USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1022 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 535 ASN : amide:sc= -0.431 K(o=-0.72,f=-2.7!) USER MOD Set 1.2: A 539 GLN : amide:sc= -0.291 X(o=-0.72,f=-0.8) USER MOD Set 2.1: A 517 SER OG : rot -101:sc= 0.772 USER MOD Set 2.2: A 520 LYS NZ :NH3+ 178:sc= 0.881 (180deg=0) USER MOD Set 3.1: A 430 GLN : amide:sc= 0.922 K(o=2,f=-1.5) USER MOD Set 3.2: A 474 HIS : no HE2:sc= 1.07 K(o=2,f=-5.9!) USER MOD Single : A 398 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0225) USER MOD Single : A 403 SER OG : rot 180:sc= 0 USER MOD Single : A 426 SER OG : rot 30:sc= 0.0484 USER MOD Single : A 429 CYS SG : rot -18:sc= -0.226 USER MOD Single : A 432 TYR OH : rot 180:sc= 0 USER MOD Single : A 434 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 435 HIS : no HD1:sc= -1.4 X(o=-1.4,f=-1.4) USER MOD Single : A 438 ASN : amide:sc= -0.664 K(o=-0.66,f=0) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 THR OG1 : rot -171:sc= 0.778 USER MOD Single : A 443 GLN : amide:sc= -0.171 X(o=-0.17,f=0.07) USER MOD Single : A 446 GLN : amide:sc= -0.936 K(o=-0.94,f=-0.35) USER MOD Single : A 447 LYS NZ :NH3+ 157:sc= 1.3 (180deg=1.14) USER MOD Single : A 450 MET CE :methyl 170:sc= -0.189 (180deg=-0.461) USER MOD Single : A 451 GLN : amide:sc= -1.59! C(o=-1.6!,f=-6.1!) USER MOD Single : A 455 GLN : amide:sc= -0.513 K(o=-0.51,f=-1.3) USER MOD Single : A 456 GLN : amide:sc= -0.0778 K(o=-0.078,f=-0.59) USER MOD Single : A 459 THR OG1 : rot -78:sc= 1.22 USER MOD Single : A 460 THR OG1 : rot 180:sc= 0 USER MOD Single : A 467 ASN : amide:sc= -0.972 K(o=-0.97,f=-0.041) USER MOD Single : A 468 SER OG : rot 0:sc= 0.525 USER MOD Single : A 470 MET CE :methyl -151:sc= -0.313 (180deg=-1.21) USER MOD Single : A 472 GLN : amide:sc= -1.91 K(o=-1.9,f=-0.55) USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 484 LYS NZ :NH3+ -160:sc= 1.24 (180deg=1.14) USER MOD Single : A 487 TYR OH : rot 180:sc= 0 USER MOD Single : A 490 MET CE :methyl -113:sc= 0 (180deg=-0.0757) USER MOD Single : A 492 ASN : amide:sc= -0.0658 X(o=-0.066,f=-0.012) USER MOD Single : A 497 CYS SG : rot -41:sc= 1.26 USER MOD Single : A 499 HIS : no HE2:sc= -2.25! C(o=-2.3!,f=-3!) USER MOD Single : A 512 MET CE :methyl -119:sc= -0.0887 (180deg=-1.42) USER MOD Single : A 515 TYR OH : rot 180:sc=-0.00443 USER MOD Single : A 516 SER OG : rot 180:sc= -0.198 USER MOD Single : A 518 LYS NZ :NH3+ -171:sc=-0.00958 (180deg=-0.158) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 523 MET CE :methyl 165:sc= -0.0696 (180deg=-0.391) USER MOD Single : A 528 TYR OH : rot 180:sc= 0.155 USER MOD Single : A 530 GLN : amide:sc= -0.249 K(o=-0.25,f=-0.84) USER MOD Single : A 531 SER OG : rot 59:sc= 1.31 USER MOD Single : A 542 THR OG1 : rot 180:sc= 0 USER MOD Single : A 543 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 72 N LYS A 398 18.465 2.618 3.423 1.00 0.00 N ATOM 73 CA LYS A 398 17.432 2.344 2.495 1.00 0.00 C ATOM 74 C LYS A 398 18.078 1.932 1.175 1.00 0.00 C ATOM 75 O LYS A 398 19.110 2.488 0.775 1.00 0.00 O ATOM 76 CB LYS A 398 16.458 3.560 2.379 1.00 0.00 C ATOM 77 CG LYS A 398 17.124 4.918 2.119 1.00 0.00 C ATOM 78 CD LYS A 398 17.533 5.104 0.670 1.00 0.00 C ATOM 79 CE LYS A 398 18.550 6.211 0.519 1.00 0.00 C ATOM 80 NZ LYS A 398 18.068 7.514 1.030 1.00 0.00 N ATOM 0 HA LYS A 398 16.807 1.516 2.829 1.00 0.00 H new ATOM 0 HB2 LYS A 398 15.751 3.361 1.573 1.00 0.00 H new ATOM 0 HB3 LYS A 398 15.880 3.629 3.300 1.00 0.00 H new ATOM 0 HG2 LYS A 398 16.437 5.715 2.403 1.00 0.00 H new ATOM 0 HG3 LYS A 398 18.004 5.014 2.755 1.00 0.00 H new ATOM 0 HD2 LYS A 398 17.948 4.172 0.286 1.00 0.00 H new ATOM 0 HD3 LYS A 398 16.653 5.333 0.069 1.00 0.00 H new ATOM 0 HE2 LYS A 398 19.461 5.934 1.049 1.00 0.00 H new ATOM 0 HE3 LYS A 398 18.812 6.315 -0.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 398 18.765 8.253 0.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 398 17.160 7.749 0.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 398 17.940 7.457 2.061 1.00 0.00 H new ATOM 94 N LEU A 399 17.552 0.926 0.569 1.00 0.00 N ATOM 95 CA LEU A 399 18.075 0.427 -0.669 1.00 0.00 C ATOM 96 C LEU A 399 17.052 0.694 -1.765 1.00 0.00 C ATOM 97 O LEU A 399 15.868 0.529 -1.533 1.00 0.00 O ATOM 98 CB LEU A 399 18.393 -1.095 -0.565 1.00 0.00 C ATOM 99 CG LEU A 399 19.303 -1.570 0.598 1.00 0.00 C ATOM 100 CD1 LEU A 399 18.528 -1.751 1.888 1.00 0.00 C ATOM 101 CD2 LEU A 399 20.045 -2.839 0.235 1.00 0.00 C ATOM 0 H LEU A 399 16.739 0.417 0.916 1.00 0.00 H new ATOM 0 HA LEU A 399 19.010 0.936 -0.905 1.00 0.00 H new ATOM 0 HB2 LEU A 399 17.446 -1.630 -0.488 1.00 0.00 H new ATOM 0 HB3 LEU A 399 18.858 -1.404 -1.501 1.00 0.00 H new ATOM 0 HG LEU A 399 20.038 -0.783 0.765 1.00 0.00 H new ATOM 0 HD11 LEU A 399 19.204 -2.084 2.675 1.00 0.00 H new ATOM 0 HD12 LEU A 399 18.075 -0.803 2.176 1.00 0.00 H new ATOM 0 HD13 LEU A 399 17.747 -2.497 1.741 1.00 0.00 H new ATOM 0 HD21 LEU A 399 20.674 -3.145 1.071 1.00 0.00 H new ATOM 0 HD22 LEU A 399 19.328 -3.629 0.012 1.00 0.00 H new ATOM 0 HD23 LEU A 399 20.669 -2.658 -0.640 1.00 0.00 H new ATOM 113 N LEU A 400 17.496 1.147 -2.929 1.00 0.00 N ATOM 114 CA LEU A 400 16.585 1.448 -4.044 1.00 0.00 C ATOM 115 C LEU A 400 15.880 0.175 -4.472 1.00 0.00 C ATOM 116 O LEU A 400 16.531 -0.842 -4.761 1.00 0.00 O ATOM 117 CB LEU A 400 17.365 2.120 -5.220 1.00 0.00 C ATOM 118 CG LEU A 400 16.581 2.631 -6.482 1.00 0.00 C ATOM 119 CD1 LEU A 400 16.083 1.501 -7.377 1.00 0.00 C ATOM 120 CD2 LEU A 400 15.421 3.532 -6.081 1.00 0.00 C ATOM 0 H LEU A 400 18.481 1.317 -3.134 1.00 0.00 H new ATOM 0 HA LEU A 400 15.826 2.161 -3.723 1.00 0.00 H new ATOM 0 HB2 LEU A 400 17.907 2.971 -4.807 1.00 0.00 H new ATOM 0 HB3 LEU A 400 18.110 1.405 -5.567 1.00 0.00 H new ATOM 0 HG LEU A 400 17.298 3.208 -7.066 1.00 0.00 H new ATOM 0 HD11 LEU A 400 15.550 1.921 -8.230 1.00 0.00 H new ATOM 0 HD12 LEU A 400 16.932 0.916 -7.731 1.00 0.00 H new ATOM 0 HD13 LEU A 400 15.411 0.857 -6.810 1.00 0.00 H new ATOM 0 HD21 LEU A 400 14.897 3.870 -6.975 1.00 0.00 H new ATOM 0 HD22 LEU A 400 14.732 2.977 -5.445 1.00 0.00 H new ATOM 0 HD23 LEU A 400 15.802 4.395 -5.536 1.00 0.00 H new ATOM 132 N ALA A 401 14.574 0.214 -4.486 1.00 0.00 N ATOM 133 CA ALA A 401 13.809 -0.941 -4.830 1.00 0.00 C ATOM 134 C ALA A 401 13.091 -0.774 -6.141 1.00 0.00 C ATOM 135 O ALA A 401 13.419 -1.446 -7.112 1.00 0.00 O ATOM 136 CB ALA A 401 12.821 -1.271 -3.734 1.00 0.00 C ATOM 0 H ALA A 401 14.021 1.041 -4.261 1.00 0.00 H new ATOM 0 HA ALA A 401 14.510 -1.768 -4.941 1.00 0.00 H new ATOM 0 HB1 ALA A 401 12.247 -2.154 -4.015 1.00 0.00 H new ATOM 0 HB2 ALA A 401 13.359 -1.467 -2.806 1.00 0.00 H new ATOM 0 HB3 ALA A 401 12.144 -0.429 -3.589 1.00 0.00 H new ATOM 142 N TRP A 402 12.164 0.158 -6.189 1.00 0.00 N ATOM 143 CA TRP A 402 11.268 0.272 -7.300 1.00 0.00 C ATOM 144 C TRP A 402 10.655 1.651 -7.290 1.00 0.00 C ATOM 145 O TRP A 402 10.579 2.288 -6.259 1.00 0.00 O ATOM 146 CB TRP A 402 10.188 -0.827 -7.161 1.00 0.00 C ATOM 147 CG TRP A 402 9.075 -0.799 -8.165 1.00 0.00 C ATOM 148 CD1 TRP A 402 9.120 -1.195 -9.467 1.00 0.00 C ATOM 149 CD2 TRP A 402 7.731 -0.384 -7.916 1.00 0.00 C ATOM 150 NE1 TRP A 402 7.886 -1.031 -10.045 1.00 0.00 N ATOM 151 CE2 TRP A 402 7.018 -0.535 -9.108 1.00 0.00 C ATOM 152 CE3 TRP A 402 7.068 0.110 -6.793 1.00 0.00 C ATOM 153 CZ2 TRP A 402 5.670 -0.216 -9.211 1.00 0.00 C ATOM 154 CZ3 TRP A 402 5.732 0.426 -6.892 1.00 0.00 C ATOM 155 CH2 TRP A 402 5.044 0.263 -8.095 1.00 0.00 C ATOM 0 H TRP A 402 12.017 0.853 -5.457 1.00 0.00 H new ATOM 0 HA TRP A 402 11.788 0.137 -8.248 1.00 0.00 H new ATOM 0 HB2 TRP A 402 10.679 -1.798 -7.222 1.00 0.00 H new ATOM 0 HB3 TRP A 402 9.751 -0.753 -6.165 1.00 0.00 H new ATOM 0 HD1 TRP A 402 9.995 -1.580 -9.969 1.00 0.00 H new ATOM 0 HE1 TRP A 402 7.653 -1.244 -11.015 1.00 0.00 H new ATOM 0 HE3 TRP A 402 7.595 0.243 -5.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 402 5.135 -0.342 -10.141 1.00 0.00 H new ATOM 0 HZ3 TRP A 402 5.209 0.805 -6.027 1.00 0.00 H new ATOM 0 HH2 TRP A 402 3.996 0.520 -8.145 1.00 0.00 H new ATOM 166 N SER A 403 10.329 2.149 -8.419 1.00 0.00 N ATOM 167 CA SER A 403 9.664 3.402 -8.512 1.00 0.00 C ATOM 168 C SER A 403 8.449 3.207 -9.405 1.00 0.00 C ATOM 169 O SER A 403 8.583 2.833 -10.573 1.00 0.00 O ATOM 170 CB SER A 403 10.631 4.431 -9.068 1.00 0.00 C ATOM 171 OG SER A 403 11.840 4.427 -8.301 1.00 0.00 O ATOM 0 H SER A 403 10.514 1.701 -9.316 1.00 0.00 H new ATOM 0 HA SER A 403 9.329 3.765 -7.540 1.00 0.00 H new ATOM 0 HB2 SER A 403 10.852 4.209 -10.112 1.00 0.00 H new ATOM 0 HB3 SER A 403 10.177 5.421 -9.042 1.00 0.00 H new ATOM 0 HG SER A 403 12.461 5.092 -8.665 1.00 0.00 H new ATOM 177 N GLY A 404 7.280 3.417 -8.857 1.00 0.00 N ATOM 178 CA GLY A 404 6.094 3.139 -9.594 1.00 0.00 C ATOM 179 C GLY A 404 4.920 3.932 -9.135 1.00 0.00 C ATOM 180 O GLY A 404 5.048 4.823 -8.286 1.00 0.00 O ATOM 0 H GLY A 404 7.133 3.776 -7.913 1.00 0.00 H new ATOM 0 HA2 GLY A 404 6.273 3.344 -10.649 1.00 0.00 H new ATOM 0 HA3 GLY A 404 5.862 2.077 -9.511 1.00 0.00 H new ATOM 184 N VAL A 405 3.782 3.605 -9.670 1.00 0.00 N ATOM 185 CA VAL A 405 2.573 4.316 -9.402 1.00 0.00 C ATOM 186 C VAL A 405 1.653 3.451 -8.551 1.00 0.00 C ATOM 187 O VAL A 405 1.559 2.233 -8.752 1.00 0.00 O ATOM 188 CB VAL A 405 1.862 4.696 -10.743 1.00 0.00 C ATOM 189 CG1 VAL A 405 0.586 5.489 -10.511 1.00 0.00 C ATOM 190 CG2 VAL A 405 2.805 5.466 -11.660 1.00 0.00 C ATOM 0 H VAL A 405 3.668 2.823 -10.315 1.00 0.00 H new ATOM 0 HA VAL A 405 2.809 5.232 -8.861 1.00 0.00 H new ATOM 0 HB VAL A 405 1.583 3.761 -11.229 1.00 0.00 H new ATOM 0 HG11 VAL A 405 0.128 5.730 -11.470 1.00 0.00 H new ATOM 0 HG12 VAL A 405 -0.108 4.895 -9.916 