USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 928 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 SER OG : rot -95:sc= -0.336 USER MOD Set 1.2: A 114 GLN :FLIP amide:sc= -3.64! C(o=-5.7!,f=-4!) USER MOD Set 2.1: A 68 MET CE :methyl -128:sc= -2.62 (180deg=-5.77!) USER MOD Set 2.2: A 144 MET CE :methyl -169:sc= -1.01 (180deg=-0.533) USER MOD Single : A 12 HIS : no HD1:sc= -9.3! C(o=-9.3!,f=-9.5!) USER MOD Single : A 13 GLN :FLIP amide:sc= -0.102 F(o=-0.86,f=-0.1) USER MOD Single : A 16 SER OG : rot 180:sc= 0.244 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= -0.135 K(o=-0.14,f=-1.1) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 145:sc= -0.137 USER MOD Single : A 39 MET CE :methyl 178:sc= -8.33! (180deg=-8.81!) USER MOD Single : A 41 SER OG : rot -58:sc= 0.0424 USER MOD Single : A 44 SER OG : rot 160:sc= 0.71 USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.326 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 53 ASN : amide:sc= -1.63! C(o=-1.6!,f=-2.4!) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 162:sc= -9.62! (180deg=-11.7!) USER MOD Single : A 57 ASN : amide:sc= -0.139 K(o=-0.14,f=-0.79) USER MOD Single : A 58 THR OG1 : rot 87:sc= -0.452 USER MOD Single : A 62 HIS : no HD1:sc= -0.0462 X(o=-0.046,f=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 66 MET CE :methyl -143:sc= -1.35 (180deg=-2.2!) USER MOD Single : A 67 GLN : amide:sc= -0.0559 X(o=-0.056,f=-0.27) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.0219 K(o=-0.022,f=-0.73) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.00183 USER MOD Single : A 112 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 118 MET CE :methyl -129:sc= -2.2 (180deg=-6.2!) USER MOD Single : A 119 THR OG1 : rot 76:sc= 1.04 USER MOD Single : A 120 HIS : no HD1:sc= -0.391 X(o=-0.39,f=-0.74) USER MOD Single : A 121 ASN : amide:sc= -0.0148 X(o=-0.015,f=0) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ -127:sc= -0.853 (180deg=-2.32!) USER MOD Single : A 139 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 1.427 0.411 -0.527 1.00 0.00 N ATOM 2 CA PRO A 1 1.351 0.435 -1.977 1.00 0.00 C ATOM 3 C PRO A 1 1.328 -0.984 -2.549 1.00 0.00 C ATOM 4 O PRO A 1 1.822 -1.919 -1.921 1.00 0.00 O ATOM 5 CB PRO A 1 2.566 1.235 -2.422 1.00 0.00 C ATOM 6 CG PRO A 1 3.522 1.231 -1.241 1.00 0.00 C ATOM 7 CD PRO A 1 2.752 0.755 -0.019 1.00 0.00 C ATOM 0 H2 PRO A 1 1.172 -0.519 -0.194 1.00 0.00 H new ATOM 0 H3 PRO A 1 0.742 1.063 -0.145 1.00 0.00 H new ATOM 0 HA PRO A 1 0.432 0.894 -2.342 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.029 0.786 -3.301 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.286 2.253 -2.694 1.00 0.00 H new ATOM 0 HG2 PRO A 1 4.369 0.574 -1.438 1.00 0.00 H new ATOM 0 HG3 PRO A 1 3.925 2.230 -1.073 1.00 0.00 H new ATOM 0 HD2 PRO A 1 3.235 -0.106 0.443 1.00 0.00 H new ATOM 0 HD3 PRO A 1 2.695 1.534 0.741 1.00 0.00 H new ATOM 15 N ILE A 2 0.749 -1.101 -3.735 1.00 0.00 N ATOM 16 CA ILE A 2 0.654 -2.390 -4.399 1.00 0.00 C ATOM 17 C ILE A 2 1.553 -2.389 -5.637 1.00 0.00 C ATOM 18 O ILE A 2 1.651 -1.380 -6.336 1.00 0.00 O ATOM 19 CB ILE A 2 -0.807 -2.732 -4.698 1.00 0.00 C ATOM 20 CG1 ILE A 2 -1.543 -3.157 -3.426 1.00 0.00 C ATOM 21 CG2 ILE A 2 -0.907 -3.790 -5.799 1.00 0.00 C ATOM 22 CD1 ILE A 2 -3.018 -3.440 -3.715 1.00 0.00 C ATOM 0 H ILE A 2 0.341 -0.323 -4.254 1.00 0.00 H new ATOM 0 HA ILE A 2 1.015 -3.184 -3.745 1.00 0.00 H new ATOM 0 HB ILE A 2 -1.299 -1.833 -5.069 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -1.073 -4.048 -3.010 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -1.460 -2.372 -2.674 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -1.956 -4.016 -5.993 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -0.443 -3.412 -6.710 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -0.394 -4.697 -5.480 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -3.518 -3.740 -2.794 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -3.491 -2.540 -4.108 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -3.098 -4.242 -4.449 1.00 0.00 H new ATOM 158 N VAL A 11 0.101 -7.821 -6.103 1.00 0.00 N ATOM 159 CA VAL A 11 0.333 -8.094 -4.695 1.00 0.00 C ATOM 160 C VAL A 11 0.702 -6.792 -3.981 1.00 0.00 C ATOM 161 O VAL A 11 1.202 -5.858 -4.605 1.00 0.00 O ATOM 162 CB VAL A 11 1.399 -9.181 -4.542 1.00 0.00 C ATOM 163 CG1 VAL A 11 0.834 -10.557 -4.903 1.00 0.00 C ATOM 164 CG2 VAL A 11 2.636 -8.859 -5.381 1.00 0.00 C ATOM 0 HA VAL A 11 -0.574 -8.477 -4.226 1.00 0.00 H new ATOM 0 HB VAL A 11 1.703 -9.207 -3.496 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.612 -11.312 -4.786 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -0.002 -10.792 -4.244 1.00 0.00 H new ATOM 0 HG13 VAL A 11 0.489 -10.549 -5.937 1.00 0.00 H new ATOM 0 HG21 VAL A 11 3.377 -9.648 -5.254 1.00 0.00 H new ATOM 0 HG22 VAL A 11 2.355 -8.791 -6.432 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.058 -7.908 -5.056 1.00 0.00 H new ATOM 174 N HIS A 12 0.441 -6.772 -2.682 1.00 0.00 N ATOM 175 CA HIS A 12 0.739 -5.600 -1.877 1.00 0.00 C ATOM 176 C HIS A 12 2.129 -5.745 -1.254 1.00 0.00 C ATOM 177 O HIS A 12 2.606 -6.860 -1.045 1.00 0.00 O ATOM 178 CB HIS A 12 -0.357 -5.364 -0.835 1.00 0.00 C ATOM 179 CG HIS A 12 -0.596 -6.540 0.082 1.00 0.00 C ATOM 180 ND1 HIS A 12 0.238 -6.843 1.144 1.00 0.00 N ATOM 181 CD2 HIS A 12 -1.582 -7.482 0.084 1.00 0.00 C ATOM 182 CE1 HIS A 12 -0.235 -7.922 1.752 1.00 0.00 C ATOM 183 NE2 HIS A 12 -1.362 -8.317 1.093 1.00 0.00 N ATOM 0 H HIS A 12 0.026 -7.549 -2.167 1.00 0.00 H new ATOM 0 HA HIS A 12 0.754 -4.713 -2.510 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -0.091 -4.495 -0.233 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -1.287 -5.122 -1.349 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -2.402 -7.539 -0.616 1.00 0.00 H new ATOM 0 HE1 HIS A 12 0.196 -8.404 2.617 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -1.941 -9.121 1.335 1.00 0.00 H new ATOM 192 N GLN A 13 2.739 -4.603 -0.974 1.00 0.00 N ATOM 193 CA GLN A 13 4.065 -4.589 -0.379 1.00 0.00 C ATOM 194 C GLN A 13 4.016 -3.951 1.010 1.00 0.00 C ATOM 195 O GLN A 13 4.907 -3.185 1.378 1.00 0.00 O ATOM 196 CB GLN A 13 5.063 -3.861 -1.282 1.00 0.00 C ATOM 197 CG GLN A 13 6.455 -4.490 -1.178 1.00 0.00 C ATOM 198 CD GLN A 13 7.069 -4.692 -2.565 1.00 0.00 C ATOM 199 OE1 GLN A 13 6.774 -3.729 -3.433 1.00 0.00 O flip ATOM 200 NE2 GLN A 13 7.763 -5.660 -2.830 1.00 0.00 N flip ATOM 0 H GLN A 13 2.340 -3.681 -1.148 1.00 0.00 H new ATOM 0 HA GLN A 13 4.406 -5.619 -0.273 1.00 0.00 H new ATOM 0 HB2 GLN A 13 4.719 -3.899 -2.316 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.113 -2.809 -1.001 1.00 0.00 H new ATOM 0 HG2 GLN A 13 7.103 -3.851 -0.579 1.00 0.00 H new ATOM 0 HG3 GLN A 13 6.388 -5.448 -0.663 1.00 0.00 H new ATOM 0 HE21 GLN A 13 7.951 -6.364 -2.116 1.00 0.00 H new ATOM 0 HE22 GLN A 13 8.155 -5.765 -3.766 1.00 0.00 H new ATOM 209 N ALA A 14 2.967 -4.289 1.746 1.00 0.00 N ATOM 210 CA ALA A 14 2.790 -3.760 3.087 1.00 0.00 C ATOM 211 C ALA A 14 3.028 -2.248 3.069 1.00 0.00 C ATOM 212 O ALA A 14 3.193 -1.655 2.004 1.00 0.00 O ATOM 213 CB ALA A 14 3.731 -4.486 4.051 1.00 0.00 C ATOM 0 H ALA A 14 2.230 -4.924 1.438 1.00 0.00 H new ATOM 0 HA ALA A 14 1.771 -3.930 3.435 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.598 -4.089 5.057 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.503 -5.552 4.048 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.763 -4.335 3.735 1.00 0.00 H new ATOM 219 N ILE A 15 3.038 -1.669 4.260 1.00 0.00 N ATOM 220 CA ILE A 15 3.253 -0.238 4.395 1.00 0.00 C ATOM 221 C ILE A 15 4.753 0.040 4.510 1.00 0.00 C ATOM 222 O ILE A 15 5.568 -0.876 4.406 1.00 0.00 O ATOM 223 CB ILE A 15 2.433 0.321 5.559 1.00 0.00 C ATOM 224 CG1 ILE A 15 2.005 1.764 5.287 1.00 0.00 C ATOM 225 CG2 ILE A 15 3.195 0.188 6.880 1.00 0.00 C ATOM 226 CD1 ILE A 15 0.482 1.878 5.206 1.00 0.00 C ATOM 0 H ILE A 15 2.901 -2.165 5.141 1.00 0.00 H new ATOM 0 HA ILE A 15 2.899 0.285 3.507 1.00 0.00 H new ATOM 0 HB ILE A 15 1.523 -0.272 5.651 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.380 2.414 6.078 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.449 2.109 4.353 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.590 0.593 7.691 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.406 -0.864 7.074 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.133 0.740 6.816 1.00 0.00 H new ATOM 0 HD11 ILE A 15 0.204 2.914 5.012 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.112 1.246 4.399 1.00 0.00 H new ATOM 0 HD13 ILE A 15 0.042 1.555 6.150 1.00 0.00 H new ATOM 238 N SER A 16 5.073 1.308 4.723 1.00 0.00 N ATOM 239 CA SER A 16 6.461 1.718 4.854 1.00 0.00 C ATOM 240 C SER A 16 6.667 2.453 6.180 1.00 0.00 C ATOM 241 O SER A 16 5.770 3.149 6.653 1.00 0.00 O ATOM 242 CB SER A 16 6.886 2.605 3.682 1.00 0.00 C ATOM 243 OG SER A 16 7.837 3.591 4.077 1.00 0.00 O ATOM 0 H SER A 16 4.395 2.065 4.808 1.00 0.00 H new ATOM 0 HA SER A 16 7.085 0.824 4.842 1.00 0.00 H new ATOM 0 HB2 SER A 16 7.313 1.985 2.894 1.00 0.00 H new ATOM 0 HB3 SER A 16 6.008 3.096 3.261 1.00 0.00 H new ATOM 0 HG SER A 16 8.085 4.136 3.301 1.00 0.00 H new ATOM 249 N PRO A 17 7.884 2.269 6.756 1.00 0.00 N ATOM 250 CA PRO A 17 8.220 2.907 8.017 1.00 0.00 C ATOM 251 C PRO A 17 8.501 4.398 7.821 1.00 0.00 C ATOM 252 O PRO A 17 8.113 5.221 8.649 1.00 0.00 O ATOM 253 CB PRO A 17 9.424 2.140 8.539 1.00 0.00 C ATOM 254 CG PRO A 17 10.003 1.408 7.339 1.00 0.00 C ATOM 255 CD PRO A 17 8.971 1.451 6.224 1.00 0.00 C ATOM 0 HA PRO A 17 7.401 2.873 8.735 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.159 2.816 8.976 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.132 1.439 9.321 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.932 1.878 7.017 1.00 0.00 H new ATOM 0 HG3 PRO A 17 10.241 0.377 7.599 1.00 0.00 H new ATOM 0 HD2 PRO A 17 9.387 1.887 5.316 1.00 0.00 H new ATOM 0 HD3 PRO A 17 8.624 0.450 5.967 1.00 0.00 H new ATOM 263 N ARG A 18 9.172 4.701 6.719 1.00 0.00 N ATOM 264 CA ARG A 18 9.508 6.078 6.403 1.00 0.00 C ATOM 265 C ARG A 18 8.240 6.878 6.098 1.00 0.00 C ATOM 266 O ARG A 18 8.173 8.074 6.379 1.00 0.00 O ATOM 267 CB ARG A 18 10.452 6.153 5.200 1.00 0.00 C ATOM 268 CG ARG A 18 11.896 6.386 5.650 1.00 0.00 C ATOM 269 CD ARG A 18 12.759 6.879 4.487 1.00 0.00 C ATOM 270 NE ARG A 18 14.193 6.714 4.817 1.00 0.00 N ATOM 271 CZ ARG A 18 15.195 7.028 3.984 1.00 0.00 C ATOM 272 NH1 ARG A 18 14.927 7.522 2.768 1.00 0.00 N ATOM 273 NH2 ARG A 18 16.466 6.846 4.368 1.00 0.00 N ATOM 0 H ARG A 18 9.492 4.016 6.034 1.00 0.00 H new ATOM 0 HA ARG A 18 10.010 6.504 7.272 1.00 0.00 H new ATOM 0 HB2 ARG A 18 10.391 5.228 4.627 1.00 0.00 H new ATOM 0 HB3 ARG A 18 10.139 6.960 4.537 1.00 0.00 H new ATOM 0 HG2 ARG A 18 11.916 7.118 6.458 1.00 0.00 H new ATOM 0 HG3 ARG A 18 12.311 5.460 6.048 1.00 0.00 H new ATOM 0 HD2 ARG A 18 12.519 6.320 3.582 1.00 0.00 H new ATOM 0 HD3 ARG A 18 12.543 7.927 4.281 1.00 0.00 H new ATOM 0 HE ARG A 18 14.433 6.338 5.734 1.00 0.00 H new ATOM 0 HH11 ARG A 18 13.960 7.660 2.475 1.00 0.00 H new ATOM 0 HH12 ARG A 18 15.690 7.761 2.135 1.00 0.00 H new ATOM 0 HH21 ARG A 18 16.670 6.469 5.293 1.00 0.00 H new ATOM 0 HH22 ARG A 18 17.229 7.085 3.735 1.00 0.00 H new ATOM 287 N THR A 19 7.266 6.186 5.525 1.00 0.00 N ATOM 288 CA THR A 19 6.003 6.817 5.179 1.00 0.00 C ATOM 289 C THR A 19 5.169 7.066 6.437 1.00 0.00 C ATOM 290 O THR A 19 4.681 8.175 6.652 1.00 0.00 O ATOM 291 CB THR A 19 5.300 5.932 4.148 1.00 0.00 C ATOM 292 OG1 THR A 19 5.335 6.700 2.949 1.00 0.00 O ATOM 293 CG2 THR A 19 3.807 5.765 4.440 1.00 0.00 C ATOM 0 H THR A 19 7.326 5.195 5.292 1.00 0.00 H new ATOM 0 HA THR A 19 6.160 7.799 4.732 1.00 0.00 H new ATOM 0 HB THR A 19 5.777 4.952 4.126 1.00 0.00 H new ATOM 0 HG1 THR A 19 4.901 6.199 2.227 1.00 0.00 H new ATOM 0 HG21 THR A 19 3.356 5.128 3.679 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.677 5.306 5.420 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.323 6.741 4.430 1.00 0.00 H new ATOM 301 N LEU A 20 5.031 6.017 7.233 1.00 0.00 N ATOM 302 CA LEU A 20 4.264 6.109 8.464 1.00 0.00 C ATOM 303 C LEU A 20 4.932 7.114 9.404 1.00 0.00 C ATOM 304 O LEU A 20 4.254 7.913 10.047 1.00 0.00 O ATOM 305 CB LEU A 20 4.074 4.722 9.081 1.00 0.00 C ATOM 306 CG LEU A 20 2.929 3.882 8.509 1.00 0.00 C ATOM 307 CD1 LEU A 20 3.025 2.430 8.980 1.00 0.00 C ATOM 308 CD2 LEU A 20 1.572 4.506 8.842 1.00 0.00 C ATOM 0 H LEU A 20 5.437 5.099 7.050 1.00 0.00 H new ATOM 0 HA LEU A 20 3.261 6.483 8.260 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.002 4.163 8.962 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.910 4.842 10.152 1.00 0.00 H new ATOM 0 HG LEU A 20 3.021 3.873 7.423 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.200 1.856 8.559 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.971 2.002 8.649 1.00 0.00 H new ATOM 0 HD13 LEU A 20 2.973 2.396 10.068 1.00 0.00 H new ATOM 0 HD21 LEU A 20 0.776 3.890 8.424 1.00 0.00 H new ATOM 0 HD22 LEU A 20 1.455 4.566 9.924 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.518 5.508 8.415 1.00 0.00 H new ATOM 320 N ASN A 21 6.254 7.040 9.453 1.00 0.00 N ATOM 321 CA ASN A 21 7.023 7.933 10.303 1.00 0.00 C ATOM 322 C ASN A 21 6.745 9.382 9.897 1.00 0.00 C ATOM 323 O ASN A 21 6.238 10.168 10.696 1.00 0.00 O ATOM 324 CB ASN A 21 8.524 7.680 10.154 1.00 0.00 C ATOM 325 CG ASN A 21 9.316 8.430 11.227 1.00 0.00 C ATOM 326 OD1 ASN A 21 9.383 9.648 11.247 1.00 0.00 O ATOM 327 ND2 ASN A 21 9.909 7.638 12.114 1.00 0.00 N ATOM 0 H ASN A 21 6.812 6.375 8.918 1.00 0.00 H new ATOM 0 HA ASN A 21 6.728 7.751 11.336 1.00 0.00 H new ATOM 0 HB2 ASN A 21 8.725 6.611 10.229 1.00 0.00 H new ATOM 0 HB3 ASN A 21 8.854 7.998 9.165 1.00 0.00 H new ATOM 0 HD21 ASN A 21 10.461 8.043 12.870 1.00 0.00 H new ATOM 0 HD22 ASN A 21 9.812 6.625 12.039 1.00 0.00 H new ATOM 334 N ALA A 22 7.087 9.690 8.654 1.00 0.00 N ATOM 335 CA ALA A 22 6.882 11.030 8.133 1.00 0.00 C ATOM 336 C ALA A 22 5.426 11.444 8.360 1.00 0.00 C ATOM 337 O ALA A 22 5.155 12.566 8.784 1.00 0.00 O ATOM 338 CB ALA A 22 7.273 11.068 6.654 1.00 0.00 C ATOM 0 H ALA A 22 7.504 9.034 7.993 1.00 0.00 H new ATOM 0 HA ALA A 22 7.515 11.746 8.657 1.00 