 248 CZ PHE A 19 4.650 4.090 -10.139 1.00 0.00 C ATOM 0 H PHE A 19 8.493 2.305 -11.611 1.00 0.00 H new ATOM 0 HA PHE A 19 7.305 -0.388 -11.426 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.711 1.589 -13.611 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.670 0.368 -12.907 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.317 0.789 -10.219 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.138 3.775 -13.144 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.299 2.489 -8.768 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.124 5.478 -11.694 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.205 4.838 -9.500 1.00 0.00 H new ATOM 258 N ALA A 20 9.503 0.694 -13.580 1.00 0.00 N ATOM 259 CA ALA A 20 10.432 0.285 -14.626 1.00 0.00 C ATOM 260 C ALA A 20 11.423 -0.750 -14.106 1.00 0.00 C ATOM 261 O ALA A 20 11.958 -1.552 -14.873 1.00 0.00 O ATOM 262 CB ALA A 20 11.171 1.495 -15.179 1.00 0.00 C ATOM 0 H ALA A 20 9.661 1.635 -13.220 1.00 0.00 H new ATOM 0 HA ALA A 20 9.856 -0.174 -15.430 1.00 0.00 H new ATOM 0 HB1 ALA A 20 11.861 1.174 -15.959 1.00 0.00 H new ATOM 0 HB2 ALA A 20 10.453 2.200 -15.597 1.00 0.00 H new ATOM 0 HB3 ALA A 20 11.729 1.978 -14.377 1.00 0.00 H new ATOM 268 N CYS A 21 11.665 -0.727 -12.800 1.00 0.00 N ATOM 269 CA CYS A 21 12.594 -1.663 -12.178 1.00 0.00 C ATOM 270 C CYS A 21 12.005 -3.069 -12.140 1.00 0.00 C ATOM 271 O CYS A 21 12.532 -4.007 -12.739 1.00 0.00 O ATOM 272 CB CYS A 21 12.941 -1.204 -10.761 1.00 0.00 C ATOM 273 SG CYS A 21 14.460 -0.229 -10.651 1.00 0.00 S ATOM 0 H CYS A 21 11.231 -0.070 -12.152 1.00 0.00 H new ATOM 0 HA CYS A 21 13.504 -1.686 -12.778 1.00 0.00 H new ATOM 0 HB2 CYS A 21 12.113 -0.613 -10.369 1.00 0.00 H new ATOM 0 HB3 CYS A 21 13.038 -2.080 -10.120 1.00 0.00 H new ATOM 0 HG CYS A 21 14.184 0.953 -10.185 1.00 0.00 H new ATOM 279 N PRO A 22 10.885 -3.223 -11.417 1.00 0.00 N ATOM 280 CA PRO A 22 10.201 -4.512 -11.282 1.00 0.00 C ATOM 281 C PRO A 22 9.539 -4.956 -12.583 1.00 0.00 C ATOM 282 O PRO A 22 9.105 -4.128 -13.385 1.00 0.00 O ATOM 283 CB PRO A 22 9.143 -4.242 -10.209 1.00 0.00 C ATOM 284 CG PRO A 22 8.891 -2.775 -10.287 1.00 0.00 C ATOM 285 CD PRO A 22 10.202 -2.150 -10.676 1.00 0.00 C ATOM 0 HA PRO A 22 10.892 -5.315 -11.026 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.233 -4.811 -10.398 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.499 -4.531 -9.220 1.00 0.00 H new ATOM 0 HG2 PRO A 22 8.118 -2.550 -11.022 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.543 -2.387 -9.330 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.057 -1.264 -11.294 1.00 0.00 H new ATOM 0 HD3 PRO A 22 10.774 -1.839 -9.802 1.00 0.00 H new ATOM 293 N LYS A 23 9.464 -6.267 -12.786 1.00 0.00 N ATOM 294 CA LYS A 23 8.853 -6.821 -13.988 1.00 0.00 C ATOM 295 C LYS A 23 7.722 -7.780 -13.631 1.00 0.00 C ATOM 296 O LYS A 23 6.849 -8.061 -14.453 1.00 0.00 O ATOM 297 CB LYS A 23 9.905 -7.548 -14.830 1.00 0.00 C ATOM 298 CG LYS A 23 9.591 -7.560 -16.316 1.00 0.00 C ATOM 299 CD LYS A 23 10.598 -8.393 -17.092 1.00 0.00 C ATOM 300 CE LYS A 23 10.259 -9.874 -17.033 1.00 0.00 C ATOM 301 NZ LYS A 23 9.100 -10.212 -17.905 1.00 0.00 N ATOM 0 H LYS A 23 9.819 -6.966 -12.133 1.00 0.00 H new ATOM 0 HA LYS A 23 8.437 -5.997 -14.568 1.00 0.00 H new ATOM 0 HB2 LYS A 23 10.874 -7.073 -14.676 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.994 -8.576 -14.477 1.00 0.00 H new ATOM 0 HG2 LYS A 23 8.589 -7.959 -16.474 1.00 0.00 H new ATOM 0 HG3 LYS A 23 9.591 -6.539 -16.697 1.00 0.00 H new ATOM 0 HD2 LYS A 23 10.620 -8.065 -18.131 1.00 0.00 H new ATOM 0 HD3 LYS A 23 11.596 -8.231 -16.686 1.00 0.00 H new ATOM 0 HE2 LYS A 23 11.127 -10.458 -17.340 1.00 0.00 H new ATOM 0 HE3 LYS A 23 10.034 -10.154 -16.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 9.015 -11.245 -17.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 8.229 -9.824 -17.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 9.245 -9.803 -18.850 1.00 0.00 H new ATOM 315 N THR A 24 7.742 -8.279 -12.399 1.00 0.00 N ATOM 316 CA THR A 24 6.718 -9.206 -11.933 1.00 0.00 C ATOM 317 C THR A 24 6.224 -8.825 -10.542 1.00 0.00 C ATOM 318 O THR A 24 5.345 -9.482 -9.984 1.00 0.00 O ATOM 319 CB THR A 24 7.244 -10.654 -11.900 1.00 0.00 C ATOM 320 OG1 THR A 24 8.334 -10.758 -10.978 1.00 0.00 O ATOM 321 CG2 THR A 24 7.698 -11.096 -13.283 1.00 0.00 C ATOM 0 H THR A 24 8.456 -8.057 -11.706 1.00 0.00 H new ATOM 0 HA THR A 24 5.890 -9.144 -12.639 1.00 0.00 H new ATOM 0 HB THR A 24 6.432 -11.305 -11.576 1.00 0.00 H new ATOM 0 HG1 THR A 24 8.662 -11.681 -10.962 1.00 0.00 H new ATOM 0 HG21 THR A 24 8.065 -12.121 -13.235 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.858 -11.043 -13.976 1.00 0.00 H new ATOM 0 HG23 THR A 24 8.496 -10.440 -13.631 1.00 0.00 H new ATOM 329 N ASP A 25 6.793 -7.761 -9.988 1.00 0.00 N ATOM 330 CA ASP A 25 6.409 -7.291 -8.662 1.00 0.00 C ATOM 331 C ASP A 25 5.194 -6.371 -8.742 1.00 0.00 C ATOM 332 O ASP A 25 5.149 -5.457 -9.565 1.00 0.00 O ATOM 333 CB ASP A 25 7.576 -6.559 -7.998 1.00 0.00 C ATOM 334 CG ASP A 25 8.719 -7.490 -7.646 1.00 0.00 C ATOM 335 OD1 ASP A 25 8.690 -8.658 -8.088 1.00 0.00 O ATOM 336 OD2 ASP A 25 9.642 -7.051 -6.930 1.00 0.00 O ATOM 0 H ASP A 25 7.522 -7.207 -10.437 1.00 0.00 H new ATOM 0 HA ASP A 25 6.146 -8.160 -8.058 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.940 -5.779 -8.667 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.223 -6.064 -7.093 1.00 0.00 H new ATOM 341 N SER A 26 4.211 -6.621 -7.883 1.00 0.00 N ATOM 342 CA SER A 26 2.994 -5.818 -7.860 1.00 0.00 C ATOM 343 C SER A 26 3.262 -4.442 -7.259 1.00 0.00 C ATOM 344 O SER A 26 4.272 -4.231 -6.585 1.00 0.00 O ATOM 345 CB SER A 26 1.902 -6.532 -7.061 1.00 0.00 C ATOM 346 OG SER A 26 1.692 -7.846 -7.547 1.00 0.00 O ATOM 0 H SER A 26 4.233 -7.373 -7.194 1.00 0.00 H new ATOM 0 HA SER A 26 2.656 -5.687 -8.888 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.183 -6.571 -6.009 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.973 -5.965 -7.122 1.00 0.00 H new ATOM 0 HG SER A 26 0.991 -8.282 -7.019 1.00 0.00 H new ATOM 352 N LEU A 27 2.352 -3.507 -7.508 1.00 0.00 N ATOM 353 CA LEU A 27 2.488 -2.149 -6.991 1.00 0.00 C ATOM 354 C LEU A 27 1.459 -1.876 -5.899 1.00 0.00 C ATOM 355 O LEU A 27 0.462 -2.587 -5.780 1.00 0.00 O ATOM 356 CB LEU A 27 2.329 -1.134 -8.124 1.00 0.00 C ATOM 357 CG LEU A 27 3.204 -1.361 -9.357 1.00 0.00 C ATOM 358 CD1 LEU A 27 3.011 -0.236 -10.363 1.00 0.00 C ATOM 359 CD2 LEU A 27 4.668 -1.477 -8.958 1.00 0.00 C ATOM 0 H LEU A 27 1.512 -3.664 -8.065 1.00 0.00 H new ATOM 0 HA LEU A 27 3.483 -2.049 -6.558 1.00 0.00 H new ATOM 0 HB2 LEU A 27 1.286 -1.132 -8.439 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.544 -0.141 -7.728 1.00 0.00 H new ATOM 0 HG LEU A 27 2.901 -2.297 -9.827 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.642 -0.415 -11.234 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.967 -0.200 -10.673 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.286 0.714 -9.904 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.276 -1.638 -9.848 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.984 -0.558 -8.464 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.794 -2.318 -8.276 1.00 0.00 H new ATOM 371 N ALA A 28 1.707 -0.840 -5.105 1.00 0.00 N ATOM 372 CA ALA A 28 0.800 -0.470 -4.026 1.00 0.00 C ATOM 373 C ALA A 28 1.030 0.972 -3.586 1.00 0.00 C ATOM 374 O ALA A 28 2.171 1.422 -3.468 1.00 0.00 O ATOM 375 CB ALA A 28 0.969 -1.417 -2.847 1.00 0.00 C ATOM 0 H ALA A 28 2.529 -0.242 -5.189 1.00 0.00 H new ATOM 0 HA ALA A 28 -0.221 -0.550 -4.399 1.00 0.00 H new ATOM 0 HB1 ALA A 28 0.286 -1.129 -2.048 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.748 -2.436 -3.164 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.995 -1.365 -2.483 1.00 0.00 H new ATOM 381 N HIS A 29 -0.060 1.694 -3.345 1.00 0.00 N ATOM 382 CA HIS A 29 0.024 3.086 -2.917 1.00 0.00 C ATOM 383 C HIS A 29 -1.267 3.521 -2.230 1.00 0.00 C ATOM 384 O HIS A 29 -2.254 2.785 -2.219 1.00 0.00 O ATOM 385 CB HIS A 29 0.309 3.993 -4.115 1.00 0.00 C ATOM 386 CG HIS A 29 0.630 5.405 -3.733 1.00 0.00 C ATOM 387 ND1 HIS A 29 -0.091 6.489 -4.187 1.00 0.00 N ATOM 388 CD2 HIS A 29 1.601 5.907 -2.935 1.00 0.00 C ATOM 389 CE1 HIS A 29 0.423 7.598 -3.685 1.00 0.00 C ATOM 390 NE2 HIS A 29 1.451 7.272 -2.922 1.00 0.00 N ATOM 0 H HIS A 29 -1.011 1.338 -3.439 1.00 0.00 H new ATOM 0 HA HIS A 29 0.842 3.173 -2.202 1.00 0.00 H new ATOM 0 HB2 HIS A 29 1.143 3.580 -4.683 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -0.558 3.992 -4.776 1.00 0.00 H new ATOM 0 HD2 HIS A 29 2.353 5.340 -2.407 1.00 0.00 H new ATOM 0 HE1 HIS A 29 0.064 8.600 -3.867 1.00 0.00 H new ATOM 0 HE2 HIS A 29 2.038 7.928 -2.407 1.00 0.00 H new ATOM 398 N CYS A 30 -1.251 4.720 -1.658 1.00 0.00 N ATOM 399 CA CYS A 30 -2.420 5.253 -0.967 1.00 0.00 C ATOM 400 C CYS A 30 -3.119 6.310 -1.817 1.00 0.00 C ATOM 401 O CYS A 30 -2.470 7.168 -2.415 1.00 0.00 O ATOM 402 CB CYS A 30 -2.013 5.852 0.380 1.00 0.00 C ATOM 403 SG CYS A 30 -1.576 4.623 1.632 1.00 0.00 S ATOM 0 H CYS A 30 -0.442 5.341 -1.659 1.00 0.00 H new ATOM 0 HA CYS A 30 -3.116 4.432 -0.796 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -1.164 6.518 0.228 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -2.833 6.463 0.757 1.00 0.00 H new ATOM 0 HG CYS A 30 -1.244 5.226 2.735 1.00 0.00 H new ATOM 409 N ILE A 31 -4.445 6.240 -1.865 1.00 0.00 N ATOM 410 CA ILE A 31 -5.231 7.190 -2.642 1.00 0.00 C ATOM 411 C ILE A 31 -6.476 7.628 -1.877 1.00 0.00 C ATOM 412 O ILE A 31 -6.702 7.204 -0.744 1.00 0.00 O ATOM 413 CB ILE A 31 -5.658 6.593 -3.996 1.00 0.00 C ATOM 414 CG1 ILE A 31 -6.689 5.482 -3.786 1.00 0.00 C ATOM 415 CG2 ILE A 31 -4.446 6.063 -4.747 1.00 0.00 C ATOM 416 CD1 ILE A 31 -7.475 5.144 -5.034 1.00 0.00 C ATOM 0 H ILE A 31 -4.997 5.536 -1.375 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.593 8.056 -2.821 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.117 7.380 -4.595 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.179 4.586 -3.434 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.382 5.784 -3.001 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.764 5.644 -5.702 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -3.743 6.877 -4.924 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.961 5.287 -4.154 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -8.187 4.349 -4.812 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -8.013 6.028 -5.375 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.792 4.811 -5.815 1.00 0.00 H new ATOM 428 N SER A 32 -7.281 8.479 -2.506 1.00 0.00 N ATOM 429 CA SER A 32 -8.502 8.977 -1.884 1.00 0.00 C ATOM 430 C SER A 32 -9.716 8.183 -2.359 1.00 0.00 C ATOM 431 O SER A 32 -9.600 7.303 -3.210 1.00 0.00 O ATOM 432 CB SER A 32 -8.693 10.461 -2.202 1.00 0.00 C ATOM 433 OG SER A 32 -9.338 10.636 -3.452 1.00 0.00 O ATOM 0 H SER A 32 -7.109 8.838 -3.445 1.00 0.00 H new ATOM 0 HA SER A 32 -8.408 8.853 -0.805 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.283 10.932 -1.416 1.00 0.00 H new ATOM 0 HB3 SER A 32 -7.724 10.961 -2.216 1.00 0.00 H new ATOM 0 HG SER A 32 -9.450 11.593 -3.631 1.00 0.00 H new ATOM 439 N GLU A 33 -10.879 8.503 -1.800 1.00 0.00 N ATOM 440 CA GLU A 33 -12.114 7.819 -2.165 1.00 0.00 C ATOM 441 C GLU A 33 -12.528 8.168 -3.592 1.00 0.00 C ATOM 442 O GLU A 33 -13.176 7.373 -4.274 1.00 0.00 O ATOM 443 CB GLU A 33 -13.235 8.190 -1.193 1.00 0.00 C ATOM 444 CG GLU A 33 -13.089 7.551 0.178 1.00 0.00 C ATOM 445 CD GLU A 33 -13.825 6.230 0.288 1.00 0.00 C ATOM 446 OE1 GLU A 33 -13.862 5.486 -0.714 1.00 0.00 O ATOM 447 OE2 GLU A 33 -14.364 5.941 1.377 1.00 0.00 O ATOM 0 H GLU A 33 -10.992 9.230 -1.094 1.00 0.00 H new ATOM 0 HA GLU A 33 -11.934 6.745 -2.109 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -13.261 9.274 -1.078 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -14.191 7.892 -1.623 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -12.032 7.392 0.390 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -13.466 8.237 0.936 1.00 0.00 H new ATOM 454 N ASP A 34 -12.148 9.361 -4.037 1.00 0.00 N ATOM 455 CA ASP A 34 -12.479 9.816 -5.382 1.00 0.00 C ATOM 456 C ASP A 34 -11.413 9.377 -6.381 1.00 0.00 C ATOM 457 O ASP A 34 -11.289 9.950 -7.465 1.00 0.00 O ATOM 458 CB ASP A 34 -12.624 11.338 -5.408 1.00 0.00 C ATOM 459 CG ASP A 34 -13.971 11.800 -4.889 1.00 0.00 C ATOM 460 OD1 ASP A 34 -14.921 11.880 -5.695 1.00 0.00 O ATOM 461 OD2 ASP A 34 -14.075 12.083 -3.677 1.00 0.00 O ATOM 0 H ASP A 34 -11.611 10.030 -3.486 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.429 9.364 -5.668 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -11.833 11.786 -4.806 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -12.489 11.696 -6.429 1.00 0.00 H new ATOM 466 N CYS A 35 -10.645 8.359 -6.010 1.00 0.00 N ATOM 467 CA CYS A 35 -9.587 7.844 -6.873 1.00 0.00 C ATOM 468 C CYS A 35 -8.903 8.978 -7.630 1.00 0.00 C ATOM 469 O CYS A 35 -8.684 8.887 -8.838 1.00 0.00 O ATOM 470 CB CYS A 35 -10.157 6.826 -7.861 1.00 0.00 C ATOM 471 SG CYS A 35 -10.917 5.383 -7.079 1.00 0.00 S ATOM 0 H CYS A 35 -10.735 7.873 -5.117 1.00 0.00 H new ATOM 0 HA CYS A 35 -8.845 7.352 -6.244 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -10.900 7.320 -8.487 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -9.357 6.489 -8.521 1.00 0.00 H new ATOM 0 HG CYS A 35 -10.085 4.385 -7.109 1.00 0.00 H new ATOM 477 N ARG A 36 -8.571 10.046 -6.912 1.00 0.00 N ATOM 478 CA ARG A 36 -7.914 11.199 -7.517 1.00 0.00 C ATOM 479 C ARG A 36 -6.489 10.854 -7.937 1.00 0.00 C ATOM 480 O ARG A 36 -6.146 10.921 -9.117 1.00 0.00 O ATOM 481 CB ARG A 36 -7.899 12.375 -6.539 1.00 0.00 C ATOM 482 CG ARG A 36 -9.243 13.073 -6.404 1.00 0.00 C ATOM 483 CD ARG A 36 -9.542 13.944 -7.615 1.00 0.00 C ATOM 484 NE ARG A 36 -8.959 15.277 -7.487 1.00 0.00 N ATOM 485 CZ ARG A 36 -9.455 16.223 -6.697 1.00 0.00 C ATOM 486 NH1 ARG A 36 -10.536 15.983 -5.967 1.00 0.00 N ATOM 487 NH2 ARG A 36 -8.869 17.411 -6.634 1.00 0.00 N ATOM 0 H ARG A 36 -8.746 10.137 -5.911 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.478 11.482 -8.406 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -7.585 12.017 -5.558 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -7.154 13.100 -6.867 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -10.031 12.329 -6.286 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -9.247 13.687 -5.503 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -9.153 13.463 -8.513 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -10.621 14.031 -7.742 1.00 0.00 H new ATOM 0 HE ARG A 36 -8.126 15.493 -8.034 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -10.989 15.070 -6.011 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -10.914 16.711 -5.361 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -8.037 