1.00 0.00 H new ATOM 0 HG13 VAL A 405 0.822 6.411 -9.980 1.00 0.00 H new ATOM 0 HG21 VAL A 405 2.287 5.718 -12.585 1.00 0.00 H new ATOM 0 HG22 VAL A 405 3.128 6.381 -11.164 1.00 0.00 H new ATOM 0 HG23 VAL A 405 3.675 4.850 -11.888 1.00 0.00 H new ATOM 200 N LEU A 406 0.992 4.068 -7.618 1.00 0.00 N ATOM 201 CA LEU A 406 0.034 3.392 -6.796 1.00 0.00 C ATOM 202 C LEU A 406 -1.298 3.965 -7.140 1.00 0.00 C ATOM 203 O LEU A 406 -1.462 5.196 -7.184 1.00 0.00 O ATOM 204 CB LEU A 406 0.311 3.619 -5.307 1.00 0.00 C ATOM 205 CG LEU A 406 1.663 3.156 -4.769 1.00 0.00 C ATOM 206 CD1 LEU A 406 1.751 3.448 -3.289 1.00 0.00 C ATOM 207 CD2 LEU A 406 1.886 1.677 -5.030 1.00 0.00 C ATOM 0 H LEU A 406 1.103 5.059 -7.405 1.00 0.00 H new ATOM 0 HA LEU A 406 0.081 2.318 -6.975 1.00 0.00 H new ATOM 0 HB2 LEU A 406 0.214 4.686 -5.104 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -0.470 3.114 -4.738 1.00 0.00 H new ATOM 0 HG LEU A 406 2.445 3.705 -5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 406 2.717 3.116 -2.909 1.00 0.00 H new ATOM 0 HD12 LEU A 406 1.645 4.520 -3.123 1.00 0.00 H new ATOM 0 HD13 LEU A 406 0.954 2.919 -2.766 1.00 0.00 H new ATOM 0 HD21 LEU A 406 2.857 1.380 -4.635 1.00 0.00 H new ATOM 0 HD22 LEU A 406 1.103 1.099 -4.540 1.00 0.00 H new ATOM 0 HD23 LEU A 406 1.858 1.489 -6.103 1.00 0.00 H new ATOM 219 N GLU A 407 -2.219 3.125 -7.438 1.00 0.00 N ATOM 220 CA GLU A 407 -3.497 3.569 -7.836 1.00 0.00 C ATOM 221 C GLU A 407 -4.509 3.075 -6.805 1.00 0.00 C ATOM 222 O GLU A 407 -4.549 1.884 -6.475 1.00 0.00 O ATOM 223 CB GLU A 407 -3.759 3.076 -9.276 1.00 0.00 C ATOM 224 CG GLU A 407 -4.872 3.792 -10.008 1.00 0.00 C ATOM 225 CD GLU A 407 -4.900 3.488 -11.492 1.00 0.00 C ATOM 226 OE1 GLU A 407 -4.383 4.303 -12.295 1.00 0.00 O ATOM 227 OE2 GLU A 407 -5.432 2.450 -11.892 1.00 0.00 O ATOM 0 H GLU A 407 -2.106 2.112 -7.412 1.00 0.00 H new ATOM 0 HA GLU A 407 -3.581 4.655 -7.864 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -2.840 3.182 -9.852 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -3.993 2.012 -9.242 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -5.828 3.510 -9.568 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -4.760 4.867 -9.866 1.00 0.00 H new ATOM 234 N TRP A 408 -5.277 3.994 -6.276 1.00 0.00 N ATOM 235 CA TRP A 408 -6.209 3.730 -5.200 1.00 0.00 C ATOM 236 C TRP A 408 -7.586 4.215 -5.577 1.00 0.00 C ATOM 237 O TRP A 408 -7.724 5.204 -6.295 1.00 0.00 O ATOM 238 CB TRP A 408 -5.728 4.390 -3.885 1.00 0.00 C ATOM 239 CG TRP A 408 -5.482 5.877 -3.967 1.00 0.00 C ATOM 240 CD1 TRP A 408 -4.347 6.495 -4.409 1.00 0.00 C ATOM 241 CD2 TRP A 408 -6.381 6.927 -3.576 1.00 0.00 C ATOM 242 NE1 TRP A 408 -4.489 7.853 -4.330 1.00 0.00 N ATOM 243 CE2 TRP A 408 -5.724 8.147 -3.819 1.00 0.00 C ATOM 244 CE3 TRP A 408 -7.678 6.952 -3.047 1.00 0.00 C ATOM 245 CZ2 TRP A 408 -6.317 9.381 -3.554 1.00 0.00 C ATOM 246 CZ3 TRP A 408 -8.264 8.175 -2.783 1.00 0.00 C ATOM 247 CH2 TRP A 408 -7.583 9.374 -3.037 1.00 0.00 C ATOM 0 H TRP A 408 -5.275 4.966 -6.585 1.00 0.00 H new ATOM 0 HA TRP A 408 -6.257 2.654 -5.034 1.00 0.00 H new ATOM 0 HB2 TRP A 408 -6.471 4.203 -3.110 1.00 0.00 H new ATOM 0 HB3 TRP A 408 -4.806 3.902 -3.568 1.00 0.00 H new ATOM 0 HD1 TRP A 408 -3.465 5.985 -4.769 1.00 0.00 H new ATOM 0 HE1 TRP A 408 -3.786 8.538 -4.608 1.00 0.00 H new ATOM 0 HE3 TRP A 408 -8.210 6.033 -2.849 1.00 0.00 H new ATOM 0 HZ2 TRP A 408 -5.796 10.307 -3.750 1.00 0.00 H new ATOM 0 HZ3 TRP A 408 -9.263 8.208 -2.374 1.00 0.00 H new ATOM 0 HH2 TRP A 408 -8.069 10.313 -2.819 1.00 0.00 H new ATOM 504 N ARG A 425 -7.719 6.819 -8.431 1.00 0.00 N ATOM 505 CA ARG A 425 -6.718 7.850 -8.560 1.00 0.00 C ATOM 506 C ARG A 425 -5.350 7.221 -8.548 1.00 0.00 C ATOM 507 O ARG A 425 -5.126 6.251 -7.843 1.00 0.00 O ATOM 508 CB ARG A 425 -6.851 8.831 -7.402 1.00 0.00 C ATOM 509 CG ARG A 425 -8.246 9.411 -7.256 1.00 0.00 C ATOM 510 CD ARG A 425 -8.647 10.238 -8.463 1.00 0.00 C ATOM 511 NE ARG A 425 -9.984 10.798 -8.304 1.00 0.00 N ATOM 512 CZ ARG A 425 -10.455 11.878 -8.915 1.00 0.00 C ATOM 513 NH1 ARG A 425 -9.719 12.539 -9.814 1.00 0.00 N ATOM 514 NH2 ARG A 425 -11.674 12.290 -8.620 1.00 0.00 N ATOM 0 HA ARG A 425 -6.858 8.385 -9.499 1.00 0.00 H new ATOM 0 HB2 ARG A 425 -6.577 8.326 -6.476 1.00 0.00 H new ATOM 0 HB3 ARG A 425 -6.141 9.646 -7.543 1.00 0.00 H new ATOM 0 HG2 ARG A 425 -8.962 8.601 -7.117 1.00 0.00 H new ATOM 0 HG3 ARG A 425 -8.289 10.032 -6.361 1.00 0.00 H new ATOM 0 HD2 ARG A 425 -7.928 11.044 -8.609 1.00 0.00 H new ATOM 0 HD3 ARG A 425 -8.615 9.617 -9.358 1.00 0.00 H new ATOM 0 HE ARG A 425 -10.615 10.315 -7.664 1.00 0.00 H new ATOM 0 HH11 ARG A 425 -8.779 12.215 -10.041 1.00 0.00 H new ATOM 0 HH12 ARG A 425 -10.098 13.367 -10.274 1.00 0.00 H new ATOM 0 HH21 ARG A 425 -12.233 11.781 -7.935 1.00 0.00 H new ATOM 0 HH22 ARG A 425 -12.057 13.118 -9.077 1.00 0.00 H new ATOM 528 N SER A 426 -4.439 7.781 -9.284 1.00 0.00 N ATOM 529 CA SER A 426 -3.129 7.214 -9.400 1.00 0.00 C ATOM 530 C SER A 426 -2.064 8.220 -8.985 1.00 0.00 C ATOM 531 O SER A 426 -2.084 9.368 -9.447 1.00 0.00 O ATOM 532 CB SER A 426 -2.934 6.758 -10.842 1.00 0.00 C ATOM 533 OG SER A 426 -3.163 7.840 -11.763 1.00 0.00 O ATOM 0 H SER A 426 -4.580 8.638 -9.818 1.00 0.00 H new ATOM 0 HA SER A 426 -3.030 6.359 -8.732 1.00 0.00 H new ATOM 0 HB2 SER A 426 -1.922 6.374 -10.972 1.00 0.00 H new ATOM 0 HB3 SER A 426 -3.617 5.938 -11.063 1.00 0.00 H new ATOM 0 HG SER A 426 -2.932 8.690 -11.333 1.00 0.00 H new ATOM 539 N LEU A 427 -1.162 7.807 -8.120 1.00 0.00 N ATOM 540 CA LEU A 427 -0.093 8.667 -7.652 1.00 0.00 C ATOM 541 C LEU A 427 1.264 7.967 -7.759 1.00 0.00 C ATOM 542 O LEU A 427 1.419 6.837 -7.286 1.00 0.00 O ATOM 543 CB LEU A 427 -0.348 9.128 -6.209 1.00 0.00 C ATOM 544 CG LEU A 427 -1.551 10.058 -6.003 1.00 0.00 C ATOM 545 CD1 LEU A 427 -1.729 10.377 -4.535 1.00 0.00 C ATOM 546 CD2 LEU A 427 -1.370 11.344 -6.796 1.00 0.00 C ATOM 0 H LEU A 427 -1.148 6.868 -7.722 1.00 0.00 H new ATOM 0 HA LEU A 427 -0.073 9.548 -8.294 1.00 0.00 H new ATOM 0 HB2 LEU A 427 -0.486 8.245 -5.585 1.00 0.00 H new ATOM 0 HB3 LEU A 427 0.546 9.637 -5.848 1.00 0.00 H new ATOM 0 HG LEU A 427 -2.444 9.546 -6.361 1.00 0.00 H new ATOM 0 HD11 LEU A 427 -2.587 11.038 -4.408 1.00 0.00 H new ATOM 0 HD12 LEU A 427 -1.896 9.454 -3.980 1.00 0.00 H new ATOM 0 HD13 LEU A 427 -0.833 10.870 -4.158 1.00 0.00 H new ATOM 0 HD21 LEU A 427 -2.232 11.993 -6.639 1.00 0.00 H new ATOM 0 HD22 LEU A 427 -0.466 11.854 -6.461 1.00 0.00 H new ATOM 0 HD23 LEU A 427 -1.282 11.108 -7.857 1.00 0.00 H new ATOM 558 N PRO A 428 2.244 8.594 -8.433 1.00 0.00 N ATOM 559 CA PRO A 428 3.601 8.051 -8.561 1.00 0.00 C ATOM 560 C PRO A 428 4.415 8.217 -7.272 1.00 0.00 C ATOM 561 O PRO A 428 4.328 9.252 -6.575 1.00 0.00 O ATOM 562 CB PRO A 428 4.222 8.881 -9.698 1.00 0.00 C ATOM 563 CG PRO A 428 3.085 9.657 -10.274 1.00 0.00 C ATOM 564 CD PRO A 428 2.120 9.856 -9.163 1.00 0.00 C ATOM 0 HA PRO A 428 3.591 6.979 -8.760 1.00 0.00 H new ATOM 0 HB2 PRO A 428 5.002 9.543 -9.323 1.00 0.00 H new ATOM 0 HB3 PRO A 428 4.683 8.239 -10.449 1.00 0.00 H new ATOM 0 HG2 PRO A 428 3.426 10.613 -10.670 1.00 0.00 H new ATOM 0 HG3 PRO A 428 2.623 9.117 -11.100 1.00 0.00 H new ATOM 0 HD2 PRO A 428 2.380 10.714 -8.544 1.00 0.00 H new ATOM 0 HD3 PRO A 428 1.106 10.021 -9.526 1.00 0.00 H new ATOM 572 N CYS A 429 5.210 7.228 -6.971 1.00 0.00 N ATOM 573 CA CYS A 429 5.980 7.205 -5.761 1.00 0.00 C ATOM 574 C CYS A 429 7.371 6.626 -6.003 1.00 0.00 C ATOM 575 O CYS A 429 7.657 6.071 -7.078 1.00 0.00 O ATOM 576 CB CYS A 429 5.238 6.394 -4.694 1.00 0.00 C ATOM 577 SG CYS A 429 4.833 4.709 -5.207 1.00 0.00 S ATOM 0 H CYS A 429 5.342 6.409 -7.564 1.00 0.00 H new ATOM 0 HA CYS A 429 6.106 8.229 -5.410 1.00 0.00 H new ATOM 0 HB2 CYS A 429 5.850 6.352 -3.793 1.00 0.00 H new ATOM 0 HB3 CYS A 429 4.317 6.915 -4.431 1.00 0.00 H new ATOM 0 HG CYS A 429 4.908 4.620 -6.502 1.00 0.00 H new ATOM 583 N GLN A 430 8.213 6.780 -5.022 1.00 0.00 N ATOM 584 CA GLN A 430 9.548 6.253 -5.003 1.00 0.00 C ATOM 585 C GLN A 430 9.557 5.255 -3.869 1.00 0.00 C ATOM 586 O GLN A 430 9.096 5.581 -2.755 1.00 0.00 O ATOM 587 CB GLN A 430 10.547 7.365 -4.649 1.00 0.00 C ATOM 588 CG GLN A 430 10.550 8.573 -5.573 1.00 0.00 C ATOM 589 CD GLN A 430 11.424 9.693 -5.030 1.00 0.00 C ATOM 590 OE1 GLN A 430 10.952 10.565 -4.293 1.00 0.00 O ATOM 591 NE2 GLN A 430 12.686 9.681 -5.372 1.00 0.00 N ATOM 0 H GLN A 430 7.978 7.299 -4.176 1.00 0.00 H new ATOM 0 HA GLN A 430 9.821 5.824 -5.967 1.00 0.00 H new ATOM 0 HB2 GLN A 430 10.336 7.707 -3.636 1.00 0.00 H new ATOM 0 HB3 GLN A 430 11.549 6.937 -4.639 1.00 0.00 H new ATOM 0 HG2 GLN A 430 10.909 8.277 -6.559 1.00 0.00 H new ATOM 0 HG3 GLN A 430 9.530 8.936 -5.701 1.00 0.00 H new ATOM 0 HE21 GLN A 430 13.042 8.945 -5.982 1.00 0.00 H new ATOM 0 HE22 GLN A 430 13.314 10.407 -5.028 1.00 0.00 H new ATOM 600 N VAL A 431 10.028 4.056 -4.134 1.00 0.00 N ATOM 601 CA VAL A 431 10.020 3.011 -3.146 1.00 0.00 C ATOM 602 C VAL A 431 11.426 2.492 -2.919 1.00 0.00 C ATOM 603 O VAL A 431 12.135 2.062 -3.863 1.00 0.00 O ATOM 604 CB VAL A 431 9.115 1.822 -3.572 1.00 0.00 C ATOM 605 CG1 VAL A 431 8.963 0.797 -2.452 1.00 0.00 C ATOM 606 CG2 VAL A 431 7.766 2.311 -4.058 1.00 0.00 C ATOM 0 H VAL A 431 10.423 3.784 -5.034 1.00 0.00 H new ATOM 0 HA VAL A 431 9.623 3.442 -2.227 1.00 0.00 H new ATOM 0 HB VAL A 431 9.608 1.318 -4.404 1.00 0.00 H new ATOM 0 HG11 VAL A 431 8.323 -0.018 -2.789 1.00 0.00 H new ATOM 0 HG12 VAL A 431 9.943 0.402 -2.185 1.00 0.00 H new ATOM 0 HG13 VAL A 431 8.514 1.274 -1.581 1.00 0.00 H new ATOM 0 HG21 VAL A 431 7.153 1.458 -4.350 1.00 0.00 H new ATOM 0 HG22 VAL A 431 7.268 2.859 -3.258 1.00 0.00 H new ATOM 0 HG23 VAL A 431 7.905 2.968 -4.916 1.00 