0.00 H new ATOM 0 HB1 ALA A 22 7.119 12.074 6.263 1.00 0.00 H new ATOM 0 HB2 ALA A 22 8.323 10.794 6.548 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.656 10.363 6.096 1.00 0.00 H new ATOM 344 N TRP A 23 4.528 10.514 8.068 1.00 0.00 N ATOM 345 CA TRP A 23 3.107 10.768 8.236 1.00 0.00 C ATOM 346 C TRP A 23 2.882 11.268 9.664 1.00 0.00 C ATOM 347 O TRP A 23 2.366 12.365 9.867 1.00 0.00 O ATOM 348 CB TRP A 23 2.285 9.522 7.901 1.00 0.00 C ATOM 349 CG TRP A 23 0.844 9.570 8.416 1.00 0.00 C ATOM 350 CD1 TRP A 23 0.284 8.815 9.370 1.00 0.00 C ATOM 351 CD2 TRP A 23 -0.202 10.456 7.963 1.00 0.00 C ATOM 352 NE1 TRP A 23 -1.041 9.147 9.565 1.00 0.00 N ATOM 353 CE2 TRP A 23 -1.345 10.176 8.681 1.00 0.00 C ATOM 354 CE3 TRP A 23 -0.181 11.459 6.977 1.00 0.00 C ATOM 355 CZ2 TRP A 23 -2.556 10.856 8.492 1.00 0.00 C ATOM 356 CZ3 TRP A 23 -1.397 12.128 6.800 1.00 0.00 C ATOM 357 CH2 TRP A 23 -2.558 11.860 7.516 1.00 0.00 C ATOM 0 H TRP A 23 4.757 9.584 7.716 1.00 0.00 H new ATOM 0 HA TRP A 23 2.767 11.536 7.541 1.00 0.00 H new ATOM 0 HB2 TRP A 23 2.269 9.390 6.819 1.00 0.00 H new ATOM 0 HB3 TRP A 23 2.782 8.648 8.322 1.00 0.00 H new ATOM 0 HD1 TRP A 23 0.804 8.043 9.918 1.00 0.00 H new ATOM 0 HE1 TRP A 23 -1.679 8.717 10.234 1.00 0.00 H new ATOM 0 HE3 TRP A 23 0.703 11.694 6.403 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 -3.439 10.619 9.067 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 -1.436 12.908 6.054 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -3.458 12.424 7.320 1.00 0.00 H new ATOM 368 N VAL A 24 3.280 10.437 10.618 1.00 0.00 N ATOM 369 CA VAL A 24 3.127 10.781 12.021 1.00 0.00 C ATOM 370 C VAL A 24 3.614 12.214 12.246 1.00 0.00 C ATOM 371 O VAL A 24 2.981 12.981 12.969 1.00 0.00 O ATOM 372 CB VAL A 24 3.858 9.757 12.892 1.00 0.00 C ATOM 373 CG1 VAL A 24 3.980 10.253 14.335 1.00 0.00 C ATOM 374 CG2 VAL A 24 3.163 8.395 12.837 1.00 0.00 C ATOM 0 H VAL A 24 3.708 9.527 10.446 1.00 0.00 H new ATOM 0 HA VAL A 24 2.077 10.745 12.312 1.00 0.00 H new ATOM 0 HB VAL A 24 4.865 9.635 12.493 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.503 9.507 14.933 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.539 11.189 14.352 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.985 10.417 14.749 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.703 7.686 13.464 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.139 8.494 13.199 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.151 8.034 11.809 1.00 0.00 H new ATOM 384 N LYS A 25 4.734 12.531 11.614 1.00 0.00 N ATOM 385 CA LYS A 25 5.312 13.858 11.737 1.00 0.00 C ATOM 386 C LYS A 25 4.380 14.879 11.082 1.00 0.00 C ATOM 387 O LYS A 25 4.230 15.995 11.576 1.00 0.00 O ATOM 388 CB LYS A 25 6.735 13.876 11.174 1.00 0.00 C ATOM 389 CG LYS A 25 7.764 13.607 12.275 1.00 0.00 C ATOM 390 CD LYS A 25 9.189 13.687 11.725 1.00 0.00 C ATOM 391 CE LYS A 25 10.214 13.727 12.860 1.00 0.00 C ATOM 392 NZ LYS A 25 11.586 13.827 12.317 1.00 0.00 N ATOM 0 H LYS A 25 5.257 11.892 11.015 1.00 0.00 H new ATOM 0 HA LYS A 25 5.404 14.137 12.787 1.00 0.00 H new ATOM 0 HB2 LYS A 25 6.830 13.124 10.391 1.00 0.00 H new ATOM 0 HB3 LYS A 25 6.935 14.843 10.713 1.00 0.00 H new ATOM 0 HG2 LYS A 25 7.640 14.332 13.079 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.591 12.621 12.706 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.384 12.827 11.084 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.294 14.577 11.104 1.00 0.00 H new ATOM 0 HE2 LYS A 25 10.011 14.578 13.511 1.00 0.00 H new ATOM 0 HE3 LYS A 25 10.123 12.829 13.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.269 13.853 13.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.782 13.002 11.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 11.674 14.696 11.753 1.00 0.00 H new ATOM 406 N VAL A 26 3.777 14.460 9.979 1.00 0.00 N ATOM 407 CA VAL A 26 2.862 15.324 9.252 1.00 0.00 C ATOM 408 C VAL A 26 1.653 15.637 10.134 1.00 0.00 C ATOM 409 O VAL A 26 1.219 16.786 10.215 1.00 0.00 O ATOM 410 CB VAL A 26 2.479 14.676 7.919 1.00 0.00 C ATOM 411 CG1 VAL A 26 1.121 15.187 7.433 1.00 0.00 C ATOM 412 CG2 VAL A 26 3.563 14.909 6.865 1.00 0.00 C ATOM 0 H VAL A 26 3.904 13.534 9.571 1.00 0.00 H new ATOM 0 HA VAL A 26 3.342 16.273 9.011 1.00 0.00 H new ATOM 0 HB VAL A 26 2.395 13.601 8.080 1.00 0.00 H new ATOM 0 HG11 VAL A 26 0.872 14.712 6.484 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.356 14.946 8.171 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.166 16.267 7.296 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.266 14.439 5.928 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.694 15.980 6.708 1.00 0.00 H new ATOM 0 HG23 VAL A 26 4.502 14.475 7.207 1.00 0.00 H new ATOM 422 N VAL A 27 1.141 14.595 10.774 1.00 0.00 N ATOM 423 CA VAL A 27 -0.009 14.746 11.648 1.00 0.00 C ATOM 424 C VAL A 27 0.390 15.565 12.876 1.00 0.00 C ATOM 425 O VAL A 27 -0.372 16.414 13.336 1.00 0.00 O ATOM 426 CB VAL A 27 -0.577 13.371 12.006 1.00 0.00 C ATOM 427 CG1 VAL A 27 -1.918 13.503 12.731 1.00 0.00 C ATOM 428 CG2 VAL A 27 -0.712 12.491 10.761 1.00 0.00 C ATOM 0 H VAL A 27 1.502 13.644 10.704 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.805 15.291 11.140 1.00 0.00 H new ATOM 0 HB VAL A 27 0.125 12.886 12.684 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.299 12.511 12.974 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.780 14.074 13.649 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.631 14.018 12.087 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.118 11.520 11.044 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.382 12.970 10.048 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.268 12.355 10.303 1.00 0.00 H new ATOM 438 N GLU A 28 1.586 15.283 13.372 1.00 0.00 N ATOM 439 CA GLU A 28 2.097 15.983 14.538 1.00 0.00 C ATOM 440 C GLU A 28 2.289 17.469 14.223 1.00 0.00 C ATOM 441 O GLU A 28 2.159 18.316 15.106 1.00 0.00 O ATOM 442 CB GLU A 28 3.403 15.355 15.028 1.00 0.00 C ATOM 443 CG GLU A 28 3.419 15.240 16.553 1.00 0.00 C ATOM 444 CD GLU A 28 4.477 14.237 17.017 1.00 0.00 C ATOM 445 OE1 GLU A 28 5.562 14.230 16.397 1.00 0.00 O ATOM 446 OE2 GLU A 28 4.176 13.501 17.981 1.00 0.00 O ATOM 0 H GLU A 28 2.216 14.579 12.987 1.00 0.00 H new ATOM 0 HA GLU A 28 1.365 15.892 15.341 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.524 14.367 14.584 1.00 0.00 H new ATOM 0 HB3 GLU A 28 4.248 15.959 14.697 1.00 0.00 H new ATOM 0 HG2 GLU A 28 3.621 16.217 16.993 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.437 14.928 16.908 1.00 0.00 H new ATOM 453 N GLU A 29 2.594 17.739 12.962 1.00 0.00 N ATOM 454 CA GLU A 29 2.805 19.107 12.520 1.00 0.00 C ATOM 455 C GLU A 29 1.475 19.742 12.110 1.00 0.00 C ATOM 456 O GLU A 29 1.285 20.947 12.267 1.00 0.00 O ATOM 457 CB GLU A 29 3.817 19.163 11.373 1.00 0.00 C ATOM 458 CG GLU A 29 4.711 20.398 11.492 1.00 0.00 C ATOM 459 CD GLU A 29 5.655 20.279 12.690 1.00 0.00 C ATOM 460 OE1 GLU A 29 5.215 20.654 13.799 1.00 0.00 O ATOM 461 OE2 GLU A 29 6.795 19.814 12.472 1.00 0.00 O ATOM 0 H GLU A 29 2.700 17.034 12.233 1.00 0.00 H new ATOM 0 HA GLU A 29 3.217 19.678 13.352 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.431 18.263 11.381 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.290 19.181 10.419 1.00 0.00 H new ATOM 0 HG2 GLU A 29 5.292 20.520 10.578 1.00 0.00 H new ATOM 0 HG3 GLU A 29 4.093 21.290 11.599 1.00 0.00 H new ATOM 468 N LYS A 30 0.590 18.904 11.592 1.00 0.00 N ATOM 469 CA LYS A 30 -0.716 19.370 11.157 1.00 0.00 C ATOM 470 C LYS A 30 -1.781 18.870 12.135 1.00 0.00 C ATOM 471 O LYS A 30 -2.275 19.633 12.964 1.00 0.00 O ATOM 472 CB LYS A 30 -0.975 18.962 9.704 1.00 0.00 C ATOM 473 CG LYS A 30 -0.600 20.091 8.743 1.00 0.00 C ATOM 474 CD LYS A 30 0.723 19.791 8.036 1.00 0.00 C ATOM 475 CE LYS A 30 1.414 21.084 7.595 1.00 0.00 C ATOM 476 NZ LYS A 30 2.707 20.783 6.940 1.00 0.00 N ATOM 0 H LYS A 30 0.751 17.905 11.464 1.00 0.00 H new ATOM 0 HA LYS A 30 -0.756 20.459 11.169 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -0.398 18.069 9.465 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.027 18.705 9.576 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -1.390 20.222 8.004 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -0.519 21.029 9.292 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.379 19.234 8.705 1.00 0.00 H new ATOM 0 HD3 LYS A 30 0.540 19.158 7.168 1.00 0.00 H new ATOM 0 HE2 LYS A 30 0.770 21.631 6.907 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.578 21.728 8.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 3.163 21.671 6.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 3.326 20.280 7.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 2.542 20.186 6.104 1.00 0.00 H new ATOM 490 N ALA A 31 -2.105 17.592 12.006 1.00 0.00 N ATOM 491 CA ALA A 31 -3.103 16.981 12.868 1.00 0.00 C ATOM 492 C ALA A 31 -4.494 17.206 12.269 1.00 0.00 C ATOM 493 O ALA A 31 -5.255 18.042 12.755 1.00 0.00 O ATOM 494 CB ALA A 31 -2.977 17.554 14.281 1.00 0.00 C ATOM 0 H ALA A 31 -1.694 16.962 11.317 1.00 0.00 H new ATOM 0 HA ALA A 31 -2.944 15.905 12.937 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -3.725 17.096 14.928 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.982 17.343 14.672 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.134 18.632 14.252 1.00 0.00 H new ATOM 500 N PHE A 32 -4.783 16.445 11.223 1.00 0.00 N ATOM 501 CA PHE A 32 -6.068 16.551 10.555 1.00 0.00 C ATOM 502 C PHE A 32 -6.305 17.974 10.042 1.00 0.00 C ATOM 503 O PHE A 32 -7.246 18.642 10.469 1.00 0.00 O ATOM 504 CB PHE A 32 -7.141 16.210 11.591 1.00 0.00 C ATOM 505 CG PHE A 32 -7.559 14.738 11.592 1.00 0.00 C ATOM 506 CD1 PHE A 32 -6.697 13.788 12.042 1.00 0.00 C ATOM 507 CD2 PHE A 32 -8.792 14.381 11.144 1.00 0.00 C ATOM 508 CE1 PHE A 32 -7.085 12.422 12.044 1.00 0.00 C ATOM 509 CE2 PHE A 32 -9.180 13.015 11.145 1.00 0.00 C ATOM 510 CZ PHE A 32 -8.318 12.064 11.595 1.00 0.00 C ATOM 0 H PHE A 32 -4.149 15.753 10.823 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.099 15.876 9.700 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.771 16.473 12.582 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -8.020 16.827 11.405 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.718 14.072 12.398 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -9.476 15.136 10.787 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -6.401 11.667 12.402 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -10.159 12.731 10.789 1.00 0.00 H new ATOM 0 HZ PHE A 32 -8.612 11.025 11.596 1.00 0.00 H new ATOM 520 N SER A 33 -5.435 18.394 9.135 1.00 0.00 N ATOM 521 CA SER A 33 -5.537 19.725 8.561 1.00 0.00 C ATOM 522 C SER A 33 -5.998 19.632 7.105 1.00 0.00 C ATOM 523 O SER A 33 -6.127 18.538 6.560 1.00 0.00 O ATOM 524 CB SER A 33 -4.202 20.467 8.649 1.00 0.00 C ATOM 525 OG SER A 33 -3.515 20.480 7.400 1.00 0.00 O ATOM 0 H SER A 33 -4.657 17.836 8.784 1.00 0.00 H new ATOM 0 HA SER A 33 -6.273 20.289 9.134 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.378 21.492 8.977 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.573 19.994 9.404 1.00 0.00 H new ATOM 0 HG SER A 33 -3.037 21.329 7.298 1.00 0.00 H new ATOM 531 N PRO A 34 -6.240 20.827 6.502 1.00 0.00 N ATOM 532 CA PRO A 34 -6.684 20.891 5.119 1.00 0.00 C ATOM 533 C PRO A 34 -5.530 20.600 4.160 1.00 0.00 C ATOM 534 O PRO A 34 -5.718 20.582 2.943 1.00 0.00 O ATOM 535 CB PRO A 34 -7.256 22.289 4.955 1.00 0.00 C ATOM 536 CG PRO A 34 -6.694 23.108 6.105 1.00 0.00 C ATOM 537 CD PRO A 34 -6.098 22.143 7.117 1.00 0.00 C ATOM 0 HA PRO A 34 -7.435 20.138 4.882 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.970 22.717 3.994 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.345 22.271 4.984 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -5.934 23.801 5.744 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -7.479 23.708 6.566 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.052 22.376 7.318 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -6.624 22.194 8.070 1.00 0.00 H new ATOM 545 N GLU A 35 -4.359 20.380 4.741 1.00 0.00 N ATOM 546 CA GLU A 35 -3.174 20.091 3.951 1.00 0.00 C ATOM 547 C GLU A 35 -2.698 18.661 4.212 1.00 0.00 C ATOM 548 O GLU A 35 -1.590 18.291 3.826 1.00 0.00 O ATOM 549 CB GLU A 35 -2.062 21.100 4.241 1.00 0.00 C ATOM 550 CG GLU A 35 -2.035 22.206 3.184 1.00 0.00 C ATOM 551 CD GLU A 35 -0.679 22.254 2.477 1.00 0.00 C ATOM 552 OE1 GLU A 35 -0.074 21.169 2.335 1.00 0.00 O ATOM 553 OE2 GLU A 35 -0.278 23.374 2.093 1.00 0.00 O ATOM 0 H GLU A 35 -4.206 20.396 5.749 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.434 20.180 2.896 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.212 21.539 5.227 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.099 20.589 4.263 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.825 22.035 2.453 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.239 23.168 3.654 1.00 0.00 H new ATOM 560 N VAL A 36 -3.559 17.895 4.866 1.00 0.00 N ATOM 561 CA VAL A 36 -3.240 16.513 5.183 1.00 0.00 C ATOM 562 C VAL A 36 -4.075 15.586 4.299 1.00 0.00 C ATOM 563 O VAL A 36 -3.682 14.449 4.040 1.00 0.00 O ATOM 564 CB VAL A 36 -3.445 16.259 6.678 1.00 0.00 C ATOM 565 CG1 VAL A 36 -3.713 14.777 6.950 1.00 0.00 C ATOM 566 CG2 VAL A 36 -2.248 16.758 7.489 1.00 0.00 C ATOM 0 H VAL A 36 -4.477 18.205 5.185 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.191 16.305 4.972 1.00 0.00 H new ATOM 0 HB VAL A 36 -4.322 16.822 6.996 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.855 14.623 8.020 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -4.611 14.466 6.416 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.864 14.185 6.608 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.420 16.565 8.548 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.347 16.236 7.167 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -2.123 17.829 7.331 1.00 0.00 H new ATOM 576 N ILE A 37 -5.213 16.104 3.860 1.00 0.00 N ATOM 577 CA ILE A 37 -6.106 15.336 3.010 1.00 0.00 C ATOM 578 C ILE A 37 -5.385 14.978 1.710 1.00 0.00 C ATOM 579 O ILE A 37 -5.496 13.854 1.223 1.00 0.00 O ATOM 580 CB ILE A 37 -7.421 16.090 2.797 1.00 0.00 