17.599 -7.192 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -9.251 18.136 -6.027 1.00 0.00 H new ATOM 501 N MET A 37 -5.662 10.487 -6.963 1.00 0.00 N ATOM 502 CA MET A 37 -4.274 10.132 -7.233 1.00 0.00 C ATOM 503 C MET A 37 -3.689 11.018 -8.327 1.00 0.00 C ATOM 504 O MET A 37 -2.880 10.568 -9.138 1.00 0.00 O ATOM 505 CB MET A 37 -4.172 8.661 -7.641 1.00 0.00 C ATOM 506 CG MET A 37 -4.834 8.354 -8.975 1.00 0.00 C ATOM 507 SD MET A 37 -4.809 6.595 -9.373 1.00 0.00 S ATOM 508 CE MET A 37 -6.106 6.510 -10.606 1.00 0.00 C ATOM 0 H MET A 37 -5.929 10.428 -5.980 1.00 0.00 H new ATOM 0 HA MET A 37 -3.700 10.288 -6.319 1.00 0.00 H new ATOM 0 HB2 MET A 37 -3.120 8.379 -7.693 1.00 0.00 H new ATOM 0 HB3 MET A 37 -4.630 8.045 -6.867 1.00 0.00 H new ATOM 0 HG2 MET A 37 -5.866 8.703 -8.953 1.00 0.00 H new ATOM 0 HG3 MET A 37 -4.327 8.909 -9.764 1.00 0.00 H new ATOM 0 HE1 MET A 37 -5.770 5.903 -11.447 1.00 0.00 H new ATOM 0 HE2 MET A 37 -6.996 6.060 -10.167 1.00 0.00 H new ATOM 0 HE3 MET A 37 -6.342 7.515 -10.956 1.00 0.00 H new ATOM 518 N GLY A 38 -4.103 12.281 -8.345 1.00 0.00 N ATOM 519 CA GLY A 38 -3.610 13.210 -9.345 1.00 0.00 C ATOM 520 C GLY A 38 -2.642 14.224 -8.768 1.00 0.00 C ATOM 521 O GLY A 38 -2.718 15.412 -9.078 1.00 0.00 O ATOM 0 H GLY A 38 -4.771 12.678 -7.685 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -3.116 12.653 -10.141 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -4.453 13.733 -9.797 1.00 0.00 H new ATOM 525 N ALA A 39 -1.729 13.754 -7.923 1.00 0.00 N ATOM 526 CA ALA A 39 -0.742 14.628 -7.301 1.00 0.00 C ATOM 527 C ALA A 39 0.510 13.851 -6.911 1.00 0.00 C ATOM 528 O ALA A 39 0.427 12.735 -6.399 1.00 0.00 O ATOM 529 CB ALA A 39 -1.340 15.315 -6.083 1.00 0.00 C ATOM 0 H ALA A 39 -1.653 12.773 -7.654 1.00 0.00 H new ATOM 0 HA ALA A 39 -0.455 15.387 -8.028 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -0.592 15.965 -5.628 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -2.201 15.910 -6.387 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -1.656 14.563 -5.360 1.00 0.00 H new ATOM 535 N GLY A 40 1.673 14.447 -7.159 1.00 0.00 N ATOM 536 CA GLY A 40 2.926 13.796 -6.828 1.00 0.00 C ATOM 537 C GLY A 40 3.161 12.541 -7.645 1.00 0.00 C ATOM 538 O GLY A 40 2.784 12.475 -8.815 1.00 0.00 O ATOM 0 H GLY A 40 1.769 15.370 -7.583 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.748 14.492 -6.993 1.00 0.00 H new ATOM 0 HA3 GLY A 40 2.931 13.542 -5.768 1.00 0.00 H new ATOM 542 N ILE A 41 3.787 11.544 -7.028 1.00 0.00 N ATOM 543 CA ILE A 41 4.072 10.286 -7.707 1.00 0.00 C ATOM 544 C ILE A 41 2.785 9.582 -8.123 1.00 0.00 C ATOM 545 O ILE A 41 2.733 8.926 -9.163 1.00 0.00 O ATOM 546 CB ILE A 41 4.896 9.339 -6.815 1.00 0.00 C ATOM 547 CG1 ILE A 41 5.208 8.041 -7.562 1.00 0.00 C ATOM 548 CG2 ILE A 41 4.149 9.046 -5.522 1.00 0.00 C ATOM 549 CD1 ILE A 41 6.476 7.363 -7.093 1.00 0.00 C ATOM 0 H ILE A 41 4.106 11.583 -6.060 1.00 0.00 H new ATOM 0 HA ILE A 41 4.653 10.532 -8.596 1.00 0.00 H new ATOM 0 HB ILE A 41 5.838 9.827 -6.565 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.372 7.352 -7.442 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.293 8.256 -8.627 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.744 8.375 -4.902 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.974 9.978 -4.984 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.194 8.575 -5.753 1.00 0.00 H new ATOM 0 HD11 ILE A 41 6.634 6.450 -7.667 1.00 0.00 H new ATOM 0 HD12 ILE A 41 7.323 8.034 -7.239 1.00 0.00 H new ATOM 0 HD13 ILE A 41 6.387 7.116 -6.035 1.00 0.00 H new ATOM 561 N ALA A 42 1.747 9.726 -7.305 1.00 0.00 N ATOM 562 CA ALA A 42 0.459 9.107 -7.590 1.00 0.00 C ATOM 563 C ALA A 42 0.044 9.345 -9.038 1.00 0.00 C ATOM 564 O ALA A 42 -0.756 8.594 -9.597 1.00 0.00 O ATOM 565 CB ALA A 42 -0.604 9.640 -6.641 1.00 0.00 C ATOM 0 H ALA A 42 1.774 10.266 -6.440 1.00 0.00 H new ATOM 0 HA ALA A 42 0.559 8.032 -7.440 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.561 9.169 -6.865 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.320 9.414 -5.613 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.693 10.719 -6.764 1.00 0.00 H new ATOM 571 N VAL A 43 0.592 10.395 -9.641 1.00 0.00 N ATOM 572 CA VAL A 43 0.279 10.732 -11.025 1.00 0.00 C ATOM 573 C VAL A 43 0.755 9.641 -11.977 1.00 0.00 C ATOM 574 O VAL A 43 -0.039 9.052 -12.711 1.00 0.00 O ATOM 575 CB VAL A 43 0.919 12.072 -11.435 1.00 0.00 C ATOM 576 CG1 VAL A 43 0.760 12.304 -12.930 1.00 0.00 C ATOM 577 CG2 VAL A 43 0.310 13.218 -10.641 1.00 0.00 C ATOM 0 H VAL A 43 1.255 11.027 -9.193 1.00 0.00 H new ATOM 0 HA VAL A 43 -0.805 10.821 -11.092 1.00 0.00 H new ATOM 0 HB VAL A 43 1.985 12.030 -11.210 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.218 13.255 -13.201 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.248 11.497 -13.477 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.300 12.326 -13.184 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.774 14.157 -10.943 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.762 13.264 -10.833 1.00 0.00 H new ATOM 0 HG23 VAL A 43 0.481 13.055 -9.577 1.00 0.00 H new ATOM 587 N LEU A 44 2.057 9.376 -11.960 1.00 0.00 N ATOM 588 CA LEU A 44 2.640 8.354 -12.823 1.00 0.00 C ATOM 589 C LEU A 44 1.730 7.134 -12.915 1.00 0.00 C ATOM 590 O LEU A 44 1.574 6.542 -13.983 1.00 0.00 O ATOM 591 CB LEU A 44 4.015 7.939 -12.296 1.00 0.00 C ATOM 592 CG LEU A 44 5.094 9.023 -12.308 1.00 0.00 C ATOM 593 CD1 LEU A 44 6.312 8.573 -11.518 1.00 0.00 C ATOM 594 CD2 LEU A 44 5.482 9.374 -13.737 1.00 0.00 C ATOM 0 H LEU A 44 2.728 9.854 -11.359 1.00 0.00 H new ATOM 0 HA LEU A 44 2.751 8.777 -13.821 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.897 7.583 -11.273 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.369 7.095 -12.888 1.00 0.00 H new ATOM 0 HG LEU A 44 4.689 9.917 -11.833 1.00 0.00 H new ATOM 0 HD11 LEU A 44 7.069 9.357 -11.538 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.023 8.374 -10.486 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.719 7.665 -11.963 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.251 10.147 -13.726 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.867 8.486 -14.238 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.606 9.741 -14.272 1.00 0.00 H new ATOM 606 N PHE A 45 1.127 6.765 -11.789 1.00 0.00 N ATOM 607 CA PHE A 45 0.230 5.616 -11.743 1.00 0.00 C ATOM 608 C PHE A 45 -0.922 5.786 -12.730 1.00 0.00 C ATOM 609 O PHE A 45 -1.167 4.921 -13.570 1.00 0.00 O ATOM 610 CB PHE A 45 -0.319 5.428 -10.328 1.00 0.00 C ATOM 611 CG PHE A 45 0.590 4.636 -9.432 1.00 0.00 C ATOM 612 CD1 PHE A 45 0.491 3.255 -9.369 1.00 0.00 C ATOM 613 CD2 PHE A 45 1.544 5.271 -8.654 1.00 0.00 C ATOM 614 CE1 PHE A 45 1.326 2.523 -8.546 1.00 0.00 C ATOM 615 CE2 PHE A 45 2.382 4.545 -7.830 1.00 0.00 C ATOM 616 CZ PHE A 45 2.272 3.169 -7.775 1.00 0.00 C ATOM 0 H PHE A 45 1.243 7.245 -10.897 1.00 0.00 H new ATOM 0 HA PHE A 45 0.799 4.730 -12.025 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.493 6.407 -9.882 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.286 4.927 -10.386 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.247 2.745 -9.970 1.00 0.00 H new ATOM 0 HD2 PHE A 45 1.634 6.347 -8.692 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.239 1.447 -8.506 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.122 5.053 -7.229 1.00 0.00 H new ATOM 0 HZ PHE A 45 2.925 2.600 -7.130 1.00 0.00 H new ATOM 626 N LYS A 46 -1.626 6.907 -12.620 1.00 0.00 N ATOM 627 CA LYS A 46 -2.752 7.193 -13.501 1.00 0.00 C ATOM 628 C LYS A 46 -2.288 7.340 -14.947 1.00 0.00 C ATOM 629 O LYS A 46 -3.064 7.144 -15.882 1.00 0.00 O ATOM 630 CB LYS A 46 -3.467 8.469 -13.051 1.00 0.00 C ATOM 631 CG LYS A 46 -2.948 9.727 -13.725 1.00 0.00 C ATOM 632 CD LYS A 46 -3.797 10.938 -13.376 1.00 0.00 C ATOM 633 CE LYS A 46 -2.957 12.204 -13.300 1.00 0.00 C ATOM 634 NZ LYS A 46 -2.923 12.926 -14.602 1.00 0.00 N ATOM 0 H LYS A 46 -1.437 7.633 -11.929 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.447 6.355 -13.445 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -4.533 8.370 -13.257 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.359 8.574 -11.971 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -1.917 9.905 -13.421 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -2.941 9.585 -14.806 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -4.579 11.063 -14.125 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.294 10.772 -12.420 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.361 12.862 -12.530 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.941 11.948 -13.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.341 13.783 -14.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.514 12.307 -15.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -3.890 13.193 -14.876 1.00 0.00 H new ATOM 648 N LYS A 47 -1.017 7.686 -15.123 1.00 0.00 N ATOM 649 CA LYS A 47 -0.448 7.858 -16.454 1.00 0.00 C ATOM 650 C LYS A 47 -0.227 6.508 -17.130 1.00 0.00 C ATOM 651 O LYS A 47 -0.455 6.358 -18.330 1.00 0.00 O ATOM 652 CB LYS A 47 0.876 8.620 -16.371 1.00 0.00 C ATOM 653 CG LYS A 47 0.706 10.109 -16.124 1.00 0.00 C ATOM 654 CD LYS A 47 1.858 10.907 -16.711 1.00 0.00 C ATOM 655 CE LYS A 47 3.185 10.521 -16.076 1.00 0.00 C ATOM 656 NZ LYS A 47 4.324 11.279 -16.664 1.00 0.00 N ATOM 0 H LYS A 47 -0.361 7.853 -14.360 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.155 8.433 -17.052 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.481 8.194 -15.571 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.428 8.475 -17.300 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.233 10.447 -16.563 1.00 0.00 H new ATOM 0 HG3 LYS A 47 0.642 10.296 -15.052 1.00 0.00 H new ATOM 0 HD2 LYS A 47 1.906 10.740 -17.787 1.00 0.00 H new ATOM 0 HD3 LYS A 47 1.678 11.972 -16.561 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.141 10.706 -15.003 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.353 9.452 -16.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 5.210 10.987 -16.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 4.382 11.083 -17.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 4.177 12.298 -16.515 1.00 0.00 H new ATOM 670 N LYS A 48 0.216 5.527 -16.351 1.00 0.00 N ATOM 671 CA LYS A 48 0.464 4.188 -16.872 1.00 0.00 C ATOM 672 C LYS A 48 -0.824 3.374 -16.917 1.00 0.00 C ATOM 673 O LYS A 48 -1.123 2.721 -17.917 1.00 0.00 O ATOM 674 CB LYS A 48 1.505 3.469 -16.011 1.00 0.00 C ATOM 675 CG LYS A 48 2.923 3.588 -16.544 1.00 0.00 C ATOM 676 CD LYS A 48 3.450 5.007 -16.413 1.00 0.00 C ATOM 677 CE LYS A 48 4.192 5.207 -15.101 1.00 0.00 C ATOM 678 NZ LYS A 48 5.278 6.219 -15.227 1.00 0.00 N ATOM 0 H LYS A 48 0.411 5.634 -15.356 1.00 0.00 H new ATOM 0 HA LYS A 48 0.846 4.286 -17.888 1.00 0.00 H new ATOM 0 HB2 LYS A 48 1.471 3.875 -15.000 1.00 0.00 H new ATOM 0 HB3 LYS A 48 1.240 2.414 -15.940 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.576 2.905 -16.000 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.946 3.285 -17.591 1.00 0.00 H new ATOM 0 HD2 LYS A 48 4.117 5.227 -17.247 1.00 0.00 H new ATOM 0 HD3 LYS A 48 2.620 5.711 -16.474 1.00 0.00 H new ATOM 0 HE2 LYS A 48 3.489 5.523 -14.330 1.00 0.00 H new ATOM 0 HE3 LYS A 48 4.616 4.257 -14.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 5.771 6.314 -14.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 5.954 5.914 -15.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 4.868 7.136 -15.497 1.00 0.00 H new ATOM 692 N PHE A 49 -1.585 3.418 -15.828 1.00 0.00 N ATOM 693 CA PHE A 49 -2.843 2.684 -15.744 1.00 0.00 C ATOM 694 C PHE A 49 -4.033 3.629 -15.880 1.00 0.00 C ATOM 695 O PHE A 49 -4.759 3.591 -16.873 1.00 0.00 O ATOM 696 CB PHE A 49 -2.928 1.927 -14.417 1.00 0.00 C ATOM 697 CG PHE A 49 -1.626 1.307 -13.996 1.00 0.00 C ATOM 698 CD1 PHE A 49 -1.215 0.097 -14.530 1.00 0.00 C ATOM 699 CD2 PHE A 49 -0.814 1.935 -13.065 1.00 0.00 C ATOM 700 CE1 PHE A 49 -0.018 -0.476 -14.145 1.00 0.00 C ATOM 701 CE2 PHE A 49 0.385 1.367 -12.677 1.00 0.00 C ATOM 702 CZ PHE A 49 0.783 0.159 -13.217 1.00 0.00 C ATOM 0 H PHE A 49 -1.353 3.954 -14.992 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.873 1.968 -16.566 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.264 2.612 -13.638 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -3.683 1.145 -14.501 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -1.838 -0.405 -15.256 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -1.121 2.878 -12.638 1.00 0.00 H new ATOM 0 HE1 PHE A 49 0.291 -1.420 -14.570 1.00 0.00 H new ATOM 0 HE2 PHE A 49 1.010 1.867 -11.952 1.00 0.00 H new ATOM 0 HZ PHE A 49 1.719 -0.287 -12.914 1.00 0.00 H new ATOM 712 N GLY A 50 -4.228 4.476 -14.874 1.00 0.00 N ATOM 713 CA GLY A 50 -5.332 5.417 -14.900 1.00 0.00 C ATOM 714 C GLY A 50 -6.676 4.732 -15.051 1.00 0.00 C ATOM 715 O GLY A 50 -7.459 5.073 -15.936 1.00 0.00 O ATOM 0 H GLY A 50 -3.641 4.527 -14.041 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.328 6.003 -13.981 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -5.190 6.116 -15.724 1.00 0.00 H new ATOM 719 N GLY A 51 -6.943 3.760 -14.184 1.00 0.00 N ATOM 720 CA GLY A 51 -8.201 3.039 -14.242 1.00 0.00 C ATOM 721 C GLY A 51 -9.199 3.529 -13.212 1.00 0.00 C ATOM 722 O GLY A 51 -9.944 2.739 -12.633 1.00 0.00 O ATOM 0 H GLY A 51 -6.310 3.459 -13.443 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.631 3.144 -15.238 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -8.015 1.976 -14.086 1.00 0.00 H new ATOM 726 N VAL A 52 -9.214 4.838 -12.982 1.00 0.00 N ATOM 727 CA VAL A 52 -10.128 5.434 -12.014 1.00 0.00 C ATOM 728 C VAL A 52 -11.516 4.811 -12.114 1.00 0.00 C ATOM 729 O VAL A 52 -12.135 4.486 -11.101 1.00 0.00 O ATOM 730 CB VAL A 52 -10.245 6.956 -12.215 1.00 0.00 C ATOM 731 CG1 VAL A 52 -8.900 7.630 -11.987 1.00 0.00 C ATOM 732 CG2 VAL A 52 -10.778 7.271 -13.605 1.00 0.00 C ATOM 0 H VAL A 52 -8.604 5.506 -13.453 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.714 5.237 -11.025 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.951 7.348 -11.482 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.002 8.705 -12.134 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -8.562 7.433 -10.970 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -8.171 7.235 -12.694 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -10.854 8.351 -13.729 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -10.099 6.866 -14.355 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.763 6.821 -13.727 1.00 0.00 H new ATOM 742 N GLN A 53 -11.999 4.649 -13.342 1.00 0.00 N ATOM 743 CA GLN A 53 -13.315 4.065 -13.573 1.00 0.00 C ATOM 744 C GLN A 53 -13.365 2.623 -13.079 1.00 0.00 C ATOM 745 O GLN A 53 -14.353 2.197 -12.481 1.00 0.00 O ATOM 746 CB GLN A 53 -13.665 4.119 -15.061 1.00 0.00 C