0.00 H new ATOM 616 N TYR A 432 11.826 2.545 -1.702 1.00 0.00 N ATOM 617 CA TYR A 432 13.081 2.028 -1.268 1.00 0.00 C ATOM 618 C TYR A 432 12.772 0.950 -0.268 1.00 0.00 C ATOM 619 O TYR A 432 11.658 0.895 0.246 1.00 0.00 O ATOM 620 CB TYR A 432 13.951 3.124 -0.619 1.00 0.00 C ATOM 621 CG TYR A 432 14.267 4.292 -1.522 1.00 0.00 C ATOM 622 CD1 TYR A 432 15.461 4.347 -2.222 1.00 0.00 C ATOM 623 CD2 TYR A 432 13.367 5.338 -1.677 1.00 0.00 C ATOM 624 CE1 TYR A 432 15.751 5.409 -3.050 1.00 0.00 C ATOM 625 CE2 TYR A 432 13.649 6.400 -2.501 1.00 0.00 C ATOM 626 CZ TYR A 432 14.840 6.432 -3.186 1.00 0.00 C ATOM 627 OH TYR A 432 15.122 7.491 -4.009 1.00 0.00 O ATOM 0 H TYR A 432 11.274 2.962 -0.952 1.00 0.00 H new ATOM 0 HA TYR A 432 13.647 1.642 -2.116 1.00 0.00 H new ATOM 0 HB2 TYR A 432 13.441 3.496 0.269 1.00 0.00 H new ATOM 0 HB3 TYR A 432 14.887 2.676 -0.285 1.00 0.00 H new ATOM 0 HD1 TYR A 432 16.176 3.544 -2.117 1.00 0.00 H new ATOM 0 HD2 TYR A 432 12.430 5.316 -1.141 1.00 0.00 H new ATOM 0 HE1 TYR A 432 16.687 5.439 -3.589 1.00 0.00 H new ATOM 0 HE2 TYR A 432 12.938 7.206 -2.610 1.00 0.00 H new ATOM 0 HH TYR A 432 14.375 8.125 -3.993 1.00 0.00 H new ATOM 637 N VAL A 433 13.695 0.096 -0.017 1.00 0.00 N ATOM 638 CA VAL A 433 13.488 -0.953 0.941 1.00 0.00 C ATOM 639 C VAL A 433 14.518 -0.881 2.030 1.00 0.00 C ATOM 640 O VAL A 433 15.654 -0.519 1.788 1.00 0.00 O ATOM 641 CB VAL A 433 13.520 -2.371 0.288 1.00 0.00 C ATOM 642 CG1 VAL A 433 12.256 -2.641 -0.501 1.00 0.00 C ATOM 643 CG2 VAL A 433 14.738 -2.532 -0.614 1.00 0.00 C ATOM 0 H VAL A 433 14.613 0.094 -0.461 1.00 0.00 H new ATOM 0 HA VAL A 433 12.494 -0.802 1.361 1.00 0.00 H new ATOM 0 HB VAL A 433 13.585 -3.098 1.097 1.00 0.00 H new ATOM 0 HG11 VAL A 433 12.309 -3.636 -0.943 1.00 0.00 H new ATOM 0 HG12 VAL A 433 11.393 -2.584 0.163 1.00 0.00 H new ATOM 0 HG13 VAL A 433 12.155 -1.897 -1.291 1.00 0.00 H new ATOM 0 HG21 VAL A 433 14.735 -3.529 -1.055 1.00 0.00 H new ATOM 0 HG22 VAL A 433 14.705 -1.784 -1.406 1.00 0.00 H new ATOM 0 HG23 VAL A 433 15.646 -2.398 -0.026 1.00 0.00 H new ATOM 653 N ASN A 434 14.088 -1.121 3.227 1.00 0.00 N ATOM 654 CA ASN A 434 14.965 -1.240 4.342 1.00 0.00 C ATOM 655 C ASN A 434 15.270 -2.710 4.586 1.00 0.00 C ATOM 656 O ASN A 434 14.303 -3.572 4.639 1.00 0.00 O ATOM 657 CB ASN A 434 14.455 -0.499 5.593 1.00 0.00 C ATOM 658 CG ASN A 434 15.361 -0.693 6.806 1.00 0.00 C ATOM 659 OD1 ASN A 434 15.140 -1.583 7.621 1.00 0.00 O ATOM 660 ND2 ASN A 434 16.392 0.103 6.919 1.00 0.00 N ATOM 0 H ASN A 434 13.102 -1.241 3.459 1.00 0.00 H new ATOM 0 HA ASN A 434 15.902 -0.736 4.105 1.00 0.00 H new ATOM 0 HB2 ASN A 434 14.375 0.565 5.372 1.00 0.00 H new ATOM 0 HB3 ASN A 434 13.452 -0.851 5.834 1.00 0.00 H new ATOM 0 HD21 ASN A 434 17.038 -0.007 7.700 1.00 0.00 H new ATOM 0 HD22 ASN A 434 16.550 0.834 6.226 1.00 0.00 H new ATOM 667 N HIS A 435 16.593 -2.944 4.768 1.00 0.00 N ATOM 668 CA HIS A 435 17.335 -4.240 4.865 1.00 0.00 C ATOM 669 C HIS A 435 16.545 -5.475 5.337 1.00 0.00 C ATOM 670 O HIS A 435 15.570 -5.389 6.083 1.00 0.00 O ATOM 671 CB HIS A 435 18.575 -4.077 5.750 1.00 0.00 C ATOM 672 CG HIS A 435 19.614 -3.164 5.188 1.00 0.00 C ATOM 673 ND1 HIS A 435 19.715 -1.831 5.500 1.00 0.00 N ATOM 674 CD2 HIS A 435 20.612 -3.416 4.311 1.00 0.00 C ATOM 675 CE1 HIS A 435 20.740 -1.330 4.814 1.00 0.00 C ATOM 676 NE2 HIS A 435 21.322 -2.250 4.076 1.00 0.00 N ATOM 0 H HIS A 435 17.236 -2.158 4.860 1.00 0.00 H new ATOM 0 HA HIS A 435 17.588 -4.456 3.827 1.00 0.00 H new ATOM 0 HB2 HIS A 435 18.265 -3.700 6.724 1.00 0.00 H new ATOM 0 HB3 HIS A 435 19.021 -5.058 5.915 1.00 0.00 H new ATOM 0 HD2 HIS A 435 20.823 -4.376 3.864 1.00 0.00 H new ATOM 0 HE1 HIS A 435 21.054 -0.298 4.858 1.00 0.00 H new ATOM 0 HE2 HIS A 435 22.126 -2.130 3.460 1.00 0.00 H new ATOM 684 N GLY A 436 17.058 -6.636 4.969 1.00 0.00 N ATOM 685 CA GLY A 436 16.344 -7.877 5.208 1.00 0.00 C ATOM 686 C GLY A 436 15.817 -8.378 3.894 1.00 0.00 C ATOM 687 O GLY A 436 15.169 -9.430 3.783 1.00 0.00 O ATOM 0 H GLY A 436 17.961 -6.745 4.506 1.00 0.00 H new ATOM 0 HA2 GLY A 436 17.007 -8.616 5.658 1.00 0.00 H new ATOM 0 HA3 GLY A 436 15.525 -7.715 5.909 1.00 0.00 H new ATOM 691 N GLU A 437 16.075 -7.579 2.903 1.00 0.00 N ATOM 692 CA GLU A 437 15.599 -7.771 1.594 1.00 0.00 C ATOM 693 C GLU A 437 16.626 -8.348 0.623 1.00 0.00 C ATOM 694 O GLU A 437 17.835 -8.379 0.892 1.00 0.00 O ATOM 695 CB GLU A 437 14.995 -6.453 1.062 1.00 0.00 C ATOM 696 CG GLU A 437 15.825 -5.191 1.339 1.00 0.00 C ATOM 697 CD GLU A 437 17.219 -5.243 0.779 1.00 0.00 C ATOM 698 OE1 GLU A 437 17.386 -5.108 -0.452 1.00 0.00 O ATOM 699 OE2 GLU A 437 18.160 -5.452 1.565 1.00 0.00 O ATOM 0 H GLU A 437 16.650 -6.743 3.004 1.00 0.00 H new ATOM 0 HA GLU A 437 14.824 -8.535 1.656 1.00 0.00 H new ATOM 0 HB2 GLU A 437 14.854 -6.546 -0.015 1.00 0.00 H new ATOM 0 HB3 GLU A 437 14.007 -6.322 1.503 1.00 0.00 H new ATOM 0 HG2 GLU A 437 15.307 -4.328 0.919 1.00 0.00 H new ATOM 0 HG3 GLU A 437 15.882 -5.035 2.416 1.00 0.00 H new ATOM 706 N ASN A 438 16.082 -8.868 -0.443 1.00 0.00 N ATOM 707 CA ASN A 438 16.759 -9.291 -1.650 1.00 0.00 C ATOM 708 C ASN A 438 15.657 -9.835 -2.525 1.00 0.00 C ATOM 709 O ASN A 438 15.173 -10.944 -2.304 1.00 0.00 O ATOM 710 CB ASN A 438 17.798 -10.399 -1.367 1.00 0.00 C ATOM 711 CG ASN A 438 18.595 -10.843 -2.595 1.00 0.00 C ATOM 712 OD1 ASN A 438 18.981 -12.014 -2.697 1.00 0.00 O ATOM 713 ND2 ASN A 438 18.907 -9.934 -3.493 1.00 0.00 N ATOM 0 H ASN A 438 15.075 -9.021 -0.500 1.00 0.00 H new ATOM 0 HA ASN A 438 17.309 -8.469 -2.108 1.00 0.00 H new ATOM 0 HB2 ASN A 438 18.493 -10.043 -0.606 1.00 0.00 H new ATOM 0 HB3 ASN A 438 17.284 -11.265 -0.949 1.00 0.00 H new ATOM 0 HD21 ASN A 438 19.480 -10.188 -4.298 1.00 0.00 H new ATOM 0 HD22 ASN A 438 18.576 -8.975 -3.385 1.00 0.00 H new ATOM 720 N LEU A 439 15.143 -8.989 -3.372 1.00 0.00 N ATOM 721 CA LEU A 439 14.108 -9.356 -4.314 1.00 0.00 C ATOM 722 C LEU A 439 14.330 -8.645 -5.623 1.00 0.00 C ATOM 723 O LEU A 439 14.994 -7.608 -5.646 1.00 0.00 O ATOM 724 CB LEU A 439 12.665 -9.103 -3.775 1.00 0.00 C ATOM 725 CG LEU A 439 12.198 -7.650 -3.513 1.00 0.00 C ATOM 726 CD1 LEU A 439 10.727 -7.653 -3.161 1.00 0.00 C ATOM 727 CD2 LEU A 439 12.970 -6.992 -2.383 1.00 0.00 C ATOM 0 H LEU A 439 15.430 -8.012 -3.434 1.00 0.00 H new ATOM 0 HA LEU A 439 14.183 -10.432 -4.468 1.00 0.00 H new ATOM 0 HB2 LEU A 439 11.968 -9.548 -4.484 1.00 0.00 H new ATOM 0 HB3 LEU A 439 12.563 -9.653 -2.840 1.00 0.00 H new ATOM 0 HG LEU A 439 12.381 -7.079 -4.423 1.00 0.00 H new ATOM 0 HD11 LEU A 439 10.395 -6.631 -2.976 1.00 0.00 H new ATOM 0 HD12 LEU A 439 10.156 -8.076 -3.988 1.00 0.00 H new ATOM 0 HD13 LEU A 439 10.568 -8.254 -2.266 1.00 0.00 H new ATOM 0 HD21 LEU A 439 12.606 -5.975 -2.238 1.00 0.00 H new ATOM 0 HD22 LEU A 439 12.829 -7.563 -1.465 1.00 0.00 H new ATOM 0 HD23 LEU A 439 14.030 -6.966 -2.634 1.00 0.00 H new ATOM 739 N LYS A 440 13.796 -9.171 -6.685 1.00 0.00 N ATOM 740 CA LYS A 440 13.828 -8.488 -7.952 1.00 0.00 C ATOM 741 C LYS A 440 12.480 -7.811 -8.172 1.00 0.00 C ATOM 742 O LYS A 440 11.423 -8.430 -7.958 1.00 0.00 O ATOM 743 CB LYS A 440 14.152 -9.446 -9.097 1.00 0.00 C ATOM 744 CG LYS A 440 15.512 -10.104 -8.981 1.00 0.00 C ATOM 745 CD LYS A 440 15.809 -10.976 -10.180 1.00 0.00 C ATOM 746 CE LYS A 440 17.173 -11.622 -10.057 1.00 0.00 C ATOM 747 NZ LYS A 440 17.500 -12.438 -11.243 1.00 0.00 N ATOM 0 H LYS A 440 13.329 -10.078 -6.703 1.00 0.00 H new ATOM 0 HA LYS A 440 14.619 -7.739 -7.936 1.00 0.00 H new ATOM 0 HB2 LYS A 440 13.387 -10.221 -9.137 1.00 0.00 H new ATOM 0 HB3 LYS A 440 14.102 -8.900 -10.039 1.00 0.00 H new ATOM 0 HG2 LYS A 440 16.281 -9.338 -8.887 1.00 0.00 H new ATOM 0 HG3 LYS A 440 15.550 -10.706 -8.073 1.00 0.00 H new ATOM 0 HD2 LYS A 440 15.044 -11.747 -10.271 1.00 0.00 H new ATOM 0 HD3 LYS A 440 15.767 -10.376 -11.089 1.00 0.00 H new ATOM 0 HE2 LYS A 440 17.931 -10.850 -9.927 1.00 0.00 H new ATOM 0 HE3 LYS A 440 17.200 -12.249 -9.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 440 18.441 -12.864 -11.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 440 16.791 -13.190 -11.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 440 17.499 -11.835 -12.090 1.00 0.00 H new ATOM 761 N THR A 441 12.511 -6.561 -8.551 1.00 0.00 N ATOM 762 CA THR A 441 11.307 -5.769 -8.750 1.00 0.00 C ATOM 763 C THR A 441 10.948 -5.631 -10.242 1.00 0.00 C ATOM 764 O THR A 441 10.160 -4.772 -10.631 1.00 0.00 O ATOM 765 CB THR A 441 11.519 -4.379 -8.136 1.00 0.00 C ATOM 766 OG1 THR A 441 12.796 -3.874 -8.562 1.00 0.00 O ATOM 767 CG2 THR A 441 11.474 -4.438 -6.611 1.00 0.00 C ATOM 0 H THR A 441 13.375 -6.051 -8.734 1.00 0.00 H new ATOM 0 HA THR A 441 10.477 -6.280 -8.262 1.00 0.00 H new ATOM 0 HB THR A 441 10.719 -3.720 -8.472 1.00 0.00 H new ATOM 0 HG1 THR A 441 13.003 -3.052 -8.071 1.00 0.00 H new ATOM 0 HG21 THR A 441 11.627 -3.439 -6.204 1.00 0.00 H new ATOM 0 HG22 THR A 441 10.503 -4.816 -6.290 1.00 0.00 H new ATOM 0 HG23 THR A 441 12.259 -5.102 -6.249 1.00 0.00 H new ATOM 775 N GLU A 442 11.485 -6.510 -11.056 1.00 0.00 N ATOM 776 CA GLU A 442 11.274 -6.462 -12.500 1.00 0.00 C ATOM 777 C GLU A 442 9.884 -6.964 -12.882 1.00 0.00 C ATOM 778 O GLU A 442 9.320 -6.581 -13.911 1.00 0.00 O ATOM 779 CB GLU A 442 12.338 -7.283 -13.193 1.00 0.00 C ATOM 780 CG GLU A 442 13.741 -6.779 -12.942 1.00 0.00 C ATOM 781 CD GLU A 442 14.772 -7.687 -13.521 1.00 0.00 C ATOM 782 OE1 GLU A 442 15.064 -7.593 -14.720 1.00 0.00 O ATOM 783 OE2 GLU A 442 15.303 -8.536 -12.786 1.00 0.00 O ATOM 0 H GLU A 442 12.079 -7.279 -10.746 1.00 0.00 H new ATOM 0 HA GLU A 442 11.346 -5.423 -12.822 1.00 0.00 H new ATOM 0 HB2 GLU A 442 12.265 -8.317 -12.857 1.00 0.00 H new ATOM 0 HB3 GLU A 442 12.146 -7.283 -14.266 