C ATOM 581 CG1 ILE A 37 -8.381 15.861 3.966 1.00 0.00 C ATOM 582 CG2 ILE A 37 -8.055 15.717 1.454 1.00 0.00 C ATOM 583 CD1 ILE A 37 -9.130 17.146 4.320 1.00 0.00 C ATOM 0 H ILE A 37 -5.537 17.047 4.077 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.377 14.397 3.492 1.00 0.00 H new ATOM 0 HB ILE A 37 -7.201 17.157 2.765 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -9.095 15.079 3.707 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -7.824 15.509 4.835 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -8.988 16.266 1.327 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -7.371 15.972 0.645 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -8.258 14.646 1.433 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.806 16.955 5.154 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.414 17.918 4.602 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -9.705 17.482 3.457 1.00 0.00 H new ATOM 595 N PRO A 38 -4.641 15.981 1.170 1.00 0.00 N ATOM 596 CA PRO A 38 -3.901 15.782 -0.064 1.00 0.00 C ATOM 597 C PRO A 38 -2.648 14.938 0.177 1.00 0.00 C ATOM 598 O PRO A 38 -2.239 14.167 -0.690 1.00 0.00 O ATOM 599 CB PRO A 38 -3.586 17.183 -0.562 1.00 0.00 C ATOM 600 CG PRO A 38 -3.751 18.101 0.637 1.00 0.00 C ATOM 601 CD PRO A 38 -4.486 17.325 1.719 1.00 0.00 C ATOM 0 HA PRO A 38 -4.468 15.225 -0.810 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -2.572 17.237 -0.958 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -4.260 17.471 -1.369 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -2.779 18.434 1.000 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -4.311 18.994 0.360 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -3.919 17.310 2.650 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -5.453 17.776 1.942 1.00 0.00 H new ATOM 609 N MET A 39 -2.076 15.111 1.358 1.00 0.00 N ATOM 610 CA MET A 39 -0.878 14.373 1.724 1.00 0.00 C ATOM 611 C MET A 39 -1.189 12.890 1.934 1.00 0.00 C ATOM 612 O MET A 39 -0.389 12.028 1.575 1.00 0.00 O ATOM 613 CB MET A 39 -0.292 14.958 3.011 1.00 0.00 C ATOM 614 CG MET A 39 0.989 15.745 2.722 1.00 0.00 C ATOM 615 SD MET A 39 2.333 14.621 2.383 1.00 0.00 S ATOM 616 CE MET A 39 2.628 13.987 4.025 1.00 0.00 C ATOM 0 H MET A 39 -2.419 15.751 2.075 1.00 0.00 H new ATOM 0 HA MET A 39 -0.157 14.462 0.911 1.00 0.00 H new ATOM 0 HB2 MET A 39 -1.025 15.611 3.485 1.00 0.00 H new ATOM 0 HB3 MET A 39 -0.078 14.154 3.716 1.00 0.00 H new ATOM 0 HG2 MET A 39 0.834 16.407 1.870 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.238 16.376 3.575 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.420 13.239 3.989 1.00 0.00 H new ATOM 0 HE2 MET A 39 2.929 14.803 4.682 1.00 0.00 H new ATOM 0 HE3 MET A 39 1.715 13.531 4.408 1.00 0.00 H new ATOM 626 N PHE A 40 -2.355 12.639 2.512 1.00 0.00 N ATOM 627 CA PHE A 40 -2.782 11.275 2.774 1.00 0.00 C ATOM 628 C PHE A 40 -3.211 10.578 1.480 1.00 0.00 C ATOM 629 O PHE A 40 -2.859 9.423 1.248 1.00 0.00 O ATOM 630 CB PHE A 40 -3.984 11.355 3.718 1.00 0.00 C ATOM 631 CG PHE A 40 -4.085 10.183 4.696 1.00 0.00 C ATOM 632 CD1 PHE A 40 -3.018 9.847 5.468 1.00 0.00 C ATOM 633 CD2 PHE A 40 -5.245 9.479 4.794 1.00 0.00 C ATOM 634 CE1 PHE A 40 -3.113 8.759 6.375 1.00 0.00 C ATOM 635 CE2 PHE A 40 -5.340 8.391 5.702 1.00 0.00 C ATOM 636 CZ PHE A 40 -4.271 8.054 6.473 1.00 0.00 C ATOM 0 H PHE A 40 -3.017 13.357 2.806 1.00 0.00 H new ATOM 0 HA PHE A 40 -1.961 10.705 3.209 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.927 12.284 4.285 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -4.897 11.399 3.124 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -2.098 10.408 5.391 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -6.093 9.747 4.182 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -2.265 8.491 6.987 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -6.260 7.831 5.780 1.00 0.00 H new ATOM 0 HZ PHE A 40 -4.342 7.226 7.163 1.00 0.00 H new ATOM 646 N SER A 41 -3.965 11.310 0.673 1.00 0.00 N ATOM 647 CA SER A 41 -4.445 10.776 -0.589 1.00 0.00 C ATOM 648 C SER A 41 -3.262 10.426 -1.494 1.00 0.00 C ATOM 649 O SER A 41 -3.259 9.382 -2.144 1.00 0.00 O ATOM 650 CB SER A 41 -5.373 11.771 -1.291 1.00 0.00 C ATOM 651 OG SER A 41 -4.651 12.693 -2.103 1.00 0.00 O ATOM 0 H SER A 41 -4.255 12.268 0.869 1.00 0.00 H new ATOM 0 HA SER A 41 -5.016 9.871 -0.382 1.00 0.00 H new ATOM 0 HB2 SER A 41 -6.088 11.227 -1.908 1.00 0.00 H new ATOM 0 HB3 SER A 41 -5.949 12.319 -0.545 1.00 0.00 H new ATOM 0 HG SER A 41 -4.003 13.177 -1.550 1.00 0.00 H new ATOM 657 N ALA A 42 -2.283 11.320 -1.507 1.00 0.00 N ATOM 658 CA ALA A 42 -1.096 11.119 -2.321 1.00 0.00 C ATOM 659 C ALA A 42 -0.228 10.029 -1.689 1.00 0.00 C ATOM 660 O ALA A 42 0.430 9.268 -2.395 1.00 0.00 O ATOM 661 CB ALA A 42 -0.349 12.446 -2.471 1.00 0.00 C ATOM 0 H ALA A 42 -2.288 12.185 -0.967 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.369 10.784 -3.322 1.00 0.00 H new ATOM 0 HB1 ALA A 42 0.541 12.295 -3.081 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.999 13.177 -2.952 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.056 12.812 -1.487 1.00 0.00 H new ATOM 667 N LEU A 43 -0.256 9.989 -0.365 1.00 0.00 N ATOM 668 CA LEU A 43 0.520 9.006 0.371 1.00 0.00 C ATOM 669 C LEU A 43 0.102 7.601 -0.070 1.00 0.00 C ATOM 670 O LEU A 43 0.951 6.739 -0.295 1.00 0.00 O ATOM 671 CB LEU A 43 0.394 9.240 1.877 1.00 0.00 C ATOM 672 CG LEU A 43 1.553 9.990 2.538 1.00 0.00 C ATOM 673 CD1 LEU A 43 1.051 10.884 3.674 1.00 0.00 C ATOM 674 CD2 LEU A 43 2.636 9.018 3.010 1.00 0.00 C ATOM 0 H LEU A 43 -0.804 10.622 0.217 1.00 0.00 H new ATOM 0 HA LEU A 43 1.581 9.111 0.144 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.525 9.795 2.063 1.00 0.00 H new ATOM 0 HB3 LEU A 43 0.286 8.272 2.367 1.00 0.00 H new ATOM 0 HG LEU A 43 2.008 10.642 1.792 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.894 11.405 4.127 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.344 11.613 3.278 1.00 0.00 H new ATOM 0 HD13 LEU A 43 0.556 10.271 4.428 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.448 9.576 3.476 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.211 8.323 3.734 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.022 8.461 2.156 1.00 0.00 H new ATOM 686 N SER A 44 -1.204 7.413 -0.178 1.00 0.00 N ATOM 687 CA SER A 44 -1.744 6.127 -0.586 1.00 0.00 C ATOM 688 C SER A 44 -1.644 5.976 -2.105 1.00 0.00 C ATOM 689 O SER A 44 -0.730 5.326 -2.609 1.00 0.00 O ATOM 690 CB SER A 44 -3.197 5.971 -0.133 1.00 0.00 C ATOM 691 OG SER A 44 -3.903 5.015 -0.921 1.00 0.00 O ATOM 0 H SER A 44 -1.905 8.130 0.010 1.00 0.00 H new ATOM 0 HA SER A 44 -1.156 5.343 -0.109 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.220 5.666 0.913 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.701 6.935 -0.195 1.00 0.00 H new ATOM 0 HG SER A 44 -4.693 4.705 -0.430 1.00 0.00 H new ATOM 697 N GLU A 45 -2.596 6.590 -2.793 1.00 0.00 N ATOM 698 CA GLU A 45 -2.626 6.532 -4.245 1.00 0.00 C ATOM 699 C GLU A 45 -3.318 5.250 -4.711 1.00 0.00 C ATOM 700 O GLU A 45 -3.850 5.194 -5.819 1.00 0.00 O ATOM 701 CB GLU A 45 -1.216 6.637 -4.827 1.00 0.00 C ATOM 702 CG GLU A 45 -1.209 7.484 -6.101 1.00 0.00 C ATOM 703 CD GLU A 45 -1.692 6.669 -7.303 1.00 0.00 C ATOM 704 OE1 GLU A 45 -1.180 5.540 -7.466 1.00 0.00 O ATOM 705 OE2 GLU A 45 -2.561 7.194 -8.033 1.00 0.00 O ATOM 0 H GLU A 45 -3.352 7.130 -2.372 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.199 7.384 -4.611 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -0.546 7.079 -4.089 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.835 5.640 -5.047 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -1.850 8.355 -5.966 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -0.202 7.855 -6.290 1.00 0.00 H new ATOM 712 N GLY A 46 -3.288 4.249 -3.842 1.00 0.00 N ATOM 713 CA GLY A 46 -3.905 2.971 -4.151 1.00 0.00 C ATOM 714 C GLY A 46 -3.501 1.906 -3.130 1.00 0.00 C ATOM 715 O GLY A 46 -3.305 0.744 -3.483 1.00 0.00 O ATOM 0 H GLY A 46 -2.846 4.298 -2.924 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -4.990 3.079 -4.159 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -3.609 2.652 -5.151 1.00 0.00 H new ATOM 719 N ALA A 47 -3.387 2.340 -1.883 1.00 0.00 N ATOM 720 CA ALA A 47 -3.010 1.439 -0.808 1.00 0.00 C ATOM 721 C ALA A 47 -4.173 0.491 -0.510 1.00 0.00 C ATOM 722 O ALA A 47 -5.310 0.756 -0.900 1.00 0.00 O ATOM 723 CB ALA A 47 -2.593 2.252 0.418 1.00 0.00 C ATOM 0 H ALA A 47 -3.549 3.305 -1.594 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.155 0.830 -1.101 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.310 1.575 1.224 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.744 2.887 0.162 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.427 2.875 0.742 1.00 0.00 H new ATOM 729 N THR A 48 -3.850 -0.594 0.177 1.00 0.00 N ATOM 730 CA THR A 48 -4.855 -1.583 0.531 1.00 0.00 C ATOM 731 C THR A 48 -5.599 -1.156 1.797 1.00 0.00 C ATOM 732 O THR A 48 -5.410 -0.045 2.289 1.00 0.00 O ATOM 733 CB THR A 48 -4.158 -2.939 0.662 1.00 0.00 C ATOM 734 OG1 THR A 48 -3.826 -3.025 2.045 1.00 0.00 O ATOM 735 CG2 THR A 48 -2.804 -2.973 -0.049 1.00 0.00 C ATOM 0 H THR A 48 -2.907 -0.811 0.498 1.00 0.00 H new ATOM 0 HA THR A 48 -5.618 -1.668 -0.243 1.00 0.00 H new ATOM 0 HB THR A 48 -4.801 -3.719 0.254 1.00 0.00 H new ATOM 0 HG1 THR A 48 -3.371 -3.875 2.220 1.00 0.00 H new ATOM 0 HG21 THR A 48 -2.352 -3.957 0.075 1.00 0.00 H new ATOM 0 HG22 THR A 48 -2.945 -2.770 -1.111 1.00 0.00 H new ATOM 0 HG23 THR A 48 -2.148 -2.216 0.381 1.00 0.00 H new ATOM 743 N PRO A 49 -6.453 -2.087 2.303 1.00 0.00 N ATOM 744 CA PRO A 49 -7.227 -1.819 3.503 1.00 0.00 C ATOM 745 C PRO A 49 -6.347 -1.897 4.752 1.00 0.00 C ATOM 746 O PRO A 49 -6.575 -1.176 5.723 1.00 0.00 O ATOM 747 CB PRO A 49 -8.339 -2.855 3.494 1.00 0.00 C ATOM 748 CG PRO A 49 -7.879 -3.951 2.546 1.00 0.00 C ATOM 749 CD PRO A 49 -6.703 -3.414 1.747 1.00 0.00 C ATOM 0 HA PRO A 49 -7.641 -0.811 3.520 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -8.512 -3.251 4.495 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -9.279 -2.417 3.158 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.587 -4.840 3.104 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -8.690 -4.245 1.880 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.829 -4.057 1.848 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -6.938 -3.360 0.684 1.00 0.00 H new ATOM 757 N GLN A 50 -5.361 -2.779 4.687 1.00 0.00 N ATOM 758 CA GLN A 50 -4.445 -2.960 5.800 1.00 0.00 C ATOM 759 C GLN A 50 -3.435 -1.812 5.851 1.00 0.00 C ATOM 760 O GLN A 50 -3.055 -1.362 6.930 1.00 0.00 O ATOM 761 CB GLN A 50 -3.734 -4.313 5.711 1.00 0.00 C ATOM 762 CG GLN A 50 -3.547 -4.926 7.100 1.00 0.00 C ATOM 763 CD GLN A 50 -4.628 -5.970 7.389 1.00 0.00 C ATOM 764 OE1 GLN A 50 -5.795 -5.792 7.083 1.00 0.00 O ATOM 765 NE2 GLN A 50 -4.175 -7.064 7.993 1.00 0.00 N ATOM 0 H GLN A 50 -5.176 -3.376 3.881 1.00 0.00 H new ATOM 0 HA GLN A 50 -5.022 -2.950 6.724 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.313 -4.992 5.085 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -2.763 -4.187 5.231 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -2.562 -5.389 7.168 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -3.583 -4.141 7.856 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -3.184 -7.148 8.221 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -4.818 -7.820 8.229 1.00 0.00 H new ATOM 774 N ASP A 51 -3.029 -1.372 4.668 1.00 0.00 N ATOM 775 CA ASP A 51 -2.070 -0.285 4.564 1.00 0.00 C ATOM 776 C ASP A 51 -2.715 1.009 5.067 1.00 0.00 C ATOM 777 O ASP A 51 -2.203 1.645 5.986 1.00 0.00 O ATOM 778 CB ASP A 51 -1.641 -0.066 3.112 1.00 0.00 C ATOM 779 CG ASP A 51 -0.693 -1.128 2.551 1.00 0.00 C ATOM 780 OD1 ASP A 51 -0.502 -2.144 3.252 1.00 0.00 O ATOM 781 OD2 ASP A 51 -0.184 -0.899 1.433 1.00 0.00 O ATOM 0 H ASP A 51 -3.346 -1.748 3.775 1.00 0.00 H new ATOM 0 HA ASP A 51 -1.197 -0.547 5.162 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -2.533 -0.030 2.487 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -1.158 0.908 3.035 1.00 0.00 H new ATOM 786 N LEU A 52 -3.830 1.358 4.442 1.00 0.00 N ATOM 787 CA LEU A 52 -4.551 2.563 4.814 1.00 0.00 C ATOM 788 C LEU A 52 -4.986 2.460 6.277 1.00 0.00 C ATOM 789 O LEU A 52 -4.888 3.431 7.027 1.00 0.00 O ATOM 790 CB LEU A 52 -5.706 2.817 3.844 1.00 0.00 C ATOM 791 CG LEU A 52 -5.485 3.925 2.813 1.00 0.00 C ATOM 792 CD1 LEU A 52 -6.617 3.950 1.783 1.00 0.00 C ATOM 793 CD2 LEU A 52 -5.301 5.282 3.495 1.00 0.00 C ATOM 0 H LEU A 52 -4.252 0.827 3.680 1.00 0.00 H new ATOM 0 HA LEU A 52 -3.902 3.436 4.735 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.918 1.890 3.312 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.595 3.061 4.425 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.563 3.709 2.273 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -6.435 4.747 1.062 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.657 2.993 1.263 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -7.566 4.128 2.289 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.146 6.051 2.739 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.191 5.520 4.077 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.435 5.243 4.156 1.00 0.00 H new ATOM 805 N ASN A 53 -5.459 1.277 6.639 1.00 0.00 N ATOM 806 CA ASN A 53 -5.909 1.035 7.999 1.00 0.00 C ATOM 807 C ASN A 53 -4.777 1.366 8.973 1.00 0.00 C ATOM 808 O ASN A 53 -5.010 1.974 10.017 1.00 0.00 O ATOM 809 CB ASN A 53 -6.291 -0.433 8.200 1.00 0.00 C ATOM 810 CG ASN A 53 -6.389 -0.776 9.688 1.00 0.00 C ATOM 811 OD1 ASN A 53 -6.510 0.086 10.543 1.00 0.00 O ATOM 812 ND2 ASN A 53 -6.328 -2.078 9.947 1.00 0.00 N ATOM 0 H ASN A 53 -5.540 0.475 6.014 1.00 0.00 H new ATOM 0 HA ASN A 53 -6.781 1.663 8.182 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.245 -0.634 7.713 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -5.549 -1.074 7.724 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -6.383 -2.410 10.910 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -6.226 -2.746 9.183 1.00 0.00 H new ATOM 819 N THR A 54 -3.576 0.951 8.598 1.00 0.00 N ATOM 820 CA THR A 54 -2.407 1.197 9.426 1.00 0.00 C