ATOM 747 CG GLN A 53 -15.089 3.684 -15.367 1.00 0.00 C ATOM 748 CD GLN A 53 -16.104 4.780 -15.104 1.00 0.00 C ATOM 749 OE1 GLN A 53 -15.846 5.955 -15.364 1.00 0.00 O ATOM 750 NE2 GLN A 53 -17.265 4.399 -14.586 1.00 0.00 N ATOM 0 H GLN A 53 -11.499 4.914 -14.191 1.00 0.00 H new ATOM 0 HA GLN A 53 -14.047 4.647 -13.013 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -13.519 5.137 -15.423 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -12.973 3.482 -15.612 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -15.154 3.376 -16.411 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.336 2.812 -14.762 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -17.435 3.413 -14.386 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -17.987 5.092 -14.388 1.00 0.00 H new ATOM 759 N GLU A 54 -12.295 1.877 -13.334 1.00 0.00 N ATOM 760 CA GLU A 54 -12.219 0.482 -12.916 1.00 0.00 C ATOM 761 C GLU A 54 -12.158 0.373 -11.395 1.00 0.00 C ATOM 762 O GLU A 54 -12.814 -0.479 -10.795 1.00 0.00 O ATOM 763 CB GLU A 54 -10.995 -0.194 -13.536 1.00 0.00 C ATOM 764 CG GLU A 54 -11.249 -0.759 -14.924 1.00 0.00 C ATOM 765 CD GLU A 54 -12.500 -1.614 -14.985 1.00 0.00 C ATOM 766 OE1 GLU A 54 -12.871 -2.199 -13.946 1.00 0.00 O ATOM 767 OE2 GLU A 54 -13.108 -1.697 -16.073 1.00 0.00 O ATOM 0 H GLU A 54 -11.469 2.215 -13.828 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.119 -0.024 -13.264 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.180 0.528 -13.590 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.664 -0.999 -12.880 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.339 0.062 -15.636 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.390 -1.355 -15.232 1.00 0.00 H new ATOM 774 N LEU A 55 -11.365 1.241 -10.777 1.00 0.00 N ATOM 775 CA LEU A 55 -11.216 1.243 -9.326 1.00 0.00 C ATOM 776 C LEU A 55 -12.519 1.650 -8.646 1.00 0.00 C ATOM 777 O LEU A 55 -12.990 0.977 -7.728 1.00 0.00 O ATOM 778 CB LEU A 55 -10.092 2.194 -8.910 1.00 0.00 C ATOM 779 CG LEU A 55 -8.714 1.905 -9.506 1.00 0.00 C ATOM 780 CD1 LEU A 55 -7.777 3.081 -9.279 1.00 0.00 C ATOM 781 CD2 LEU A 55 -8.130 0.633 -8.909 1.00 0.00 C ATOM 0 H LEU A 55 -10.815 1.953 -11.258 1.00 0.00 H new ATOM 0 HA LEU A 55 -10.963 0.231 -9.010 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.380 3.208 -9.187 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.008 2.172 -7.823 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.828 1.759 -10.580 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.801 2.857 -9.710 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.188 3.971 -9.755 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.669 3.259 -8.209 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.149 0.443 -9.345 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.031 0.750 -7.830 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.791 -0.207 -9.124 1.00 0.00 H new ATOM 793 N LEU A 56 -13.099 2.755 -9.102 1.00 0.00 N ATOM 794 CA LEU A 56 -14.350 3.251 -8.540 1.00 0.00 C ATOM 795 C LEU A 56 -15.425 2.169 -8.564 1.00 0.00 C ATOM 796 O LEU A 56 -16.269 2.098 -7.672 1.00 0.00 O ATOM 797 CB LEU A 56 -14.829 4.480 -9.315 1.00 0.00 C ATOM 798 CG LEU A 56 -13.945 5.723 -9.215 1.00 0.00 C ATOM 799 CD1 LEU A 56 -14.206 6.659 -10.384 1.00 0.00 C ATOM 800 CD2 LEU A 56 -14.178 6.439 -7.893 1.00 0.00 C ATOM 0 H LEU A 56 -12.722 3.325 -9.860 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.167 3.532 -7.503 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.922 4.208 -10.367 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.828 4.740 -8.964 1.00 0.00 H new ATOM 0 HG LEU A 56 -12.902 5.408 -9.255 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.568 7.538 -10.296 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -13.986 6.143 -11.319 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.251 6.967 -10.377 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.540 7.321 -7.840 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -15.223 6.742 -7.822 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.938 5.768 -7.068 1.00 0.00 H new ATOM 812 N ASN A 57 -15.387 1.327 -9.592 1.00 0.00 N ATOM 813 CA ASN A 57 -16.357 0.247 -9.733 1.00 0.00 C ATOM 814 C ASN A 57 -16.353 -0.651 -8.500 1.00 0.00 C ATOM 815 O ASN A 57 -17.359 -1.282 -8.177 1.00 0.00 O ATOM 816 CB ASN A 57 -16.052 -0.581 -10.982 1.00 0.00 C ATOM 817 CG ASN A 57 -16.362 0.169 -12.263 1.00 0.00 C ATOM 818 OD1 ASN A 57 -17.211 1.060 -12.284 1.00 0.00 O ATOM 819 ND2 ASN A 57 -15.672 -0.189 -13.340 1.00 0.00 N ATOM 0 H ASN A 57 -14.695 1.372 -10.340 1.00 0.00 H new ATOM 0 HA ASN A 57 -17.347 0.692 -9.834 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -15.000 -0.867 -10.977 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -16.633 -1.503 -10.954 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -15.837 0.280 -14.230 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -14.977 -0.933 -13.277 1.00 0.00 H new ATOM 826 N GLN A 58 -15.215 -0.702 -7.815 1.00 0.00 N ATOM 827 CA GLN A 58 -15.080 -1.523 -6.618 1.00 0.00 C ATOM 828 C GLN A 58 -15.884 -0.936 -5.462 1.00 0.00 C ATOM 829 O GLN A 58 -16.316 -1.659 -4.565 1.00 0.00 O ATOM 830 CB GLN A 58 -13.608 -1.645 -6.220 1.00 0.00 C ATOM 831 CG GLN A 58 -12.730 -2.233 -7.313 1.00 0.00 C ATOM 832 CD GLN A 58 -11.396 -2.726 -6.787 1.00 0.00 C ATOM 833 OE1 GLN A 58 -11.342 -3.536 -5.861 1.00 0.00 O ATOM 834 NE2 GLN A 58 -10.310 -2.240 -7.377 1.00 0.00 N ATOM 0 H GLN A 58 -14.373 -0.184 -8.069 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.472 -2.515 -6.843 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -13.229 -0.658 -5.952 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -13.531 -2.268 -5.329 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -13.256 -3.060 -7.791 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -12.557 -1.479 -8.081 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -10.401 -1.570 -8.141 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -9.385 -2.536 -7.066 1.00 0.00 H new ATOM 843 N GLN A 59 -16.081 0.378 -5.491 1.00 0.00 N ATOM 844 CA GLN A 59 -16.832 1.061 -4.445 1.00 0.00 C ATOM 845 C GLN A 59 -16.178 0.856 -3.083 1.00 0.00 C ATOM 846 O GLN A 59 -16.857 0.604 -2.087 1.00 0.00 O ATOM 847 CB GLN A 59 -18.276 0.556 -4.412 1.00 0.00 C ATOM 848 CG GLN A 59 -19.017 0.745 -5.726 1.00 0.00 C ATOM 849 CD GLN A 59 -20.508 0.938 -5.533 1.00 0.00 C ATOM 850 OE1 GLN A 59 -21.147 0.209 -4.774 1.00 0.00 O ATOM 851 NE2 GLN A 59 -21.071 1.925 -6.220 1.00 0.00 N ATOM 0 H GLN A 59 -15.731 0.991 -6.228 1.00 0.00 H new ATOM 0 HA GLN A 59 -16.833 2.127 -4.670 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -18.276 -0.503 -4.154 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -18.816 1.077 -3.622 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -18.607 1.609 -6.249 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -18.846 -0.123 -6.363 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -20.503 2.505 -6.838 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -22.071 2.103 -6.130 1.00 0.00 H new ATOM 860 N LYS A 60 -14.854 0.967 -3.045 1.00 0.00 N ATOM 861 CA LYS A 60 -14.107 0.795 -1.805 1.00 0.00 C ATOM 862 C LYS A 60 -14.275 2.008 -0.896 1.00 0.00 C ATOM 863 O LYS A 60 -14.780 3.048 -1.318 1.00 0.00 O ATOM 864 CB LYS A 60 -12.623 0.571 -2.107 1.00 0.00 C ATOM 865 CG LYS A 60 -12.349 -0.684 -2.916 1.00 0.00 C ATOM 866 CD LYS A 60 -12.582 -1.940 -2.093 1.00 0.00 C ATOM 867 CE LYS A 60 -12.895 -3.137 -2.978 1.00 0.00 C ATOM 868 NZ LYS A 60 -12.876 -4.414 -2.212 1.00 0.00 N ATOM 0 H LYS A 60 -14.276 1.175 -3.859 1.00 0.00 H new ATOM 0 HA LYS A 60 -14.503 -0.080 -1.290 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -12.237 1.434 -2.649 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.074 0.514 -1.167 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -12.993 -0.699 -3.795 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.320 -0.669 -3.275 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -11.697 -2.152 -1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.406 -1.774 -1.399 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -13.875 -3.003 -3.436 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -12.168 -3.189 -3.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -13.094 -5.205 -2.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -11.934 -4.555 -1.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -13.587 -4.375 -1.454 1.00 0.00 H new ATOM 882 N LYS A 61 -13.846 1.868 0.354 1.00 0.00 N ATOM 883 CA LYS A 61 -13.946 2.953 1.323 1.00 0.00 C ATOM 884 C LYS A 61 -12.750 2.948 2.271 1.00 0.00 C ATOM 885 O LYS A 61 -11.984 1.986 2.313 1.00 0.00 O ATOM 886 CB LYS A 61 -15.245 2.832 2.123 1.00 0.00 C ATOM 887 CG LYS A 61 -16.492 2.815 1.257 1.00 0.00 C ATOM 888 CD LYS A 61 -17.030 4.217 1.025 1.00 0.00 C ATOM 889 CE LYS A 61 -17.994 4.257 -0.151 1.00 0.00 C ATOM 890 NZ LYS A 61 -17.281 4.446 -1.445 1.00 0.00 N ATOM 0 H LYS A 61 -13.426 1.014 0.720 1.00 0.00 H new ATOM 0 HA LYS A 61 -13.950 3.896 0.776 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -15.213 1.919 2.717 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -15.310 3.665 2.823 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.264 2.349 0.298 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -17.259 2.205 1.734 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -17.537 4.567 1.924 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -16.201 4.900 0.840 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -18.566 3.330 -0.183 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -18.708 5.068 -0.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -17.865 4.075 -2.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -17.104 5.459 -1.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -16.375 3.936 -1.420 1.00 0.00 H new ATOM 904 N SER A 62 -12.599 4.027 3.031 1.00 0.00 N ATOM 905 CA SER A 62 -11.496 4.148 3.977 1.00 0.00 C ATOM 906 C SER A 62 -11.245 2.823 4.691 1.00 0.00 C ATOM 907 O SER A 62 -12.183 2.114 5.056 1.00 0.00 O ATOM 908 CB SER A 62 -11.792 5.244 5.002 1.00 0.00 C ATOM 909 OG SER A 62 -11.867 6.516 4.382 1.00 0.00 O ATOM 0 H SER A 62 -13.227 4.831 3.010 1.00 0.00 H new ATOM 0 HA SER A 62 -10.599 4.416 3.418 1.00 0.00 H new ATOM 0 HB2 SER A 62 -12.732 5.027 5.509 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.013 5.253 5.764 1.00 0.00 H new ATOM 0 HG SER A 62 -12.059 7.199 5.058 1.00 0.00 H new ATOM 915 N GLY A 63 -9.972 2.494 4.886 1.00 0.00 N ATOM 916 CA GLY A 63 -9.619 1.255 5.555 1.00 0.00 C ATOM 917 C GLY A 63 -9.631 0.066 4.616 1.00 0.00 C ATOM 918 O GLY A 63 -9.090 -0.992 4.937 1.00 0.00 O ATOM 0 H GLY A 63 -9.178 3.063 4.593 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -8.628 1.354 5.998 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -10.317 1.075 6.373 1.00 0.00 H new ATOM 922 N GLU A 64 -10.251 0.238 3.453 1.00 0.00 N ATOM 923 CA GLU A 64 -10.333 -0.832 2.465 1.00 0.00 C ATOM 924 C GLU A 64 -9.304 -0.629 1.357 1.00 0.00 C ATOM 925 O GLU A 64 -8.867 0.493 1.098 1.00 0.00 O ATOM 926 CB GLU A 64 -11.739 -0.897 1.866 1.00 0.00 C ATOM 927 CG GLU A 64 -12.066 -2.234 1.223 1.00 0.00 C ATOM 928 CD GLU A 64 -12.365 -3.315 2.244 1.00 0.00 C ATOM 929 OE1 GLU A 64 -11.408 -3.840 2.850 1.00 0.00 O ATOM 930 OE2 GLU A 64 -13.556 -3.634 2.436 1.00 0.00 O ATOM 0 H GLU A 64 -10.704 1.108 3.172 1.00 0.00 H new ATOM 0 HA GLU A 64 -10.117 -1.774 2.969 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -12.468 -0.692 2.650 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -11.844 -0.109 1.120 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -12.925 -2.115 0.563 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -11.228 -2.549 0.601 1.00 0.00 H new ATOM 937 N VAL A 65 -8.922 -1.722 0.705 1.00 0.00 N ATOM 938 CA VAL A 65 -7.945 -1.666 -0.377 1.00 0.00 C ATOM 939 C VAL A 65 -8.572 -2.072 -1.705 1.00 0.00 C ATOM 940 O VAL A 65 -9.382 -2.997 -1.764 1.00 0.00 O ATOM 941 CB VAL A 65 -6.738 -2.578 -0.091 1.00 0.00 C ATOM 942 CG1 VAL A 65 -7.174 -4.033 -0.014 1.00 0.00 C ATOM 943 CG2 VAL A 65 -5.665 -2.390 -1.153 1.00 0.00 C ATOM 0 H VAL A 65 -9.274 -2.658 0.907 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.603 -0.633 -0.441 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.315 -2.299 0.874 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.307 -4.662 0.189 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.904 -4.152 0.786 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.623 -4.329 -0.962 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.819 -3.042 -0.935 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.074 -2.641 -2.132 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.332 -1.352 -1.154 1.00 0.00 H new ATOM 953 N ALA A 66 -8.192 -1.375 -2.771 1.00 0.00 N ATOM 954 CA ALA A 66 -8.715 -1.664 -4.100 1.00 0.00 C ATOM 955 C ALA A 66 -7.681 -2.395 -4.950 1.00 0.00 C ATOM 956 O ALA A 66 -6.546 -1.939 -5.092 1.00 0.00 O ATOM 957 CB ALA A 66 -9.152 -0.379 -4.787 1.00 0.00 C ATOM 0 H ALA A 66 -7.523 -0.606 -2.740 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.582 -2.316 -3.988 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.540 -0.611 -5.779 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.931 0.103 -4.196 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.298 0.293 -4.879 1.00 0.00 H new ATOM 963 N VAL A 67 -8.080 -3.531 -5.512 1.00 0.00 N ATOM 964 CA VAL A 67 -7.187 -4.325 -6.349 1.00 0.00 C ATOM 965 C VAL A 67 -7.618 -4.279 -7.810 1.00 0.00 C ATOM 966 O VAL A 67 -8.809 -4.342 -8.120 1.00 0.00 O ATOM 967 CB VAL A 67 -7.141 -5.793 -5.884 1.00 0.00 C ATOM 968 CG1 VAL A 67 -6.185 -6.597 -6.752 1.00 0.00 C ATOM 969 CG2 VAL A 67 -6.741 -5.875 -4.419 1.00 0.00 C ATOM 0 H VAL A 67 -9.015 -3.923 -5.403 1.00 0.00 H new ATOM 0 HA VAL A 67 -6.192 -3.890 -6.253 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.138 -6.221 -5.989 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -6.165 -7.632 -6.409 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -6.520 -6.565 -7.789 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.184 -6.172 -6.681 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -6.714 -6.919 -4.107 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.755 -5.430 -4.286 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.468 -5.334 -3.813 1.00 0.00 H new ATOM 979 N LEU A 68 -6.643 -4.169 -8.705 1.00 0.00 N ATOM 980 CA LEU A 68 -6.920 -4.116 -10.137 1.00 0.00 C ATOM 981 C LEU A 68 -5.820 -4.812 -10.931 1.00 0.00 C ATOM 982 O LEU A 68 -4.633 -4.566 -10.716 1.00 0.00 O ATOM 983 CB LEU A 68 -7.055 -2.663 -10.596 1.00 0.00 C ATOM 984 CG LEU A 68 -7.999 -2.416 -11.773 1.00 0.00 C ATOM 985 CD1 LEU A 68 -9.448 -2.561 -11.336 1.00 0.00 C ATOM 986 CD2 LEU A 68 -7.756 -1.038 -12.371 1.00 0.00 C ATOM 0 H LEU A 68 -5.653 -4.115 -8.465 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.859 -4.638 -10.320 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -7.397 -2.066 -9.750 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.065 -2.295 -10.866 1.00 0.00 H new ATOM 0 HG LEU A 68 -7.796 -3.164 -12.539 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -10.105 -2.382 -12.187 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.614 -3.569 -10.956 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.666 -1.837 -10.551 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -8.437 -0.879 -13.208 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.930 -0.276 -11.612 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.727 -0.970 -12.723 1.00 0.00 H new ATOM 998 N LYS A 69 -6.223 -5.681 -11.852 1.00 0.00 N ATOM 999 CA LYS A 69 -5.272 -6.411 -12.683 1.00 0.00 C ATOM 1000 C LYS A 69 -5.120 -5.748 -14.048 1.00 0.00 C ATOM 1001 O LYS A 69 -6.011 -5.834 -14.893 1.00 0.00 O ATOM 1002 CB LYS A 69 -5.726 -7.863 -12.857 1.00 0.00 C ATOM 1003 CG LYS A 69 -4.937 -8.625 -13.907 1.00 0.00 C ATOM 1004 CD LYS A 69 -3.637 -9.171 -13.341 1.00 0.00 C ATOM 1005 CE LYS A 69 -3.137 -10.363 -14.142 1.00 0.00 C ATOM 1006 NZ LYS A 69 -4.036 -11.542 -14.002 1.00 0.00 N ATOM 0 H LYS A 69 -7.202 -5.897 -12.042 1.00 0.00 H new ATOM 0 HA LYS A 69 -4.304 -6.396 -12.182 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -5.637 -8.380 -11.901 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -6.782 -7.875 -13.128 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.541 -9.447 -14.292 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -4.720 -7.967 -14.749 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.880 -8.387 -13.343 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.787 -9.466 -12.303 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.061 -10.087 -15.194 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.134 -10.630 -13.