1.00 0.00 H new ATOM 0 HG2 GLU A 442 13.851 -5.784 -13.373 1.00 0.00 H new ATOM 0 HG3 GLU A 442 13.905 -6.682 -11.869 1.00 0.00 H new ATOM 790 N GLN A 443 9.349 -7.832 -12.058 1.00 0.00 N ATOM 791 CA GLN A 443 8.036 -8.413 -12.272 1.00 0.00 C ATOM 792 C GLN A 443 6.972 -7.602 -11.502 1.00 0.00 C ATOM 793 O GLN A 443 5.800 -7.969 -11.415 1.00 0.00 O ATOM 794 CB GLN A 443 8.062 -9.909 -11.860 1.00 0.00 C ATOM 795 CG GLN A 443 6.768 -10.677 -12.106 1.00 0.00 C ATOM 796 CD GLN A 443 6.280 -10.561 -13.536 1.00 0.00 C ATOM 797 OE1 GLN A 443 5.537 -9.654 -13.871 1.00 0.00 O ATOM 798 NE2 GLN A 443 6.668 -11.473 -14.370 1.00 0.00 N ATOM 0 H GLN A 443 9.813 -8.161 -11.211 1.00 0.00 H new ATOM 0 HA GLN A 443 7.767 -8.369 -13.327 1.00 0.00 H new ATOM 0 HB2 GLN A 443 8.867 -10.404 -12.403 1.00 0.00 H new ATOM 0 HB3 GLN A 443 8.306 -9.972 -10.800 1.00 0.00 H new ATOM 0 HG2 GLN A 443 6.923 -11.728 -11.864 1.00 0.00 H new ATOM 0 HG3 GLN A 443 5.996 -10.305 -11.432 1.00 0.00 H new ATOM 0 HE21 GLN A 443 7.290 -12.218 -14.057 1.00 0.00 H new ATOM 0 HE22 GLN A 443 6.351 -11.446 -15.339 1.00 0.00 H new ATOM 807 N TRP A 444 7.395 -6.487 -10.967 1.00 0.00 N ATOM 808 CA TRP A 444 6.499 -5.603 -10.276 1.00 0.00 C ATOM 809 C TRP A 444 5.740 -4.769 -11.281 1.00 0.00 C ATOM 810 O TRP A 444 6.356 -4.090 -12.124 1.00 0.00 O ATOM 811 CB TRP A 444 7.250 -4.701 -9.299 1.00 0.00 C ATOM 812 CG TRP A 444 7.657 -5.376 -8.024 1.00 0.00 C ATOM 813 CD1 TRP A 444 8.049 -6.673 -7.855 1.00 0.00 C ATOM 814 CD2 TRP A 444 7.721 -4.767 -6.738 1.00 0.00 C ATOM 815 NE1 TRP A 444 8.335 -6.904 -6.536 1.00 0.00 N ATOM 816 CE2 TRP A 444 8.139 -5.745 -5.830 1.00 0.00 C ATOM 817 CE3 TRP A 444 7.455 -3.481 -6.266 1.00 0.00 C ATOM 818 CZ2 TRP A 444 8.300 -5.479 -4.478 1.00 0.00 C ATOM 819 CZ3 TRP A 444 7.616 -3.216 -4.924 1.00 0.00 C ATOM 820 CH2 TRP A 444 8.034 -4.211 -4.041 1.00 0.00 C ATOM 0 H TRP A 444 8.364 -6.169 -10.998 1.00 0.00 H new ATOM 0 HA TRP A 444 5.799 -6.205 -9.697 1.00 0.00 H new ATOM 0 HB2 TRP A 444 8.142 -4.314 -9.792 1.00 0.00 H new ATOM 0 HB3 TRP A 444 6.622 -3.844 -9.058 1.00 0.00 H new ATOM 0 HD1 TRP A 444 8.122 -7.407 -8.644 1.00 0.00 H new ATOM 0 HE1 TRP A 444 8.644 -7.793 -6.143 1.00 0.00 H new ATOM 0 HE3 TRP A 444 7.128 -2.705 -6.943 1.00 0.00 H new ATOM 0 HZ2 TRP A 444 8.625 -6.248 -3.793 1.00 0.00 H new ATOM 0 HZ3 TRP A 444 7.416 -2.223 -4.550 1.00 0.00 H new ATOM 0 HH2 TRP A 444 8.150 -3.976 -2.993 1.00 0.00 H new ATOM 831 N PRO A 445 4.397 -4.860 -11.268 1.00 0.00 N ATOM 832 CA PRO A 445 3.548 -4.053 -12.135 1.00 0.00 C ATOM 833 C PRO A 445 3.806 -2.576 -11.894 1.00 0.00 C ATOM 834 O PRO A 445 4.108 -2.178 -10.780 1.00 0.00 O ATOM 835 CB PRO A 445 2.125 -4.425 -11.697 1.00 0.00 C ATOM 836 CG PRO A 445 2.261 -5.764 -11.070 1.00 0.00 C ATOM 837 CD PRO A 445 3.608 -5.770 -10.418 1.00 0.00 C ATOM 0 HA PRO A 445 3.726 -4.233 -13.195 1.00 0.00 H new ATOM 0 HB2 PRO A 445 1.725 -3.697 -10.992 1.00 0.00 H new ATOM 0 HB3 PRO A 445 1.444 -4.453 -12.547 1.00 0.00 H new ATOM 0 HG2 PRO A 445 1.471 -5.936 -10.339 1.00 0.00 H new ATOM 0 HG3 PRO A 445 2.183 -6.555 -11.816 1.00 0.00 H new ATOM 0 HD2 PRO A 445 3.558 -5.417 -9.388 1.00 0.00 H new ATOM 0 HD3 PRO A 445 4.038 -6.771 -10.392 1.00 0.00 H new ATOM 845 N GLN A 446 3.640 -1.767 -12.919 1.00 0.00 N ATOM 846 CA GLN A 446 3.948 -0.397 -12.872 1.00 0.00 C ATOM 847 C GLN A 446 2.889 0.358 -12.053 1.00 0.00 C ATOM 848 O GLN A 446 3.150 1.454 -11.524 1.00 0.00 O ATOM 849 CB GLN A 446 3.999 0.078 -14.310 1.00 0.00 C ATOM 850 CG GLN A 446 4.350 1.503 -14.480 1.00 0.00 C ATOM 851 CD GLN A 446 5.739 1.841 -13.961 1.00 0.00 C ATOM 852 OE1 GLN A 446 6.723 1.772 -14.685 1.00 0.00 O ATOM 853 NE2 GLN A 446 5.824 2.198 -12.710 1.00 0.00 N ATOM 0 H GLN A 446 3.276 -2.075 -13.821 1.00 0.00 H new ATOM 0 HA GLN A 446 4.903 -0.211 -12.381 1.00 0.00 H new ATOM 0 HB2 GLN A 446 4.725 -0.528 -14.852 1.00 0.00 H new ATOM 0 HB3 GLN A 446 3.028 -0.100 -14.771 1.00 0.00 H new ATOM 0 HG2 GLN A 446 4.291 1.762 -15.537 1.00 0.00 H new ATOM 0 HG3 GLN A 446 3.615 2.117 -13.960 1.00 0.00 H new ATOM 0 HE21 GLN A 446 4.983 2.245 -12.135 1.00 0.00 H new ATOM 0 HE22 GLN A 446 6.732 2.430 -12.306 1.00 0.00 H new ATOM 862 N LYS A 447 1.718 -0.235 -11.951 1.00 0.00 N ATOM 863 CA LYS A 447 0.662 0.272 -11.120 1.00 0.00 C ATOM 864 C LYS A 447 0.226 -0.791 -10.159 1.00 0.00 C ATOM 865 O LYS A 447 -0.128 -1.909 -10.569 1.00 0.00 O ATOM 866 CB LYS A 447 -0.551 0.741 -11.911 1.00 0.00 C ATOM 867 CG LYS A 447 -0.357 2.002 -12.706 1.00 0.00 C ATOM 868 CD LYS A 447 -1.677 2.440 -13.286 1.00 0.00 C ATOM 869 CE LYS A 447 -1.565 3.759 -14.007 1.00 0.00 C ATOM 870 NZ LYS A 447 -2.878 4.202 -14.502 1.00 0.00 N ATOM 0 H LYS A 447 1.476 -1.091 -12.450 1.00 0.00 H new ATOM 0 HA LYS A 447 1.067 1.138 -10.596 1.00 0.00 H new ATOM 0 HB2 LYS A 447 -0.848 -0.056 -12.593 1.00 0.00 H new ATOM 0 HB3 LYS A 447 -1.378 0.893 -11.218 1.00 0.00 H new ATOM 0 HG2 LYS A 447 0.050 2.787 -12.069 1.00 0.00 H new ATOM 0 HG3 LYS A 447 0.365 1.833 -13.505 1.00 0.00 H new ATOM 0 HD2 LYS A 447 -2.041 1.679 -13.976 1.00 0.00 H new ATOM 0 HD3 LYS A 447 -2.414 2.524 -12.488 1.00 0.00 H new ATOM 0 HE2 LYS A 447 -1.153 4.511 -13.334 1.00 0.00 H new ATOM 0 HE3 LYS A 447 -0.871 3.663 -14.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 447 -2.869 5.233 -14.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 447 -3.081 3.737 -15.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 447 -3.613 3.949 -13.811 1.00 0.00 H new ATOM 884 N LEU A 448 0.279 -0.468 -8.910 1.00 0.00 N ATOM 885 CA LEU A 448 -0.167 -1.344 -7.869 1.00 0.00 C ATOM 886 C LEU A 448 -1.478 -0.818 -7.335 1.00 0.00 C ATOM 887 O LEU A 448 -1.691 0.399 -7.300 1.00 0.00 O ATOM 888 CB LEU A 448 0.873 -1.444 -6.759 1.00 0.00 C ATOM 889 CG LEU A 448 2.231 -2.027 -7.150 1.00 0.00 C ATOM 890 CD1 LEU A 448 3.153 -2.067 -5.957 1.00 0.00 C ATOM 891 CD2 LEU A 448 2.062 -3.399 -7.753 1.00 0.00 C ATOM 0 H LEU A 448 0.639 0.426 -8.574 1.00 0.00 H new ATOM 0 HA LEU A 448 -0.308 -2.349 -8.267 1.00 0.00 H new ATOM 0 HB2 LEU A 448 1.034 -0.446 -6.351 1.00 0.00 H new ATOM 0 HB3 LEU A 448 0.458 -2.053 -5.956 1.00 0.00 H new ATOM 0 HG LEU A 448 2.684 -1.381 -7.903 1.00 0.00 H new ATOM 0 HD11 LEU A 448 4.115 -2.485 -6.254 1.00 0.00 H new ATOM 0 HD12 LEU A 448 3.299 -1.056 -5.576 1.00 0.00 H new ATOM 0 HD13 LEU A 448 2.713 -2.689 -5.178 1.00 0.00 H new ATOM 0 HD21 LEU A 448 3.038 -3.799 -8.026 1.00 0.00 H new ATOM 0 HD22 LEU A 448 1.589 -4.060 -7.027 1.00 0.00 H new ATOM 0 HD23 LEU A 448 1.436 -3.331 -8.643 1.00 0.00 H new ATOM 903 N ILE A 449 -2.347 -1.703 -6.920 1.00 0.00 N ATOM 904 CA ILE A 449 -3.669 -1.307 -6.498 1.00 0.00 C ATOM 905 C ILE A 449 -3.706 -1.213 -4.991 1.00 0.00 C ATOM 906 O ILE A 449 -3.460 -2.198 -4.282 1.00 0.00 O ATOM 907 CB ILE A 449 -4.755 -2.313 -6.991 1.00 0.00 C ATOM 908 CG1 ILE A 449 -4.722 -2.451 -8.529 1.00 0.00 C ATOM 909 CG2 ILE A 449 -6.155 -1.902 -6.517 1.00 0.00 C ATOM 910 CD1 ILE A 449 -4.970 -1.156 -9.288 1.00 0.00 C ATOM 0 H ILE A 449 -2.164 -2.705 -6.865 1.00 0.00 H new ATOM 0 HA ILE A 449 -3.891 -0.335 -6.939 1.00 0.00 H new ATOM 0 HB ILE A 449 -4.525 -3.284 -6.553 1.00 0.00 H new ATOM 0 HG12 ILE A 449 -3.751 -2.849 -8.824 1.00 0.00 H new ATOM 0 HG13 ILE A 449 -5.471 -3.183 -8.831 1.00 0.00 H new ATOM 0 HG21 ILE A 449 -6.888 -2.624 -6.878 1.00 0.00 H new ATOM 0 HG22 ILE A 449 -6.177 -1.876 -5.428 1.00 0.00 H new ATOM 0 HG23 ILE A 449 -6.396 -0.914 -6.909 1.00 0.00 H new ATOM 0 HD11 ILE A 449 -4.928 -1.349 -10.360 1.00 0.00 H new ATOM 0 HD12 ILE A 449 -5.953 -0.764 -9.028 1.00 0.00 H new ATOM 0 HD13 ILE A 449 -4.206 -0.426 -9.021 1.00 0.00 H new ATOM 922 N MET A 450 -3.989 -0.050 -4.507 1.00 0.00 N ATOM 923 CA MET A 450 -4.034 0.190 -3.097 1.00 0.00 C ATOM 924 C MET A 450 -5.447 0.502 -2.662 1.00 0.00 C ATOM 925 O MET A 450 -6.115 1.327 -3.259 1.00 0.00 O ATOM 926 CB MET A 450 -3.091 1.337 -2.711 1.00 0.00 C ATOM 927 CG MET A 450 -3.142 1.699 -1.228 1.00 0.00 C ATOM 928 SD MET A 450 -1.996 3.011 -0.765 1.00 0.00 S ATOM 929 CE MET A 450 -2.552 4.367 -1.798 1.00 0.00 C ATOM 0 H MET A 450 -4.197 0.768 -5.079 1.00 0.00 H new ATOM 0 HA MET A 450 -3.702 -0.713 -2.585 1.00 0.00 H new ATOM 0 HB2 MET A 450 -2.070 1.061 -2.974 1.00 0.00 H new ATOM 0 HB3 MET A 450 -3.344 2.218 -3.300 1.00 0.00 H new ATOM 0 HG2 MET A 450 -4.156 2.007 -0.973 1.00 0.00 H new ATOM 0 HG3 MET A 450 -2.921 0.810 -0.638 1.00 0.00 H new ATOM 0 HE1 MET A 450 -2.054 5.286 -1.491 1.00 0.00 H new ATOM 0 HE2 MET A 450 -2.311 4.154 -2.839 1.00 0.00 H new ATOM 0 HE3 MET A 450 -3.630 4.486 -1.693 1.00 0.00 H new ATOM 939 N GLN A 451 -5.899 -0.176 -1.650 1.00 0.00 N ATOM 940 CA GLN A 451 -7.194 0.088 -1.088 1.00 0.00 C ATOM 941 C GLN A 451 -7.027 0.504 0.347 1.00 0.00 C ATOM 942 O GLN A 451 -6.288 -0.137 1.119 1.00 0.00 O ATOM 943 CB GLN A 451 -8.146 -1.108 -1.227 1.00 0.00 C ATOM 944 CG GLN A 451 -8.556 -1.418 -2.675 1.00 0.00 C ATOM 945 CD GLN A 451 -9.400 -0.312 -3.339 1.00 0.00 C ATOM 946 OE1 GLN A 451 -9.280 0.878 -3.033 1.00 0.00 O ATOM 947 NE2 GLN A 451 -10.255 -0.703 -4.249 1.00 0.00 N ATOM 0 H GLN A 451 -5.384 -0.926 -1.190 1.00 0.00 H new ATOM 0 HA GLN A 451 -7.659 0.900 -1.647 1.00 0.00 H new ATOM 0 HB2 GLN A 451 -7.669 -1.990 -0.799 1.00 0.00 H new ATOM 0 HB3 GLN A 451 -9.044 -0.914 -0.640 1.00 0.00 H new ATOM 0 HG2 GLN A 451 -7.657 -1.581 -3.269 1.00 0.00 H new ATOM 0 HG3 GLN A 451 -9.121 -2.350 -2.690 1.00 0.00 H new ATOM 0 HE21 GLN A 451 -10.334 -1.693 -4.483 1.00 0.00 H new ATOM 0 HE22 GLN A 451 -10.843 -0.018 -4.725 1.00 0.00 H new ATOM 956 N LEU A 452 -7.664 1.580 0.689 1.00 0.00 N ATOM 957 CA LEU A 452 -7.554 2.159 2.005 1.00 0.00 C ATOM 958 C LEU A 452 -8.523 1.484 2.958 1.00 0.00 C ATOM 959 O LEU A 452 -9.726 1.426 2.705 1.00 0.00 O ATOM 960 CB LEU A 452 -7.792 3.670 1.921 1.00 0.00 C ATOM 961 CG LEU A 452 -6.850 4.430 0.958 1.00 0.00 C ATOM 962 CD1 LEU A 452 -7.225 5.893 0.871 1.00 0.00 C ATOM 963 CD2 LEU A 452 -5.396 4.286 1.392 1.00 0.00 C ATOM 0 H LEU A 452 -8.283 2.092 0.061 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.550 1.997 2.397 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -8.822 3.843 1.609 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -7.686 4.095 2.919 1.00 0.00 H new ATOM 0 HG LEU A 452 -6.963 3.986 -0.031 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -6.546 6.403 0.187 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -8.247 5.985 0.504 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -7.152 6.347 1.859 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.754 4.829 0.699 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.274 4.694 2.395 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -5.119 3.232 1.393 1.00 0.00 H new ATOM 975 N ILE A 453 -7.983 0.964 4.026 1.00 0.00 N ATOM 976 CA ILE A 453 -8.726 0.209 5.017 1.00 0.00 C ATOM 977 C ILE A 453 -8.441 0.775 6.410 1.00 0.00 C ATOM 978 O ILE A 453 -7.445 1.460 6.593 1.00 0.00 O ATOM 979 CB ILE A 453 -8.303 -1.295 4.991 1.00 0.00 C ATOM 980 CG1 ILE A 453 -6.771 -1.427 5.178 1.00 0.00 C ATOM 981 CG2 ILE A 453 -8.768 -1.968 3.697 1.00 0.00 C ATOM 982 CD1 ILE A 453 -6.260 -2.848 5.261 1.00 0.00 C ATOM 0 H ILE A 453 -6.990 1.052 4.243 1.00 0.00 H new ATOM 0 HA ILE A 453 -9.788 0.288 4.786 1.00 0.00 H new ATOM 0 HB ILE A 453 -8.789 -1.808 5.821 1.00 0.00 H new ATOM 0 HG12 ILE A 453 -6.274 -0.925 4.348 1.00 0.00 H new ATOM 0 HG13 ILE A 453 -6.484 -0.899 6.087 1.00 0.00 H new ATOM 0 HG21 ILE A 453 -8.462 -3.014 3.701 1.00 0.00 H new ATOM 0 HG22 ILE A 453 -9.854 -1.907 3.625 1.00 0.00 H new ATOM 0 HG23 ILE A 453 -8.319 -1.462 2.842 1.00 0.00 H new ATOM 0 HD11 ILE A 453 -5.178 -2.838 5.392 1.00 0.00 H new ATOM 0 HD12 ILE A 453 -6.723 -3.352 6.109 1.00 0.00 H new ATOM 0 HD13 ILE A 453 -6.510 -3.379 4.342 1.00 0.00 H new ATOM 994 N PRO A 454 -9.321 0.549 7.398 1.00 0.00 N ATOM 995 CA PRO A 454 -9.067 0.984 8.776 1.00 0.00 C ATOM 996 C PRO A 454 -7.839 0.270 9.371 1.00 0.00 C ATOM 997 O PRO A 454 -7.750 -0.969 9.338 1.00 0.00 O ATOM 998 CB PRO A 454 -10.333 0.570 9.539 1.00 0.00 C ATOM 999 CG PRO A 454 -11.366 0.289 8.494 1.00 0.00 C ATOM 1000 CD PRO A 454 -10.633 -0.094 7.244 1.00 0.00 C ATOM 0 HA PRO A 454 -8.859 2.052 8.834 1.00 0.00 H new ATOM 0 HB2 PRO A 454 -10.149 -0.311 10.153 1.00 0.00 H new ATOM 0 HB3 PRO A 454 -10.662 1.363 10.210 1.00 0.00 H new ATOM 0 HG2 PRO A 454 -12.029 -0.515 8.814 1.00 0.00 H new ATOM 0 HG3 PRO A 454 -11.989 1.167 8.322 1.00 0.00 H new ATOM 0 HD2 PRO A 454 -10.540 -1.176 7.150 1.00 0.00 H new ATOM 0 HD3 PRO A 454 -11.150 0.260 6.352 1.00 0.00 H new ATOM 1008 N GLN A 455 -6.926 1.050 9.949 1.00 0.00 N ATOM 1009 CA GLN A 455 -5.668 0.538 10.511 1.00 0.00 C ATOM 1010 C GLN A 455 -5.920 -0.439 11.666 1.00 0.00 C ATOM 1011 O GLN A 455 -5.154 -1.369 11.876 1.00 0.00 O ATOM 1012 CB GLN A 455 -4.744 1.731 10.914 1.00 0.00 C ATOM 1013 CG GLN A 455 -3.352 1.383 11.492 1.00 0.00 C ATOM 1014 CD GLN A 455 -3.369 0.963 12.961 1.00 0.00 C ATOM 1015 OE1 GLN A 455 -4.211 1.414 13.747 1.00 0.00 O ATOM 1016 NE2 GLN A 455 -2.455 0.109 13.339 1.00 0.00 N ATOM 0 H GLN A 455 -7.035 2.060 10.043 1.00 0.00 H new ATOM 0 HA GLN A 455 -5.147 -0.039 9.747 1.00 0.00 H new ATOM 0 HB2 GLN A 455 -4.597 2.357 10.034 1.00 0.00 H new ATOM 0 HB3 GLN A 455 -5.274 2.335 11.650 1.00 0.00 H new ATOM 0 HG2 GLN A 455 -2.917 0.577 10.901 1.00 0.00 H new ATOM 0 HG3 GLN A 455 -2.699 2.248 11.381 1.00 0.00 H new ATOM 0 HE21 GLN A 455 -1.776 -0.243 12.664 1.00 0.00 H new ATOM 0 HE22 GLN A 455 -2.421 -0.206 14.309 1.00 0.00 H new ATOM 1025 N GLN A 456 -7.009 -0.248 12.379 1.00 0.00 N ATOM 1026 CA GLN A 456 -7.359 -1.115 13.498 1.00 0.00 C ATOM 1027 C GLN A 456 -7.548 -2.586 13.061 1.00 0.00 C ATOM 1028 O GLN A 456 -7.218 -3.512 13.808 1.00 0.00 O ATOM 1029 CB GLN A 456 -8.606 -0.576 14.220 1.00 0.00 C ATOM 1030 CG GLN A 456 -9.074 -1.414 15.408 1.00 0.00 C ATOM 1031 CD GLN A 456 -7.985 -1.646 16.444 1.00 0.00 C ATOM 1032 OE1 GLN A 456 -7.083 -0.821 16.632 1.00 0.00 O ATOM 1033 NE2 GLN A 456 -8.061 -2.756 17.118 1.00 0.00 N ATOM 0 H GLN A 456 -7.676 0.504 12.207 1.00 0.00 H new ATOM 0 HA GLN A 456 -6.524 -1.107 14.198 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -8.398 0.436 14.567 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -9.422 -0.504 13.501 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -9.919 -0.917 15.884 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -9.433 -2.377 15.046 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -8.820 -3.413 16.935 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -7.362 -2.970 17.829 1.00 0.00 H new ATOM 1042 N LEU A 457 -8.000 -2.795 11.837 1.00 0.00 N ATOM 1043 CA LEU A 457 -8.251 -4.147 11.338 1.00 0.00 C ATOM 1044 C LEU A 457 -6.943 -4.829 10.906 1.00 0.00 C ATOM 1045 O LEU A 457 -6.886 -6.045 10.730 1.00 0.00 O ATOM 1046 CB LEU A 457 -9.257 -4.111 10.179 1.00 0.00 C ATOM 1047 CG LEU A 457 -10.643 -3.523 10.495 1.00 0.00 C ATOM 1048 CD1 LEU A 457 -11.513 -3.505 9.253 1.00 0.00 C ATOM 1049 CD2 LEU A 457 -11.329 -4.311 11.600 1.00 0.00 C ATOM 0 H LEU A 457 -8.202 -2.052 11.168 1.00 0.00 H new ATOM 0 HA LEU A 457 -8.680 -4.735 12.149 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -8.819 -3.535 9.364 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -9.393 -5.129 9.813 1.00 0.00 H new ATOM 0 HG LEU A 457 -10.500 -2.498 10.838 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -12.489 -3.086 9.498 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -11.038 -2.894 8.485 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -11.638 -4.522 8.882 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -12.307 -3.875 11.804 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -11.452 -5.347 11.285 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -10.720 -4.276 12.503 1.00 0.00 H new ATOM 1061 N LEU A 458 -5.894 -4.033 10.802 1.00 0.00 N ATOM 1062 CA LEU A 458 -4.567 -4.478 10.372 1.00 0.00 C ATOM 1063 C LEU A 458 -3.876 -5.287 11.476 1.00 0.00 C ATOM 1064 O LEU A 458 -3.023 -6.131 11.197 1.00 0.00 O ATOM 1065 CB LEU A 458 -3.747 -3.207 9.959 1.00 0.00 C ATOM 1066 CG LEU A 458 -2.251 -3.312 9.562 1.00 0.00 C ATOM 1067 CD1 LEU A 458 -1.840 -2.022 8.885 1.00 0.00 C ATOM 1068 CD2 LEU A 458 -1.351 -3.494 10.782 1.00 0.00 C ATOM 0 H LEU A 458 -5.935 -3.037 11.017 1.00 0.00 H new ATOM 0 HA LEU A 458 -4.644 -5.148 9.516 1.00 0.00 H new ATOM 0 HB2 LEU A 458 -4.269 -2.751 9.118 1.00 0.00 H new ATOM 0 HB3 LEU A 458 -3.808 -2.505 10.790 1.00 0.00 H new ATOM 0 HG LEU A 458 -2.139 -4.176 8.907 1.00 0.00 H new ATOM 0 HD11 LEU A 458 -0.790 -2.080 8.599 1.00 0.00 H new ATOM 0 HD12 LEU A 458 -2.450 -1.868 7.995 1.00 0.00 H new ATOM 0 HD13 LEU A 458 -1.984 -1.188 9.572 1.00 0.00 H new ATOM 0 HD21 LEU A 458 -0.312 -3.563 10.460 1.00 0.00 H new ATOM 0 HD22 LEU A 458 -1.468 -2.641 11.451 1.00 0.00 H new ATOM 0 HD23 LEU A 458 -1.630 -4.408 11.307 1.00 0.00 H new ATOM 1080 N THR A 459 -4.310 -5.084 12.714 1.00 0.00 N ATOM 1081 CA THR A 459 -3.664 -5.668 13.895 1.00 0.00 C ATOM 1082 C THR A 459 -3.596 -7.221 13.875 1.00 0.00 C ATOM 1083 O THR A 459 -2.753 -7.827 14.552 1.00 0.00 O ATOM 1084 CB THR A 459 -4.334 -5.165 15.197 1.00 0.00 C ATOM 1085 OG1 THR A 459 -5.752 -5.417 15.156 1.00 0.00 O ATOM 1086 CG2 THR A 459 -4.089 -3.671 15.392 1.00 0.00 C ATOM 0 H THR A 459 -5.123 -4.508 12.934 1.00 0.00 H new ATOM 0 HA THR A 459 -2.630 -5.324 13.866 1.00 0.00 H new ATOM 0 HB THR A 459 -3.893 -5.706 16.034 1.00 0.00 H new ATOM 0 HG1 THR A 459 -6.188 -4.741 14.596 1.00 0.00 H new ATOM 0 HG21 THR A 459 -4.569 -3.341 16.313 1.00 0.00 H new ATOM 0 HG22 THR A 459 -3.017 -3.483 15.454 1.00 0.00 H new ATOM 0 HG23 THR A 459 -4.505 -3.121 14.548 1.00 0.00 H new ATOM 1094 N THR A 460 -4.439 -7.844 13.064 1.00 0.00 N ATOM 1095 CA THR A 460 -4.478 -9.293 12.937 1.00 0.00 C ATOM 1096 C THR A 460 -3.223 -9.816 12.204 1.00 0.00 C ATOM 1097 O THR A 460 -2.825 -10.974 12.361 1.00 0.00 O ATOM 1098 CB THR A 460 -5.774 -9.747 12.189 1.00 0.00 C ATOM 1099 OG1 THR A 460 -5.909 -11.174 12.199 1.00 0.00 O ATOM 1100 CG2 THR A 460 -5.809 -9.247 10.743 1.00 0.00 C ATOM 0 H THR A 460 -5.116 -7.358 12.475 1.00 0.00 H new ATOM 0 HA THR A 460 -4.490 -9.718 13.941 1.00 0.00 H new ATOM 0 HB THR A 460 -6.610 -9.302 12.729 1.00 0.00 H new ATOM 0 HG1 THR A 460 -6.729 -11.428 11.726 1.00 0.00 H new ATOM 0 HG21 THR A 460 -6.727 -9.586 10.263 1.00 0.00 H new ATOM 0 HG22 THR A 460 -5.776 -8.158 10.734 1.00 0.00 H new ATOM 0 HG23 THR A 460 -4.949 -9.641 10.201 1.00 0.00 H new ATOM 1108 N LEU A 461 -2.582 -8.948 11.462 1.00 0.00 N ATOM 1109 CA LEU A 461 -1.428 -9.310 10.649 1.00 0.00 C ATOM 1110 C LEU A 461 -0.115 -9.190 11.426 1.00 0.00 C ATOM 1111 O LEU A 461 0.961 -9.262 10.836 1.00 0.00 O ATOM 1112 CB LEU A 461 -1.375 -8.444 9.397 1.00 0.00 C ATOM 1113 CG LEU A 461 -2.595 -8.494 8.476 1.00 0.00 C ATOM 1114 CD1 LEU A 461 -2.401 -7.555 7.318 1.00 0.00 C ATOM 1115 CD2 LEU A 461 -2.864 -9.910 7.977 1.00 0.00 C ATOM 0 H LEU A 461 -2.840 -7.963 11.399 1.00 0.00 H new ATOM 0 HA LEU A 461 -1.546 -10.356 10.364 1.00 0.00 H new ATOM 0 HB2 LEU A 461 -1.223 -7.409 9.705 1.00 0.00 H new ATOM 0 HB3 LEU A 461 -0.499 -8.736 8.818 1.00 0.00 H new ATOM 0 HG LEU A 461 -3.466 -8.179 9.051 1.00 0.00 H new ATOM 0 HD11 LEU A 461 -3.274 -7.596 6.666 1.00 0.00 H new ATOM 0 HD12 LEU A 461 -2.274 -6.539 7.691 1.00 0.00 H new ATOM 0 HD13 LEU A 461 -1.514 -7.849 6.756 1.00 0.00 H new ATOM 0 HD21 LEU A 461 -3.738 -9.906 7.326 1.00 0.00 