ATOM 821 C THR A 54 -2.152 2.700 9.556 1.00 0.00 C ATOM 822 O THR A 54 -1.906 3.198 10.654 1.00 0.00 O ATOM 823 CB THR A 54 -1.230 0.430 8.820 1.00 0.00 C ATOM 824 OG1 THR A 54 -1.140 -0.751 9.613 1.00 0.00 O ATOM 825 CG2 THR A 54 0.108 1.135 9.050 1.00 0.00 C ATOM 0 H THR A 54 -3.387 0.446 7.732 1.00 0.00 H new ATOM 0 HA THR A 54 -2.559 0.837 10.443 1.00 0.00 H new ATOM 0 HB THR A 54 -1.393 0.300 7.750 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.402 -1.308 9.288 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.910 0.549 8.600 1.00 0.00 H new ATOM 0 HG22 THR A 54 0.081 2.124 8.593 1.00 0.00 H new ATOM 0 HG23 THR A 54 0.288 1.234 10.120 1.00 0.00 H new ATOM 833 N MET A 55 -2.217 3.379 8.421 1.00 0.00 N ATOM 834 CA MET A 55 -1.996 4.815 8.395 1.00 0.00 C ATOM 835 C MET A 55 -3.021 5.543 9.267 1.00 0.00 C ATOM 836 O MET A 55 -2.710 6.570 9.869 1.00 0.00 O ATOM 837 CB MET A 55 -2.101 5.321 6.954 1.00 0.00 C ATOM 838 CG MET A 55 -0.716 5.444 6.315 1.00 0.00 C ATOM 839 SD MET A 55 -0.129 7.124 6.447 1.00 0.00 S ATOM 840 CE MET A 55 -0.842 7.819 4.966 1.00 0.00 C ATOM 0 H MET A 55 -2.419 2.962 7.512 1.00 0.00 H new ATOM 0 HA MET A 55 -1.001 5.018 8.790 1.00 0.00 H new ATOM 0 HB2 MET A 55 -2.716 4.638 6.369 1.00 0.00 H new ATOM 0 HB3 MET A 55 -2.599 6.290 6.940 1.00 0.00 H new ATOM 0 HG2 MET A 55 -0.018 4.767 6.807 1.00 0.00 H new ATOM 0 HG3 MET A 55 -0.762 5.148 5.267 1.00 0.00 H new ATOM 0 HE1 MET A 55 -0.853 8.906 5.043 1.00 0.00 H new ATOM 0 HE2 MET A 55 -0.247 7.523 4.102 1.00 0.00 H new ATOM 0 HE3 MET A 55 -1.862 7.453 4.847 1.00 0.00 H new ATOM 850 N LEU A 56 -4.221 4.985 9.307 1.00 0.00 N ATOM 851 CA LEU A 56 -5.293 5.569 10.096 1.00 0.00 C ATOM 852 C LEU A 56 -5.052 5.268 11.576 1.00 0.00 C ATOM 853 O LEU A 56 -5.162 6.157 12.420 1.00 0.00 O ATOM 854 CB LEU A 56 -6.654 5.093 9.585 1.00 0.00 C ATOM 855 CG LEU A 56 -6.990 5.451 8.136 1.00 0.00 C ATOM 856 CD1 LEU A 56 -8.223 4.686 7.653 1.00 0.00 C ATOM 857 CD2 LEU A 56 -7.152 6.963 7.968 1.00 0.00 C ATOM 0 H LEU A 56 -4.476 4.134 8.806 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.299 6.654 9.988 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.700 4.009 9.691 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -7.428 5.510 10.230 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.154 5.144 7.507 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.439 4.959 6.620 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.033 3.614 7.712 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -9.077 4.938 8.282 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.390 7.190 6.929 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.958 7.316 8.611 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.223 7.461 8.244 1.00 0.00 H new ATOM 869 N ASN A 57 -4.729 4.012 11.847 1.00 0.00 N ATOM 870 CA ASN A 57 -4.472 3.583 13.212 1.00 0.00 C ATOM 871 C ASN A 57 -3.258 4.337 13.759 1.00 0.00 C ATOM 872 O ASN A 57 -3.162 4.577 14.961 1.00 0.00 O ATOM 873 CB ASN A 57 -4.164 2.086 13.270 1.00 0.00 C ATOM 874 CG ASN A 57 -5.136 1.361 14.202 1.00 0.00 C ATOM 875 OD1 ASN A 57 -5.606 1.900 15.191 1.00 0.00 O ATOM 876 ND2 ASN A 57 -5.409 0.113 13.835 1.00 0.00 N ATOM 0 H ASN A 57 -4.639 3.277 11.145 1.00 0.00 H new ATOM 0 HA ASN A 57 -5.363 3.791 13.804 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -4.228 1.659 12.269 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -3.142 1.935 13.616 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -6.047 -0.455 14.393 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -4.981 -0.277 12.995 1.00 0.00 H new ATOM 883 N THR A 58 -2.362 4.690 12.849 1.00 0.00 N ATOM 884 CA THR A 58 -1.158 5.412 13.225 1.00 0.00 C ATOM 885 C THR A 58 -1.519 6.761 13.852 1.00 0.00 C ATOM 886 O THR A 58 -0.879 7.196 14.808 1.00 0.00 O ATOM 887 CB THR A 58 -0.274 5.537 11.984 1.00 0.00 C ATOM 888 OG1 THR A 58 0.695 4.504 12.143 1.00 0.00 O ATOM 889 CG2 THR A 58 0.551 6.826 11.979 1.00 0.00 C ATOM 0 H THR A 58 -2.446 4.490 11.852 1.00 0.00 H new ATOM 0 HA THR A 58 -0.597 4.873 13.988 1.00 0.00 H new ATOM 0 HB THR A 58 -0.897 5.502 11.090 1.00 0.00 H new ATOM 0 HG1 THR A 58 0.345 3.667 11.772 1.00 0.00 H new ATOM 0 HG21 THR A 58 1.161 6.864 11.076 1.00 0.00 H new ATOM 0 HG22 THR A 58 -0.118 7.686 12.002 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.199 6.847 12.855 1.00 0.00 H new ATOM 897 N VAL A 59 -2.543 7.384 13.288 1.00 0.00 N ATOM 898 CA VAL A 59 -2.997 8.673 13.780 1.00 0.00 C ATOM 899 C VAL A 59 -3.041 8.646 15.309 1.00 0.00 C ATOM 900 O VAL A 59 -2.951 7.579 15.916 1.00 0.00 O ATOM 901 CB VAL A 59 -4.345 9.029 13.150 1.00 0.00 C ATOM 902 CG1 VAL A 59 -5.464 8.999 14.194 1.00 0.00 C ATOM 903 CG2 VAL A 59 -4.283 10.390 12.452 1.00 0.00 C ATOM 0 H VAL A 59 -3.071 7.020 12.495 1.00 0.00 H new ATOM 0 HA VAL A 59 -2.299 9.458 13.489 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.570 8.276 12.395 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.411 9.256 13.720 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.533 8.000 14.625 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -5.246 9.720 14.982 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -5.254 10.618 12.013 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -4.023 11.160 13.178 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.527 10.362 11.667 1.00 0.00 H new ATOM 913 N GLY A 60 -3.181 9.829 15.887 1.00 0.00 N ATOM 914 CA GLY A 60 -3.238 9.953 17.334 1.00 0.00 C ATOM 915 C GLY A 60 -4.315 9.039 17.920 1.00 0.00 C ATOM 916 O GLY A 60 -4.003 8.036 18.559 1.00 0.00 O ATOM 0 H GLY A 60 -3.257 10.711 15.380 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.268 9.700 17.763 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -3.447 10.988 17.606 1.00 0.00 H new ATOM 920 N GLY A 61 -5.562 9.419 17.684 1.00 0.00 N ATOM 921 CA GLY A 61 -6.688 8.646 18.180 1.00 0.00 C ATOM 922 C GLY A 61 -7.929 9.526 18.340 1.00 0.00 C ATOM 923 O GLY A 61 -8.514 9.590 19.420 1.00 0.00 O ATOM 0 H GLY A 61 -5.818 10.253 17.155 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.904 7.829 17.492 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -6.431 8.196 19.139 1.00 0.00 H new ATOM 927 N HIS A 62 -8.294 10.183 17.249 1.00 0.00 N ATOM 928 CA HIS A 62 -9.456 11.055 17.253 1.00 0.00 C ATOM 929 C HIS A 62 -10.716 10.234 16.975 1.00 0.00 C ATOM 930 O HIS A 62 -10.949 9.813 15.842 1.00 0.00 O ATOM 931 CB HIS A 62 -9.271 12.211 16.268 1.00 0.00 C ATOM 932 CG HIS A 62 -8.027 13.031 16.510 1.00 0.00 C ATOM 933 ND1 HIS A 62 -7.499 13.891 15.562 1.00 0.00 N ATOM 934 CD2 HIS A 62 -7.213 13.116 17.602 1.00 0.00 C ATOM 935 CE1 HIS A 62 -6.416 14.461 16.071 1.00 0.00 C ATOM 936 NE2 HIS A 62 -6.240 13.978 17.335 1.00 0.00 N ATOM 0 H HIS A 62 -7.805 10.129 16.356 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.571 11.508 18.238 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -9.238 11.810 15.255 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.141 12.865 16.324 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.339 12.573 18.527 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -5.784 15.181 15.573 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -5.485 14.237 17.970 1.00 0.00 H new ATOM 945 N GLN A 63 -11.497 10.032 18.026 1.00 0.00 N ATOM 946 CA GLN A 63 -12.727 9.269 17.909 1.00 0.00 C ATOM 947 C GLN A 63 -13.752 10.038 17.073 1.00 0.00 C ATOM 948 O GLN A 63 -14.518 9.442 16.318 1.00 0.00 O ATOM 949 CB GLN A 63 -13.292 8.924 19.288 1.00 0.00 C ATOM 950 CG GLN A 63 -14.033 7.585 19.258 1.00 0.00 C ATOM 951 CD GLN A 63 -14.614 7.249 20.633 1.00 0.00 C ATOM 952 OE1 GLN A 63 -15.197 8.081 21.309 1.00 0.00 O ATOM 953 NE2 GLN A 63 -14.422 5.988 21.007 1.00 0.00 N ATOM 0 H GLN A 63 -11.301 10.384 18.963 1.00 0.00 H new ATOM 0 HA GLN A 63 -12.502 8.332 17.400 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -12.482 8.879 20.016 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -13.971 9.712 19.614 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -14.835 7.625 18.521 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -13.351 6.795 18.944 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.925 5.344 20.392 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.771 5.665 21.909 1.00 0.00 H new ATOM 962 N ALA A 64 -13.733 11.353 17.236 1.00 0.00 N ATOM 963 CA ALA A 64 -14.650 12.212 16.507 1.00 0.00 C ATOM 964 C ALA A 64 -14.287 12.193 15.021 1.00 0.00 C ATOM 965 O ALA A 64 -15.150 11.980 14.170 1.00 0.00 O ATOM 966 CB ALA A 64 -14.611 13.622 17.099 1.00 0.00 C ATOM 0 H ALA A 64 -13.096 11.845 17.863 1.00 0.00 H new ATOM 0 HA ALA A 64 -15.673 11.848 16.601 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.299 14.266 16.551 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -14.906 13.585 18.148 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -13.600 14.022 17.020 1.00 0.00 H new ATOM 972 N ALA A 65 -13.009 12.418 14.754 1.00 0.00 N ATOM 973 CA ALA A 65 -12.522 12.430 13.385 1.00 0.00 C ATOM 974 C ALA A 65 -12.772 11.062 12.747 1.00 0.00 C ATOM 975 O ALA A 65 -13.382 10.971 11.684 1.00 0.00 O ATOM 976 CB ALA A 65 -11.041 12.816 13.374 1.00 0.00 C ATOM 0 H ALA A 65 -12.296 12.593 15.462 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.058 13.172 12.794 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -10.675 12.825 12.347 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -10.920 13.807 13.811 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -10.472 12.091 13.956 1.00 0.00 H new ATOM 982 N MET A 66 -12.288 10.031 13.426 1.00 0.00 N ATOM 983 CA MET A 66 -12.451 8.671 12.939 1.00 0.00 C ATOM 984 C MET A 66 -13.932 8.321 12.778 1.00 0.00 C ATOM 985 O MET A 66 -14.309 7.617 11.843 1.00 0.00 O ATOM 986 CB MET A 66 -11.799 7.696 13.920 1.00 0.00 C ATOM 987 CG MET A 66 -10.308 7.528 13.617 1.00 0.00 C ATOM 988 SD MET A 66 -10.093 6.769 12.016 1.00 0.00 S ATOM 989 CE MET A 66 -8.690 7.698 11.419 1.00 0.00 C ATOM 0 H MET A 66 -11.783 10.110 14.309 1.00 0.00 H new ATOM 0 HA MET A 66 -11.971 8.594 11.964 1.00 0.00 H new ATOM 0 HB2 MET A 66 -11.928 8.060 14.939 1.00 0.00 H new ATOM 0 HB3 MET A 66 -12.297 6.728 13.861 1.00 0.00 H new ATOM 0 HG2 MET A 66 -9.812 8.499 13.638 1.00 0.00 H new ATOM 0 HG3 MET A 66 -9.839 6.914 14.386 1.00 0.00 H new ATOM 0 HE1 MET A 66 -8.800 7.875 10.349 1.00 0.00 H new ATOM 0 HE2 MET A 66 -8.637 8.653 11.941 1.00 0.00 H new ATOM 0 HE3 MET A 66 -7.776 7.134 11.601 1.00 0.00 H new ATOM 999 N GLN A 67 -14.731 8.829 13.705 1.00 0.00 N ATOM 1000 CA GLN A 67 -16.162 8.578 13.678 1.00 0.00 C ATOM 1001 C GLN A 67 -16.766 9.086 12.367 1.00 0.00 C ATOM 1002 O GLN A 67 -17.451 8.343 11.666 1.00 0.00 O ATOM 1003 CB GLN A 67 -16.854 9.218 14.883 1.00 0.00 C ATOM 1004 CG GLN A 67 -18.375 9.109 14.765 1.00 0.00 C ATOM 1005 CD GLN A 67 -19.037 10.480 14.924 1.00 0.00 C ATOM 1006 OE1 GLN A 67 -18.630 11.305 15.725 1.00 0.00 O ATOM 1007 NE2 GLN A 67 -20.078 10.674 14.119 1.00 0.00 N ATOM 0 H GLN A 67 -14.415 9.413 14.479 1.00 0.00 H new ATOM 0 HA GLN A 67 -16.323 7.502 13.737 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -16.521 8.730 15.799 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.566 10.267 14.957 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -18.639 8.684 13.797 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -18.755 8.427 15.526 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -20.366 9.940 13.471 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -20.589 11.557 14.149 1.00 0.00 H new ATOM 1016 N MET A 68 -16.489 10.349 12.075 1.00 0.00 N ATOM 1017 CA MET A 68 -16.996 10.964 10.860 1.00 0.00 C ATOM 1018 C MET A 68 -16.501 10.218 9.619 1.00 0.00 C ATOM 1019 O MET A 68 -17.254 10.020 8.669 1.00 0.00 O ATOM 1020 CB MET A 68 -16.536 12.423 10.797 1.00 0.00 C ATOM 1021 CG MET A 68 -17.569 13.351 11.440 1.00 0.00 C ATOM 1022 SD MET A 68 -16.779 14.395 12.653 1.00 0.00 S ATOM 1023 CE MET A 68 -15.588 15.228 11.617 1.00 0.00 C ATOM 0 H MET A 68 -15.920 10.963 12.659 1.00 0.00 H new ATOM 0 HA MET A 68 -18.085 10.917 10.878 1.00 0.00 H new ATOM 0 HB2 MET A 68 -15.579 12.529 11.308 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.377 12.714 9.759 1.00 0.00 H new ATOM 0 HG2 MET A 68 -18.045 13.964 10.675 1.00 0.00 H new ATOM 0 HG3 MET A 68 -18.356 12.762 11.912 1.00 0.00 H new ATOM 0 HE1 MET A 68 -14.595 15.137 12.058 1.00 0.00 H new ATOM 0 HE2 MET A 68 -15.587 14.774 10.626 1.00 0.00 H new ATOM 0 HE3 MET A 68 -15.853 16.282 11.533 1.00 0.00 H new ATOM 1033 N LEU A 69 -15.236 9.826 9.670 1.00 0.00 N ATOM 1034 CA LEU A 69 -14.632 9.105 8.562 1.00 0.00 C ATOM 1035 C LEU A 69 -15.332 7.756 8.393 1.00 0.00 C ATOM 1036 O LEU A 69 -15.491 7.271 7.274 1.00 0.00 O ATOM 1037 CB LEU A 69 -13.119 8.993 8.758 1.00 0.00 C ATOM 1038 CG LEU A 69 -12.341 8.337 7.615 1.00 0.00 C ATOM 1039 CD1 LEU A 69 -11.200 9.239 7.140 1.00 0.00 C ATOM 1040 CD2 LEU A 69 -11.844 6.948 8.017 1.00 0.00 C ATOM 0 H LEU A 69 -14.613 9.994 10.460 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.770 9.654 7.630 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.718 9.994 8.916 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -12.932 8.427 9.670 1.00 0.00 H new ATOM 0 HG LEU A 69 -13.019 8.205 6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.663 8.749 6.328 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.608 10.186 6.787 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.515 9.425 7.967 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.294 6.504 7.187 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.187 7.033 8.883 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -12.695 6.315 8.268 1.00 0.00 H new ATOM 1052 N LYS A 70 -15.733 7.188 9.521 1.00 0.00 N ATOM 1053 CA LYS A 70 -16.413 5.905 9.512 1.00 0.00 C ATOM 1054 C LYS A 70 -17.761 6.051 8.804 1.00 0.00 C ATOM 1055 O LYS A 70 -18.095 5.256 7.927 1.00 0.00 O ATOM 1056 CB LYS A 70 -16.522 5.346 10.932 1.00 0.00 C ATOM 1057 CG LYS A 70 -16.110 3.873 10.975 1.00 0.00 C ATOM 1058 CD LYS A 70 -16.530 3.225 12.296 1.00 0.00 C ATOM 1059 CE LYS A 70 -16.768 1.724 12.119 1.00 0.00 C ATOM 1060 NZ LYS A 70 -18.166 1.376 12.460 1.00 0.00 N ATOM 0 H LYS A 70 -15.600 7.593 10.447 1.00 0.00 H new ATOM 0 HA LYS A 70 -15.835 5.172 8.949 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -15.888 5.924 11.604 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -17.546 5.451 11.291 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -16.568 3.339 10.142 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -15.030 3.790 10.852 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -15.757 3.388 13.047 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -17.439 3.700 12.665 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -16.556 1.435 11.090 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -16.082 1.164 12.