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.509 -12.409 -14.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -4.387 -11.596 -13.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.840 -11.445 -14.654 1.00 0.00 H new ATOM 1020 N ARG A 70 -3.986 -5.087 -14.256 1.00 0.00 N ATOM 1021 CA ARG A 70 -3.718 -4.410 -15.519 1.00 0.00 C ATOM 1022 C ARG A 70 -2.538 -5.053 -16.242 1.00 0.00 C ATOM 1023 O ARG A 70 -2.710 -5.711 -17.268 1.00 0.00 O ATOM 1024 CB ARG A 70 -3.434 -2.926 -15.276 1.00 0.00 C ATOM 1025 CG ARG A 70 -3.890 -2.024 -16.411 1.00 0.00 C ATOM 1026 CD ARG A 70 -5.327 -1.567 -16.216 1.00 0.00 C ATOM 1027 NE ARG A 70 -5.634 -0.375 -17.003 1.00 0.00 N ATOM 1028 CZ ARG A 70 -6.867 -0.016 -17.342 1.00 0.00 C ATOM 1029 NH1 ARG A 70 -7.903 -0.753 -16.966 1.00 0.00 N ATOM 1030 NH2 ARG A 70 -7.065 1.083 -18.059 1.00 0.00 N ATOM 0 H ARG A 70 -3.239 -5.006 -13.567 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.603 -4.506 -16.148 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.929 -2.616 -14.356 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -2.363 -2.790 -15.123 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -3.236 -1.154 -16.472 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -3.802 -2.556 -17.358 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -6.005 -2.372 -16.498 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -5.501 -1.359 -15.160 1.00 0.00 H new ATOM 0 HE ARG A 70 -4.859 0.214 -17.309 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -7.754 -1.598 -16.415 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -8.849 -0.475 -17.228 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -6.270 1.652 -18.350 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -8.012 1.358 -18.319 1.00 0.00 H new ATOM 1044 N ASP A 71 -1.341 -4.857 -15.699 1.00 0.00 N ATOM 1045 CA ASP A 71 -0.133 -5.419 -16.292 1.00 0.00 C ATOM 1046 C ASP A 71 0.259 -6.719 -15.597 1.00 0.00 C ATOM 1047 O ASP A 71 1.145 -6.736 -14.743 1.00 0.00 O ATOM 1048 CB ASP A 71 1.017 -4.414 -16.206 1.00 0.00 C ATOM 1049 CG ASP A 71 0.953 -3.366 -17.300 1.00 0.00 C ATOM 1050 OD1 ASP A 71 -0.161 -2.885 -17.596 1.00 0.00 O ATOM 1051 OD2 ASP A 71 2.016 -3.028 -17.861 1.00 0.00 O ATOM 0 H ASP A 71 -1.182 -4.314 -14.850 1.00 0.00 H new ATOM 0 HA ASP A 71 -0.339 -5.636 -17.340 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.994 -3.922 -15.234 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.966 -4.946 -16.271 1.00 0.00 H new ATOM 1056 N GLY A 72 -0.408 -7.807 -15.969 1.00 0.00 N ATOM 1057 CA GLY A 72 -0.116 -9.097 -15.371 1.00 0.00 C ATOM 1058 C GLY A 72 0.270 -8.984 -13.909 1.00 0.00 C ATOM 1059 O GLY A 72 1.134 -9.719 -13.431 1.00 0.00 O ATOM 0 H GLY A 72 -1.145 -7.818 -16.674 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -0.989 -9.743 -15.464 1.00 0.00 H new ATOM 0 HA3 GLY A 72 0.694 -9.574 -15.922 1.00 0.00 H new ATOM 1063 N ARG A 73 -0.370 -8.062 -13.199 1.00 0.00 N ATOM 1064 CA ARG A 73 -0.086 -7.853 -11.784 1.00 0.00 C ATOM 1065 C ARG A 73 -1.264 -7.179 -11.087 1.00 0.00 C ATOM 1066 O ARG A 73 -2.028 -6.441 -11.710 1.00 0.00 O ATOM 1067 CB ARG A 73 1.175 -7.004 -11.615 1.00 0.00 C ATOM 1068 CG ARG A 73 0.969 -5.535 -11.946 1.00 0.00 C ATOM 1069 CD ARG A 73 2.211 -4.714 -11.635 1.00 0.00 C ATOM 1070 NE ARG A 73 3.117 -4.639 -12.777 1.00 0.00 N ATOM 1071 CZ ARG A 73 3.047 -3.696 -13.710 1.00 0.00 C ATOM 1072 NH1 ARG A 73 2.118 -2.753 -13.635 1.00 0.00 N ATOM 1073 NH2 ARG A 73 3.908 -3.694 -14.719 1.00 0.00 N ATOM 0 H ARG A 73 -1.089 -7.447 -13.580 1.00 0.00 H new ATOM 0 HA ARG A 73 0.077 -8.828 -11.324 1.00 0.00 H new ATOM 0 HB2 ARG A 73 1.526 -7.090 -10.587 1.00 0.00 H new ATOM 0 HB3 ARG A 73 1.961 -7.405 -12.255 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.717 -5.431 -13.001 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.124 -5.148 -11.377 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.916 -3.707 -11.340 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.734 -5.155 -10.786 1.00 0.00 H new ATOM 0 HE ARG A 73 3.844 -5.350 -12.863 1.00 0.00 H new ATOM 0 HH11 ARG A 73 1.455 -2.751 -12.860 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.066 -2.030 -14.353 1.00 0.00 H new ATOM 0 HH21 ARG A 73 4.625 -4.417 -14.779 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.853 -2.969 -15.435 1.00 0.00 H new ATOM 1087 N TYR A 74 -1.405 -7.438 -9.792 1.00 0.00 N ATOM 1088 CA TYR A 74 -2.491 -6.858 -9.010 1.00 0.00 C ATOM 1089 C TYR A 74 -2.018 -5.622 -8.253 1.00 0.00 C ATOM 1090 O TYR A 74 -1.196 -5.716 -7.340 1.00 0.00 O ATOM 1091 CB TYR A 74 -3.048 -7.890 -8.028 1.00 0.00 C ATOM 1092 CG TYR A 74 -3.488 -9.178 -8.687 1.00 0.00 C ATOM 1093 CD1 TYR A 74 -4.376 -9.165 -9.757 1.00 0.00 C ATOM 1094 CD2 TYR A 74 -3.019 -10.406 -8.241 1.00 0.00 C ATOM 1095 CE1 TYR A 74 -4.782 -10.338 -10.362 1.00 0.00 C ATOM 1096 CE2 TYR A 74 -3.418 -11.585 -8.841 1.00 0.00 C ATOM 1097 CZ TYR A 74 -4.300 -11.546 -9.901 1.00 0.00 C ATOM 1098 OH TYR A 74 -4.702 -12.717 -10.500 1.00 0.00 O ATOM 0 H TYR A 74 -0.781 -8.046 -9.261 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.281 -6.559 -9.699 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.287 -8.116 -7.281 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -3.896 -7.455 -7.499 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -4.755 -8.221 -10.121 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -2.330 -10.441 -7.410 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -5.473 -10.310 -11.192 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -3.042 -12.532 -8.482 1.00 0.00 H new ATOM 0 HH TYR A 74 -4.270 -13.476 -10.056 1.00 0.00 H new ATOM 1108 N ILE A 75 -2.543 -4.463 -8.637 1.00 0.00 N ATOM 1109 CA ILE A 75 -2.176 -3.208 -7.993 1.00 0.00 C ATOM 1110 C ILE A 75 -3.139 -2.869 -6.861 1.00 0.00 C ATOM 1111 O ILE A 75 -4.357 -2.897 -7.039 1.00 0.00 O ATOM 1112 CB ILE A 75 -2.156 -2.044 -9.001 1.00 0.00 C ATOM 1113 CG1 ILE A 75 -1.311 -2.412 -10.222 1.00 0.00 C ATOM 1114 CG2 ILE A 75 -1.622 -0.781 -8.341 1.00 0.00 C ATOM 1115 CD1 ILE A 75 -1.330 -1.361 -11.310 1.00 0.00 C ATOM 0 H ILE A 75 -3.224 -4.367 -9.391 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.174 -3.343 -7.586 1.00 0.00 H new ATOM 0 HB ILE A 75 -3.176 -1.853 -9.334 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.281 -2.576 -9.905 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.672 -3.355 -10.633 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.614 0.033 -9.066 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.261 -0.512 -7.500 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.608 -0.958 -7.983 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.710 -1.689 -12.144 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.353 -1.213 -11.655 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.941 -0.422 -10.916 1.00 0.00 H new ATOM 1127 N TYR A 76 -2.586 -2.547 -5.697 1.00 0.00 N ATOM 1128 CA TYR A 76 -3.395 -2.203 -4.535 1.00 0.00 C ATOM 1129 C TYR A 76 -3.457 -0.690 -4.342 1.00 0.00 C ATOM 1130 O TYR A 76 -2.488 0.021 -4.610 1.00 0.00 O ATOM 1131 CB TYR A 76 -2.829 -2.865 -3.278 1.00 0.00 C ATOM 1132 CG TYR A 76 -2.751 -4.372 -3.370 1.00 0.00 C ATOM 1133 CD1 TYR A 76 -1.627 -4.999 -3.895 1.00 0.00 C ATOM 1134 CD2 TYR A 76 -3.801 -5.170 -2.932 1.00 0.00 C ATOM 1135 CE1 TYR A 76 -1.553 -6.376 -3.982 1.00 0.00 C ATOM 1136 CE2 TYR A 76 -3.734 -6.547 -3.014 1.00 0.00 C ATOM 1137 CZ TYR A 76 -2.608 -7.145 -3.540 1.00 0.00 C ATOM 1138 OH TYR A 76 -2.537 -8.517 -3.624 1.00 0.00 O ATOM 0 H TYR A 76 -1.580 -2.517 -5.534 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.406 -2.571 -4.707 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -1.832 -2.469 -3.087 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -3.449 -2.593 -2.424 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -0.798 -4.400 -4.241 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -4.685 -4.705 -2.520 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -0.673 -6.847 -4.394 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -4.559 -7.152 -2.668 1.00 0.00 H new ATOM 0 HH TYR A 76 -2.772 -8.910 -2.758 1.00 0.00 H new ATOM 1148 N TYR A 77 -4.603 -0.206 -3.876 1.00 0.00 N ATOM 1149 CA TYR A 77 -4.793 1.221 -3.649 1.00 0.00 C ATOM 1150 C TYR A 77 -5.383 1.479 -2.265 1.00 0.00 C ATOM 1151 O TYR A 77 -6.598 1.608 -2.110 1.00 0.00 O ATOM 1152 CB TYR A 77 -5.707 1.813 -4.723 1.00 0.00 C ATOM 1153 CG TYR A 77 -5.136 1.722 -6.121 1.00 0.00 C ATOM 1154 CD1 TYR A 77 -5.275 0.563 -6.875 1.00 0.00 C ATOM 1155 CD2 TYR A 77 -4.457 2.794 -6.686 1.00 0.00 C ATOM 1156 CE1 TYR A 77 -4.755 0.475 -8.151 1.00 0.00 C ATOM 1157 CE2 TYR A 77 -3.935 2.715 -7.962 1.00 0.00 C ATOM 1158 CZ TYR A 77 -4.086 1.554 -8.691 1.00 0.00 C ATOM 1159 OH TYR A 77 -3.566 1.471 -9.962 1.00 0.00 O ATOM 0 H TYR A 77 -5.414 -0.781 -3.648 1.00 0.00 H new ATOM 0 HA TYR A 77 -3.818 1.704 -3.705 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.666 1.296 -4.697 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -5.902 2.859 -4.486 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -5.799 -0.283 -6.456 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.335 3.704 -6.118 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -4.871 -0.434 -8.723 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -3.411 3.558 -8.387 1.00 0.00 H new ATOM 0 HH TYR A 77 -3.127 2.317 -10.192 1.00 0.00 H new ATOM 1169 N LEU A 78 -4.514 1.553 -1.263 1.00 0.00 N ATOM 1170 CA LEU A 78 -4.947 1.796 0.108 1.00 0.00 C ATOM 1171 C LEU A 78 -5.708 3.114 0.214 1.00 0.00 C ATOM 1172 O LEU A 78 -5.256 4.144 -0.287 1.00 0.00 O ATOM 1173 CB LEU A 78 -3.741 1.814 1.049 1.00 0.00 C ATOM 1174 CG LEU A 78 -2.774 0.635 0.923 1.00 0.00 C ATOM 1175 CD1 LEU A 78 -1.380 1.038 1.378 1.00 0.00 C ATOM 1176 CD2 LEU A 78 -3.277 -0.555 1.728 1.00 0.00 C ATOM 0 H LEU A 78 -3.506 1.448 -1.374 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.616 0.987 0.400 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.184 2.735 0.876 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.107 1.850 2.075 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.721 0.343 -0.126 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.706 0.187 1.281 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.019 1.859 0.759 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.415 1.357 2.420 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.577 -1.385 1.627 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -3.359 -0.275 2.778 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.256 -0.859 1.356 1.00 0.00 H new ATOM 1188 N ILE A 79 -6.862 3.073 0.870 1.00 0.00 N ATOM 1189 CA ILE A 79 -7.684 4.265 1.044 1.00 0.00 C ATOM 1190 C ILE A 79 -7.732 4.690 2.508 1.00 0.00 C ATOM 1191 O ILE A 79 -8.315 4.003 3.347 1.00 0.00 O ATOM 1192 CB ILE A 79 -9.121 4.036 0.540 1.00 0.00 C ATOM 1193 CG1 ILE A 79 -9.113 3.692 -0.951 1.00 0.00 C ATOM 1194 CG2 ILE A 79 -9.976 5.268 0.800 1.00 0.00 C ATOM 1195 CD1 ILE A 79 -10.257 2.795 -1.370 1.00 0.00 C ATOM 0 H ILE A 79 -7.249 2.228 1.290 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.222 5.056 0.453 1.00 0.00 H new ATOM 0 HB ILE A 79 -9.552 3.196 1.085 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -9.155 4.615 -1.529 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -8.170 3.204 -1.198 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -10.989 5.091 0.438 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -10.003 5.473 1.870 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -9.549 6.124 0.278 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -10.188 2.593 -2.439 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.204 1.856 -0.819 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -11.204 3.289 -1.155 1.00 0.00 H new ATOM 1207 N THR A 80 -7.117 5.830 2.807 1.00 0.00 N ATOM 1208 CA THR A 80 -7.090 6.349 4.169 1.00 0.00 C ATOM 1209 C THR A 80 -7.861 7.659 4.274 1.00 0.00 C ATOM 1210 O THR A 80 -8.598 7.883 5.235 1.00 0.00 O ATOM 1211 CB THR A 80 -5.646 6.576 4.655 1.00 0.00 C ATOM 1212 OG1 THR A 80 -4.912 7.322 3.678 1.00 0.00 O ATOM 1213 CG2 THR A 80 -4.948 5.250 4.917 1.00 0.00 C ATOM 0 H THR A 80 -6.631 6.411 2.124 1.00 0.00 H new ATOM 0 HA THR A 80 -7.565 5.600 4.802 1.00 0.00 H new ATOM 0 HB THR A 80 -5.685 7.139 5.588 1.00 0.00 H new ATOM 0 HG1 THR A 80 -3.996 7.464 3.995 1.00 0.00 H new ATOM 0 HG21 THR A 80 -3.930 5.436 5.259 1.00 0.00 H new ATOM 0 HG22 THR A 80 -5.493 4.697 5.682 1.00 0.00 H new ATOM 0 HG23 THR A 80 -4.921 4.665 3.997 1.00 0.00 H new ATOM 1221 N LYS A 81 -7.689 8.523 3.280 1.00 0.00 N ATOM 1222 CA LYS A 81 -8.370 9.812 3.258 1.00 0.00 C ATOM 1223 C LYS A 81 -9.504 9.810 2.238 1.00 0.00 C ATOM 1224 O LYS A 81 -9.342 9.334 1.114 1.00 0.00 O ATOM 1225 CB LYS A 81 -7.379 10.931 2.932 1.00 0.00 C ATOM 1226 CG LYS A 81 -6.839 10.871 1.514 1.00 0.00 C ATOM 1227 CD LYS A 81 -5.729 11.886 1.296 1.00 0.00 C ATOM 1228 CE LYS A 81 -6.273 13.306 1.250 1.00 0.00 C ATOM 1229 NZ LYS A 81 -5.244 14.280 0.791 1.00 0.00 N ATOM 0 H LYS A 81 -7.083 8.354 2.477 1.00 0.00 H new ATOM 0 HA LYS A 81 -8.794 9.988 4.247 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -7.867 11.893 3.085 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -6.545 10.882 3.632 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.462 9.869 1.309 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -7.648 11.058 0.808 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -4.995 11.802 2.098 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -5.209 11.664 0.364 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -7.133 13.344 0.581 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.627 13.592 2.