H new ATOM 0 HD22 LEU A 461 -1.999 -10.270 7.421 1.00 0.00 H new ATOM 0 HD23 LEU A 461 -3.048 -10.567 8.827 1.00 0.00 H new ATOM 1127 N GLY A 462 -0.220 -9.010 12.739 1.00 0.00 N ATOM 1128 CA GLY A 462 0.952 -8.904 13.624 1.00 0.00 C ATOM 1129 C GLY A 462 2.051 -9.962 13.362 1.00 0.00 C ATOM 1130 O GLY A 462 3.184 -9.592 13.048 1.00 0.00 O ATOM 0 H GLY A 462 -1.113 -8.933 13.225 1.00 0.00 H new ATOM 0 HA2 GLY A 462 1.387 -7.911 13.512 1.00 0.00 H new ATOM 0 HA3 GLY A 462 0.620 -8.992 14.658 1.00 0.00 H new ATOM 1134 N PRO A 463 1.740 -11.293 13.452 1.00 0.00 N ATOM 1135 CA PRO A 463 2.732 -12.374 13.200 1.00 0.00 C ATOM 1136 C PRO A 463 3.290 -12.344 11.771 1.00 0.00 C ATOM 1137 O PRO A 463 4.410 -12.807 11.513 1.00 0.00 O ATOM 1138 CB PRO A 463 1.922 -13.668 13.408 1.00 0.00 C ATOM 1139 CG PRO A 463 0.494 -13.250 13.303 1.00 0.00 C ATOM 1140 CD PRO A 463 0.436 -11.859 13.846 1.00 0.00 C ATOM 0 HA PRO A 463 3.598 -12.276 13.855 1.00 0.00 H new ATOM 0 HB2 PRO A 463 2.171 -14.415 12.654 1.00 0.00 H new ATOM 0 HB3 PRO A 463 2.132 -14.114 14.380 1.00 0.00 H new ATOM 0 HG2 PRO A 463 0.153 -13.280 12.268 1.00 0.00 H new ATOM 0 HG3 PRO A 463 -0.152 -13.919 13.871 1.00 0.00 H new ATOM 0 HD2 PRO A 463 -0.394 -11.294 13.421 1.00 0.00 H new ATOM 0 HD3 PRO A 463 0.304 -11.854 14.928 1.00 0.00 H new ATOM 1148 N LEU A 464 2.524 -11.773 10.868 1.00 0.00 N ATOM 1149 CA LEU A 464 2.891 -11.715 9.476 1.00 0.00 C ATOM 1150 C LEU A 464 3.973 -10.660 9.259 1.00 0.00 C ATOM 1151 O LEU A 464 5.000 -10.937 8.643 1.00 0.00 O ATOM 1152 CB LEU A 464 1.645 -11.441 8.625 1.00 0.00 C ATOM 1153 CG LEU A 464 1.824 -11.387 7.111 1.00 0.00 C ATOM 1154 CD1 LEU A 464 2.397 -12.692 6.575 1.00 0.00 C ATOM 1155 CD2 LEU A 464 0.493 -11.100 6.465 1.00 0.00 C ATOM 0 H LEU A 464 1.628 -11.336 11.082 1.00 0.00 H new ATOM 0 HA LEU A 464 3.305 -12.674 9.165 1.00 0.00 H new ATOM 0 HB2 LEU A 464 0.908 -12.212 8.849 1.00 0.00 H new ATOM 0 HB3 LEU A 464 1.220 -10.491 8.948 1.00 0.00 H new ATOM 0 HG LEU A 464 2.531 -10.592 6.871 1.00 0.00 H new ATOM 0 HD11 LEU A 464 2.513 -12.622 5.493 1.00 0.00 H new ATOM 0 HD12 LEU A 464 3.369 -12.878 7.032 1.00 0.00 H new ATOM 0 HD13 LEU A 464 1.720 -13.512 6.815 1.00 0.00 H new ATOM 0 HD21 LEU A 464 0.615 -11.060 5.383 1.00 0.00 H new ATOM 0 HD22 LEU A 464 -0.214 -11.889 6.722 1.00 0.00 H new ATOM 0 HD23 LEU A 464 0.114 -10.143 6.823 1.00 0.00 H new ATOM 1167 N PHE A 465 3.775 -9.477 9.843 1.00 0.00 N ATOM 1168 CA PHE A 465 4.743 -8.377 9.715 1.00 0.00 C ATOM 1169 C PHE A 465 6.022 -8.650 10.486 1.00 0.00 C ATOM 1170 O PHE A 465 7.035 -7.981 10.286 1.00 0.00 O ATOM 1171 CB PHE A 465 4.154 -7.029 10.141 1.00 0.00 C ATOM 1172 CG PHE A 465 3.053 -6.531 9.259 1.00 0.00 C ATOM 1173 CD1 PHE A 465 1.811 -6.233 9.782 1.00 0.00 C ATOM 1174 CD2 PHE A 465 3.262 -6.360 7.900 1.00 0.00 C ATOM 1175 CE1 PHE A 465 0.798 -5.773 8.970 1.00 0.00 C ATOM 1176 CE2 PHE A 465 2.253 -5.903 7.084 1.00 0.00 C ATOM 1177 CZ PHE A 465 1.019 -5.610 7.620 1.00 0.00 C ATOM 0 H PHE A 465 2.956 -9.253 10.409 1.00 0.00 H new ATOM 0 HA PHE A 465 4.986 -8.319 8.654 1.00 0.00 H new ATOM 0 HB2 PHE A 465 3.776 -7.117 11.160 1.00 0.00 H new ATOM 0 HB3 PHE A 465 4.952 -6.287 10.160 1.00 0.00 H new ATOM 0 HD1 PHE A 465 1.632 -6.362 10.839 1.00 0.00 H new ATOM 0 HD2 PHE A 465 4.229 -6.588 7.476 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -0.169 -5.540 9.391 1.00 0.00 H new ATOM 0 HE2 PHE A 465 2.428 -5.774 6.026 1.00 0.00 H new ATOM 0 HZ PHE A 465 0.224 -5.252 6.982 1.00 0.00 H new ATOM 1187 N ARG A 466 5.983 -9.626 11.370 1.00 0.00 N ATOM 1188 CA ARG A 466 7.167 -10.001 12.122 1.00 0.00 C ATOM 1189 C ARG A 466 8.176 -10.717 11.233 1.00 0.00 C ATOM 1190 O ARG A 466 9.350 -10.815 11.569 1.00 0.00 O ATOM 1191 CB ARG A 466 6.821 -10.830 13.352 1.00 0.00 C ATOM 1192 CG ARG A 466 6.090 -10.047 14.422 1.00 0.00 C ATOM 1193 CD ARG A 466 5.796 -10.906 15.627 1.00 0.00 C ATOM 1194 NE ARG A 466 5.160 -10.137 16.701 1.00 0.00 N ATOM 1195 CZ ARG A 466 4.954 -10.584 17.950 1.00 0.00 C ATOM 1196 NH1 ARG A 466 5.284 -11.840 18.279 1.00 0.00 N ATOM 1197 NH2 ARG A 466 4.401 -9.781 18.857 1.00 0.00 N ATOM 0 H ARG A 466 5.149 -10.173 11.586 1.00 0.00 H new ATOM 0 HA ARG A 466 7.630 -9.081 12.480 1.00 0.00 H new ATOM 0 HB2 ARG A 466 6.206 -11.677 13.048 1.00 0.00 H new ATOM 0 HB3 ARG A 466 7.739 -11.238 13.775 1.00 0.00 H new ATOM 0 HG2 ARG A 466 6.692 -9.189 14.723 1.00 0.00 H new ATOM 0 HG3 ARG A 466 5.157 -9.656 14.016 1.00 0.00 H new ATOM 0 HD2 ARG A 466 5.145 -11.730 15.336 1.00 0.00 H new ATOM 0 HD3 ARG A 466 6.723 -11.346 15.995 1.00 0.00 H new ATOM 0 HE ARG A 466 4.850 -9.190 16.483 1.00 0.00 H new ATOM 0 HH11 ARG A 466 5.693 -12.460 17.580 1.00 0.00 H new ATOM 0 HH12 ARG A 466 5.126 -12.177 19.229 1.00 0.00 H new ATOM 0 HH21 ARG A 466 4.135 -8.830 18.602 1.00 0.00 H new ATOM 0 HH22 ARG A 466 4.243 -10.117 19.807 1.00 0.00 H new ATOM 1211 N ASN A 467 7.721 -11.186 10.098 1.00 0.00 N ATOM 1212 CA ASN A 467 8.586 -11.804 9.116 1.00 0.00 C ATOM 1213 C ASN A 467 8.379 -11.130 7.790 1.00 0.00 C ATOM 1214 O ASN A 467 7.628 -11.611 6.937 1.00 0.00 O ATOM 1215 CB ASN A 467 8.359 -13.322 9.003 1.00 0.00 C ATOM 1216 CG ASN A 467 8.841 -14.116 10.213 1.00 0.00 C ATOM 1217 OD1 ASN A 467 8.226 -15.118 10.591 1.00 0.00 O ATOM 1218 ND2 ASN A 467 9.946 -13.719 10.805 1.00 0.00 N ATOM 0 H ASN A 467 6.739 -11.151 9.825 1.00 0.00 H new ATOM 0 HA ASN A 467 9.618 -11.675 9.441 1.00 0.00 H new ATOM 0 HB2 ASN A 467 7.295 -13.510 8.859 1.00 0.00 H new ATOM 0 HB3 ASN A 467 8.870 -13.690 8.113 1.00 0.00 H new ATOM 0 HD21 ASN A 467 10.316 -14.243 11.598 1.00 0.00 H new ATOM 0 HD22 ASN A 467 10.433 -12.887 10.471 1.00 0.00 H new ATOM 1225 N SER A 468 8.952 -9.952 7.661 1.00 0.00 N ATOM 1226 CA SER A 468 8.832 -9.145 6.475 1.00 0.00 C ATOM 1227 C SER A 468 10.058 -8.224 6.309 1.00 0.00 C ATOM 1228 O SER A 468 10.924 -8.147 7.187 1.00 0.00 O ATOM 1229 CB SER A 468 7.523 -8.326 6.500 1.00 0.00 C ATOM 1230 OG SER A 468 6.378 -9.172 6.518 1.00 0.00 O ATOM 0 H SER A 468 9.522 -9.526 8.391 1.00 0.00 H new ATOM 0 HA SER A 468 8.796 -9.812 5.613 1.00 0.00 H new ATOM 0 HB2 SER A 468 7.513 -7.680 7.378 1.00 0.00 H new ATOM 0 HB3 SER A 468 7.483 -7.676 5.626 1.00 0.00 H new ATOM 0 HG SER A 468 6.664 -10.109 6.516 1.00 0.00 H new ATOM 1236 N ARG A 469 10.119 -7.595 5.170 1.00 0.00 N ATOM 1237 CA ARG A 469 11.155 -6.655 4.769 1.00 0.00 C ATOM 1238 C ARG A 469 10.555 -5.265 4.682 1.00 0.00 C ATOM 1239 O ARG A 469 9.380 -5.137 4.295 1.00 0.00 O ATOM 1240 CB ARG A 469 11.875 -7.097 3.483 1.00 0.00 C ATOM 1241 CG ARG A 469 10.966 -7.504 2.335 1.00 0.00 C ATOM 1242 CD ARG A 469 11.770 -8.067 1.166 1.00 0.00 C ATOM 1243 NE ARG A 469 12.654 -9.171 1.598 1.00 0.00 N ATOM 1244 CZ ARG A 469 13.281 -10.063 0.817 1.00 0.00 C ATOM 1245 NH1 ARG A 469 13.079 -10.086 -0.502 1.00 0.00 N ATOM 1246 NH2 ARG A 469 14.106 -10.932 1.376 1.00 0.00 N ATOM 0 H ARG A 469 9.411 -7.724 4.447 1.00 0.00 H new ATOM 0 HA ARG A 469 11.939 -6.635 5.526 1.00 0.00 H new ATOM 0 HB2 ARG A 469 12.515 -6.281 3.146 1.00 0.00 H new ATOM 0 HB3 ARG A 469 12.528 -7.936 3.722 1.00 0.00 H new ATOM 0 HG2 ARG A 469 10.251 -8.251 2.681 1.00 0.00 H new ATOM 0 HG3 ARG A 469 10.389 -6.641 2.001 1.00 0.00 H new ATOM 0 HD2 ARG A 469 11.089 -8.426 0.394 1.00 0.00 H new ATOM 0 HD3 ARG A 469 12.369 -7.273 0.719 1.00 0.00 H new ATOM 0 HE ARG A 469 12.804 -9.265 2.603 1.00 0.00 H new ATOM 0 HH11 ARG A 469 12.439 -9.418 -0.932 1.00 0.00 H new ATOM 0 HH12 ARG A 469 13.565 -10.772 -1.080 1.00 0.00 H new ATOM 0 HH21 ARG A 469 14.256 -10.916 2.385 1.00 0.00 H new ATOM 0 HH22 ARG A 469 14.592 -11.618 0.798 1.00 0.00 H new ATOM 1260 N MET A 470 11.303 -4.230 5.048 1.00 0.00 N ATOM 1261 CA MET A 470 10.700 -2.919 5.238 1.00 0.00 C ATOM 1262 C MET A 470 10.838 -2.100 4.002 1.00 0.00 C ATOM 1263 O MET A 470 11.708 -2.338 3.193 1.00 0.00 O ATOM 1264 CB MET A 470 11.429 -2.197 6.367 1.00 0.00 C ATOM 1265 CG MET A 470 10.933 -2.490 7.756 1.00 0.00 C ATOM 1266 SD MET A 470 9.498 -1.494 8.208 1.00 0.00 S ATOM 1267 CE MET A 470 10.169 0.166 8.123 1.00 0.00 C ATOM 0 H MET A 470 12.308 -4.272 5.216 1.00 0.00 H new ATOM 0 HA MET A 470 9.644 -3.050 5.474 1.00 0.00 H new ATOM 0 HB2 MET A 470 12.486 -2.457 6.316 1.00 0.00 H new ATOM 0 HB3 MET A 470 11.356 -1.123 6.194 1.00 0.00 H new ATOM 0 HG2 MET A 470 10.675 -3.546 7.830 1.00 0.00 H new ATOM 0 HG3 MET A 470 11.736 -2.308 8.470 1.00 0.00 H new ATOM 0 HE1 MET A 470 9.638 0.810 8.824 1.00 0.00 H new ATOM 0 HE2 MET A 470 11.228 0.144 8.381 1.00 0.00 H new ATOM 0 HE3 MET A 470 10.050 0.555 7.112 1.00 0.00 H new ATOM 1277 N VAL A 471 9.924 -1.195 3.822 1.00 0.00 N ATOM 1278 CA VAL A 471 9.907 -0.339 2.674 1.00 0.00 C ATOM 1279 C VAL A 471 9.830 1.118 3.104 1.00 0.00 C ATOM 1280 O VAL A 471 9.501 1.431 4.265 1.00 0.00 O ATOM 1281 CB VAL A 471 8.738 -0.678 1.697 1.00 0.00 C ATOM 1282 CG1 VAL A 471 8.770 -2.135 1.288 1.00 0.00 C ATOM 1283 CG2 VAL A 471 7.396 -0.331 2.288 1.00 0.00 C ATOM 0 H VAL A 471 9.159 -1.028 4.476 1.00 0.00 H new ATOM 0 HA VAL A 471 10.838 -0.508 2.132 1.00 0.00 H new ATOM 0 HB VAL A 471 8.881 -0.065 0.807 1.00 0.00 H new ATOM 0 HG11 VAL A 471 7.944 -2.340 0.608 1.00 0.00 H new ATOM 0 HG12 VAL A 471 9.714 -2.352 0.788 1.00 0.00 H new ATOM 0 HG13 VAL A 471 8.676 -2.764 2.173 1.00 0.00 H new ATOM 0 HG21 VAL A 471 6.609 -0.582 1.577 1.00 0.00 H new ATOM 0 HG22 VAL A 471 7.247 -0.896 3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 471 7.360 0.736 2.507 1.00 0.00 H new ATOM 1293 N GLN A 472 10.168 1.972 2.200 1.00 0.00 N ATOM 1294 CA GLN A 472 10.168 3.388 2.391 1.00 0.00 C ATOM 1295 C GLN A 472 9.484 4.002 1.175 1.00 0.00 C ATOM 1296 O GLN A 472 9.929 3.796 0.040 1.00 0.00 O ATOM 1297 CB GLN A 472 11.630 