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -18.310 0.354 12.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -18.356 1.633 13.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -18.815 1.896 11.836 1.00 0.00 H new ATOM 1074 N GLU A 71 -18.500 7.072 9.211 1.00 0.00 N ATOM 1075 CA GLU A 71 -19.804 7.334 8.626 1.00 0.00 C ATOM 1076 C GLU A 71 -19.673 7.565 7.119 1.00 0.00 C ATOM 1077 O GLU A 71 -20.470 7.049 6.337 1.00 0.00 O ATOM 1078 CB GLU A 71 -20.481 8.525 9.306 1.00 0.00 C ATOM 1079 CG GLU A 71 -21.578 8.058 10.265 1.00 0.00 C ATOM 1080 CD GLU A 71 -22.652 9.135 10.436 1.00 0.00 C ATOM 1081 OE1 GLU A 71 -22.320 10.175 11.044 1.00 0.00 O ATOM 1082 OE2 GLU A 71 -23.780 8.893 9.955 1.00 0.00 O ATOM 0 H GLU A 71 -18.220 7.729 9.940 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.435 6.460 8.787 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -19.739 9.107 9.853 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -20.909 9.184 8.551 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -22.033 7.143 9.885 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -21.141 7.818 11.234 1.00 0.00 H new ATOM 1089 N THR A 72 -18.662 8.340 6.757 1.00 0.00 N ATOM 1090 CA THR A 72 -18.416 8.644 5.357 1.00 0.00 C ATOM 1091 C THR A 72 -18.151 7.360 4.570 1.00 0.00 C ATOM 1092 O THR A 72 -18.883 7.038 3.634 1.00 0.00 O ATOM 1093 CB THR A 72 -17.264 9.648 5.287 1.00 0.00 C ATOM 1094 OG1 THR A 72 -17.909 10.903 5.087 1.00 0.00 O ATOM 1095 CG2 THR A 72 -16.405 9.467 4.034 1.00 0.00 C ATOM 0 H THR A 72 -18.003 8.767 7.408 1.00 0.00 H new ATOM 0 HA THR A 72 -19.291 9.098 4.892 1.00 0.00 H new ATOM 0 HB THR A 72 -16.639 9.545 6.174 1.00 0.00 H new ATOM 0 HG1 THR A 72 -17.235 11.612 5.032 1.00 0.00 H new ATOM 0 HG21 THR A 72 -15.602 10.204 4.034 1.00 0.00 H new ATOM 0 HG22 THR A 72 -15.977 8.465 4.028 1.00 0.00 H new ATOM 0 HG23 THR A 72 -17.023 9.603 3.146 1.00 0.00 H new ATOM 1103 N ILE A 73 -17.103 6.659 4.978 1.00 0.00 N ATOM 1104 CA ILE A 73 -16.733 5.417 4.322 1.00 0.00 C ATOM 1105 C ILE A 73 -17.984 4.561 4.116 1.00 0.00 C ATOM 1106 O ILE A 73 -18.193 4.009 3.036 1.00 0.00 O ATOM 1107 CB ILE A 73 -15.625 4.707 5.104 1.00 0.00 C ATOM 1108 CG1 ILE A 73 -14.253 5.292 4.764 1.00 0.00 C ATOM 1109 CG2 ILE A 73 -15.677 3.195 4.879 1.00 0.00 C ATOM 1110 CD1 ILE A 73 -13.209 4.183 4.610 1.00 0.00 C ATOM 0 H ILE A 73 -16.499 6.928 5.755 1.00 0.00 H new ATOM 0 HA ILE A 73 -16.317 5.618 3.335 1.00 0.00 H new ATOM 0 HB ILE A 73 -15.793 4.879 6.167 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -14.317 5.867 3.840 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -13.943 5.982 5.549 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -14.879 2.715 5.446 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -16.641 2.810 5.212 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -15.548 2.980 3.818 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -12.242 4.624 4.368 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -13.130 3.625 5.543 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -13.510 3.508 3.809 1.00 0.00 H new ATOM 1122 N ASN A 74 -18.785 4.477 5.168 1.00 0.00 N ATOM 1123 CA ASN A 74 -20.010 3.698 5.116 1.00 0.00 C ATOM 1124 C ASN A 74 -20.912 4.247 4.008 1.00 0.00 C ATOM 1125 O ASN A 74 -21.547 3.483 3.284 1.00 0.00 O ATOM 1126 CB ASN A 74 -20.776 3.787 6.437 1.00 0.00 C ATOM 1127 CG ASN A 74 -21.672 2.563 6.635 1.00 0.00 C ATOM 1128 OD1 ASN A 74 -21.931 1.797 5.721 1.00 0.00 O ATOM 1129 ND2 ASN A 74 -22.131 2.423 7.875 1.00 0.00 N ATOM 0 H ASN A 74 -18.609 4.936 6.062 1.00 0.00 H new ATOM 0 HA ASN A 74 -19.741 2.659 4.925 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -20.072 3.864 7.265 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -21.383 4.692 6.449 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -22.739 1.638 8.108 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -21.875 3.101 8.593 1.00 0.00 H new ATOM 1136 N GLU A 75 -20.939 5.569 3.912 1.00 0.00 N ATOM 1137 CA GLU A 75 -21.752 6.229 2.905 1.00 0.00 C ATOM 1138 C GLU A 75 -21.244 5.885 1.504 1.00 0.00 C ATOM 1139 O GLU A 75 -21.980 5.323 0.694 1.00 0.00 O ATOM 1140 CB GLU A 75 -21.774 7.743 3.125 1.00 0.00 C ATOM 1141 CG GLU A 75 -23.205 8.251 3.305 1.00 0.00 C ATOM 1142 CD GLU A 75 -23.374 9.644 2.695 1.00 0.00 C ATOM 1143 OE1 GLU A 75 -22.772 10.585 3.255 1.00 0.00 O ATOM 1144 OE2 GLU A 75 -24.100 9.736 1.682 1.00 0.00 O ATOM 0 H GLU A 75 -20.411 6.200 4.515 1.00 0.00 H new ATOM 0 HA GLU A 75 -22.776 5.867 2.997 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -21.182 7.995 4.005 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -21.311 8.244 2.275 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -23.902 7.558 2.835 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -23.453 8.282 4.366 1.00 0.00 H new ATOM 1151 N GLU A 76 -19.991 6.238 1.260 1.00 0.00 N ATOM 1152 CA GLU A 76 -19.376 5.973 -0.031 1.00 0.00 C ATOM 1153 C GLU A 76 -19.661 4.536 -0.470 1.00 0.00 C ATOM 1154 O GLU A 76 -19.912 4.281 -1.646 1.00 0.00 O ATOM 1155 CB GLU A 76 -17.871 6.246 0.013 1.00 0.00 C ATOM 1156 CG GLU A 76 -17.385 6.854 -1.303 1.00 0.00 C ATOM 1157 CD GLU A 76 -18.188 8.108 -1.656 1.00 0.00 C ATOM 1158 OE1 GLU A 76 -18.728 8.721 -0.710 1.00 0.00 O ATOM 1159 OE2 GLU A 76 -18.243 8.424 -2.864 1.00 0.00 O ATOM 0 H GLU A 76 -19.384 6.705 1.934 1.00 0.00 H new ATOM 0 HA GLU A 76 -19.813 6.649 -0.766 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -17.645 6.924 0.836 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -17.335 5.317 0.208 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -16.327 7.105 -1.223 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -17.479 6.120 -2.104 1.00 0.00 H new ATOM 1166 N ALA A 77 -19.613 3.635 0.501 1.00 0.00 N ATOM 1167 CA ALA A 77 -19.863 2.228 0.229 1.00 0.00 C ATOM 1168 C ALA A 77 -21.299 2.058 -0.273 1.00 0.00 C ATOM 1169 O ALA A 77 -21.526 1.457 -1.322 1.00 0.00 O ATOM 1170 CB ALA A 77 -19.585 1.407 1.488 1.00 0.00 C ATOM 0 H ALA A 77 -19.405 3.851 1.476 1.00 0.00 H new ATOM 0 HA ALA A 77 -19.195 1.863 -0.551 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -19.772 0.353 1.284 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -18.545 1.539 1.786 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -20.239 1.742 2.293 1.00 0.00 H new ATOM 1176 N ALA A 78 -22.230 2.599 0.499 1.00 0.00 N ATOM 1177 CA ALA A 78 -23.637 2.514 0.146 1.00 0.00 C ATOM 1178 C ALA A 78 -23.833 3.037 -1.278 1.00 0.00 C ATOM 1179 O ALA A 78 -24.474 2.384 -2.100 1.00 0.00 O ATOM 1180 CB ALA A 78 -24.468 3.287 1.173 1.00 0.00 C ATOM 0 H ALA A 78 -22.038 3.098 1.368 1.00 0.00 H new ATOM 0 HA ALA A 78 -23.977 1.479 0.166 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -25.524 3.224 0.909 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -24.315 2.857 2.163 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -24.158 4.332 1.180 1.00 0.00 H new ATOM 1186 N GLU A 79 -23.270 4.211 -1.526 1.00 0.00 N ATOM 1187 CA GLU A 79 -23.375 4.830 -2.836 1.00 0.00 C ATOM 1188 C GLU A 79 -22.770 3.918 -3.904 1.00 0.00 C ATOM 1189 O GLU A 79 -23.296 3.816 -5.010 1.00 0.00 O ATOM 1190 CB GLU A 79 -22.708 6.206 -2.848 1.00 0.00 C ATOM 1191 CG GLU A 79 -23.623 7.254 -3.485 1.00 0.00 C ATOM 1192 CD GLU A 79 -24.829 7.547 -2.590 1.00 0.00 C ATOM 1193 OE1 GLU A 79 -24.625 8.240 -1.571 1.00 0.00 O ATOM 1194 OE2 GLU A 79 -25.929 7.069 -2.945 1.00 0.00 O ATOM 0 H GLU A 79 -22.740 4.750 -0.841 1.00 0.00 H new ATOM 0 HA GLU A 79 -24.431 4.973 -3.064 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -22.463 6.504 -1.829 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -21.769 6.154 -3.400 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -23.063 8.173 -3.659 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -23.965 6.900 -4.458 1.00 0.00 H new ATOM 1201 N TRP A 80 -21.669 3.277 -3.535 1.00 0.00 N ATOM 1202 CA TRP A 80 -20.986 2.376 -4.447 1.00 0.00 C ATOM 1203 C TRP A 80 -21.972 1.280 -4.857 1.00 0.00 C ATOM 1204 O TRP A 80 -22.244 1.095 -6.042 1.00 0.00 O ATOM 1205 CB TRP A 80 -19.706 1.825 -3.817 1.00 0.00 C ATOM 1206 CG TRP A 80 -18.504 1.804 -4.765 1.00 0.00 C ATOM 1207 CD1 TRP A 80 -17.938 0.744 -5.355 1.00 0.00 C ATOM 1208 CD2 TRP A 80 -17.742 2.946 -5.211 1.00 0.00 C ATOM 1209 NE1 TRP A 80 -16.869 1.115 -6.146 1.00 0.00 N ATOM 1210 CE2 TRP A 80 -16.746 2.496 -6.055 1.00 0.00 C ATOM 1211 CE3 TRP A 80 -17.888 4.311 -4.911 1.00 0.00 C ATOM 1212 CZ2 TRP A 80 -15.820 3.349 -6.669 1.00 0.00 C ATOM 1213 CZ3 TRP A 80 -16.955 5.149 -5.532 1.00 0.00 C ATOM 1214 CH2 TRP A 80 -15.946 4.713 -6.384 1.00 0.00 C ATOM 0 H TRP A 80 -21.234 3.365 -2.617 1.00 0.00 H new ATOM 0 HA TRP A 80 -20.664 2.906 -5.343 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -19.456 2.426 -2.943 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -19.895 0.811 -3.463 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -18.275 -0.274 -5.228 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -16.279 0.491 -6.696 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -18.659 4.684 -4.253 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.050 2.974 -7.327 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -17.023 6.209 -5.336 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -15.263 5.424 -6.824 1.00 0.00 H new ATOM 1225 N ASP A 81 -22.480 0.581 -3.852 1.00 0.00 N ATOM 1226 CA ASP A 81 -23.429 -0.493 -4.091 1.00 0.00 C ATOM 1227 C ASP A 81 -24.669 0.074 -4.788 1.00 0.00 C ATOM 1228 O ASP A 81 -25.328 -0.625 -5.556 1.00 0.00 O ATOM 1229 CB ASP A 81 -23.878 -1.135 -2.778 1.00 0.00 C ATOM 1230 CG ASP A 81 -24.223 -2.623 -2.870 1.00 0.00 C ATOM 1231 OD1 ASP A 81 -24.366 -3.102 -4.016 1.00 0.00 O ATOM 1232 OD2 ASP A 81 -24.335 -3.247 -1.793 1.00 0.00 O ATOM 0 H ASP A 81 -22.252 0.738 -2.870 1.00 0.00 H new ATOM 0 HA ASP A 81 -22.938 -1.244 -4.710 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -23.087 -1.006 -2.039 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -24.751 -0.597 -2.408 1.00 0.00 H new ATOM 1237 N ARG A 82 -24.948 1.335 -4.495 1.00 0.00 N ATOM 1238 CA ARG A 82 -26.095 2.004 -5.083 1.00 0.00 C ATOM 1239 C ARG A 82 -25.971 2.030 -6.609 1.00 0.00 C ATOM 1240 O ARG A 82 -26.943 1.776 -7.318 1.00 0.00 O ATOM 1241 CB ARG A 82 -26.222 3.438 -4.565 1.00 0.00 C ATOM 1242 CG ARG A 82 -27.691 3.859 -4.470 1.00 0.00 C ATOM 1243 CD ARG A 82 -27.870 5.320 -4.882 1.00 0.00 C ATOM 1244 NE ARG A 82 -29.180 5.823 -4.409 1.00 0.00 N ATOM 1245 CZ ARG A 82 -29.787 6.914 -4.896 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -29.205 7.625 -5.873 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -30.974 7.295 -4.406 1.00 0.00 N ATOM 0 H ARG A 82 -24.399 1.912 -3.857 1.00 0.00 H new ATOM 0 HA ARG A 82 -26.986 1.446 -4.797 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -25.753 3.517 -3.584 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -25.688 4.117 -5.229 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -28.298 3.220 -5.111 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -28.048 3.719 -3.450 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -27.066 5.926 -4.463 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -27.806 5.411 -5.966 1.00 0.00 H new ATOM 0 HE ARG A 82 -29.650 5.306 -3.666 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -28.301 7.335 -6.245 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -29.667 8.455 -6.244 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -31.416 6.755 -3.662 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -31.436 8.125 -4.777 1.00 0.00 H new ATOM 1545 N SER A 102 -18.869 -2.114 0.422 1.00 0.00 N ATOM 1546 CA SER A 102 -18.959 -2.734 1.733 1.00 0.00 C ATOM 1547 C SER A 102 -17.711 -3.578 2.000 1.00 0.00 C ATOM 1548 O SER A 102 -17.033 -3.387 3.009 1.00 0.00 O ATOM 1549 CB SER A 102 -20.219 -3.597 1.849 1.00 0.00 C ATOM 1550 OG SER A 102 -21.329 -2.856 2.347 1.00 0.00 O ATOM 0 HA SER A 102 -19.022 -1.944 2.481 1.00 0.00 H new ATOM 0 HB2 SER A 102 -20.468 -4.009 0.871 1.00 0.00 H new ATOM 0 HB3 SER A 102 -20.021 -4.441 2.510 1.00 0.00 H new ATOM 0 HG SER A 102 -22.113 -3.441 2.405 1.00 0.00 H new ATOM 1556 N ASP A 103 -17.446 -4.492 1.079 1.00 0.00 N ATOM 1557 CA ASP A 103 -16.293 -5.366 1.203 1.00 0.00 C ATOM 1558 C ASP A 103 -15.021 -4.570 0.902 1.00 0.00 C ATOM 1559 O ASP A 103 -13.953 -4.878 1.427 1.00 0.00 O ATOM 1560 CB ASP A 103 -16.370 -6.526 0.207 1.00 0.00 C ATOM 1561 CG ASP A 103 -17.311 -7.663 0.611 1.00 0.00 C ATOM 1562 OD1 ASP A 103 -18.509 -7.554 0.275 1.00 0.00 O ATOM 1563 OD2 ASP A 103 -16.809 -8.614 1.247 1.00 0.00 O ATOM 0 H ASP A 103 -18.010 -4.646 0.243 1.00 0.00 H new ATOM 0 HA ASP A 103 -16.279 -5.762 2.218 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -16.690 -6.135 -0.759 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -15.369 -6.934 0.070 1.00 0.00 H new ATOM 1568 N ILE A 104 -15.179 -3.559 0.059 1.00 0.00 N ATOM 1569 CA ILE A 104 -14.057 -2.717 -0.317 1.00 0.00 C ATOM 1570 C ILE A 104 -13.365 -2.203 0.946 1.00 0.00 C ATOM 1571 O ILE A 104 -12.167 -1.924 0.932 1.00 0.00 O ATOM 1572 CB ILE A 104 -14.516 -1.605 -1.263 1.00 0.00 C ATOM 1573 CG1 ILE A 104 -14.932 -2.176 -2.620 1.00 0.00 C ATOM 1574 CG2 ILE A 104 -13.442 -0.524 -1.401 1.00 0.00 C ATOM 1575 CD1 ILE A 104 -15.360 -1.062 -3.576 1.00 0.00 C ATOM 0 H ILE A 104 -16.067 -3.305 -0.374 1.00 0.00 H new ATOM 0 HA ILE A 104 -13.318 -3.293 -0.874 1.00 0.00 H new ATOM 0 HB ILE A 104 -15.397 -1.131 -0.830 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -14.102 -2.733 -3.054 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -15.753 -2.880 -2.486 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -13.794 0.254 -2.079 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -13.237 -0.088 -0.423 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -12.529 -0.967 -1.800 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -15.651 -1.495 -4.533 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -16.206 -0.522 -3.150 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -14.529 -0.373 -3.727 1.00 0.00 H new ATOM 1587 N ALA A 105 -14.149 -2.093 2.009 1.00 0.00 N ATOM 1588 CA ALA A 105 -13.626 -1.617 3.278 1.00 0.00 C ATOM 1589 C ALA A 105 -13.048 -2.797 4.063 1.00 0.00 C ATOM 1590 O ALA A 105 -12.181 -2.616 4.915 1.00 0.00 O ATOM 1591 CB ALA A 105 -14.733 -0.893 4.047 1.00 0.00 C ATOM 0 H ALA A 105 -15.142 -2.325 2.017 1.00 0.00 H new ATOM 0 HA ALA A 105 -12.819 -0.902 3.116 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -14.341 -0.536 4.999 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -15.089 -0.046 3.461 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -15.559 -1.581 4.230 1.00 0.00 H new ATOM 1597 N GLY A 106 -13.553 -3.981 3.745 1.00 0.00 N ATOM 1598 CA GLY A 106 -13.098 -5.190 4.409 1.00 0.00 C ATOM 1599 C GLY A 106 -13.890 -5.443 5.692 1.00 0.00 C ATOM 1600 O GLY A 106 -13.388 -6.072 6.622 1.00 0.00 O ATOM 0 H GLY A 106 -14.272 -4.128 3.037 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -13.207 -6.041 3.737 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -12.037 -5.103 4.644 1.00 0.00 H new ATOM 1604 N THR A 107 -15.115 -4.937 5.704 1.00 0.00 N ATOM 1605 CA THR A 107 -15.982 -5.100 6.858 1.00 0.00 C ATOM 1606 C THR A 107 -16.339 -6.574 7.054 1.00 0.00 C ATOM 1607 O THR A 107 -16.416 -7.054 8.184 1.00 0.00 O ATOM 1608 CB THR A 107 -17.203 -4.198 6.664 1.00 0.00 C ATOM 1609 OG1 THR A 107 -16.689 -2.879 6.826 1.00 0.00 O ATOM 1610 CG2 THR A 107 -18.223 -4.343 7.794 1.00 0.00 C ATOM 0 H THR A 107 -15.527 -4.414 4.932 1.00 0.00 H new ATOM 0 HA THR A 107 -15.479 -4.796 7.776 1.00 0.00 H new ATOM 0 HB THR A 107 -17.680 -4.433 5.713 1.00 0.00 H new ATOM 0 HG1 THR A 107 -17.414 -2.229 6.714 1.00 0.00 H new ATOM 0 HG21 THR A 107 -19.069 -3.682 7.607 1.00 0.00 H new ATOM 0 HG22 THR A 107 -18.572 -5.375 7.839 1.00 0.00 H new ATOM 0 HG23 THR A 107 -17.756 -4.076 8.742 1.00 0.00 H new ATOM 1618 N THR A 108 -16.550 -7.252 5.935 1.00 0.00 N ATOM 1619 CA THR A 108 -16.898 -8.662 5.969 1.00 0.00 C ATOM 1620 C THR A 108 -15.814 -9.495 5.283 1.00 0.00 C ATOM 1621 O THR A 108 -15.788 -10.718 5.416 1.00 0.00 O ATOM 1622 CB THR A 108 -18.280 -8.823 5.334 1.00 0.00 C ATOM 1623 OG1 THR A 108 -19.170 -8.254 6.291 1.00 0.00 O ATOM 1624 CG2 THR A 108 -18.717 -10.286 5.244 1.00 0.00 C ATOM 0 H THR A 108 -16.487 -6.851 4.999 1.00 0.00 H new ATOM 0 HA THR A 108 -16.950 -9.032 6.993 1.00 0.00 H new ATOM 0 HB THR A 108 -18.274 -8.384 4.336 1.00 0.00 H new ATOM 0 HG1 THR A 108 -20.090 -8.315 5.959 1.00 0.00 H new ATOM 0 HG21 THR A 108 -19.704 -10.343 4.786 1.00 0.00 H new ATOM 0 HG22 THR A 108 -18.003 -10.842 4.637 1.00 0.00 H new ATOM 0 HG23 THR A 108 -18.756 -10.716 6.245 1.00 0.00 H new ATOM 1632 N SER A 109 -14.943 -8.801 4.565 1.00 0.00 N ATOM 1633 CA SER A 109 -13.859 -9.462 3.858 1.00 0.00 C ATOM 1634 C SER A 109 -12.513 -9.026 4.439 1.00 0.00 C ATOM 1635 O SER A 109 -12.425 -7.996 5.105 1.00 0.00 O ATOM 1636 CB SER A 109 -13.914 -9.158 2.358 1.00 0.00 C ATOM 1637 OG SER A 109 -13.636 -7.789 2.081 1.00 0.00 O ATOM 0 H SER A 109 -14.966 -7.787 4.458 1.00 0.00 H new ATOM 0 HA SER A 109 -13.972 -10.538 3.988 1.00 0.00 H new ATOM 0 HB2 SER A 109 -13.195 -9.787 1.834 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.901 -9.413 1.972 1.00 0.00 H new ATOM 0 HG SER A 109 -14.478 -7.292 2.011 1.00 0.00 H new ATOM 1643 N THR A 110 -11.498 -9.833 4.167 1.00 0.00 N ATOM 1644 CA THR A 110 -10.161 -9.544 4.655 1.00 0.00 C ATOM 1645 C THR A 110 -9.268 -9.060 3.510 1.00 0.00 C ATOM 1646 O THR A 110 -9.722 -8.937 2.373 1.00 0.00 O ATOM 1647 CB THR A 110 -9.630 -10.798 5.350 1.00 0.00 C ATOM 1648 OG1 THR A 110 -9.618 -11.787 4.324 1.00 0.00 O ATOM 1649 CG2 THR A 110 -10.609 -11.351 6.389 1.00 0.00 C ATOM 0 H THR A 110 -11.575 -10.687 3.615 1.00 0.00 H new ATOM 0 HA THR A 110 -10.173 -8.732 5.382 1.00 0.00 H new ATOM 0 HB THR A 110 -8.679 -10.570 5.832 1.00 0.00 H new ATOM 0 HG1 THR A 110 -9.285 -12.633 4.689 1.00 0.00 H new ATOM 0 HG21 THR A 110 -10.183 -12.241 6.853 1.00 0.00 H new ATOM 0 HG22 THR A 110 -10.793 -10.596 7.154 1.00 0.00 H new ATOM 0 HG23 THR A 110 -11.549 -11.610 5.902 1.00 0.00 H new ATOM 1657 N LEU A 111 -8.014 -8.800 3.849 1.00 0.00 N ATOM 1658 CA LEU A 111 -7.054 -8.334 2.863 1.00 0.00 C ATOM 1659 C LEU A 111 -7.007 -9.321 1.697 1.00 0.00 C ATOM 1660 O LEU A 111 -7.153 -8.928 0.540 1.00 0.00 O ATOM 1661 CB LEU A 111 -5.693 -8.088 3.516 1.00 0.00 C ATOM 1662 CG LEU A 111 -4.488 -8.076 2.573 1.00 0.00 C ATOM 1663 CD1 LEU A 111 -4.334 -6.711 1.898 1.00 0.00 C ATOM 1664 CD2 LEU A 111 -3.213 -8.500 3.305 1.00 0.00 C ATOM 0 H LEU A 111 -7.641 -8.903 4.793 1.00 0.00 H new ATOM 0 HA LEU A 111 -7.364 -7.372 2.454 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.730 -7.132 4.038 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -5.530 -8.857 4.271 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.665 -8.808 1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -3.470 -6.729 1.233 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.231 -6.487 1.321 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -4.190 -5.943 2.658 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -2.372 -8.483 2.611 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.019 -7.811 4.127 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.338 -9.509 3.699 1.00 0.00 H new ATOM 1676 N GLN A 112 -6.802 -10.584 2.040 1.00 0.00 N ATOM 1677 CA GLN A 112 -6.733 -11.631 1.034 1.00 0.00 C ATOM 1678 C GLN A 112 -7.880 -11.480 0.032 1.00 0.00 C ATOM 1679 O GLN A 112 -7.663 -11.540 -1.178 1.00 0.00 O ATOM 1680 CB GLN A 112 -6.752 -13.016 1.683 1.00 0.00 C ATOM 1681 CG GLN A 112 -5.461 -13.780 1.381 1.00 0.00 C ATOM 1682 CD GLN A 112 -5.571 -15.241 1.825 1.00 0.00 C ATOM 1683 OE1 GLN A 112 -6.648 -15.770 2.043 1.00 0.00 O ATOM 1684 NE2 GLN A 112 -4.399 -15.859 1.946 1.00 0.00 N ATOM 0 H GLN A 112 -6.681 -10.906 3.000 1.00 0.00 H new ATOM 0 HA GLN A 112 -5.790 -11.530 0.496 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -6.875 -12.915 2.761 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -7.608 -13.582 1.316 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -5.250 -13.736 0.313 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -4.624 -13.303 1.891 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -3.534 -15.356 1.747 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -4.365 -16.836 2.237 1.00 0.00 H new ATOM 1693 N GLU A 113 -9.074 -11.288 0.571 1.00 0.00 N ATOM 1694 CA GLU A 113 -10.254 -11.128 -0.261 1.00 0.00 C ATOM 1695 C GLU A 113 -10.127 -9.874 -1.128 1.00 0.00 C ATOM 1696 O GLU A 113 -10.536 -9.872 -2.288 1.00 0.00 O ATOM 1697 CB GLU A 113 -11.523 -11.078 0.592 1.00 0.00 C ATOM 1698 CG GLU A 113 -12.017 -12.488 0.924 1.00 0.00 C ATOM 1699 CD GLU A 113 -12.362 -13.263 -0.350 1.00 0.00 C ATOM 1700 OE1 GLU A 113 -13.044 -12.665 -1.209 1.00 0.00 O ATOM 1701 OE2 GLU A 113 -11.934 -14.433 -0.435 1.00 0.00 O ATOM 0 H GLU A 113 -9.250 -11.240 1.575 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.331 -11.994 -0.919 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.324 -10.532 1.514 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.302 -10.532 0.060 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -11.250 -13.024 1.483 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.896 -12.427 1.566 1.00 0.00 H new ATOM 1708 N GLN A 114 -9.558 -8.836 -0.532 1.00 0.00 N ATOM 1709 CA GLN A 114 -9.370 -7.579 -1.235 1.00 0.00 C ATOM 1710 C GLN A 114 -8.370 -7.754 -2.380 1.00 0.00 C ATOM 1711 O GLN A 114 -8.533 -7.164 -3.447 1.00 0.00 O ATOM 1712 CB GLN A 114 -8.919 -6.476 -0.276 1.00 0.00 C ATOM 1713 CG GLN A 114 -10.058 -5.494 0.007 1.00 0.00 C ATOM 1714 CD GLN A 114 -10.578 -5.654 1.437 1.00 0.00 C ATOM 1715 OE1 GLN A 114 -11.050 -4.531 1.970 1.00 0.00 O flip ATOM 1716 NE2 GLN A 114 -10.552 -6.727 2.017 1.00 0.00 N flip ATOM 0 H GLN A 114 -9.221 -8.840 0.431 1.00 0.00 H new ATOM 0 HA GLN A 114 -10.327 -7.277 -1.659 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -8.576 -6.920 0.659 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -8.071 -5.941 -0.704 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -9.708 -4.473 -0.144 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -10.871 -5.661 -0.700 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -10.175 -7.551 1.548 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -10.907 -6.800 2.970 1.00 0.00 H new ATOM 1725 N ILE A 115 -7.358 -8.568 -2.118 1.00 0.00 N ATOM 1726 CA ILE A 115 -6.332 -8.829 -3.114 1.00 0.00 C ATOM 1727 C ILE A 115 -6.953 -9.569 -4.299 1.00 0.00 C ATOM 1728 O ILE A 115 -6.630 -9.286 -5.452 1.00 0.00 O ATOM 1729 CB ILE A 115 -5.147 -9.563 -2.482 1.00 0.00 C ATOM 1730 CG1 ILE A 115 -4.612 -8.799 -1.269 1.00 0.00 C ATOM 1731 CG2 ILE A 115 -4.053 -9.832 -3.518 1.00 0.00 C ATOM 1732 CD1 ILE A 115 -4.707 -7.288 -1.487 1.00 0.00 C ATOM 0 H ILE A 115 -7.226 -9.055 -1.232 1.00 0.00 H new ATOM 0 HA ILE A 115 -5.929 -7.893 -3.500 1.00 0.00 H new ATOM 0 HB ILE A 115 -5.497 -10.531 -2.124 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -5.178 -9.078 -0.380 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -3.574 -9.079 -1.087 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -3.223 -10.354 -3.043 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -4.457 -10.447 -4.322 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -3.700 -8.886 -3.928 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -4.320 -6.769 -0.610 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -4.120 -7.009 -2.362 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -5.749 -7.008 -1.644 1.00 0.00 H new ATOM 1744 N GLY A 116 -7.834 -10.505 -3.975 1.00 0.00 N ATOM 1745 CA GLY A 116 -8.503 -11.288 -5.000 1.00 0.00 C ATOM 1746 C GLY A 116 -9.350 -10.395 -5.908 1.00 0.00 C ATOM 1747 O GLY A 116 -9.159 -10.379 -7.123 1.00 0.00 O ATOM 0 H GLY A 116 -8.100 -10.738 -3.018 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.762 -11.821 -5.597 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.137 -12.041 -4.531 1.00 0.00 H new ATOM 1751 N TRP A 117 -10.269 -9.672 -5.283 1.00 0.00 N ATOM 1752 CA TRP A 117 -11.145 -8.778 -6.020 1.00 0.00 C ATOM 1753 C TRP A 117 -10.272 -7.840 -6.855 1.00 0.00 C ATOM 1754 O TRP A 117 -10.539 -7.623 -8.036 1.00 0.00 O ATOM 1755 CB TRP A 117 -12.089 -8.033 -5.074 1.00 0.00 C ATOM 1756 CG TRP A 117 -13.292 -8.860 -4.616 1.00 0.00 C ATOM 1757 CD1 TRP A 117 -14.168 -9.533 -5.374 1.00 0.00 C ATOM 1758 CD2 TRP A 117 -13.718 -9.076 -3.253 1.00 0.00 C ATOM 1759 NE1 TRP A 117 -15.124 -10.163 -4.604 1.00 0.00 N ATOM 1760 CE2 TRP A 117 -14.842 -9.877 -3.274 1.00 0.00 C ATOM 1761 CE3 TRP A 117 -13.173 -8.609 -2.045 1.00 0.00 C ATOM 1762 CZ2 TRP A 117 -15.515 -10.282 -2.116 1.00 0.00 C ATOM 1763 CZ3 TRP A 117 -13.857 -9.022 -0.896 1.00 0.00 C ATOM 1764 CH2 TRP A 117 -14.990 -9.829 -0.899 1.00 0.00 C ATOM 0 H TRP A 117 -10.425 -9.688 -4.275 1.00 0.00 H new ATOM 0 HA TRP A 117 -11.792 -9.341 -6.693 1.00 0.00 H new ATOM 0 HB2 TRP A 117 -11.528 -7.711 -4.197 1.00 0.00 H new ATOM 0 HB3 TRP A 117 -12.449 -7.132 -5.571 1.00 0.00 H new ATOM 0 HD1 TRP A 117 -14.131 -9.577 -6.452 1.00 0.00 H new ATOM 0 HE1 TRP A 117 -15.896 -10.734 -4.948 1.00 0.00 H new ATOM 0 HE3 TRP A 117 -12.295 -7.981 -2.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 -16.392 -10.910 -2.158 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 -13.479 -8.691 0.060 1.00 0.00 H new ATOM 0 HH2 TRP A 117 -15.462 -10.105 0.032 1.00 0.00 H new ATOM 1775 N MET A 118 -9.244 -7.309 -6.208 1.00 0.00 N ATOM 1776 CA MET A 118 -8.329 -6.398 -6.875 1.00 0.00 C ATOM 1777 C MET A 118 -7.470 -7.140 -7.901 1.00 0.00 C ATOM 1778 O MET A 118 -6.885 -6.522 -8.789 1.00 0.00 O ATOM 1779 CB MET A 118 -7.424 -5.732 -5.837 1.00 0.00 C ATOM 1780 CG MET A 118 -6.552 -4.654 -6.483 1.00 0.00 C ATOM 1781 SD MET A 118 -7.121 -3.034 -5.994 1.00 0.00 S ATOM 1782 CE MET A 118 -6.117 -2.777 -4.542 1.00 0.00 C ATOM 0 H MET A 118 -9.025 -7.492 -5.229 1.00 0.00 H new ATOM 0 HA MET A 118 -8.914 -5.641 -7.397 1.00 0.00 H new ATOM 0 HB2 MET A 118 -8.033 -5.289 -5.049 1.00 0.00 H new ATOM 0 HB3 MET A 118 -6.791 -6.483 -5.366 1.00 0.00 H new ATOM 0 HG2 MET A 118 -5.512 -4.789 -6.185 1.00 0.00 H new ATOM 0 HG3 MET A 118 -6.587 -4.748 -7.568 1.00 0.00 H new ATOM 0 HE1 MET A 118 -6.753 -2.481 -3.708 1.00 0.00 H new ATOM 0 HE2 MET A 118 -5.597 -3.701 -4.291 1.00 0.00 H new ATOM 0 HE3 MET A 118 -5.387 -1.992 -4.739 1.00 0.00 H new ATOM 1792 N THR A 119 -7.420 -8.455 -7.744 1.00 0.00 N ATOM 1793 CA THR A 119 -6.642 -9.287 -8.647 1.00 0.00 C ATOM 1794 C THR A 119 -7.567 -10.142 -9.516 1.00 0.00 C ATOM 1795 O THR A 119 -7.147 -11.164 -10.057 1.00 0.00 O ATOM 1796 CB THR A 119 -5.667 -10.112 -7.804 1.00 0.00 C ATOM 1797 OG1 THR A 119 -4.880 -9.135 -7.128 1.00 0.00 O ATOM 1798 CG2 THR A 119 -4.655 -10.877 -8.662 1.00 0.00 C ATOM 0 H THR A 119 -7.905 -8.965 -7.006 1.00 0.00 H new ATOM 0 HA THR A 119 -6.063 -8.681 -9.344 1.00 0.00 H new ATOM 0 HB THR A 119 -6.226 -10.815 -7.186 1.00 0.00 H new ATOM 0 HG1 THR A 119 -5.401 -8.744 -6.396 1.00 0.00 H new ATOM 0 HG21 THR A 119 -3.987 -11.446 -8.016 1.00 0.00 H new ATOM 0 HG22 THR A 119 -5.184 -11.559 -9.327 1.00 0.00 H new ATOM 0 HG23 THR A 119 -4.073 -10.171 -9.254 1.00 0.00 H new ATOM 1806 N HIS A 120 -8.809 -9.692 -9.622 1.00 0.00 N ATOM 1807 CA HIS A 120 -9.796 -10.402 -10.417 1.00 0.00 C ATOM 1808 C HIS A 120 -10.104 -9.605 -11.686 1.00 0.00 C ATOM 1809 O HIS A 120 -9.659 -8.468 -11.833 1.00 0.00 O ATOM 1810 CB HIS A 120 -11.046 -10.703 -9.587 1.00 0.00 C ATOM 1811 CG HIS A 120 -11.813 -11.919 -10.049 1.00 0.00 C ATOM 1812 ND1 HIS A 120 -11.194 -13.038 -10.577 1.00 