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.581 15.249 0.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -4.359 14.122 1.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.073 14.150 -0.227 1.00 0.00 H new ATOM 1243 N LYS A 82 -10.653 10.347 2.636 1.00 0.00 N ATOM 1244 CA LYS A 82 -11.814 10.411 1.757 1.00 0.00 C ATOM 1245 C LYS A 82 -11.605 11.444 0.654 1.00 0.00 C ATOM 1246 O LYS A 82 -11.607 11.111 -0.531 1.00 0.00 O ATOM 1247 CB LYS A 82 -13.070 10.754 2.561 1.00 0.00 C ATOM 1248 CG LYS A 82 -13.590 9.599 3.398 1.00 0.00 C ATOM 1249 CD LYS A 82 -15.097 9.675 3.579 1.00 0.00 C ATOM 1250 CE LYS A 82 -15.832 9.153 2.354 1.00 0.00 C ATOM 1251 NZ LYS A 82 -17.218 8.718 2.683 1.00 0.00 N ATOM 0 H LYS A 82 -10.804 10.745 3.563 1.00 0.00 H new ATOM 0 HA LYS A 82 -11.943 9.433 1.294 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -12.853 11.598 3.216 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -13.853 11.076 1.875 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -13.327 8.655 2.920 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -13.105 9.608 4.374 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -15.389 9.095 4.455 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -15.390 10.708 3.768 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -15.867 9.932 1.592 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -15.280 8.315 1.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -17.686 8.369 1.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -17.184 7.957 3.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -17.753 9.524 3.065 1.00 0.00 H new ATOM 1265 N ARG A 83 -11.425 12.699 1.052 1.00 0.00 N ATOM 1266 CA ARG A 83 -11.214 13.781 0.098 1.00 0.00 C ATOM 1267 C ARG A 83 -10.067 14.683 0.542 1.00 0.00 C ATOM 1268 O ARG A 83 -9.713 14.719 1.720 1.00 0.00 O ATOM 1269 CB ARG A 83 -12.493 14.606 -0.061 1.00 0.00 C ATOM 1270 CG ARG A 83 -13.693 13.788 -0.509 1.00 0.00 C ATOM 1271 CD ARG A 83 -14.808 14.678 -1.038 1.00 0.00 C ATOM 1272 NE ARG A 83 -16.111 14.023 -0.969 1.00 0.00 N ATOM 1273 CZ ARG A 83 -17.265 14.665 -1.111 1.00 0.00 C ATOM 1274 NH1 ARG A 83 -17.277 15.973 -1.330 1.00 0.00 N ATOM 1275 NH2 ARG A 83 -18.410 13.999 -1.036 1.00 0.00 N ATOM 0 H ARG A 83 -11.421 12.992 2.029 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.953 13.338 -0.863 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -12.726 15.087 0.889 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -12.315 15.401 -0.785 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -13.387 13.086 -1.285 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -14.064 13.196 0.328 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.837 15.603 -0.463 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.594 14.951 -2.071 1.00 0.00 H new ATOM 0 HE ARG A 83 -16.136 13.017 -0.803 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -16.399 16.488 -1.390 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -18.165 16.464 -1.439 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -18.405 12.993 -0.869 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -19.296 14.493 -1.145 1.00 0.00 H new ATOM 1289 N ALA A 84 -9.489 15.409 -0.410 1.00 0.00 N ATOM 1290 CA ALA A 84 -8.382 16.311 -0.117 1.00 0.00 C ATOM 1291 C ALA A 84 -8.661 17.132 1.138 1.00 0.00 C ATOM 1292 O ALA A 84 -7.772 17.345 1.962 1.00 0.00 O ATOM 1293 CB ALA A 84 -8.121 17.228 -1.303 1.00 0.00 C ATOM 0 H ALA A 84 -9.769 15.390 -1.391 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.492 15.708 0.065 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -7.292 17.896 -1.071 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -7.870 16.629 -2.178 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -9.014 17.817 -1.511 1.00 0.00 H new ATOM 1299 N SER A 85 -9.901 17.592 1.275 1.00 0.00 N ATOM 1300 CA SER A 85 -10.296 18.394 2.427 1.00 0.00 C ATOM 1301 C SER A 85 -10.030 17.643 3.728 1.00 0.00 C ATOM 1302 O SER A 85 -9.642 18.239 4.734 1.00 0.00 O ATOM 1303 CB SER A 85 -11.777 18.766 2.333 1.00 0.00 C ATOM 1304 OG SER A 85 -12.258 19.261 3.570 1.00 0.00 O ATOM 0 H SER A 85 -10.649 17.423 0.602 1.00 0.00 H new ATOM 0 HA SER A 85 -9.699 19.306 2.425 1.00 0.00 H new ATOM 0 HB2 SER A 85 -11.918 19.519 1.557 1.00 0.00 H new ATOM 0 HB3 SER A 85 -12.357 17.892 2.038 1.00 0.00 H new ATOM 0 HG SER A 85 -13.206 19.493 3.483 1.00 0.00 H new ATOM 1310 N HIS A 86 -10.240 16.331 3.701 1.00 0.00 N ATOM 1311 CA HIS A 86 -10.023 15.497 4.878 1.00 0.00 C ATOM 1312 C HIS A 86 -8.585 14.989 4.926 1.00 0.00 C ATOM 1313 O HIS A 86 -8.011 14.620 3.901 1.00 0.00 O ATOM 1314 CB HIS A 86 -10.994 14.316 4.878 1.00 0.00 C ATOM 1315 CG HIS A 86 -12.377 14.678 4.433 1.00 0.00 C ATOM 1316 ND1 HIS A 86 -12.957 14.170 3.289 1.00 0.00 N ATOM 1317 CD2 HIS A 86 -13.299 15.501 4.987 1.00 0.00 C ATOM 1318 CE1 HIS A 86 -14.174 14.667 3.157 1.00 0.00 C ATOM 1319 NE2 HIS A 86 -14.406 15.477 4.175 1.00 0.00 N ATOM 0 H HIS A 86 -10.560 15.822 2.877 1.00 0.00 H new ATOM 0 HA HIS A 86 -10.204 16.106 5.763 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -10.604 13.535 4.225 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -11.043 13.896 5.883 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -13.185 16.070 5.898 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -14.862 14.448 2.354 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -15.268 16.000 4.332 1.00 0.00 H new ATOM 1327 N LYS A 87 -8.008 14.974 6.122 1.00 0.00 N ATOM 1328 CA LYS A 87 -6.637 14.512 6.305 1.00 0.00 C ATOM 1329 C LYS A 87 -6.609 13.045 6.722 1.00 0.00 C ATOM 1330 O LYS A 87 -7.533 12.538 7.359 1.00 0.00 O ATOM 1331 CB LYS A 87 -5.925 15.365 7.357 1.00 0.00 C ATOM 1332 CG LYS A 87 -5.186 16.557 6.774 1.00 0.00 C ATOM 1333 CD LYS A 87 -6.015 17.264 5.715 1.00 0.00 C ATOM 1334 CE LYS A 87 -5.537 16.922 4.312 1.00 0.00 C ATOM 1335 NZ LYS A 87 -4.501 17.878 3.831 1.00 0.00 N ATOM 0 H LYS A 87 -8.469 15.277 6.980 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.117 14.612 5.352 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -6.658 15.721 8.081 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.217 14.740 7.901 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -4.938 17.258 7.571 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -4.244 16.224 6.338 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -7.062 16.981 5.823 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.959 18.342 5.867 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -5.130 15.911 4.303 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.385 16.930 3.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -4.201 17.611 2.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -4.897 18.840 3.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -3.681 17.852 4.470 1.00 0.00 H new ATOM 1349 N PRO A 88 -5.525 12.345 6.357 1.00 0.00 N ATOM 1350 CA PRO A 88 -5.350 10.927 6.685 1.00 0.00 C ATOM 1351 C PRO A 88 -5.115 10.701 8.174 1.00 0.00 C ATOM 1352 O PRO A 88 -4.728 11.618 8.899 1.00 0.00 O ATOM 1353 CB PRO A 88 -4.110 10.528 5.881 1.00 0.00 C ATOM 1354 CG PRO A 88 -3.352 11.797 5.698 1.00 0.00 C ATOM 1355 CD PRO A 88 -4.385 12.885 5.597 1.00 0.00 C ATOM 0 HA PRO A 88 -6.237 10.341 6.446 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -3.516 9.785 6.413 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -4.385 10.089 4.922 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -2.679 11.974 6.537 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -2.737 11.758 4.799 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.025 13.821 6.023 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -4.654 13.089 4.561 1.00 0.00 H new ATOM 1363 N THR A 89 -5.350 9.473 8.627 1.00 0.00 N ATOM 1364 CA THR A 89 -5.165 9.127 10.030 1.00 0.00 C ATOM 1365 C THR A 89 -4.457 7.785 10.176 1.00 0.00 C ATOM 1366 O THR A 89 -4.723 6.846 9.425 1.00 0.00 O ATOM 1367 CB THR A 89 -6.511 9.068 10.777 1.00 0.00 C ATOM 1368 OG1 THR A 89 -7.443 8.265 10.044 1.00 0.00 O ATOM 1369 CG2 THR A 89 -7.082 10.464 10.974 1.00 0.00 C ATOM 0 H THR A 89 -5.669 8.701 8.041 1.00 0.00 H new ATOM 0 HA THR A 89 -4.548 9.911 10.470 1.00 0.00 H new ATOM 0 HB THR A 89 -6.339 8.622 11.756 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.296 8.231 10.526 1.00 0.00 H new ATOM 0 HG21 THR A 89 -8.032 10.397 11.504 1.00 0.00 H new ATOM 0 HG22 THR A 89 -6.383 11.064 11.557 1.00 0.00 H new ATOM 0 HG23 THR A 89 -7.240 10.933 10.003 1.00 0.00 H new ATOM 1377 N TYR A 90 -3.554 7.701 11.147 1.00 0.00 N ATOM 1378 CA TYR A 90 -2.806 6.473 11.391 1.00 0.00 C ATOM 1379 C TYR A 90 -3.750 5.299 11.632 1.00 0.00 C ATOM 1380 O TYR A 90 -3.542 4.204 11.110 1.00 0.00 O ATOM 1381 CB TYR A 90 -1.874 6.648 12.591 1.00 0.00 C ATOM 1382 CG TYR A 90 -0.761 7.643 12.353 1.00 0.00 C ATOM 1383 CD1 TYR A 90 0.062 7.541 11.238 1.00 0.00 C ATOM 1384 CD2 TYR A 90 -0.533 8.686 13.242 1.00 0.00 C ATOM 1385 CE1 TYR A 90 1.081 8.447 11.018 1.00 0.00 C ATOM 1386 CE2 TYR A 90 0.483 9.598 13.029 1.00 0.00 C ATOM 1387 CZ TYR A 90 1.287 9.474 11.915 1.00 0.00 C ATOM 1388 OH TYR A 90 2.300 10.380 11.698 1.00 0.00 O ATOM 0 H TYR A 90 -3.322 8.468 11.778 1.00 0.00 H new ATOM 0 HA TYR A 90 -2.209 6.259 10.505 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -2.460 6.970 13.452 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.438 5.682 12.846 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.098 6.740 10.532 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -1.161 8.786 14.115 1.00 0.00 H new ATOM 0 HE1 TYR A 90 1.713 8.352 10.148 1.00 0.00 H new ATOM 0 HE2 TYR A 90 0.647 10.403 13.730 1.00 0.00 H new ATOM 0 HH TYR A 90 2.668 10.250 10.799 1.00 0.00 H new ATOM 1398 N GLU A 91 -4.788 5.537 12.428 1.00 0.00 N ATOM 1399 CA GLU A 91 -5.764 4.499 12.739 1.00 0.00 C ATOM 1400 C GLU A 91 -6.243 3.804 11.468 1.00 0.00 C ATOM 1401 O GLU A 91 -6.093 2.592 11.317 1.00 0.00 O ATOM 1402 CB GLU A 91 -6.957 5.098 13.487 1.00 0.00 C ATOM 1403 CG GLU A 91 -8.040 4.084 13.817 1.00 0.00 C ATOM 1404 CD GLU A 91 -9.253 4.718 14.471 1.00 0.00 C ATOM 1405 OE1 GLU A 91 -9.832 5.648 13.872 1.00 0.00 O ATOM 1406 OE2 GLU A 91 -9.622 4.283 15.582 1.00 0.00 O ATOM 0 H GLU A 91 -4.974 6.438 12.868 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.279 3.759 13.376 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.604 5.554 14.412 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -7.390 5.896 12.884 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.348 3.577 12.903 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.630 3.323 14.481 1.00 0.00 H new ATOM 1413 N ASN A 92 -6.821 4.580 10.558 1.00 0.00 N ATOM 1414 CA ASN A 92 -7.324 4.040 9.300 1.00 0.00 C ATOM 1415 C ASN A 92 -6.209 3.348 8.521 1.00 0.00 C ATOM 1416 O ASN A 92 -6.367 2.215 8.064 1.00 0.00 O ATOM 1417 CB ASN A 92 -7.939 5.154 8.451 1.00 0.00 C ATOM 1418 CG ASN A 92 -9.357 5.486 8.873 1.00 0.00 C ATOM 1419 OD1 ASN A 92 -10.133 4.601 9.232 1.00 0.00 O ATOM 1420 ND2 ASN A 92 -9.702 6.768 8.830 1.00 0.00 N ATOM 0 H ASN A 92 -6.953 5.585 10.668 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.093 3.303 9.532 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -7.321 6.049 8.527 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -7.936 4.853 7.403 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -10.643 7.052 9.101 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -9.026 7.468 8.526 1.00 0.00 H new ATOM 1427 N LEU A 93 -5.083 4.037 8.374 1.00 0.00 N ATOM 1428 CA LEU A 93 -3.940 3.489 7.651 1.00 0.00 C ATOM 1429 C LEU A 93 -3.681 2.042 8.057 1.00 0.00 C ATOM 1430 O LEU A 93 -3.710 1.139 7.221 1.00 0.00 O ATOM 1431 CB LEU A 93 -2.693 4.335 7.913 1.00 0.00 C ATOM 1432 CG LEU A 93 -1.365 3.733 7.452 1.00 0.00 C ATOM 1433 CD1 LEU A 93 -1.199 3.893 5.949 1.00 0.00 C ATOM 1434 CD2 LEU A 93 -0.202 4.379 8.191 1.00 0.00 C ATOM 0 H LEU A 93 -4.937 4.976 8.745 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.170 3.512 6.586 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.822 5.299 7.421 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.629 4.530 8.984 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.371 2.668 7.684 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.248 3.459 5.640 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.015 3.383 5.437 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.215 4.952 5.692 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.735 3.939 7.851 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.193 5.450 7.990 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.314 4.211 9.262 1.00 0.00 H new ATOM 1446 N GLN A 94 -3.431 1.829 9.345 1.00 0.00 N ATOM 1447 CA GLN A 94 -3.169 0.491 9.861 1.00 0.00 C ATOM 1448 C GLN A 94 -4.086 -0.535 9.204 1.00 0.00 C ATOM 1449 O GLN A 94 -3.623 -1.460 8.537 1.00 0.00 O ATOM 1450 CB GLN A 94 -3.356 0.462 11.379 1.00 0.00 C ATOM 1451 CG GLN A 94 -2.474 -0.558 12.081 1.00 0.00 C ATOM 1452 CD GLN A 94 -2.912 -0.826 13.507 1.00 0.00 C ATOM 1453 OE1 GLN A 94 -3.339 0.084 14.219 1.00 0.00 O ATOM 1454 NE2 GLN A 94 -2.809 -2.079 13.933 1.00 0.00 N ATOM 0 H GLN A 94 -3.404 2.566 10.050 1.00 0.00 H new ATOM 0 HA GLN A 94 -2.137 0.233 9.624 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -3.144 1.452 11.782 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -4.400 0.244 11.604 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -2.488 -1.492 11.519 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.444 -0.202 12.082 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -2.450 -2.802 13.309 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -3.089 -2.319 14.884 1.00 0.00 H new ATOM 1463 N LYS A 95 -5.390 -0.366 9.397 1.00 0.00 N ATOM 1464 CA LYS A 95 -6.373 -1.276 8.823 1.00 0.00 C ATOM 1465 C LYS A 95 -6.079 -1.536 7.349 1.00 0.00 C ATOM 1466 O LYS A 95 -5.917 -2.683 6.932 1.00 0.00 O ATOM 1467 CB LYS A 95 -7.783 -0.701 8.979 1.00 0.00 C ATOM 1468 CG LYS A 95 -8.166 -0.411 10.420 1.00 0.00 C ATOM 1469 CD LYS A 95 -9.628 -0.017 10.540 1.00 0.00 C ATOM 1470 CE LYS A 95 -9.878 1.374 9.976 1.00 0.00 C ATOM 1471 NZ LYS A 95 -11.331 1.696 9.918 1.00 0.00 N ATOM 0 H LYS A 95 -5.790 0.394 9.947 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.312 -2.223 9.360 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.857 0.220 8.400 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -8.501 -1.403 8.555 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -7.974 -1.292 11.033 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -7.539 0.391 10.810 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -10.246 -0.742 10.011 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -9.929 -0.046 11.587 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -9.367 2.113 10.593 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -9.451 1.443 8.