3.846 2.487 1.00 0.00 C ATOM 1298 CG GLN A 472 11.864 5.334 2.717 1.00 0.00 C ATOM 1299 CD GLN A 472 11.296 5.832 4.027 1.00 0.00 C ATOM 1300 OE1 GLN A 472 11.184 5.090 5.001 1.00 0.00 O ATOM 1301 NE2 GLN A 472 10.989 7.091 4.080 1.00 0.00 N ATOM 0 H GLN A 472 10.466 1.693 1.265 1.00 0.00 H new ATOM 0 HA GLN A 472 9.643 3.690 3.297 1.00 0.00 H new ATOM 0 HB2 GLN A 472 12.107 3.296 3.299 1.00 0.00 H new ATOM 0 HB3 GLN A 472 12.138 3.559 1.566 1.00 0.00 H new ATOM 0 HG2 GLN A 472 12.935 5.534 2.694 1.00 0.00 H new ATOM 0 HG3 GLN A 472 11.416 5.896 1.897 1.00 0.00 H new ATOM 0 HE21 GLN A 472 11.095 7.677 3.252 1.00 0.00 H new ATOM 0 HE22 GLN A 472 10.642 7.495 4.950 1.00 0.00 H new ATOM 1310 N PHE A 473 8.408 4.706 1.408 1.00 0.00 N ATOM 1311 CA PHE A 473 7.630 5.318 0.355 1.00 0.00 C ATOM 1312 C PHE A 473 7.657 6.826 0.449 1.00 0.00 C ATOM 1313 O PHE A 473 7.340 7.428 1.512 1.00 0.00 O ATOM 1314 CB PHE A 473 6.168 4.859 0.382 1.00 0.00 C ATOM 1315 CG PHE A 473 5.855 3.562 -0.289 1.00 0.00 C ATOM 1316 CD1 PHE A 473 6.033 2.352 0.353 1.00 0.00 C ATOM 1317 CD2 PHE A 473 5.343 3.564 -1.575 1.00 0.00 C ATOM 1318 CE1 PHE A 473 5.707 1.178 -0.289 1.00 0.00 C ATOM 1319 CE2 PHE A 473 5.021 2.384 -2.209 1.00 0.00 C ATOM 1320 CZ PHE A 473 5.205 1.194 -1.566 1.00 0.00 C ATOM 0 H PHE A 473 8.040 4.875 2.344 1.00 0.00 H new ATOM 0 HA PHE A 473 8.090 5.000 -0.580 1.00 0.00 H new ATOM 0 HB2 PHE A 473 5.854 4.787 1.423 1.00 0.00 H new ATOM 0 HB3 PHE A 473 5.560 5.636 -0.081 1.00 0.00 H new ATOM 0 HD1 PHE A 473 6.428 2.327 1.358 1.00 0.00 H new ATOM 0 HD2 PHE A 473 5.194 4.503 -2.088 1.00 0.00 H new ATOM 0 HE1 PHE A 473 5.848 0.235 0.218 1.00 0.00 H new ATOM 0 HE2 PHE A 473 4.624 2.400 -3.213 1.00 0.00 H new ATOM 0 HZ PHE A 473 4.956 0.267 -2.061 1.00 0.00 H new ATOM 1330 N HIS A 474 8.024 7.427 -0.637 1.00 0.00 N ATOM 1331 CA HIS A 474 7.998 8.855 -0.773 1.00 0.00 C ATOM 1332 C HIS A 474 7.317 9.149 -2.090 1.00 0.00 C ATOM 1333 O HIS A 474 7.745 8.657 -3.119 1.00 0.00 O ATOM 1334 CB HIS A 474 9.432 9.408 -0.763 1.00 0.00 C ATOM 1335 CG HIS A 474 9.529 10.908 -0.797 1.00 0.00 C ATOM 1336 ND1 HIS A 474 9.883 11.635 -1.913 1.00 0.00 N ATOM 1337 CD2 HIS A 474 9.337 11.814 0.193 1.00 0.00 C ATOM 1338 CE1 HIS A 474 9.899 12.930 -1.576 1.00 0.00 C ATOM 1339 NE2 HIS A 474 9.573 13.092 -0.303 1.00 0.00 N ATOM 0 H HIS A 474 8.355 6.937 -1.468 1.00 0.00 H new ATOM 0 HA HIS A 474 7.462 9.327 0.051 1.00 0.00 H new ATOM 0 HB2 HIS A 474 9.940 9.045 0.130 1.00 0.00 H new ATOM 0 HB3 HIS A 474 9.968 9.004 -1.621 1.00 0.00 H new ATOM 0 HD1 HIS A 474 10.096 11.253 -2.835 1.00 0.00 H new ATOM 0 HD2 HIS A 474 9.047 11.580 1.207 1.00 0.00 H new ATOM 0 HE1 HIS A 474 10.145 13.735 -2.252 1.00 0.00 H new ATOM 1347 N PHE A 475 6.269 9.908 -2.069 1.00 0.00 N ATOM 1348 CA PHE A 475 5.536 10.188 -3.285 1.00 0.00 C ATOM 1349 C PHE A 475 6.160 11.307 -4.068 1.00 0.00 C ATOM 1350 O PHE A 475 6.873 12.143 -3.511 1.00 0.00 O ATOM 1351 CB PHE A 475 4.062 10.470 -3.008 1.00 0.00 C ATOM 1352 CG PHE A 475 3.260 9.246 -2.661 1.00 0.00 C ATOM 1353 CD1 PHE A 475 2.463 8.642 -3.619 1.00 0.00 C ATOM 1354 CD2 PHE A 475 3.300 8.701 -1.392 1.00 0.00 C ATOM 1355 CE1 PHE A 475 1.723 7.521 -3.317 1.00 0.00 C ATOM 1356 CE2 PHE A 475 2.561 7.577 -1.085 1.00 0.00 C ATOM 1357 CZ PHE A 475 1.772 6.987 -2.046 1.00 0.00 C ATOM 0 H PHE A 475 5.893 10.350 -1.230 1.00 0.00 H new ATOM 0 HA PHE A 475 5.590 9.287 -3.897 1.00 0.00 H new ATOM 0 HB2 PHE A 475 3.987 11.185 -2.189 1.00 0.00 H new ATOM 0 HB3 PHE A 475 3.622 10.943 -3.886 1.00 0.00 H new ATOM 0 HD1 PHE A 475 2.421 9.056 -4.616 1.00 0.00 H new ATOM 0 HD2 PHE A 475 3.916 9.159 -0.633 1.00 0.00 H new ATOM 0 HE1 PHE A 475 1.105 7.061 -4.074 1.00 0.00 H new ATOM 0 HE2 PHE A 475 2.602 7.160 -0.090 1.00 0.00 H new ATOM 0 HZ PHE A 475 1.193 6.108 -1.806 1.00 0.00 H new ATOM 1429 N LEU A 480 0.682 17.682 -5.227 1.00 0.00 N ATOM 1430 CA LEU A 480 0.613 17.877 -3.796 1.00 0.00 C ATOM 1431 C LEU A 480 -0.833 17.932 -3.311 1.00 0.00 C ATOM 1432 O LEU A 480 -1.122 17.660 -2.142 1.00 0.00 O ATOM 1433 CB LEU A 480 1.392 19.131 -3.397 1.00 0.00 C ATOM 1434 CG LEU A 480 2.896 19.102 -3.720 1.00 0.00 C ATOM 1435 CD1 LEU A 480 3.545 20.429 -3.390 1.00 0.00 C ATOM 1436 CD2 LEU A 480 3.588 17.974 -2.962 1.00 0.00 C ATOM 0 HA LEU A 480 1.077 17.020 -3.308 1.00 0.00 H new ATOM 0 HB2 LEU A 480 0.946 19.990 -3.898 1.00 0.00 H new ATOM 0 HB3 LEU A 480 1.270 19.288 -2.325 1.00 0.00 H new ATOM 0 HG LEU A 480 3.006 18.922 -4.789 1.00 0.00 H new ATOM 0 HD11 LEU A 480 4.608 20.383 -3.627 1.00 0.00 H new ATOM 0 HD12 LEU A 480 3.076 21.219 -3.976 1.00 0.00 H new ATOM 0 HD13 LEU A 480 3.419 20.642 -2.328 1.00 0.00 H new ATOM 0 HD21 LEU A 480 4.651 17.971 -3.205 1.00 0.00 H new ATOM 0 HD22 LEU A 480 3.461 18.124 -1.890 1.00 0.00 H new ATOM 0 HD23 LEU A 480 3.148 17.019 -3.249 1.00 0.00 H new ATOM 1448 N GLU A 481 -1.727 18.303 -4.202 1.00 0.00 N ATOM 1449 CA GLU A 481 -3.143 18.383 -3.894 1.00 0.00 C ATOM 1450 C GLU A 481 -3.789 17.012 -3.716 1.00 0.00 C ATOM 1451 O GLU A 481 -4.541 16.803 -2.767 1.00 0.00 O ATOM 1452 CB GLU A 481 -3.877 19.228 -4.912 1.00 0.00 C ATOM 1453 CG GLU A 481 -3.469 20.686 -4.862 1.00 0.00 C ATOM 1454 CD GLU A 481 -3.694 21.277 -3.493 1.00 0.00 C ATOM 1455 OE1 GLU A 481 -2.735 21.400 -2.711 1.00 0.00 O ATOM 1456 OE2 GLU A 481 -4.839 21.613 -3.165 1.00 0.00 O ATOM 0 H GLU A 481 -1.495 18.558 -5.162 1.00 0.00 H new ATOM 0 HA GLU A 481 -3.228 18.880 -2.928 1.00 0.00 H new ATOM 0 HB2 GLU A 481 -3.686 18.835 -5.911 1.00 0.00 H new ATOM 0 HB3 GLU A 481 -4.950 19.149 -4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 481 -2.417 20.780 -5.131 1.00 0.00 H new ATOM 0 HG3 GLU A 481 -4.039 21.250 -5.601 1.00 0.00 H new ATOM 1463 N SER A 482 -3.492 16.077 -4.610 1.00 0.00 N ATOM 1464 CA SER A 482 -4.007 14.721 -4.471 1.00 0.00 C ATOM 1465 C SER A 482 -3.442 14.088 -3.201 1.00 0.00 C ATOM 1466 O SER A 482 -4.141 13.367 -2.476 1.00 0.00 O ATOM 1467 CB SER A 482 -3.640 13.873 -5.685 1.00 0.00 C ATOM 1468 OG SER A 482 -4.157 14.429 -6.893 1.00 0.00 O ATOM 0 H SER A 482 -2.904 16.230 -5.430 1.00 0.00 H new ATOM 0 HA SER A 482 -5.094 14.766 -4.404 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.555 13.791 -5.757 1.00 0.00 H new ATOM 0 HB3 SER A 482 -4.028 12.863 -5.554 1.00 0.00 H new ATOM 0 HG SER A 482 -3.902 13.861 -7.650 1.00 0.00 H new ATOM 1474 N LEU A 483 -2.182 14.403 -2.920 1.00 0.00 N ATOM 1475 CA LEU A 483 -1.516 13.928 -1.726 1.00 0.00 C ATOM 1476 C LEU A 483 -2.172 14.489 -0.478 1.00 0.00 C ATOM 1477 O LEU A 483 -2.338 13.782 0.493 1.00 0.00 O ATOM 1478 CB LEU A 483 -0.023 14.272 -1.755 1.00 0.00 C ATOM 1479 CG LEU A 483 0.821 13.506 -2.777 1.00 0.00 C ATOM 1480 CD1 LEU A 483 2.246 14.034 -2.785 1.00 0.00 C ATOM 1481 CD2 LEU A 483 0.819 12.018 -2.453 1.00 0.00 C ATOM 0 H LEU A 483 -1.601 14.993 -3.515 1.00 0.00 H new ATOM 0 HA LEU A 483 -1.612 12.843 -1.701 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.080 15.339 -1.954 1.00 0.00 H new ATOM 0 HB3 LEU A 483 0.391 14.091 -0.763 1.00 0.00 H new ATOM 0 HG LEU A 483 0.386 13.652 -3.766 1.00 0.00 H new ATOM 0 HD11 LEU A 483 2.835 13.480 -3.516 1.00 0.00 H new ATOM 0 HD12 LEU A 483 2.241 15.092 -3.049 1.00 0.00 H new ATOM 0 HD13 LEU A 483 2.686 13.909 -1.795 1.00 0.00 H new ATOM 0 HD21 LEU A 483 1.423 11.485 -3.187 1.00 0.00 H new ATOM 0 HD22 LEU A 483 1.236 11.862 -1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -0.203 11.641 -2.481 1.00 0.00 H new ATOM 1493 N LYS A 484 -2.611 15.731 -0.561 1.00 0.00 N ATOM 1494 CA LYS A 484 -3.248 16.445 0.550 1.00 0.00 C ATOM 1495 C LYS A 484 -4.434 15.644 1.098 1.00 0.00 C ATOM 1496 O LYS A 484 -4.579 15.490 2.323 1.00 0.00 O ATOM 1497 CB LYS A 484 -3.726 17.807 0.037 1.00 0.00 C ATOM 1498 CG LYS A 484 -4.439 18.700 1.043 1.00 0.00 C ATOM 1499 CD LYS A 484 -5.008 19.943 0.354 1.00 0.00 C ATOM 1500 CE LYS A 484 -6.127 19.581 -0.628 1.00 0.00 C ATOM 1501 NZ LYS A 484 -6.619 20.743 -1.388 1.00 0.00 N ATOM 0 H LYS A 484 -2.538 16.288 -1.412 1.00 0.00 H new ATOM 0 HA LYS A 484 -2.530 16.578 1.360 1.00 0.00 H new ATOM 0 HB2 LYS A 484 -2.862 18.349 -0.348 1.00 0.00 H new ATOM 0 HB3 LYS A 484 -4.397 17.638 -0.805 1.00 0.00 H new ATOM 0 HG2 LYS A 484 -5.244 18.144 1.524 1.00 0.00 H new ATOM 0 HG3 LYS A 484 -3.744 18.999 1.828 1.00 0.00 H new ATOM 0 HD2 LYS A 484 -5.392 20.633 1.106 1.00 0.00 H new ATOM 0 HD3 LYS A 484 -4.211 20.462 -0.178 1.00 0.00 H new ATOM 0 HE2 LYS A 484 -5.763 18.825 -1.324 1.00 0.00 H new ATOM 0 HE3 LYS A 484 -6.956 19.135 -0.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 -7.564 20.534 -1.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 -6.674 21.570 -0.