0.00 N ATOM 1813 CD2 HIS A 120 -13.151 -12.179 -10.058 1.00 0.00 C ATOM 1814 CE1 HIS A 120 -12.128 -13.927 -10.885 1.00 0.00 C ATOM 1815 NE2 HIS A 120 -13.340 -13.392 -10.563 1.00 0.00 N ATOM 0 H HIS A 120 -9.154 -8.845 -9.171 1.00 0.00 H new ATOM 0 HA HIS A 120 -9.394 -11.367 -10.726 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -10.753 -10.845 -8.547 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -11.707 -9.837 -9.617 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -13.926 -11.511 -9.713 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -11.959 -14.903 -11.315 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -14.243 -13.849 -10.689 1.00 0.00 H new ATOM 1824 N ASN A 121 -10.865 -10.233 -12.571 1.00 0.00 N ATOM 1825 CA ASN A 121 -11.238 -9.596 -13.822 1.00 0.00 C ATOM 1826 C ASN A 121 -12.754 -9.396 -13.856 1.00 0.00 C ATOM 1827 O ASN A 121 -13.512 -10.365 -13.838 1.00 0.00 O ATOM 1828 CB ASN A 121 -10.848 -10.465 -15.020 1.00 0.00 C ATOM 1829 CG ASN A 121 -9.498 -10.032 -15.595 1.00 0.00 C ATOM 1830 OD1 ASN A 121 -8.454 -10.190 -14.984 1.00 0.00 O ATOM 1831 ND2 ASN A 121 -9.577 -9.481 -16.803 1.00 0.00 N ATOM 0 H ASN A 121 -11.233 -11.176 -12.446 1.00 0.00 H new ATOM 0 HA ASN A 121 -10.715 -8.642 -13.883 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -10.799 -11.510 -14.715 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -11.615 -10.394 -15.791 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -8.731 -9.161 -17.274 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -10.484 -9.379 -17.259 1.00 0.00 H new ATOM 1838 N PRO A 122 -13.163 -8.100 -13.905 1.00 0.00 N ATOM 1839 CA PRO A 122 -12.200 -7.013 -13.922 1.00 0.00 C ATOM 1840 C PRO A 122 -11.585 -6.802 -12.537 1.00 0.00 C ATOM 1841 O PRO A 122 -12.104 -7.303 -11.541 1.00 0.00 O ATOM 1842 CB PRO A 122 -12.979 -5.805 -14.416 1.00 0.00 C ATOM 1843 CG PRO A 122 -14.447 -6.145 -14.212 1.00 0.00 C ATOM 1844 CD PRO A 122 -14.547 -7.638 -13.945 1.00 0.00 C ATOM 0 HA PRO A 122 -11.349 -7.216 -14.573 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -12.705 -4.909 -13.860 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.766 -5.606 -15.466 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -14.857 -5.579 -13.375 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -15.027 -5.875 -15.094 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -15.059 -7.839 -13.004 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -15.111 -8.144 -14.729 1.00 0.00 H new ATOM 1852 N PRO A 123 -10.457 -6.042 -12.518 1.00 0.00 N ATOM 1853 CA PRO A 123 -9.766 -5.760 -11.272 1.00 0.00 C ATOM 1854 C PRO A 123 -10.524 -4.717 -10.448 1.00 0.00 C ATOM 1855 O PRO A 123 -10.701 -3.582 -10.888 1.00 0.00 O ATOM 1856 CB PRO A 123 -8.380 -5.294 -11.689 1.00 0.00 C ATOM 1857 CG PRO A 123 -8.497 -4.889 -13.149 1.00 0.00 C ATOM 1858 CD PRO A 123 -9.814 -5.433 -13.679 1.00 0.00 C ATOM 0 HA PRO A 123 -9.701 -6.631 -10.620 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -8.050 -4.455 -11.076 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -7.646 -6.090 -11.562 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -8.465 -3.804 -13.248 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -7.661 -5.287 -13.724 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -10.429 -4.639 -14.101 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -9.651 -6.164 -14.470 1.00 0.00 H new ATOM 1866 N ILE A 124 -10.952 -5.140 -9.268 1.00 0.00 N ATOM 1867 CA ILE A 124 -11.687 -4.258 -8.378 1.00 0.00 C ATOM 1868 C ILE A 124 -10.722 -3.245 -7.758 1.00 0.00 C ATOM 1869 O ILE A 124 -9.793 -3.624 -7.047 1.00 0.00 O ATOM 1870 CB ILE A 124 -12.473 -5.070 -7.347 1.00 0.00 C ATOM 1871 CG1 ILE A 124 -13.724 -5.689 -7.974 1.00 0.00 C ATOM 1872 CG2 ILE A 124 -12.808 -4.220 -6.120 1.00 0.00 C ATOM 1873 CD1 ILE A 124 -13.555 -7.198 -8.160 1.00 0.00 C ATOM 0 H ILE A 124 -10.804 -6.083 -8.907 1.00 0.00 H new ATOM 0 HA ILE A 124 -12.431 -3.689 -8.935 1.00 0.00 H new ATOM 0 HB ILE A 124 -11.843 -5.892 -7.007 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -14.588 -5.492 -7.340 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -13.922 -5.220 -8.938 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -13.367 -4.821 -5.403 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -11.885 -3.868 -5.658 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -13.411 -3.364 -6.424 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -14.458 -7.613 -8.607 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -12.705 -7.391 -8.814 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -13.381 -7.667 -7.191 1.00 0.00 H new ATOM 1885 N PRO A 125 -10.982 -1.944 -8.058 1.00 0.00 N ATOM 1886 CA PRO A 125 -10.147 -0.876 -7.538 1.00 0.00 C ATOM 1887 C PRO A 125 -10.433 -0.628 -6.055 1.00 0.00 C ATOM 1888 O PRO A 125 -10.594 0.517 -5.633 1.00 0.00 O ATOM 1889 CB PRO A 125 -10.457 0.328 -8.413 1.00 0.00 C ATOM 1890 CG PRO A 125 -11.785 0.021 -9.086 1.00 0.00 C ATOM 1891 CD PRO A 125 -12.073 -1.459 -8.897 1.00 0.00 C ATOM 0 HA PRO A 125 -9.085 -1.116 -7.577 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -10.522 1.238 -7.817 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -9.672 0.487 -9.152 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -12.582 0.624 -8.650 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -11.742 0.269 -10.147 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.040 -1.616 -8.419 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -12.100 -1.982 -9.853 1.00 0.00 H new ATOM 1899 N VAL A 126 -10.490 -1.718 -5.305 1.00 0.00 N ATOM 1900 CA VAL A 126 -10.755 -1.633 -3.880 1.00 0.00 C ATOM 1901 C VAL A 126 -9.761 -0.663 -3.238 1.00 0.00 C ATOM 1902 O VAL A 126 -10.081 -0.005 -2.248 1.00 0.00 O ATOM 1903 CB VAL A 126 -10.715 -3.029 -3.255 1.00 0.00 C ATOM 1904 CG1 VAL A 126 -9.541 -3.842 -3.804 1.00 0.00 C ATOM 1905 CG2 VAL A 126 -10.658 -2.947 -1.729 1.00 0.00 C ATOM 0 H VAL A 126 -10.357 -2.666 -5.658 1.00 0.00 H new ATOM 0 HA VAL A 126 -11.756 -1.240 -3.701 1.00 0.00 H new ATOM 0 HB VAL A 126 -11.636 -3.543 -3.528 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -9.536 -4.830 -3.343 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -9.644 -3.946 -4.884 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -8.606 -3.330 -3.576 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -10.630 -3.953 -1.311 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -9.762 -2.404 -1.427 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -11.541 -2.425 -1.359 1.00 0.00 H new ATOM 1915 N GLY A 127 -8.575 -0.604 -3.826 1.00 0.00 N ATOM 1916 CA GLY A 127 -7.534 0.275 -3.324 1.00 0.00 C ATOM 1917 C GLY A 127 -7.887 1.742 -3.570 1.00 0.00 C ATOM 1918 O GLY A 127 -8.193 2.477 -2.631 1.00 0.00 O ATOM 0 H GLY A 127 -8.312 -1.151 -4.646 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -7.394 0.105 -2.256 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -6.588 0.039 -3.811 1.00 0.00 H new ATOM 1922 N GLU A 128 -7.837 2.127 -4.837 1.00 0.00 N ATOM 1923 CA GLU A 128 -8.149 3.493 -5.219 1.00 0.00 C ATOM 1924 C GLU A 128 -9.462 3.938 -4.571 1.00 0.00 C ATOM 1925 O GLU A 128 -9.600 5.092 -4.169 1.00 0.00 O ATOM 1926 CB GLU A 128 -8.210 3.638 -6.740 1.00 0.00 C ATOM 1927 CG GLU A 128 -6.973 4.362 -7.273 1.00 0.00 C ATOM 1928 CD GLU A 128 -7.315 5.195 -8.510 1.00 0.00 C ATOM 1929 OE1 GLU A 128 -7.827 6.318 -8.314 1.00 0.00 O ATOM 1930 OE2 GLU A 128 -7.058 4.689 -9.624 1.00 0.00 O ATOM 0 H GLU A 128 -7.585 1.515 -5.613 1.00 0.00 H new ATOM 0 HA GLU A 128 -7.351 4.142 -4.859 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -8.285 2.653 -7.200 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -9.107 4.190 -7.020 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -6.563 5.008 -6.497 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -6.201 3.634 -7.522 1.00 0.00 H new ATOM 1937 N ILE A 129 -10.393 2.999 -4.491 1.00 0.00 N ATOM 1938 CA ILE A 129 -11.690 3.279 -3.900 1.00 0.00 C ATOM 1939 C ILE A 129 -11.501 3.695 -2.440 1.00 0.00 C ATOM 1940 O ILE A 129 -11.798 4.830 -2.071 1.00 0.00 O ATOM 1941 CB ILE A 129 -12.632 2.087 -4.084 1.00 0.00 C ATOM 1942 CG1 ILE A 129 -12.946 1.859 -5.564 1.00 0.00 C ATOM 1943 CG2 ILE A 129 -13.902 2.259 -3.248 1.00 0.00 C ATOM 1944 CD1 ILE A 129 -13.165 0.373 -5.854 1.00 0.00 C ATOM 0 H ILE A 129 -10.275 2.043 -4.826 1.00 0.00 H new ATOM 0 HA ILE A 129 -12.169 4.115 -4.410 1.00 0.00 H new ATOM 0 HB ILE A 129 -12.126 1.192 -3.721 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -13.837 2.423 -5.842 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -12.126 2.236 -6.176 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -14.555 1.399 -3.397 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -13.636 2.335 -2.194 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -14.421 3.166 -3.557 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -13.387 0.238 -6.913 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -12.264 -0.184 -5.598 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -14.001 0.005 -5.259 1.00 0.00 H new ATOM 1956 N TYR A 130 -11.009 2.754 -1.649 1.00 0.00 N ATOM 1957 CA TYR A 130 -10.776 3.008 -0.237 1.00 0.00 C ATOM 1958 C TYR A 130 -10.005 4.314 -0.035 1.00 0.00 C ATOM 1959 O TYR A 130 -10.269 5.054 0.912 1.00 0.00 O ATOM 1960 CB TYR A 130 -9.923 1.842 0.266 1.00 0.00 C ATOM 1961 CG TYR A 130 -10.172 1.475 1.730 1.00 0.00 C ATOM 1962 CD1 TYR A 130 -11.463 1.391 2.211 1.00 0.00 C ATOM 1963 CD2 TYR A 130 -9.106 1.230 2.571 1.00 0.00 C ATOM 1964 CE1 TYR A 130 -11.697 1.045 3.589 1.00 0.00 C ATOM 1965 CE2 TYR A 130 -9.340 0.885 3.950 1.00 0.00 C ATOM 1966 CZ TYR A 130 -10.625 0.810 4.391 1.00 0.00 C ATOM 1967 OH TYR A 130 -10.846 0.484 5.692 1.00 0.00 O ATOM 0 H TYR A 130 -10.765 1.813 -1.959 1.00 0.00 H new ATOM 0 HA TYR A 130 -11.721 3.095 0.299 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -10.118 0.968 -0.355 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -8.870 2.094 0.139 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -12.298 1.585 1.554 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -8.096 1.297 2.195 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -12.702 0.974 3.977 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -8.514 0.690 4.618 1.00 0.00 H new ATOM 0 HH TYR A 130 -9.988 0.343 6.144 1.00 0.00 H new ATOM 1977 N LYS A 131 -9.069 4.556 -0.940 1.00 0.00 N ATOM 1978 CA LYS A 131 -8.257 5.760 -0.873 1.00 0.00 C ATOM 1979 C LYS A 131 -9.167 6.988 -0.955 1.00 0.00 C ATOM 1980 O LYS A 131 -9.024 7.925 -0.172 1.00 0.00 O ATOM 1981 CB LYS A 131 -7.164 5.730 -1.943 1.00 0.00 C ATOM 1982 CG LYS A 131 -6.394 7.052 -1.976 1.00 0.00 C ATOM 1983 CD LYS A 131 -5.984 7.412 -3.406 1.00 0.00 C ATOM 1984 CE LYS A 131 -6.879 8.515 -3.970 1.00 0.00 C ATOM 1985 NZ LYS A 131 -8.274 8.035 -4.102 1.00 0.00 N ATOM 0 H LYS A 131 -8.854 3.940 -1.724 1.00 0.00 H new ATOM 0 HA LYS A 131 -7.733 5.814 0.081 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.476 4.909 -1.742 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -7.610 5.540 -2.919 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -7.012 7.848 -1.560 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -5.507 6.976 -1.348 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -4.945 7.740 -3.419 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -6.047 6.528 -4.040 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -6.848 9.386 -3.316 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -6.504 8.834 -4.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -8.608 8.202 -5.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -8.312 7.017 -3.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -8.883 8.549 -3.433 1.00 0.00 H new ATOM 1999 N ARG A 132 -10.082 6.943 -1.912 1.00 0.00 N ATOM 2000 CA ARG A 132 -11.015 8.040 -2.107 1.00 0.00 C ATOM 2001 C ARG A 132 -11.997 8.117 -0.937 1.00 0.00 C ATOM 2002 O ARG A 132 -12.405 9.205 -0.534 1.00 0.00 O ATOM 2003 CB ARG A 132 -11.798 7.872 -3.411 1.00 0.00 C ATOM 2004 CG ARG A 132 -12.225 9.229 -3.973 1.00 0.00 C ATOM 2005 CD ARG A 132 -12.934 9.066 -5.319 1.00 0.00 C ATOM 2006 NE ARG A 132 -11.963 8.652 -6.355 1.00 0.00 N ATOM 2007 CZ ARG A 132 -12.228 8.634 -7.670 1.00 0.00 C ATOM 2008 NH1 ARG A 132 -13.435 9.008 -8.114 1.00 0.00 N ATOM 2009 NH2 ARG A 132 -11.286 8.242 -8.538 1.00 0.00 N ATOM 0 H ARG A 132 -10.197 6.164 -2.561 1.00 0.00 H new ATOM 0 HA ARG A 132 -10.436 8.962 -2.160 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -11.184 7.348 -4.143 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -12.679 7.255 -3.234 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -12.889 9.727 -3.266 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -11.350 9.868 -4.094 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -13.727 8.323 -5.234 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -13.407 10.005 -5.606 1.00 0.00 H new ATOM 0 HE ARG A 132 -11.034 8.362 -6.051 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -14.152 9.306 -7.452 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -13.637 8.995 -9.114 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -10.367 7.957 -8.199 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -11.488 8.228 -9.538 1.00 0.00 H new ATOM 2023 N TRP A 133 -12.349 6.947 -0.423 1.00 0.00 N ATOM 2024 CA TRP A 133 -13.275 6.868 0.693 1.00 0.00 C ATOM 2025 C TRP A 133 -12.615 7.531 1.904 1.00 0.00 C ATOM 2026 O TRP A 133 -13.076 8.571 2.374 1.00 0.00 O ATOM 2027 CB TRP A 133 -13.692 5.420 0.958 1.00 0.00 C ATOM 2028 CG TRP A 133 -14.575 4.816 -0.136 1.00 0.00 C ATOM 2029 CD1 TRP A 133 -14.831 5.308 -1.355 1.00 0.00 C ATOM 2030 CD2 TRP A 133 -15.312 3.577 -0.060 1.00 0.00 C ATOM 2031 NE1 TRP A 133 -15.676 4.482 -2.068 1.00 0.00 N ATOM 2032 CE2 TRP A 133 -15.977 3.396 -1.254 1.00 0.00 C ATOM 2033 CE3 TRP A 133 -15.413 2.642 0.985 1.00 0.00 C ATOM 2034 CZ2 TRP A 133 -16.791 2.288 -1.518 1.00 0.00 C ATOM 2035 CZ3 TRP A 133 -16.230 1.539 0.706 1.00 0.00 C ATOM 2036 CH2 TRP A 133 -16.907 1.343 -0.492 1.00 0.00 C ATOM 0 H TRP A 133 -12.009 6.046 -0.760 1.00 0.00 H new ATOM 0 HA TRP A 133 -14.199 7.400 0.466 