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -11.455 2.703 9.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.786 1.117 9.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -11.769 1.492 10.839 1.00 0.00 H new ATOM 1485 N SER A 96 -6.010 -0.464 6.566 1.00 0.00 N ATOM 1486 CA SER A 96 -5.737 -0.577 5.138 1.00 0.00 C ATOM 1487 C SER A 96 -4.630 -1.594 4.875 1.00 0.00 C ATOM 1488 O SER A 96 -4.734 -2.423 3.971 1.00 0.00 O ATOM 1489 CB SER A 96 -5.341 0.785 4.564 1.00 0.00 C ATOM 1490 OG SER A 96 -6.448 1.669 4.540 1.00 0.00 O ATOM 0 H SER A 96 -6.139 0.492 6.896 1.00 0.00 H new ATOM 0 HA SER A 96 -6.646 -0.921 4.645 1.00 0.00 H new ATOM 0 HB2 SER A 96 -4.540 1.217 5.163 1.00 0.00 H new ATOM 0 HB3 SER A 96 -4.951 0.658 3.554 1.00 0.00 H new ATOM 0 HG SER A 96 -6.169 2.533 4.171 1.00 0.00 H new ATOM 1496 N LEU A 97 -3.569 -1.523 5.672 1.00 0.00 N ATOM 1497 CA LEU A 97 -2.442 -2.437 5.527 1.00 0.00 C ATOM 1498 C LEU A 97 -2.874 -3.879 5.774 1.00 0.00 C ATOM 1499 O LEU A 97 -2.385 -4.803 5.124 1.00 0.00 O ATOM 1500 CB LEU A 97 -1.322 -2.055 6.498 1.00 0.00 C ATOM 1501 CG LEU A 97 -0.690 -0.679 6.285 1.00 0.00 C ATOM 1502 CD1 LEU A 97 0.138 -0.280 7.497 1.00 0.00 C ATOM 1503 CD2 LEU A 97 0.165 -0.674 5.027 1.00 0.00 C ATOM 0 H LEU A 97 -3.466 -0.842 6.425 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.072 -2.358 4.505 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.718 -2.098 7.513 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.537 -2.808 6.430 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.489 0.052 6.159 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.580 0.702 7.328 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.502 -0.243 8.379 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.930 -1.013 7.654 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.607 0.313 4.891 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.958 -1.416 5.123 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.456 -0.915 4.164 1.00 0.00 H new ATOM 1515 N GLU A 98 -3.794 -4.063 6.715 1.00 0.00 N ATOM 1516 CA GLU A 98 -4.293 -5.393 7.046 1.00 0.00 C ATOM 1517 C GLU A 98 -5.106 -5.971 5.892 1.00 0.00 C ATOM 1518 O GLU A 98 -5.012 -7.159 5.585 1.00 0.00 O ATOM 1519 CB GLU A 98 -5.149 -5.341 8.313 1.00 0.00 C ATOM 1520 CG GLU A 98 -4.340 -5.185 9.589 1.00 0.00 C ATOM 1521 CD GLU A 98 -5.175 -5.391 10.838 1.00 0.00 C ATOM 1522 OE1 GLU A 98 -6.005 -6.323 10.850 1.00 0.00 O ATOM 1523 OE2 GLU A 98 -4.996 -4.619 11.804 1.00 0.00 O ATOM 0 H GLU A 98 -4.209 -3.308 7.262 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.435 -6.041 7.224 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -5.850 -4.510 8.234 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.742 -6.253 8.378 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -3.518 -5.901 9.584 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -3.896 -4.190 9.614 1.00 0.00 H new ATOM 1530 N ALA A 99 -5.907 -5.122 5.256 1.00 0.00 N ATOM 1531 CA ALA A 99 -6.736 -5.547 4.135 1.00 0.00 C ATOM 1532 C ALA A 99 -5.884 -5.862 2.910 1.00 0.00 C ATOM 1533 O ALA A 99 -6.187 -6.784 2.153 1.00 0.00 O ATOM 1534 CB ALA A 99 -7.764 -4.476 3.804 1.00 0.00 C ATOM 0 H ALA A 99 -5.999 -4.135 5.498 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.258 -6.459 4.426 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -8.376 -4.806 2.965 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -8.401 -4.302 4.672 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.253 -3.551 3.538 1.00 0.00 H new ATOM 1540 N MET A 100 -4.819 -5.090 2.722 1.00 0.00 N ATOM 1541 CA MET A 100 -3.923 -5.289 1.588 1.00 0.00 C ATOM 1542 C MET A 100 -3.252 -6.657 1.658 1.00 0.00 C ATOM 1543 O MET A 100 -3.421 -7.489 0.767 1.00 0.00 O ATOM 1544 CB MET A 100 -2.861 -4.188 1.551 1.00 0.00 C ATOM 1545 CG MET A 100 -1.774 -4.427 0.516 1.00 0.00 C ATOM 1546 SD MET A 100 -0.669 -3.014 0.331 1.00 0.00 S ATOM 1547 CE MET A 100 0.094 -2.967 1.951 1.00 0.00 C ATOM 0 H MET A 100 -4.555 -4.322 3.339 1.00 0.00 H new ATOM 0 HA MET A 100 -4.517 -5.242 0.675 1.00 0.00 H new ATOM 0 HB2 MET A 100 -3.346 -3.234 1.343 1.00 0.00 H new ATOM 0 HB3 MET A 100 -2.402 -4.104 2.536 1.00 0.00 H new ATOM 0 HG2 MET A 100 -1.192 -5.303 0.801 1.00 0.00 H new ATOM 0 HG3 MET A 100 -2.236 -4.650 -0.446 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.668 -2.046 2.056 1.00 0.00 H new ATOM 0 HE2 MET A 100 -0.679 -3.002 2.718 1.00 0.00 H new ATOM 0 HE3 MET A 100 0.758 -3.824 2.065 1.00 0.00 H new ATOM 1557 N LYS A 101 -2.489 -6.883 2.723 1.00 0.00 N ATOM 1558 CA LYS A 101 -1.793 -8.150 2.911 1.00 0.00 C ATOM 1559 C LYS A 101 -2.754 -9.326 2.764 1.00 0.00 C ATOM 1560 O LYS A 101 -2.515 -10.241 1.976 1.00 0.00 O ATOM 1561 CB LYS A 101 -1.127 -8.191 4.288 1.00 0.00 C ATOM 1562 CG LYS A 101 -2.106 -8.050 5.441 1.00 0.00 C ATOM 1563 CD LYS A 101 -1.388 -7.775 6.752 1.00 0.00 C ATOM 1564 CE LYS A 101 -2.206 -8.244 7.945 1.00 0.00 C ATOM 1565 NZ LYS A 101 -1.985 -9.688 8.236 1.00 0.00 N ATOM 0 H LYS A 101 -2.337 -6.204 3.469 1.00 0.00 H new ATOM 0 HA LYS A 101 -1.026 -8.232 2.141 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -0.587 -9.132 4.394 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -0.389 -7.392 4.349 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.803 -7.239 5.230 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.696 -8.962 5.532 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.422 -8.279 6.751 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.190 -6.707 6.843 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.942 -7.652 8.822 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.264 -8.071 7.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.560 -9.969 9.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -2.261 -10.255 7.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.980 -9.850 8.447 1.00 0.00 H new ATOM 1579 N SER A 102 -3.842 -9.294 3.527 1.00 0.00 N ATOM 1580 CA SER A 102 -4.837 -10.358 3.484 1.00 0.00 C ATOM 1581 C SER A 102 -5.014 -10.880 2.061 1.00 0.00 C ATOM 1582 O SER A 102 -5.060 -12.089 1.831 1.00 0.00 O ATOM 1583 CB SER A 102 -6.177 -9.854 4.024 1.00 0.00 C ATOM 1584 OG SER A 102 -7.090 -10.924 4.201 1.00 0.00 O ATOM 0 H SER A 102 -4.056 -8.542 4.182 1.00 0.00 H new ATOM 0 HA SER A 102 -4.484 -11.176 4.112 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.021 -9.344 4.974 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.598 -9.122 3.335 1.00 0.00 H new ATOM 0 HG SER A 102 -7.938 -10.576 4.548 1.00 0.00 H new ATOM 1590 N HIS A 103 -5.112 -9.958 1.108 1.00 0.00 N ATOM 1591 CA HIS A 103 -5.282 -10.323 -0.294 1.00 0.00 C ATOM 1592 C HIS A 103 -4.092 -11.138 -0.792 1.00 0.00 C ATOM 1593 O HIS A 103 -4.257 -12.247 -1.302 1.00 0.00 O ATOM 1594 CB HIS A 103 -5.452 -9.070 -1.153 1.00 0.00 C ATOM 1595 CG HIS A 103 -6.020 -9.346 -2.511 1.00 0.00 C ATOM 1596 ND1 HIS A 103 -5.346 -9.061 -3.680 1.00 0.00 N ATOM 1597 CD2 HIS A 103 -7.203 -9.888 -2.883 1.00 0.00 C ATOM 1598 CE1 HIS A 103 -6.092 -9.413 -4.712 1.00 0.00 C ATOM 1599 NE2 HIS A 103 -7.224 -9.918 -4.255 1.00 0.00 N ATOM 0 H HIS A 103 -5.077 -8.953 1.281 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.180 -10.936 -0.377 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -6.103 -8.368 -0.632 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -4.483 -8.583 -1.266 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -4.417 -8.644 -3.739 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.985 -10.233 -2.223 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -5.822 -9.306 -5.752 1.00 0.00 H new ATOM 1607 N CYS A 104 -2.896 -10.581 -0.641 1.00 0.00 N ATOM 1608 CA CYS A 104 -1.678 -11.255 -1.077 1.00 0.00 C ATOM 1609 C CYS A 104 -1.769 -12.757 -0.826 1.00 0.00 C ATOM 1610 O CYS A 104 -1.618 -13.561 -1.747 1.00 0.00 O ATOM 1611 CB CYS A 104 -0.463 -10.677 -0.351 1.00 0.00 C ATOM 1612 SG CYS A 104 -0.093 -8.960 -0.783 1.00 0.00 S ATOM 0 H CYS A 104 -2.743 -9.665 -0.220 1.00 0.00 H new ATOM 0 HA CYS A 104 -1.564 -11.090 -2.148 1.00 0.00 H new ATOM 0 HB2 CYS A 104 -0.631 -10.742 0.724 1.00 0.00 H new ATOM 0 HB3 CYS A 104 0.408 -11.293 -0.576 1.00 0.00 H new ATOM 0 HG CYS A 104 1.185 -8.751 -0.674 1.00 0.00 H new ATOM 1618 N LEU A 105 -2.013 -13.128 0.425 1.00 0.00 N ATOM 1619 CA LEU A 105 -2.122 -14.535 0.798 1.00 0.00 C ATOM 1620 C LEU A 105 -3.298 -15.197 0.087 1.00 0.00 C ATOM 1621 O LEU A 105 -3.142 -16.233 -0.560 1.00 0.00 O ATOM 1622 CB LEU A 105 -2.286 -14.669 2.313 1.00 0.00 C ATOM 1623 CG LEU A 105 -1.355 -13.809 3.168 1.00 0.00 C ATOM 1624 CD1 LEU A 105 -1.991 -12.458 3.457 1.00 0.00 C ATOM 1625 CD2 LEU A 105 -1.008 -14.525 4.465 1.00 0.00 C ATOM 0 H LEU A 105 -2.139 -12.475 1.199 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.206 -15.039 0.492 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.316 -14.420 2.570 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -2.133 -15.714 2.584 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.433 -13.642 2.611 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.314 -11.860 4.067 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.187 -11.940 2.518 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -2.928 -12.604 3.994 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.345 -13.898 5.061 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -1.921 -14.723 5.027 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.510 -15.467 4.238 1.00 0.00 H new ATOM 1637 N LYS A 106 -4.474 -14.592 0.211 1.00 0.00 N ATOM 1638 CA LYS A 106 -5.677 -15.120 -0.422 1.00 0.00 C ATOM 1639 C LYS A 106 -5.382 -15.591 -1.843 1.00 0.00 C ATOM 1640 O LYS A 106 -5.853 -16.645 -2.267 1.00 0.00 O ATOM 1641 CB LYS A 106 -6.776 -14.056 -0.443 1.00 0.00 C ATOM 1642 CG LYS A 106 -7.483 -13.884 0.890 1.00 0.00 C ATOM 1643 CD LYS A 106 -8.399 -12.671 0.884 1.00 0.00 C ATOM 1644 CE LYS A 106 -9.656 -12.926 0.067 1.00 0.00 C ATOM 1645 NZ LYS A 106 -10.564 -11.746 0.064 1.00 0.00 N ATOM 0 H LYS A 106 -4.620 -13.735 0.744 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.019 -15.975 0.161 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -6.340 -13.102 -0.739 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -7.511 -14.320 -1.203 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.064 -14.779 1.112 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.744 -13.779 1.684 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -8.674 -12.417 1.908 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -7.866 -11.813 0.475 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -9.379 -13.174 -0.958 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -10.184 -13.789 0.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.409 -11.960 -0.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.849 -11.525 1.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -10.069 -10.928 -0.346 1.00 0.00 H new ATOM 1659 N ASN A 107 -4.600 -14.802 -2.572 1.00 0.00 N ATOM 1660 CA ASN A 107 -4.242 -15.139 -3.945 1.00 0.00 C ATOM 1661 C ASN A 107 -2.906 -15.873 -3.994 1.00 0.00 C ATOM 1662 O ASN A 107 -2.852 -17.067 -4.288 1.00 0.00 O ATOM 1663 CB ASN A 107 -4.172 -13.872 -4.801 1.00 0.00 C ATOM 1664 CG ASN A 107 -3.766 -12.652 -3.997 1.00 0.00 C ATOM 1665 OD1 ASN A 107 -2.591 -12.467 -3.680 1.00 0.00 O ATOM 1666 ND2 ASN A 107 -4.740 -11.813 -3.663 1.00 0.00 N ATOM 0 H ASN A 107 -4.202 -13.925 -2.235 1.00 0.00 H new ATOM 0 HA ASN A 107 -5.013 -15.798 -4.344 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.459 -14.023 -5.611 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -5.144 -13.694 -5.261 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.528 -10.975 -3.122 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -5.700 -12.007 -3.948 1.00 0.00 H new ATOM 1673 N GLY A 108 -1.828 -15.151 -3.703 1.00 0.00 N ATOM 1674 CA GLY A 108 -0.507 -15.750 -3.719 1.00 0.00 C ATOM 1675 C GLY A 108 0.575 -14.759 -4.099 1.00 0.00 C ATOM 1676 O GLY A 108 1.365 -15.009 -5.010 1.00 0.00 O ATOM 0 H GLY A 108 -1.847 -14.161 -3.456 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.287 -16.163 -2.735 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -0.497 -16.582 -4.424 1.00 0.00 H new ATOM 1680 N VAL A 109 0.612 -13.628 -3.401 1.00 0.00 N ATOM 1681 CA VAL A 109 1.604 -12.595 -3.670 1.00 0.00 C ATOM 1682 C VAL A 109 2.644 -12.528 -2.557 1.00 0.00 C ATOM 1683 O VAL A 109 2.305 -12.541 -1.373 1.00 0.00 O ATOM 1684 CB VAL A 109 0.946 -11.211 -3.826 1.00 0.00 C ATOM 1685 CG1 VAL A 109 2.004 -10.122 -3.904 1.00 0.00 C ATOM 1686 CG2 VAL A 109 0.050 -11.184 -5.055 1.00 0.00 C ATOM 0 H VAL A 109 -0.035 -13.404 -2.644 1.00 0.00 H new ATOM 0 HA VAL A 109 2.094 -12.864 -4.606 1.00 0.00 H new ATOM 0 HB VAL A 109 0.328 -11.021 -2.949 1.00 0.00 H new ATOM 0 HG11 VAL A 109 1.520 -9.152 -4.014 1.00 0.00 H new ATOM 0 HG12 VAL A 109 2.601 -10.128 -2.992 1.00 0.00 H new ATOM 0 HG13 VAL A 109 2.651 -10.304 -4.762 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -0.407 -10.199 -5.150 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.645 -11.396 -5.944 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.731 -11.938 -4.953 1.00 0.00 H new ATOM 1696 N THR A 110 3.914 -12.456 -2.944 1.00 0.00 N ATOM 1697 CA THR A 110 5.004 -12.388 -1.979 1.00 0.00 C ATOM 1698 C THR A 110 5.889 -11.174 -2.235 1.00 0.00 C ATOM 1699 O THR A 110 6.843 -10.922 -1.498 1.00 0.00 O ATOM 1700 CB THR A 110 5.872 -13.660 -2.022 1.00 0.00 C ATOM 1701 OG1 THR A 110 6.875 -13.535 -3.036 1.00 0.00 O ATOM 1702 CG2 THR A 110 5.018 -14.889 -2.294 1.00 0.00 C ATOM 0 H THR A 110 4.213 -12.443 -3.919 1.00 0.00 H new ATOM 0 HA THR A 110 4.548 -12.301 -0.993 1.00 0.00 H new ATOM 0 HB THR A 110 6.352 -13.779 -1.051 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.423 -14.347 -3.056 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.653 -15.775 -2.320 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.275 -14.998 -1.504 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.513 -14.776 -3.254 1.00 0.00 H new ATOM 1710 N ASP A 111 5.568 -10.424 -3.283 1.00 0.00 N ATOM 1711 CA ASP A 111 6.334 -9.234 -3.636 1.00 0.00 C ATOM 1712 C ASP A 111 5.410 -8.040 -3.860 1.00 0.00 C ATOM 1713 O ASP A 111 4.359 -8.165 -4.489 1.00 0.00 O ATOM 1714 CB ASP A 111 7.169 -9.491 -4.891 1.00 0.00 C ATOM 1715 CG ASP A 111 8.404 -8.615 -4.954 1.00 0.00 C ATOM 1716 OD1 ASP A 111 8.268 -7.385 -4.787 1.00 0.00 O ATOM 1717 OD2 ASP A 111 9.507 -9.159 -5.172 1.00 0.00 O ATOM 0 H ASP A 111 4.782 -10.619 -3.903 1.00 0.00 H new ATOM 0 HA ASP A 111 7.002 -9.003 -2.806 1.00 0.00 H new ATOM 0 HB2 ASP A 111 7.469 -10.539 -4.916 1.00 0.00 H new ATOM 0 HB3 ASP A 111 6.556 -9.314 -5.774 1.00 0.00 H new ATOM 1722 N LEU A 112 5.809 -6.884 -3.341 1.00 0.00 N ATOM 1723 CA LEU A 112 5.017 -5.667 -3.484 1.00 0.00 C ATOM 1724 C LEU A 112 5.909 -4.430 -3.450 1.00 0.00 C ATOM 1725 O LEU A 112 6.849 -4.351 -2.659 1.00 0.00 O ATOM 1726 CB LEU A 112 3.969 -5.585 -2.373 1.00 0.00 C ATOM 1727 CG LEU A 112 2.882 -4.524 -2.553 1.00 0.00 C ATOM 1728 CD1 LEU A 112 1.982 -4.878 -3.727 1.00 0.00 C ATOM 1729 CD2 LEU A 112 2.066 -4.375 -1.278 1.00 0.00 C ATOM 0 H LEU A 112 6.676 -6.764 -2.817 1.00 0.00 H new ATOM 0 HA LEU A 112 4.512 -5.702 -4.450 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.487 -6.559 -2.283 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.482 -5.395 -1.430 1.00 0.00 H new ATOM 0 HG LEU A 112 3.363 -3.569 -2.765 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.214 -4.113 -3.841 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.577 -4.933 -4.638 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.508 -5.843 -3.544 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.297 -3.616 -1.424 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.594 -5.327 -1.035 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.721 -4.075 -0.460 1.00 0.00 H new ATOM 1741 N SER A 113 5.606 -3.466 -4.313 1.00 0.00 N ATOM 1742 CA SER A 113 6.381 -2.232 -4.383 1.00 0.00 C ATOM 1743 C SER A 113 5.499 -1.019 -4.106 1.00 0.00 C ATOM 1744 O SER A 113 4.490 -0.805 -4.779 1.00 0.00 O ATOM 1745 CB SER A 113 7.038 -2.096 -5.758 1.00 0.00 C ATOM 1746 OG SER A 113 8.160 -1.232 -5.704 1.00 0.00 O ATOM 0 H SER A 113 4.830 -3.515 -4.973 1.00 0.00 H new ATOM 0 HA SER A 113 7.157 -2.276 -3.619 1.00 0.00 H new ATOM 0 HB2 SER A 113 7.348 -3.078 -6.115 1.00 0.00 H new ATOM 0 HB3 SER A 113 6.313 -1.711 -6.475 1.00 0.00 H new ATOM 0 HG SER A 113 8.918 -1.651 -6.162 1.00 0.00 H new ATOM 1752 N MET A 114 5.886 -0.229 -3.111 1.00 0.00 N ATOM 1753 CA MET A 114 5.131 0.964 -2.745 1.00 0.00 C ATOM 1754 C MET A 114 6.067 2.129 -2.440 1.00 0.00 C ATOM 1755 O MET A 114 7.007 2.011 -1.654 1.00 0.00 O ATOM 1756 CB MET A 114 4.242 0.679 -1.533 1.00 0.00 C ATOM 1757 CG MET A 114 5.022 0.437 -0.251 1.00 0.00 C ATOM 1758 SD MET A 114 3.956 0.029 1.145 1.00 0.00 S ATOM 1759 CE MET A 114 3.092 -1.404 0.504 1.00 0.00 C ATOM 0 H MET A 114 6.718 -0.393 -2.544 1.00 0.00 H new ATOM 0 HA MET A 114 4.502 1.239 -3.592 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.565 1.520 -1.383 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.624 -0.194 -1.743 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.732 -0.375 -0.410 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.604 1.327 -0.011 1.00 0.00 H new ATOM 0 HE1 MET A 114 2.877 -2.094 1.320 1.00 0.00 H new ATOM 0 HE2 MET A 114 2.158 -1.088 0.040 1.00 0.00 H new ATOM 0 HE3 MET A 114 3.715 -1.903 -0.238 1.00 0.00 H new ATOM 1769 N PRO A 115 5.808 3.280 -3.077 1.00 0.00 N ATOM 1770 CA PRO A 115 6.617 4.488 -2.890 1.00 0.00 C ATOM 1771 C PRO A 115 6.434 5.099 -1.505 1.00 0.00 C ATOM 1772 O PRO A 115 5.833 4.488 -0.621 1.00 0.00 O ATOM 1773 CB PRO A 115 6.090 5.439 -3.967 1.00 0.00 C ATOM 1774 CG PRO A 115 4.696 4.983 -4.226 1.00 0.00 C ATOM 1775 CD PRO A 115 4.704 3.492 -4.029 1.00 0.00 C ATOM 0 HA PRO A 115 7.684 4.280 -2.971 1.00 0.00 H new ATOM 0 HB2 PRO A 115 6.111 6.474 -3.626 1.00 0.00 H new ATOM 0 HB3 PRO A 115 6.697 5.389 -4.871 1.00 0.00 H new ATOM 0 HG2 PRO A 115 3.995 5.463 -3.543 1.00 0.00 H new ATOM 0 HG3 PRO A 115 4.383 5.241 -5.238 1.00 0.00 H new ATOM 0 HD2 PRO A 115 3.755 3.134 -3.630 1.00 0.00 H new ATOM 0 HD3 PRO A 115 4.875 2.964 -4.967 1.00 0.00 H new ATOM 1783 N ARG A 116 6.956 6.308 -1.323 1.00 0.00 N ATOM 1784 CA ARG A 116 6.851 7.001 -0.044 1.00 0.00 C ATOM 1785 C ARG A 116 5.426 7.494 0.191 1.00 0.00 C ATOM 1786 O ARG A 116 4.863 8.213 -0.635 1.00 0.00 O ATOM 1787 CB ARG A 116 7.824 8.180 0.003 1.00 0.00 C ATOM 1788 CG ARG A 116 9.260 7.773 0.289 1.00 0.00 C ATOM 1789 CD ARG A 116 10.161 8.987 0.456 1.00 0.00 C ATOM 1790 NE ARG A 116 9.756 9.817 1.587 1.00 0.00 N ATOM 1791 CZ ARG A 116 10.309 10.991 1.872 1.00 0.00 C ATOM 1792 NH1 ARG A 116 11.284 11.470 1.113 1.00 0.00 N ATOM 1793 NH2 ARG A 116 9.886 11.688 2.919 1.00 0.00 N ATOM 0 H ARG A 116 7.456 6.828 -2.045 1.00 0.00 H new ATOM 0 HA ARG A 116 7.108 6.295 0.746 1.00 0.00 H new ATOM 0 HB2 ARG A 116 7.788 8.708 -0.950 1.00 0.00 H new ATOM 0 HB3 ARG A 116 7.495 8.882 0.769 1.00 0.00 H new ATOM 0 HG2 ARG A 116 9.294 7.166 1.194 1.00 0.00 H new ATOM 0 HG3 ARG A 116 9.632 7.152 -0.526 1.00 0.00 H new ATOM 0 HD2 ARG A 116 11.190 8.658 0.598 1.00 0.00 H new ATOM 0 HD3 ARG A 116 10.140 9.583 -0.457 1.00 0.00 H new ATOM 0 HE ARG A 116 9.008 9.477 2.191 1.00 0.00 H new ATOM 0 HH11 ARG A 116 11.612 10.937 0.307 1.00 0.00 H new ATOM 0 HH12 ARG A 116 11.707 12.372 1.334 1.00 0.00 H new ATOM 0 HH21 ARG A 116 9.136 11.323 3.506 1.00 0.00 H new ATOM 0 HH22 ARG A 116 10.311 12.589 3.137 1.00 0.00 H new ATOM 1807 N ILE A 117 4.849 7.102 1.322 1.00 0.00 N ATOM 1808 CA ILE A 117 3.491 7.505 1.665 1.00 0.00 C ATOM 1809 C ILE A 117 3.476 8.385 2.910 1.00 0.00 C ATOM 1810 O ILE A 117 3.692 7.908 4.023 1.00 0.00 O ATOM 1811 CB ILE A 117 2.584 6.283 1.904 1.00 0.00 C ATOM 1812 CG1 ILE A 117 3.294 5.261 2.795 1.00 0.00 C ATOM 1813 CG2 ILE A 117 2.186 5.651 0.578 1.00 0.00 C ATOM 1814 CD1 ILE A 117 2.439 4.061 3.137 1.00 0.00 C ATOM 0 H ILE A 117 5.301 6.506 2.016 1.00 0.00 H new ATOM 0 HA ILE A 117 3.107 8.072 0.817 1.00 0.00 H new ATOM 0 HB ILE A 117 1.679 6.615 2.412 1.00 0.00 H new ATOM 0 HG12 ILE A 117 4.200 4.921 2.293 1.00 0.00 H new ATOM 0 HG13 ILE A 117 3.606 5.750 3.718 1.00 0.00 H new ATOM 0 HG21 ILE A 117 1.545 4.789 0.764 1.00 0.00 H new ATOM 0 HG22 ILE A 117 1.646 6.381 -0.026 1.00 0.00 H new ATOM 0 HG23 ILE A 117 3.081 5.330 0.045 1.00 0.00 H new ATOM 0 HD11 ILE A 117 3.006 3.379 3.770 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.545 4.390 3.667 1.00 0.00 H new ATOM 0 HD13 ILE A 117 2.149 3.548 2.220 1.00 0.00 H new ATOM 1925 N GLN A 125 4.055 10.962 9.347 1.00 0.00 N ATOM 1926 CA GLN A 125 5.509 10.856 9.333 1.00 0.00 C ATOM 1927 C GLN A 125 5.948 9.415 9.094 1.00 0.00 C ATOM 1928 O GLN A 125 5.615 8.518 9.869 1.00 0.00 O ATOM 1929 CB GLN A 125 6.092 11.367 10.651 1.00 0.00 C ATOM 1930 CG GLN A 125 5.691 12.796 10.980 1.00 0.00 C ATOM 1931 CD GLN A 125 6.674 13.478 11.911 1.00 0.00 C ATOM 1932 OE1 GLN A 125 6.455 13.548 13.121 1.00 0.00 O ATOM 1933 NE2 GLN A 125 7.766 13.986 11.351 1.00 0.00 N ATOM 0 HA GLN A 125 5.884 11.471 8.515 1.00 0.00 H new ATOM 0 HB2 GLN A 125 5.768 10.712 11.460 1.00 0.00 H new ATOM 0 HB3 GLN A 125 7.179 11.305 10.606 1.00 0.00 H new ATOM 0 HG2 GLN A 125 5.613 13.369 10.056 1.00 0.00 H new ATOM 0 HG3 GLN A 125 4.702 12.795 11.439 1.00 0.00 H new ATOM 0 HE21 GLN A 125 7.907 13.905 10.344 1.00 0.00 H new ATOM 0 HE22 GLN A 125 8.463 14.457 11.928 1.00 0.00 H new ATOM 1942 N TRP A 126 6.695 9.200 8.017 1.00 0.00 N ATOM 1943 CA TRP A 126 7.179 7.867 7.677 1.00 0.00 C ATOM 1944 C TRP A 126 7.631 7.117 8.924 1.00 0.00 C ATOM 1945 O TRP A 126 7.348 5.929 9.081 1.00 0.00 O ATOM 1946 CB TRP A 126 8.332 7.961 6.676 1.00 0.00 C ATOM 1947 CG TRP A 126 8.874 6.625 6.268 1.00 0.00 C ATOM 1948 CD1 TRP A 126 10.066 6.073 6.645 1.00 0.00 C ATOM 1949 CD2 TRP A 126 8.246 5.673 5.402 1.00 0.00 C ATOM 1950 NE1 TRP A 126 10.216 4.836 6.066 1.00 0.00 N ATOM 1951 CE2 TRP A 126 9.113 4.567 5.300 1.00 0.00 C ATOM 1952 CE3 TRP A 126 7.035 5.646 4.705 1.00 0.00 C ATOM 1953 CZ2 TRP A 126 8.805 3.450 4.528 1.00 0.00 C ATOM 1954 CZ3 TRP A 126 6.732 4.537 3.939 1.00 0.00 C ATOM 1955 CH2 TRP A 126 7.613 3.451 3.856 1.00 0.00 C ATOM 0 H TRP A 126 6.979 9.931 7.365 1.00 0.00 H new ATOM 0 HA TRP A 126 6.357 7.314 7.223 1.00 0.00 H new ATOM 0 HB2 TRP A 126 7.990 8.493 5.788 1.00 0.00 H new ATOM 0 HB3 TRP A 126 9.136 8.553 7.113 1.00 0.00 H new ATOM 0 HD1 TRP A 126 10.785 6.541 7.302 1.00 0.00 H new ATOM 0 HE1 TRP A 126 11.019 4.218 6.187 1.00 0.00 H new ATOM 0 HE3 TRP A 126 6.348 6.477 4.764 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 9.483 2.612 4.462 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 5.800 4.507 3.395 1.00 0.00 H new ATOM 0 HH2 TRP A 126 7.346 2.598 3.250 1.00 0.00 H new ATOM 1966 N GLU A 127 8.335 7.817 9.808 1.00 0.00 N ATOM 1967 CA GLU A 127 8.826 7.215 11.042 1.00 0.00 C ATOM 1968 C GLU A 127 7.747 6.357 11.696 1.00 0.00 C ATOM 1969 O GLU A 127 8.011 5.241 12.142 1.00 0.00 O ATOM 1970 CB GLU A 127 9.291 8.300 12.016 1.00 0.00 C ATOM 1971 CG GLU A 127 10.227 7.787 13.097 1.00 0.00 C ATOM 1972 CD GLU A 127 11.136 8.870 13.644 1.00 0.00 C ATOM 1973 OE1 GLU A 127 10.612 9.858 14.201 1.00 0.00 O ATOM 1974 OE2 GLU A 127 12.370 8.731 13.515 1.00 0.00 O ATOM 0 H GLU A 127 8.578 8.801 9.693 1.00 0.00 H new ATOM 0 HA GLU A 127 9.672 6.575 10.792 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.794 9.088 11.456 1.00 0.00 H new ATOM 0 HB3 GLU A 127 8.418 8.752 12.487 1.00 0.00 H new ATOM 0 HG2 GLU A 127 9.638 7.366 13.912 1.00 0.00 H new ATOM 0 HG3 GLU A 127 10.835 6.978 12.692 1.00 0.00 H new ATOM 1981 N ASN A 128 6.530 6.888 11.751 1.00 0.00 N ATOM 1982 CA ASN A 128 5.410 6.173 12.352 1.00 0.00 C ATOM 1983 C ASN A 128 4.845 5.137 11.385 1.00 0.00 C ATOM 1984 O ASN A 128 4.664 3.973 11.742 1.00 0.00 O ATOM 1985 CB ASN A 128 4.312 7.156 12.764 1.00 0.00 C ATOM 1986 CG ASN A 128 4.706 7.995 13.964 1.00 0.00 C ATOM 1987 OD1 ASN A 128 4.720 7.511 15.096 1.00 0.00 O ATOM 1988 ND2 ASN A 128 5.030 9.259 13.721 1.00 0.00 N ATOM 0 H ASN A 128 6.294 7.811 11.387 1.00 0.00 H new ATOM 0 HA ASN A 128 5.775 5.655 13.239 1.00 0.00 H new ATOM 0 HB2 ASN A 128 4.083 7.813 11.925 1.00 0.00 H new ATOM 0 HB3 ASN A 128 3.401 6.603 12.994 1.00 0.00 H new ATOM 0 HD21 ASN A 128 5.305 9.872 14.489 1.00 0.00 H new ATOM 0 HD22 ASN A 128 5.004 9.618 12.766 1.00 0.00 H new ATOM 1995 N VAL A 129 4.567 5.569 10.159 1.00 0.00 N ATOM 1996 CA VAL A 129 4.024 4.679 9.140 1.00 0.00 C ATOM 1997 C VAL A 129 4.869 3.417 9.006 1.00 0.00 C ATOM 1998 O VAL A 129 4.419 2.319 9.334 1.00 0.00 O ATOM 1999 CB VAL A 129 3.944 5.378 7.770 1.00 0.00 C ATOM 2000 CG1 VAL A 129 3.397 4.427 6.716 1.00 0.00 C ATOM 2001 CG2 VAL A 129 3.091 6.634 7.862 1.00 0.00 C ATOM 0 H VAL A 129 4.709 6.530 9.848 1.00 0.00 H new ATOM 0 HA VAL A 129 3.018 4.407 9.460 1.00 0.00 H new ATOM 0 HB VAL A 129 4.951 5.671 7.472 1.00 0.00 H new ATOM 0 HG11 VAL A 129 3.348 4.939 5.755 1.00 0.00 H new ATOM 0 HG12 VAL A 129 4.053 3.560 6.633 1.00 0.00 H new ATOM 0 HG13 VAL A 129 2.398 4.100 7.004 1.00 0.00 H new ATOM 0 HG21 VAL A 129 3.045 7.115 6.885 1.00 0.00 H new ATOM 0 HG22 VAL A 129 2.084 6.367 8.183 1.00 0.00 H new ATOM 0 HG23 VAL A 129 3.532 7.321 8.585 1.00 0.00 H new ATOM 2011 N SER A 130 6.095 3.581 8.521 1.00 0.00 N ATOM 2012 CA SER A 130 7.003 2.454 8.340 1.00 0.00 C ATOM 2013 C SER A 130 6.813 1.421 9.447 1.00 0.00 C ATOM 2014 O SER A 130 6.810 0.216 9.193 1.00 0.00 O ATOM 2015 CB SER A 130 8.454 2.938 8.323 1.00 0.00 C ATOM 2016 OG SER A 130 8.786 3.600 9.531 1.00 0.00 O ATOM 0 H SER A 130 6.483 4.483 8.246 1.00 0.00 H new ATOM 0 HA SER A 130 6.773 1.984 7.384 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.122 2.089 8.175 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.605 3.614 7.481 1.00 0.00 H new ATOM 0 HG SER A 130 8.339 4.472 9.560 1.00 0.00 H new ATOM 2022 N ALA A 131 6.654 1.901 10.675 1.00 0.00 N ATOM 2023 CA ALA A 131 6.461 1.021 11.821 1.00 0.00 C ATOM 2024 C ALA A 131 5.202 0.177 11.659 1.00 0.00 C ATOM 2025 O ALA A 131 5.234 -1.042 11.826 1.00 0.00 O ATOM 2026 CB ALA A 131 6.393 1.833 13.105 1.00 0.00 C ATOM 0 H ALA A 131 6.655 2.895 10.902 1.00 0.00 H new ATOM 0 HA ALA A 131 7.315 0.346 11.877 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.249 1.163 13.952 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.323 2.387 13.235 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.559 2.532 13.049 1.00 0.00 H new ATOM 2032 N MET A 132 4.093 0.833 11.333 1.00 0.00 N ATOM 2033 CA MET A 132 2.822 0.141 11.148 1.00 0.00 C ATOM 2034 C MET A 132 2.989 -1.066 10.231 1.00 0.00 C ATOM 2035 O MET A 132 2.508 -2.158 10.535 1.00 0.00 O ATOM 2036 CB MET A 132 1.777 1.097 10.569 1.00 0.00 C ATOM 2037 CG MET A 132 0.975 1.835 11.628 1.00 0.00 C ATOM 2038 SD MET A 132 1.850 3.267 12.289 1.00 0.00 S ATOM 2039 CE MET A 132 0.866 4.604 11.615 1.00 0.00 C ATOM 0 H MET A 132 4.048 1.842 11.192 1.00 0.00 H new ATOM 0 HA MET A 132 2.482 -0.210 12.122 1.00 0.00 H new ATOM 0 HB2 MET A 132 2.277 1.825 9.931 1.00 0.00 H new ATOM 0 HB3 MET A 132 1.093 0.533 9.934 1.00 0.00 H new ATOM 0 HG2 MET A 132 0.027 2.159 11.200 1.00 0.00 H new ATOM 0 HG3 MET A 132 0.739 1.150 12.443 1.00 0.00 H new ATOM 0 HE1 MET A 132 0.900 5.458 12.292 1.00 0.00 H new ATOM 0 HE2 MET A 132 1.265 4.895 10.643 1.00 0.00 H new ATOM 0 HE3 MET A 132 -0.166 4.274 11.499 1.00 0.00 H new ATOM 2049 N ILE A 133 3.671 -0.862 9.110 1.00 0.00 N ATOM 2050 CA ILE A 133 3.901 -1.934 8.150 1.00 0.00 C ATOM 2051 C ILE A 133 4.674 -3.085 8.785 1.00 0.00 C ATOM 2052 O ILE A 133 4.476 -4.247 8.433 1.00 0.00 O ATOM 2053 CB ILE A 133 4.675 -1.430 6.917 1.00 0.00 C ATOM 2054 CG1 ILE A 133 3.973 -0.214 6.309 1.00 0.00 C ATOM 2055 CG2 ILE A 133 4.811 -2.541 5.886 1.00 0.00 C ATOM 2056 CD1 ILE A 133 4.815 0.523 5.291 1.00 0.00 C ATOM 0 H ILE A 133 4.074 0.036 8.844 1.00 0.00 H new ATOM 0 HA ILE A 133 2.920 -2.289 7.833 1.00 0.00 H new ATOM 0 HB ILE A 133 5.674 -1.129 7.232 1.00 0.00 H new ATOM 0 HG12 ILE A 133 3.046 -0.539 5.836 1.00 0.00 H new ATOM 0 HG13 ILE A 133 3.699 0.474 7.108 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.360 -2.169 5.021 1.00 0.00 H new ATOM 0 HG22 ILE A 133 5.350 -3.381 6.325 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.820 -2.870 5.573 1.00 0.00 H new ATOM 0 HD11 ILE A 133 4.254 1.373 4.902 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.730 0.878 5.765 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.068 -0.150 4.472 1.00 0.00 H new ATOM 2068 N GLU A 134 5.553 -2.752 9.726 1.00 0.00 N ATOM 2069 CA GLU A 134 6.354 -3.759 10.411 1.00 0.00 C ATOM 2070 C GLU A 134 5.482 -4.626 11.314 1.00 0.00 C ATOM 