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -12.796 4.809 1.066 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -14.225 5.374 1.907 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -14.427 6.235 -1.733 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -16.017 4.639 -3.017 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -14.901 2.764 1.928 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -17.302 2.169 -2.462 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -16.342 0.789 1.475 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -17.520 0.465 -0.631 1.00 0.00 H new ATOM 2047 N ILE A 134 -11.547 6.904 2.372 1.00 0.00 N ATOM 2048 CA ILE A 134 -10.818 7.421 3.519 1.00 0.00 C ATOM 2049 C ILE A 134 -10.646 8.933 3.368 1.00 0.00 C ATOM 2050 O ILE A 134 -10.909 9.688 4.303 1.00 0.00 O ATOM 2051 CB ILE A 134 -9.500 6.666 3.701 1.00 0.00 C ATOM 2052 CG1 ILE A 134 -9.732 5.312 4.374 1.00 0.00 C ATOM 2053 CG2 ILE A 134 -8.482 7.517 4.461 1.00 0.00 C ATOM 2054 CD1 ILE A 134 -8.403 4.625 4.694 1.00 0.00 C ATOM 0 H ILE A 134 -11.168 6.043 1.979 1.00 0.00 H new ATOM 0 HA ILE A 134 -11.382 7.254 4.437 1.00 0.00 H new ATOM 0 HB ILE A 134 -9.081 6.467 2.715 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -10.304 5.451 5.291 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -10.327 4.674 3.721 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -7.554 6.957 4.577 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.286 8.433 3.904 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -8.880 7.768 5.444 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -8.596 3.664 5.172 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -7.844 4.466 3.772 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -7.821 5.255 5.367 1.00 0.00 H new ATOM 2066 N ILE A 135 -10.206 9.332 2.183 1.00 0.00 N ATOM 2067 CA ILE A 135 -9.995 10.741 1.899 1.00 0.00 C ATOM 2068 C ILE A 135 -11.326 11.485 2.015 1.00 0.00 C ATOM 2069 O ILE A 135 -11.366 12.626 2.476 1.00 0.00 O ATOM 2070 CB ILE A 135 -9.309 10.916 0.543 1.00 0.00 C ATOM 2071 CG1 ILE A 135 -7.787 10.928 0.695 1.00 0.00 C ATOM 2072 CG2 ILE A 135 -9.823 12.167 -0.174 1.00 0.00 C ATOM 2073 CD1 ILE A 135 -7.315 9.767 1.573 1.00 0.00 C ATOM 0 H ILE A 135 -9.990 8.704 1.409 1.00 0.00 H new ATOM 0 HA ILE A 135 -9.319 11.181 2.632 1.00 0.00 H new ATOM 0 HB ILE A 135 -9.563 10.059 -0.081 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -7.319 10.860 -0.287 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -7.469 11.874 1.134 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -9.319 12.268 -1.135 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -10.897 12.079 -0.335 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -9.619 13.046 0.437 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -6.229 9.798 1.665 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -7.766 9.852 2.562 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -7.613 8.822 1.118 1.00 0.00 H new ATOM 2085 N LEU A 136 -12.384 10.810 1.591 1.00 0.00 N ATOM 2086 CA LEU A 136 -13.715 11.394 1.642 1.00 0.00 C ATOM 2087 C LEU A 136 -14.019 11.833 3.076 1.00 0.00 C ATOM 2088 O LEU A 136 -14.476 12.952 3.301 1.00 0.00 O ATOM 2089 CB LEU A 136 -14.747 10.424 1.065 1.00 0.00 C ATOM 2090 CG LEU A 136 -15.704 11.007 0.023 1.00 0.00 C ATOM 2091 CD1 LEU A 136 -16.023 9.978 -1.064 1.00 0.00 C ATOM 2092 CD2 LEU A 136 -16.971 11.552 0.685 1.00 0.00 C ATOM 0 H LEU A 136 -12.347 9.864 1.211 1.00 0.00 H new ATOM 0 HA LEU A 136 -13.765 12.286 1.017 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -14.216 9.586 0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -15.338 10.021 1.888 1.00 0.00 H new ATOM 0 HG LEU A 136 -15.208 11.847 -0.463 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -16.705 10.417 -1.792 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -15.102 9.679 -1.564 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -16.490 9.103 -0.611 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -17.633 11.960 -0.078 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -17.480 10.747 1.214 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -16.703 12.338 1.391 1.00 0.00 H new ATOM 2104 N GLY A 137 -13.753 10.929 4.007 1.00 0.00 N ATOM 2105 CA GLY A 137 -13.993 11.210 5.413 1.00 0.00 C ATOM 2106 C GLY A 137 -13.111 12.362 5.900 1.00 0.00 C ATOM 2107 O GLY A 137 -13.604 13.309 6.511 1.00 0.00 O ATOM 0 H GLY A 137 -13.374 10.002 3.816 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -15.043 11.462 5.563 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -13.792 10.318 6.005 1.00 0.00 H new ATOM 2111 N LEU A 138 -11.824 12.243 5.611 1.00 0.00 N ATOM 2112 CA LEU A 138 -10.870 13.263 6.012 1.00 0.00 C ATOM 2113 C LEU A 138 -11.392 14.638 5.590 1.00 0.00 C ATOM 2114 O LEU A 138 -11.385 15.578 6.384 1.00 0.00 O ATOM 2115 CB LEU A 138 -9.478 12.940 5.465 1.00 0.00 C ATOM 2116 CG LEU A 138 -8.606 12.039 6.341 1.00 0.00 C ATOM 2117 CD1 LEU A 138 -7.276 11.725 5.651 1.00 0.00 C ATOM 2118 CD2 LEU A 138 -8.400 12.655 7.727 1.00 0.00 C ATOM 0 H LEU A 138 -11.419 11.456 5.104 1.00 0.00 H new ATOM 0 HA LEU A 138 -10.765 13.280 7.097 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -9.593 12.465 4.491 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -8.947 13.878 5.301 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.128 11.092 6.483 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.675 11.083 6.295 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.467 11.215 4.707 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.737 12.653 5.459 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.777 11.994 8.330 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.910 13.623 7.626 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -9.366 12.786 8.214 1.00 0.00 H new ATOM 2130 N ASN A 139 -11.834 14.712 4.343 1.00 0.00 N ATOM 2131 CA ASN A 139 -12.358 15.955 3.807 1.00 0.00 C ATOM 2132 C ASN A 139 -13.558 16.401 4.645 1.00 0.00 C ATOM 2133 O ASN A 139 -13.656 17.567 5.024 1.00 0.00 O ATOM 2134 CB ASN A 139 -12.831 15.777 2.363 1.00 0.00 C ATOM 2135 CG ASN A 139 -12.602 17.052 1.549 1.00 0.00 C ATOM 2136 OD1 ASN A 139 -12.825 18.160 2.007 1.00 0.00 O ATOM 2137 ND2 ASN A 139 -12.143 16.834 0.320 1.00 0.00 N ATOM 0 H ASN A 139 -11.840 13.930 3.688 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.560 16.697 3.836 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -12.297 14.946 1.902 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -13.890 15.520 2.353 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -11.956 17.621 -0.302 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -11.978 15.880 -0.001 1.00 0.00 H new ATOM 2144 N LYS A 140 -14.440 15.449 4.911 1.00 0.00 N ATOM 2145 CA LYS A 140 -15.629 15.729 5.698 1.00 0.00 C ATOM 2146 C LYS A 140 -15.213 16.256 7.073 1.00 0.00 C ATOM 2147 O LYS A 140 -15.877 17.128 7.633 1.00 0.00 O ATOM 2148 CB LYS A 140 -16.533 14.496 5.760 1.00 0.00 C ATOM 2149 CG LYS A 140 -18.007 14.891 5.659 1.00 0.00 C ATOM 2150 CD LYS A 140 -18.756 14.551 6.949 1.00 0.00 C ATOM 2151 CE LYS A 140 -20.129 15.224 6.981 1.00 0.00 C ATOM 2152 NZ LYS A 140 -20.985 14.609 8.020 1.00 0.00 N ATOM 0 H LYS A 140 -14.355 14.483 4.596 1.00 0.00 H new ATOM 0 HA LYS A 140 -16.225 16.509 5.224 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -16.279 13.814 4.949 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -16.360 13.960 6.693 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -18.088 15.959 5.458 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -18.469 14.373 4.819 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -18.875 13.471 7.030 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -18.169 14.873 7.810 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -20.014 16.289 7.181 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -20.608 15.132 6.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -21.913 15.078 8.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -21.110 13.598 7.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -20.534 14.719 8.951 1.00 0.00 H new ATOM 2166 N ILE A 141 -14.118 15.707 7.575 1.00 0.00 N ATOM 2167 CA ILE A 141 -13.605 16.112 8.873 1.00 0.00 C ATOM 2168 C ILE A 141 -13.103 17.555 8.792 1.00 0.00 C ATOM 2169 O ILE A 141 -13.443 18.382 9.636 1.00 0.00 O ATOM 2170 CB ILE A 141 -12.550 15.119 9.365 1.00 0.00 C ATOM 2171 CG1 ILE A 141 -13.164 13.738 9.600 1.00 0.00 C ATOM 2172 CG2 ILE A 141 -11.838 15.650 10.612 1.00 0.00 C ATOM 2173 CD1 ILE A 141 -12.129 12.633 9.375 1.00 0.00 C ATOM 0 H ILE A 141 -13.571 14.985 7.107 1.00 0.00 H new ATOM 0 HA ILE A 141 -14.399 16.093 9.619 1.00 0.00 H new ATOM 0 HB ILE A 141 -11.796 15.007 8.586 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -13.552 13.677 10.617 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -14.009 13.592 8.927 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -11.093 14.926 10.942 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -11.347 16.594 10.376 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -12.567 15.809 11.407 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -12.591 11.661 9.548 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -11.761 12.682 8.350 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -11.297 12.768 10.066 1.00 0.00 H new ATOM 2185 N VAL A 142 -12.303 17.812 7.768 1.00 0.00 N ATOM 2186 CA VAL A 142 -11.750 19.139 7.564 1.00 0.00 C ATOM 2187 C VAL A 142 -12.892 20.133 7.339 1.00 0.00 C ATOM 2188 O VAL A 142 -12.778 21.306 7.692 1.00 0.00 O ATOM 2189 CB VAL A 142 -10.741 19.117 6.415 1.00 0.00 C ATOM 2190 CG1 VAL A 142 -10.648 20.487 5.740 1.00 0.00 C ATOM 2191 CG2 VAL A 142 -9.367 18.651 6.900 1.00 0.00 C ATOM 0 H VAL A 142 -12.024 17.122 7.070 1.00 0.00 H new ATOM 0 HA VAL A 142 -11.204 19.465 8.449 1.00 0.00 H new ATOM 0 HB VAL A 142 -11.095 18.401 5.673 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -9.924 20.443 4.927 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -11.624 20.764 5.342 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -10.330 21.231 6.470 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -8.669 18.645 6.063 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -9.003 19.331 7.671 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -9.449 17.645 7.312 1.00 0.00 H new ATOM 2201 N ARG A 143 -13.967 19.627 6.751 1.00 0.00 N ATOM 2202 CA ARG A 143 -15.127 20.456 6.474 1.00 0.00 C ATOM 2203 C ARG A 143 -15.731 20.978 7.779 1.00 0.00 C ATOM 2204 O ARG A 143 -16.161 22.127 7.852 1.00 0.00 O ATOM 2205 CB ARG A 143 -16.192 19.671 5.705 1.00 0.00 C ATOM 2206 CG ARG A 143 -16.037 19.870 4.196 1.00 0.00 C ATOM 2207 CD ARG A 143 -17.320 20.436 3.583 1.00 0.00 C ATOM 2208 NE ARG A 143 -18.271 19.339 3.295 1.00 0.00 N ATOM 2209 CZ ARG A 143 -18.231 18.581 2.191 1.00 0.00 C ATOM 2210 NH1 ARG A 143 -17.288 18.797 1.263 1.00 0.00 N ATOM 2211 NH2 ARG A 143 -19.134 17.607 2.013 1.00 0.00 N ATOM 0 H ARG A 143 -14.058 18.654 6.459 1.00 0.00 H new ATOM 0 HA ARG A 143 -14.797 21.295 5.862 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -16.112 18.611 5.946 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -17.185 19.995 6.018 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -15.206 20.547 3.998 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -15.793 18.919 3.723 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -17.775 21.152 4.268 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -17.087 20.976 2.665 1.00 0.00 H new ATOM 0 HE ARG A 143 -19.002 19.148 3.980 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.601 19.539 1.397 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -17.258 18.220 0.423 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -19.852 17.442 2.718 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -19.103 17.030 1.172 1.00 0.00 H new ATOM 2225 N MET A 144 -15.744 20.107 8.778 1.00 0.00 N ATOM 2226 CA MET A 144 -16.288 20.466 10.077 1.00 0.00 C ATOM 2227 C MET A 144 -15.297 21.321 10.869 1.00 0.00 C ATOM 2228 O MET A 144 -15.681 22.320 11.475 1.00 0.00 O ATOM 2229 CB MET A 144 -16.610 19.194 10.864 1.00 0.00 C ATOM 2230 CG MET A 144 -17.515 19.502 12.058 1.00 0.00 C ATOM 2231 SD MET A 144 -17.807 18.017 13.003 1.00 0.00 S ATOM 2232 CE MET A 144 -16.214 17.828 13.784 1.00 0.00 C ATOM 0 H MET A 144 -15.387 19.154 8.714 1.00 0.00 H new ATOM 0 HA MET A 144 -17.197 21.048 9.922 1.00 0.00 H new ATOM 0 HB2 MET A 144 -17.098 18.471 10.210 1.00 0.00 H new ATOM 0 HB3 MET A 144 -15.685 18.734 11.213 1.00 0.00 H new ATOM 0 HG2 MET A 144 -17.052 20.260 12.690 1.00 0.00 H new ATOM 0 HG3 MET A 144 -18.462 19.913 11.710 1.00 0.00 H new ATOM 0 HE1 MET A 144 -16.154 16.847 14.256 1.00 0.00 H new ATOM 0 HE2 MET A 144 -15.428 17.918 13.034 1.00 0.00 H new ATOM 0 HE3 MET A 144 -16.085 18.603 14.540 1.00 0.00 H new ATOM 2242 N TYR A 145 -14.042 20.897 10.838 1.00 0.00 N ATOM 2243 CA TYR A 145 -12.994 21.612 11.546 1.00 0.00 C ATOM 2244 C TYR A 145 -12.983 23.092 11.159 1.00 0.00 C ATOM 2245 O TYR A 145 -12.990 23.964 12.027 1.00 0.00 O ATOM 2246 CB TYR A 145 -11.676 20.972 11.104 1.00 0.00 C ATOM 2247 CG TYR A 145 -11.089 19.992 12.122 1.00 0.00 C ATOM 2248 CD1 TYR A 145 -11.888 19.015 12.679 1.00 0.00 C ATOM 2249 CD2 TYR A 145 -9.760 20.084 12.482 1.00 0.00 C ATOM 2250 CE1 TYR A 145 -11.336 18.092 13.637 1.00 0.00 C ATOM 2251 CE2 TYR A 145 -9.208 19.162 13.440 1.00 0.00 C ATOM 2252 CZ TYR A 145 -10.024 18.211 13.970 1.00 0.00 C ATOM 2253 OH TYR A 145 -9.501 17.340 14.875 1.00 0.00 O ATOM 0 H TYR A 145 -13.728 20.068 10.334 1.00 0.00 H new ATOM 0 HA TYR A 145 -13.148 21.552 12.623 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -11.836 20.449 10.161 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -10.948 21.760 10.911 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -12.928 18.942 12.397 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -9.134 20.848 12.045 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -11.951 17.323 14.081 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -8.170 19.224 13.731 1.00 0.00 H new ATOM 0 HH TYR A 145 -8.553 17.544 15.015 1.00 0.00 H new