2071 O GLU A 134 5.476 -5.851 11.198 1.00 0.00 O ATOM 2072 CB GLU A 134 7.456 -3.091 11.237 1.00 0.00 C ATOM 2073 CG GLU A 134 8.428 -2.272 10.405 1.00 0.00 C ATOM 2074 CD GLU A 134 9.819 -2.230 11.006 1.00 0.00 C ATOM 2075 OE1 GLU A 134 10.593 -3.182 10.774 1.00 0.00 O ATOM 2076 OE2 GLU A 134 10.134 -1.247 11.708 1.00 0.00 O ATOM 0 H GLU A 134 5.728 -1.794 10.030 1.00 0.00 H new ATOM 0 HA GLU A 134 6.812 -4.397 9.655 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.997 -2.445 11.985 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.010 -3.859 11.777 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.483 -2.691 9.400 1.00 0.00 H new ATOM 0 HG3 GLU A 134 8.048 -1.255 10.306 1.00 0.00 H new ATOM 2083 N GLU A 135 4.747 -3.981 12.214 1.00 0.00 N ATOM 2084 CA GLU A 135 3.872 -4.693 13.138 1.00 0.00 C ATOM 2085 C GLU A 135 2.754 -5.409 12.386 1.00 0.00 C ATOM 2086 O GLU A 135 2.317 -6.490 12.782 1.00 0.00 O ATOM 2087 CB GLU A 135 3.274 -3.724 14.160 1.00 0.00 C ATOM 2088 CG GLU A 135 2.416 -2.635 13.537 1.00 0.00 C ATOM 2089 CD GLU A 135 1.579 -1.894 14.562 1.00 0.00 C ATOM 2090 OE1 GLU A 135 1.162 -2.526 15.555 1.00 0.00 O ATOM 2091 OE2 GLU A 135 1.341 -0.684 14.371 1.00 0.00 O ATOM 0 H GLU A 135 4.740 -2.967 12.323 1.00 0.00 H new ATOM 0 HA GLU A 135 4.470 -5.438 13.662 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.671 -4.287 14.872 1.00 0.00 H new ATOM 0 HB3 GLU A 135 4.083 -3.259 14.724 1.00 0.00 H new ATOM 0 HG2 GLU A 135 3.058 -1.925 13.016 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.759 -3.079 12.789 1.00 0.00 H new ATOM 2098 N VAL A 136 2.294 -4.798 11.299 1.00 0.00 N ATOM 2099 CA VAL A 136 1.227 -5.376 10.490 1.00 0.00 C ATOM 2100 C VAL A 136 1.713 -6.612 9.742 1.00 0.00 C ATOM 2101 O VAL A 136 1.037 -7.641 9.716 1.00 0.00 O ATOM 2102 CB VAL A 136 0.679 -4.357 9.473 1.00 0.00 C ATOM 2103 CG1 VAL A 136 -0.101 -5.065 8.376 1.00 0.00 C ATOM 2104 CG2 VAL A 136 -0.188 -3.321 10.172 1.00 0.00 C ATOM 0 H VAL A 136 2.644 -3.902 10.958 1.00 0.00 H new ATOM 0 HA VAL A 136 0.428 -5.660 11.175 1.00 0.00 H new ATOM 0 HB VAL A 136 1.521 -3.841 9.012 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.481 -4.329 7.667 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.554 -5.765 7.857 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.937 -5.609 8.817 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.567 -2.609 9.439 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -1.026 -3.818 10.661 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.406 -2.792 10.917 1.00 0.00 H new ATOM 2114 N PHE A 137 2.890 -6.505 9.135 1.00 0.00 N ATOM 2115 CA PHE A 137 3.468 -7.615 8.386 1.00 0.00 C ATOM 2116 C PHE A 137 4.356 -8.473 9.282 1.00 0.00 C ATOM 2117 O PHE A 137 4.885 -9.497 8.851 1.00 0.00 O ATOM 2118 CB PHE A 137 4.277 -7.090 7.198 1.00 0.00 C ATOM 2119 CG PHE A 137 3.428 -6.663 6.036 1.00 0.00 C ATOM 2120 CD1 PHE A 137 2.657 -5.513 6.109 1.00 0.00 C ATOM 2121 CD2 PHE A 137 3.400 -7.410 4.869 1.00 0.00 C ATOM 2122 CE1 PHE A 137 1.874 -5.118 5.041 1.00 0.00 C ATOM 2123 CE2 PHE A 137 2.619 -7.020 3.798 1.00 0.00 C ATOM 2124 CZ PHE A 137 1.856 -5.872 3.884 1.00 0.00 C ATOM 0 H PHE A 137 3.463 -5.661 9.147 1.00 0.00 H new ATOM 0 HA PHE A 137 2.651 -8.234 8.015 1.00 0.00 H new ATOM 0 HB2 PHE A 137 4.882 -6.244 7.526 1.00 0.00 H new ATOM 0 HB3 PHE A 137 4.967 -7.866 6.867 1.00 0.00 H new ATOM 0 HD1 PHE A 137 2.668 -4.919 7.011 1.00 0.00 H new ATOM 0 HD2 PHE A 137 3.996 -8.308 4.796 1.00 0.00 H new ATOM 0 HE1 PHE A 137 1.277 -4.221 5.111 1.00 0.00 H new ATOM 0 HE2 PHE A 137 2.605 -7.612 2.895 1.00 0.00 H new ATOM 0 HZ PHE A 137 1.246 -5.564 3.048 1.00 0.00 H new ATOM 2134 N GLU A 138 4.514 -8.046 10.531 1.00 0.00 N ATOM 2135 CA GLU A 138 5.340 -8.774 11.487 1.00 0.00 C ATOM 2136 C GLU A 138 5.076 -10.275 11.402 1.00 0.00 C ATOM 2137 O GLU A 138 5.966 -11.087 11.653 1.00 0.00 O ATOM 2138 CB GLU A 138 5.070 -8.278 12.909 1.00 0.00 C ATOM 2139 CG GLU A 138 3.778 -8.811 13.505 1.00 0.00 C ATOM 2140 CD GLU A 138 3.418 -8.138 14.815 1.00 0.00 C ATOM 2141 OE1 GLU A 138 4.314 -7.989 15.672 1.00 0.00 O ATOM 2142 OE2 GLU A 138 2.239 -7.760 14.984 1.00 0.00 O ATOM 0 H GLU A 138 4.082 -7.201 10.904 1.00 0.00 H new ATOM 0 HA GLU A 138 6.385 -8.591 11.238 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.903 -8.568 13.550 1.00 0.00 H new ATOM 0 HB3 GLU A 138 5.036 -7.189 12.904 1.00 0.00 H new ATOM 0 HG2 GLU A 138 2.967 -8.666 12.792 1.00 0.00 H new ATOM 0 HG3 GLU A 138 3.873 -9.885 13.667 1.00 0.00 H new ATOM 2149 N ALA A 139 3.847 -10.634 11.047 1.00 0.00 N ATOM 2150 CA ALA A 139 3.466 -12.036 10.927 1.00 0.00 C ATOM 2151 C ALA A 139 3.022 -12.365 9.506 1.00 0.00 C ATOM 2152 O ALA A 139 2.038 -13.075 9.300 1.00 0.00 O ATOM 2153 CB ALA A 139 2.360 -12.369 11.918 1.00 0.00 C ATOM 0 H ALA A 139 3.098 -9.974 10.838 1.00 0.00 H new ATOM 0 HA ALA A 139 4.340 -12.645 11.156 1.00 0.00 H new ATOM 0 HB1 ALA A 139 2.085 -13.419 11.817 1.00 0.00 H new ATOM 0 HB2 ALA A 139 2.712 -12.182 12.932 1.00 0.00 H new ATOM 0 HB3 ALA A 139 1.490 -11.745 11.715 1.00 0.00 H new ATOM 2159 N THR A 140 3.754 -11.842 8.527 1.00 0.00 N ATOM 2160 CA THR A 140 3.435 -12.079 7.124 1.00 0.00 C ATOM 2161 C THR A 140 4.682 -12.452 6.332 1.00 0.00 C ATOM 2162 O THR A 140 5.794 -12.055 6.682 1.00 0.00 O ATOM 2163 CB THR A 140 2.783 -10.841 6.480 1.00 0.00 C ATOM 2164 OG1 THR A 140 3.681 -9.727 6.540 1.00 0.00 O ATOM 2165 CG2 THR A 140 1.481 -10.487 7.184 1.00 0.00 C ATOM 0 H THR A 140 4.572 -11.252 8.680 1.00 0.00 H new ATOM 0 HA THR A 140 2.729 -12.909 7.096 1.00 0.00 H new ATOM 0 HB THR A 140 2.563 -11.074 5.438 1.00 0.00 H new ATOM 0 HG1 THR A 140 3.229 -8.924 6.206 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.039 -9.610 6.712 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.789 -11.326 7.112 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.682 -10.272 8.234 1.00 0.00 H new ATOM 2173 N ASP A 141 4.491 -13.217 5.263 1.00 0.00 N ATOM 2174 CA ASP A 141 5.601 -13.643 4.419 1.00 0.00 C ATOM 2175 C ASP A 141 5.639 -12.838 3.123 1.00 0.00 C ATOM 2176 O ASP A 141 6.037 -13.348 2.076 1.00 0.00 O ATOM 2177 CB ASP A 141 5.487 -15.135 4.103 1.00 0.00 C ATOM 2178 CG ASP A 141 5.481 -15.992 5.353 1.00 0.00 C ATOM 2179 OD1 ASP A 141 4.384 -16.244 5.895 1.00 0.00 O ATOM 2180 OD2 ASP A 141 6.573 -16.413 5.789 1.00 0.00 O ATOM 0 H ASP A 141 3.577 -13.555 4.960 1.00 0.00 H new ATOM 0 HA ASP A 141 6.528 -13.465 4.964 1.00 0.00 H new ATOM 0 HB2 ASP A 141 4.572 -15.315 3.538 1.00 0.00 H new ATOM 0 HB3 ASP A 141 6.319 -15.433 3.465 1.00 0.00 H new ATOM 2185 N ILE A 142 5.223 -11.578 3.203 1.00 0.00 N ATOM 2186 CA ILE A 142 5.209 -10.704 2.037 1.00 0.00 C ATOM 2187 C ILE A 142 6.360 -9.703 2.087 1.00 0.00 C ATOM 2188 O ILE A 142 6.580 -9.044 3.103 1.00 0.00 O ATOM 2189 CB ILE A 142 3.880 -9.935 1.926 1.00 0.00 C ATOM 2190 CG1 ILE A 142 2.707 -10.912 1.829 1.00 0.00 C ATOM 2191 CG2 ILE A 142 3.904 -9.007 0.720 1.00 0.00 C ATOM 2192 CD1 ILE A 142 1.402 -10.343 2.341 1.00 0.00 C ATOM 0 H ILE A 142 4.892 -11.140 4.063 1.00 0.00 H new ATOM 0 HA ILE A 142 5.324 -11.343 1.162 1.00 0.00 H new ATOM 0 HB ILE A 142 3.751 -9.330 2.823 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.580 -11.212 0.789 1.00 0.00 H new ATOM 0 HG13 ILE A 142 2.947 -11.813 2.394 1.00 0.00 H new ATOM 0 HG21 ILE A 142 2.958 -8.470 0.655 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.720 -8.292 0.827 1.00 0.00 H new ATOM 0 HG23 ILE A 142 4.052 -9.593 -0.187 1.00 0.00 H new ATOM 0 HD11 ILE A 142 0.615 -11.091 2.241 1.00 0.00 H new ATOM 0 HD12 ILE A 142 1.511 -10.069 3.390 1.00 0.00 H new ATOM 0 HD13 ILE A 142 1.138 -9.459 1.761 1.00 0.00 H new ATOM 2204 N LYS A 143 7.090 -9.594 0.983 1.00 0.00 N ATOM 2205 CA LYS A 143 8.216 -8.672 0.898 1.00 0.00 C ATOM 2206 C LYS A 143 7.808 -7.378 0.201 1.00 0.00 C ATOM 2207 O LYS A 143 7.246 -7.402 -0.895 1.00 0.00 O ATOM 2208 CB LYS A 143 9.379 -9.324 0.146 1.00 0.00 C ATOM 2209 CG LYS A 143 9.719 -10.718 0.643 1.00 0.00 C ATOM 2210 CD LYS A 143 10.730 -10.675 1.777 1.00 0.00 C ATOM 2211 CE LYS A 143 10.053 -10.441 3.119 1.00 0.00 C ATOM 2212 NZ LYS A 143 10.921 -10.853 4.257 1.00 0.00 N ATOM 0 H LYS A 143 6.922 -10.133 0.134 1.00 0.00 H new ATOM 0 HA LYS A 143 8.535 -8.433 1.912 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.132 -9.376 -0.914 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.261 -8.690 0.237 1.00 0.00 H new ATOM 0 HG2 LYS A 143 8.811 -11.216 0.983 1.00 0.00 H new ATOM 0 HG3 LYS A 143 10.119 -11.311 -0.180 1.00 0.00 H new ATOM 0 HD2 LYS A 143 11.285 -11.613 1.807 1.00 0.00 H new ATOM 0 HD3 LYS A 143 11.454 -9.882 1.590 1.00 0.00 H new ATOM 0 HE2 LYS A 143 9.800 -9.386 3.219 1.00 0.00 H new ATOM 0 HE3 LYS A 143 9.117 -10.998 3.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 10.424 -10.678 5.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 11.142 -11.866 4.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 11.804 -10.303 4.237 1.00 0.00 H new ATOM 2226 N ILE A 144 8.096 -6.250 0.842 1.00 0.00 N ATOM 2227 CA ILE A 144 7.761 -4.947 0.281 1.00 0.00 C ATOM 2228 C ILE A 144 9.019 -4.153 -0.055 1.00 0.00 C ATOM 2229 O ILE A 144 9.975 -4.123 0.722 1.00 0.00 O ATOM 2230 CB ILE A 144 6.892 -4.124 1.251 1.00 0.00 C ATOM 2231 CG1 ILE A 144 5.540 -4.806 1.463 1.00 0.00 C ATOM 2232 CG2 ILE A 144 6.701 -2.710 0.721 1.00 0.00 C ATOM 2233 CD1 ILE A 144 4.871 -4.430 2.766 1.00 0.00 C ATOM 0 H ILE A 144 8.560 -6.212 1.749 1.00 0.00 H new ATOM 0 HA ILE A 144 7.196 -5.132 -0.633 1.00 0.00 H new ATOM 0 HB ILE A 144 7.402 -4.065 2.212 1.00 0.00 H new ATOM 0 HG12 ILE A 144 4.878 -4.547 0.636 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.679 -5.887 1.434 1.00 0.00 H new ATOM 0 HG21 ILE A 144 6.085 -2.141 1.417 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.672 -2.226 0.617 1.00 0.00 H new ATOM 0 HG23 ILE A 144 6.209 -2.749 -0.251 1.00 0.00 H new ATOM 0 HD11 ILE A 144 3.917 -4.951 2.849 1.00 0.00 H new ATOM 0 HD12 ILE A 144 5.513 -4.714 3.600 1.00 0.00 H new ATOM 0 HD13 ILE A 144 4.700 -3.354 2.790 1.00 0.00 H new ATOM 2245 N THR A 145 9.013 -3.509 -1.218 1.00 0.00 N ATOM 2246 CA THR A 145 10.153 -2.715 -1.657 1.00 0.00 C ATOM 2247 C THR A 145 9.747 -1.268 -1.918 1.00 0.00 C ATOM 2248 O THR A 145 8.942 -0.989 -2.806 1.00 0.00 O ATOM 2249 CB THR A 145 10.785 -3.297 -2.936 1.00 0.00 C ATOM 2250 OG1 THR A 145 10.860 -4.724 -2.839 1.00 0.00 O ATOM 2251 CG2 THR A 145 12.176 -2.725 -3.161 1.00 0.00 C ATOM 0 H THR A 145 8.231 -3.522 -1.873 1.00 0.00 H new ATOM 0 HA THR A 145 10.887 -2.745 -0.852 1.00 0.00 H new ATOM 0 HB THR A 145 10.156 -3.023 -3.783 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.261 -5.087 -3.656 1.00 0.00 H new ATOM 0 HG21 THR A 145 12.602 -3.151 -4.070 1.00 0.00 H new ATOM 0 HG22 THR A 145 12.112 -1.642 -3.263 1.00 0.00 H new ATOM 0 HG23 THR A 145 12.813 -2.972 -2.312 1.00 0.00 H new ATOM 2259 N VAL A 146 10.310 -0.351 -1.138 1.00 0.00 N ATOM 2260 CA VAL A 146 10.008 1.068 -1.285 1.00 0.00 C ATOM 2261 C VAL A 146 11.046 1.762 -2.160 1.00 0.00 C ATOM 2262 O VAL A 146 12.190 1.957 -1.749 1.00 0.00 O ATOM 2263 CB VAL A 146 9.950 1.775 0.082 1.00 0.00 C ATOM 2264 CG1 VAL A 146 9.717 3.267 -0.098 1.00 0.00 C ATOM 2265 CG2 VAL A 146 8.866 1.159 0.954 1.00 0.00 C ATOM 0 H VAL A 146 10.978 -0.565 -0.398 1.00 0.00 H new ATOM 0 HA VAL A 146 9.030 1.136 -1.762 1.00 0.00 H new ATOM 0 HB VAL A 146 10.908 1.639 0.583 1.00 0.00 H new ATOM 0 HG11 VAL A 146 9.679 3.750 0.879 1.00 0.00 H new ATOM 0 HG12 VAL A 146 10.532 3.695 -0.683 1.00 0.00 H new ATOM 0 HG13 VAL A 146 8.773 3.428 -0.619 1.00 0.00 H new ATOM 0 HG21 VAL A 146 8.839 1.670 1.916 1.00 0.00 H new ATOM 0 HG22 VAL A 146 7.900 1.262 0.461 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.082 0.102 1.111 1.00 0.00 H new ATOM 2275 N TYR A 147 10.638 2.134 -3.369 1.00 0.00 N ATOM 2276 CA TYR A 147 11.533 2.806 -4.304 1.00 0.00 C ATOM 2277 C TYR A 147 11.493 4.318 -4.106 1.00 0.00 C ATOM 2278 O TYR A 147 10.422 4.927 -4.094 1.00 0.00 O ATOM 2279 CB TYR A 147 11.154 2.458 -5.744 1.00 0.00 C ATOM 2280 CG TYR A 147 11.578 1.069 -6.164 1.00 0.00 C ATOM 2281 CD1 TYR A 147 10.839 -0.047 -5.792 1.00 0.00 C ATOM 2282 CD2 TYR A 147 12.719 0.873 -6.933 1.00 0.00 C ATOM 2283 CE1 TYR A 147 11.224 -1.318 -6.173 1.00 0.00 C ATOM 2284 CE2 TYR A 147 13.110 -0.394 -7.320 1.00 0.00 C ATOM 2285 CZ TYR A 147 12.360 -1.486 -6.937 1.00 0.00 C ATOM 2286 OH TYR A 147 12.746 -2.751 -7.319 1.00 0.00 O ATOM 0 H TYR A 147 9.694 1.982 -3.724 1.00 0.00 H new ATOM 0 HA TYR A 147 12.548 2.460 -4.109 1.00 0.00 H new ATOM 0 HB2 TYR A 147 10.074 2.549 -5.858 1.00 0.00 H new ATOM 0 HB3 TYR A 147 11.608 3.186 -6.416 1.00 0.00 H new ATOM 0 HD1 TYR A 147 9.948 0.081 -5.195 1.00 0.00 H new ATOM 0 HD2 TYR A 147 13.310 1.726 -7.233 1.00 0.00 H new ATOM 0 HE1 TYR A 147 10.639 -2.175 -5.874 1.00 0.00 H new ATOM 0 HE2 TYR A 147 13.998 -0.529 -7.919 1.00 0.00 H new ATOM 0 HH TYR A 147 13.565 -2.696 -7.854 1.00 0.00 H new ATOM 2296 N THR A 148 12.668 4.920 -3.952 1.00 0.00 N ATOM 2297 CA THR A 148 12.769 6.360 -3.754 1.00 0.00 C ATOM 2298 C THR A 148 13.801 6.973 -4.693 1.00 0.00 C ATOM 2299 O THR A 148 14.981 6.622 -4.649 1.00 0.00 O ATOM 2300 CB THR A 148 13.146 6.703 -2.300 1.00 0.00 C ATOM 2301 OG1 THR A 148 14.479 6.258 -2.022 1.00 0.00 O ATOM 2302 CG2 THR A 148 12.176 6.056 -1.323 1.00 0.00 C ATOM 0 H THR A 148 13.564 4.432 -3.961 1.00 0.00 H new ATOM 0 HA THR A 148 11.787 6.779 -3.975 1.00 0.00 H new ATOM 0 HB THR A 148 13.092 7.785 -2.179 1.00 0.00 H new ATOM 0 HG1 THR A 148 14.952 6.095 -2.865 1.00 0.00 H new ATOM 0 HG21 THR A 148 12.462 6.312 -0.303 1.00 0.00 H new ATOM 0 HG22 THR A 148 11.167 6.418 -1.519 1.00 0.00 H new ATOM 0 HG23 THR A 148 12.203 4.973 -1.446 1.00 0.00 H new ATOM 2310 N LEU A 149 13.351 7.892 -5.541 1.00 0.00 N ATOM 2311 CA LEU A 149 14.238 8.555 -6.491 1.00 0.00 C ATOM 2312 C LEU A 149 14.196 10.069 -6.308 1.00 0.00 C ATOM 2313 O LEU A 149 13.217 10.617 -5.804 1.00 0.00 O ATOM 2314 CB LEU A 149 13.845 8.192 -7.924 1.00 0.00 C ATOM 2315 CG LEU A 149 12.684 8.987 -8.524 1.00 0.00 C ATOM 2316 CD1 LEU A 149 12.825 9.078 -10.035 1.00 0.00 C ATOM 2317 CD2 LEU A 149 11.353 8.353 -8.148 1.00 0.00 C ATOM 0 H LEU A 149 12.378 8.195 -5.590 1.00 0.00 H new ATOM 0 HA LEU A 149 15.255 8.212 -6.302 1.00 0.00 H new ATOM 0 HB2 LEU A 149 14.718 8.324 -8.563 1.00 0.00 H new ATOM 0 HB3 LEU A 149 13.587 7.133 -7.951 1.00 0.00 H new ATOM 0 HG LEU A 149 12.711 9.997 -8.115 1.00 0.00 H new ATOM 0 HD11 LEU A 149 11.990 9.647 -10.445 1.00 0.00 H new ATOM 0 HD12 LEU A 149 13.761 9.577 -10.284 1.00 0.00 H new ATOM 0 HD13 LEU A 149 12.824 8.075 -10.462 1.00 0.00 H new ATOM 0 HD21 LEU A 149 10.538 8.932 -8.583 1.00 0.00 H new ATOM 0 HD22 LEU A 149 11.316 7.332 -8.528 1.00 0.00 H new ATOM 0 HD23 LEU A 149 11.250 8.340 -7.063 1.00 0.00 H new