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 -5.967 20.946 -2.172 1.00 0.00 H new ATOM 1515 N GLY A 485 -5.243 15.117 0.194 1.00 0.00 N ATOM 1516 CA GLY A 485 -6.376 14.313 0.580 1.00 0.00 C ATOM 1517 C GLY A 485 -5.954 12.975 1.170 1.00 0.00 C ATOM 1518 O GLY A 485 -6.482 12.550 2.201 1.00 0.00 O ATOM 0 H GLY A 485 -5.130 15.236 -0.813 1.00 0.00 H new ATOM 0 HA2 GLY A 485 -6.975 14.858 1.310 1.00 0.00 H new ATOM 0 HA3 GLY A 485 -7.011 14.141 -0.289 1.00 0.00 H new ATOM 1522 N LEU A 486 -4.977 12.336 0.533 1.00 0.00 N ATOM 1523 CA LEU A 486 -4.485 11.027 0.947 1.00 0.00 C ATOM 1524 C LEU A 486 -3.846 11.120 2.353 1.00 0.00 C ATOM 1525 O LEU A 486 -4.085 10.263 3.210 1.00 0.00 O ATOM 1526 CB LEU A 486 -3.490 10.498 -0.122 1.00 0.00 C ATOM 1527 CG LEU A 486 -3.171 8.981 -0.134 1.00 0.00 C ATOM 1528 CD1 LEU A 486 -2.414 8.621 -1.395 1.00 0.00 C ATOM 1529 CD2 LEU A 486 -2.351 8.548 1.067 1.00 0.00 C ATOM 0 H LEU A 486 -4.503 12.713 -0.288 1.00 0.00 H new ATOM 0 HA LEU A 486 -5.309 10.317 1.020 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -3.882 10.764 -1.104 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -2.550 11.036 0.002 1.00 0.00 H new ATOM 0 HG LEU A 486 -4.127 8.459 -0.096 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -2.194 7.553 -1.395 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -3.021 8.866 -2.266 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -1.481 9.184 -1.433 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -2.157 7.477 1.008 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -1.405 9.089 1.075 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -2.902 8.767 1.982 1.00 0.00 H new ATOM 1541 N TYR A 487 -3.071 12.177 2.582 1.00 0.00 N ATOM 1542 CA TYR A 487 -2.443 12.432 3.883 1.00 0.00 C ATOM 1543 C TYR A 487 -3.487 12.548 4.991 1.00 0.00 C ATOM 1544 O TYR A 487 -3.308 12.005 6.080 1.00 0.00 O ATOM 1545 CB TYR A 487 -1.569 13.697 3.838 1.00 0.00 C ATOM 1546 CG TYR A 487 -0.162 13.488 3.296 1.00 0.00 C ATOM 1547 CD1 TYR A 487 0.071 13.210 1.962 1.00 0.00 C ATOM 1548 CD2 TYR A 487 0.933 13.598 4.130 1.00 0.00 C ATOM 1549 CE1 TYR A 487 1.344 13.053 1.468 1.00 0.00 C ATOM 1550 CE2 TYR A 487 2.214 13.436 3.649 1.00 0.00 C ATOM 1551 CZ TYR A 487 2.415 13.165 2.315 1.00 0.00 C ATOM 1552 OH TYR A 487 3.704 13.024 1.819 1.00 0.00 O ATOM 0 H TYR A 487 -2.859 12.881 1.875 1.00 0.00 H new ATOM 0 HA TYR A 487 -1.803 11.579 4.107 1.00 0.00 H new ATOM 0 HB2 TYR A 487 -2.071 14.445 3.225 1.00 0.00 H new ATOM 0 HB3 TYR A 487 -1.497 14.107 4.846 1.00 0.00 H new ATOM 0 HD1 TYR A 487 -0.769 13.114 1.290 1.00 0.00 H new ATOM 0 HD2 TYR A 487 0.783 13.815 5.177 1.00 0.00 H new ATOM 0 HE1 TYR A 487 1.499 12.843 0.420 1.00 0.00 H new ATOM 0 HE2 TYR A 487 3.058 13.522 4.317 1.00 0.00 H new ATOM 0 HH TYR A 487 4.349 13.132 2.549 1.00 0.00 H new ATOM 1562 N ARG A 488 -4.594 13.209 4.686 1.00 0.00 N ATOM 1563 CA ARG A 488 -5.677 13.392 5.648 1.00 0.00 C ATOM 1564 C ARG A 488 -6.343 12.039 5.963 1.00 0.00 C ATOM 1565 O ARG A 488 -6.711 11.773 7.104 1.00 0.00 O ATOM 1566 CB ARG A 488 -6.681 14.477 5.127 1.00 0.00 C ATOM 1567 CG ARG A 488 -7.898 14.808 6.029 1.00 0.00 C ATOM 1568 CD ARG A 488 -9.024 13.796 5.862 1.00 0.00 C ATOM 1569 NE ARG A 488 -10.217 14.097 6.674 1.00 0.00 N ATOM 1570 CZ ARG A 488 -11.444 13.600 6.417 1.00 0.00 C ATOM 1571 NH1 ARG A 488 -11.668 12.945 5.272 1.00 0.00 N ATOM 1572 NH2 ARG A 488 -12.448 13.806 7.275 1.00 0.00 N ATOM 0 H ARG A 488 -4.769 13.631 3.774 1.00 0.00 H new ATOM 0 HA ARG A 488 -5.280 13.765 6.592 1.00 0.00 H new ATOM 0 HB2 ARG A 488 -6.125 15.399 4.959 1.00 0.00 H new ATOM 0 HB3 ARG A 488 -7.058 14.151 4.158 1.00 0.00 H new ATOM 0 HG2 ARG A 488 -7.581 14.829 7.072 1.00 0.00 H new ATOM 0 HG3 ARG A 488 -8.268 15.805 5.788 1.00 0.00 H new ATOM 0 HD2 ARG A 488 -9.311 13.756 4.811 1.00 0.00 H new ATOM 0 HD3 ARG A 488 -8.654 12.806 6.129 1.00 0.00 H new ATOM 0 HE ARG A 488 -10.108 14.717 7.477 1.00 0.00 H new ATOM 0 HH11 ARG A 488 -10.912 12.823 4.598 1.00 0.00 H new ATOM 0 HH12 ARG A 488 -12.594 12.567 5.073 1.00 0.00 H new ATOM 0 HH21 ARG A 488 -12.288 14.341 8.128 1.00 0.00 H new ATOM 0 HH22 ARG A 488 -13.374 13.428 7.076 1.00 0.00 H new ATOM 1586 N ILE A 489 -6.475 11.190 4.952 1.00 0.00 N ATOM 1587 CA ILE A 489 -7.051 9.859 5.138 1.00 0.00 C ATOM 1588 C ILE A 489 -6.108 8.986 5.980 1.00 0.00 C ATOM 1589 O ILE A 489 -6.525 8.341 6.943 1.00 0.00 O ATOM 1590 CB ILE A 489 -7.367 9.163 3.779 1.00 0.00 C ATOM 1591 CG1 ILE A 489 -8.330 10.023 2.950 1.00 0.00 C ATOM 1592 CG2 ILE A 489 -7.969 7.780 4.014 1.00 0.00 C ATOM 1593 CD1 ILE A 489 -8.660 9.451 1.584 1.00 0.00 C ATOM 0 H ILE A 489 -6.192 11.397 3.994 1.00 0.00 H new ATOM 0 HA ILE A 489 -7.996 9.981 5.667 1.00 0.00 H new ATOM 0 HB ILE A 489 -6.434 9.048 3.227 1.00 0.00 H new ATOM 0 HG12 ILE A 489 -9.256 10.153 3.510 1.00 0.00 H new ATOM 0 HG13 ILE A 489 -7.894 11.014 2.820 1.00 0.00 H new ATOM 0 HG21 ILE A 489 -8.183 7.309 3.055 1.00 0.00 H new ATOM 0 HG22 ILE A 489 -7.262 7.165 4.570 1.00 0.00 H new ATOM 0 HG23 ILE A 489 -8.892 7.877 4.585 1.00 0.00 H new ATOM 0 HD11 ILE A 489 -9.346 10.121 1.065 1.00 0.00 H new ATOM 0 HD12 ILE A 489 -7.744 9.347 1.002 1.00 0.00 H new ATOM 0 HD13 ILE A 489 -9.127 8.473 1.702 1.00 0.00 H new ATOM 1605 N MET A 490 -4.834 9.022 5.648 1.00 0.00 N ATOM 1606 CA MET A 490 -3.814 8.258 6.373 1.00 0.00 C ATOM 1607 C MET A 490 -3.692 8.720 7.817 1.00 0.00 C ATOM 1608 O MET A 490 -3.504 7.907 8.737 1.00 0.00 O ATOM 1609 CB MET A 490 -2.471 8.371 5.679 1.00 0.00 C ATOM 1610 CG MET A 490 -2.262 7.402 4.532 1.00 0.00 C ATOM 1611 SD MET A 490 -2.131 5.696 5.103 1.00 0.00 S ATOM 1612 CE MET A 490 -1.728 4.833 3.584 1.00 0.00 C ATOM 0 H MET A 490 -4.468 9.576 4.874 1.00 0.00 H new ATOM 0 HA MET A 490 -4.128 7.214 6.376 1.00 0.00 H new ATOM 0 HB2 MET A 490 -2.358 9.387 5.302 1.00 0.00 H new ATOM 0 HB3 MET A 490 -1.683 8.214 6.416 1.00 0.00 H new ATOM 0 HG2 MET A 490 -3.092 7.487 3.830 1.00 0.00 H new ATOM 0 HG3 MET A 490 -1.357 7.673 3.989 1.00 0.00 H new ATOM 0 HE1 MET A 490 -2.556 4.182 3.305 1.00 0.00 H new ATOM 0 HE2 MET A 490 -1.552 5.558 2.789 1.00 0.00 H new ATOM 0 HE3 MET A 490 -0.830 4.233 3.733 1.00 0.00 H new ATOM 1622 N GLY A 491 -3.823 10.013 8.018 1.00 0.00 N ATOM 1623 CA GLY A 491 -3.770 10.579 9.345 1.00 0.00 C ATOM 1624 C GLY A 491 -5.045 10.325 10.133 1.00 0.00 C ATOM 1625 O GLY A 491 -5.095 10.562 11.337 1.00 0.00 O ATOM 0 H GLY A 491 -3.968 10.695 7.273 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -2.922 10.156 9.884 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -3.598 11.653 9.273 1.00 0.00 H new ATOM 1629 N ASN A 492 -6.075 9.825 9.461 1.00 0.00 N ATOM 1630 CA ASN A 492 -7.369 9.565 10.098 1.00 0.00 C ATOM 1631 C ASN A 492 -7.423 8.110 10.604 1.00 0.00 C ATOM 1632 O ASN A 492 -8.460 7.613 11.033 1.00 0.00 O ATOM 1633 CB ASN A 492 -8.520 9.846 9.100 1.00 0.00 C ATOM 1634 CG ASN A 492 -9.897 9.993 9.756 1.00 0.00 C ATOM 1635 OD1 ASN A 492 -10.286 11.092 10.150 1.00 0.00 O ATOM 1636 ND2 ASN A 492 -10.641 8.917 9.868 1.00 0.00 N ATOM 0 H ASN A 492 -6.043 9.589 8.469 1.00 0.00 H new ATOM 0 HA ASN A 492 -7.488 10.231 10.952 1.00 0.00 H new ATOM 0 HB2 ASN A 492 -8.293 10.758 8.548 1.00 0.00 H new ATOM 0 HB3 ASN A 492 -8.561 9.036 8.372 1.00 0.00 H new ATOM 0 HD21 ASN A 492 -11.567 8.979 10.290 1.00 0.00 H new ATOM 0 HD22 ASN A 492 -10.293 8.019 9.533 1.00 0.00 H new ATOM 1643 N GLY A 493 -6.298 7.431 10.549 1.00 0.00 N ATOM 1644 CA GLY A 493 -6.241 6.080 11.071 1.00 0.00 C ATOM 1645 C GLY A 493 -6.541 5.034 10.026 1.00 0.00 C ATOM 1646 O GLY A 493 -7.088 3.959 10.334 1.00 0.00 O ATOM 0 H GLY A 493 -5.425 7.782 10.156 1.00 0.00 H new ATOM 0 HA2 GLY A 493 -5.250 5.898 11.486 1.00 0.00 H new ATOM 0 HA3 GLY A 493 -6.953 5.982 11.891 1.00 0.00 H new ATOM 1650 N PHE A 494 -6.221 5.339 8.798 1.00 0.00 N ATOM 1651 CA PHE A 494 -6.393 4.406 7.720 1.00 0.00 C ATOM 1652 C PHE A 494 -5.049 3.916 7.235 1.00 0.00 C ATOM 1653 O PHE A 494 -4.029 4.572 7.447 1.00 0.00 O ATOM 1654 CB PHE A 494 -7.196 5.009 6.567 1.00 0.00 C ATOM 1655 CG PHE A 494 -8.638 5.231 6.907 1.00 0.00 C ATOM 1656 CD1 PHE A 494 -9.485 4.155 7.051 1.00 0.00 C ATOM 1657 CD2 PHE A 494 -9.147 6.503 7.082 1.00 0.00 C ATOM 1658 CE1 PHE A 494 -10.808 4.331 7.364 1.00 0.00 C ATOM 1659 CE2 PHE A 494 -10.477 6.693 7.395 1.00 0.00 C ATOM 1660 CZ PHE A 494 -11.310 5.604 7.538 1.00 0.00 C ATOM 0 H PHE A 494 -5.834 6.240 8.517 1.00 0.00 H new ATOM 0 HA PHE A 494 -6.963 3.559 8.102 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -6.747 5.959 6.277 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -7.130 4.349 5.702 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -9.100 3.155 6.915 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -8.497 7.358 6.973 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -11.456 3.474 7.474 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -10.865 7.692 7.528 1.00 0.00 H new ATOM 0 HZ PHE A 494 -12.352 5.747 7.785 1.00 0.00 H new ATOM 1670 N ALA A 495 -5.056 2.776 6.622 1.00 0.00 N ATOM 1671 CA ALA A 495 -3.883 2.150 6.090 1.00 0.00 C ATOM 1672 C ALA A 495 -4.158 1.794 4.650 1.00 0.00 C ATOM 1673 O ALA A 495 -5.324 1.708 4.246 1.00 0.00 O ATOM 1674 CB ALA A 495 -3.566 0.896 6.885 1.00 0.00 C ATOM 0 H ALA A 495 -5.907 2.234 6.472 1.00 0.00 H new ATOM 0 HA ALA A 495 -3.028 2.824 6.154 1.00 0.00 H new ATOM 0 HB1 ALA A 495 -2.673 0.423 6.477 1.00 0.00 H new ATOM 0 HB2 ALA A 495 -3.392 1.161 7.928 1.00 0.00 H new ATOM 0 HB3 ALA A 495 -4.405 0.203 6.821 1.00 0.00 H new ATOM 1680 N GLY A 496 -3.134 1.582 3.888 1.00 0.00 N ATOM 1681 CA GLY A 496 -3.323 1.263 2.516 1.00 0.00 C ATOM 1682 C GLY A 496 -2.784 -0.088 2.191 1.00 0.00 C ATOM 1683 O GLY A 496 -1.581 -0.289 2.177 1.00 0.00 O ATOM 0 H GLY A 496 -2.162 1.624 4.194 1.00 0.00 H new ATOM 0 HA2 GLY A 496 -4.386 1.300 2.276 1.00 0.00 H new ATOM 0 HA3 GLY A 496 -2.830 2.012 1.896 1.00 0.00 H new ATOM 1687 N CYS A 497 -3.647 -1.020 1.940 1.00 0.00 N ATOM 1688 CA CYS A 497 -3.200 -2.329 1.576 1.00 0.00 C ATOM 1689 C CYS A 497 -2.882 -2.322 0.097 1.00 0.00 C ATOM 1690 O CYS A 497 -3.741 -1.972 -0.736 1.00 0.00 O ATOM 1691 CB CYS A 497 -4.243 -3.404 1.947 1.00 0.00 C ATOM 1692 SG CYS A 497 -5.905 -3.132 1.281 1.00 0.00 S ATOM 0 H CYS A 497 -4.659 -0.902 1.980 1.00 0.00 H new ATOM 0 HA CYS A 497 -2.300 -2.587 2.134 1.00 0.00 H new ATOM 0 HB2 CYS A 497 -3.883 -4.372 1.597 1.00 0.00 H new ATOM 0 HB3 CYS A 497 -4.310 -3.462 3.033 1.00 0.00 H new ATOM 0 HG CYS A 497 -6.205 -1.870 1.366 1.00 0.00 H new ATOM 1698 N VAL A 498 -1.658 -2.625 -0.233 1.00 0.00 N ATOM 1699 CA VAL A 498 -1.229 -2.592 -1.591 1.00 0.00 C ATOM 1700 C VAL A 498 -1.169 -4.001 -2.133 1.00 0.00 C ATOM 1701 O VAL A 498 -0.419 -4.861 -1.630 1.00 0.00 O ATOM 1702 CB VAL A 498 0.167 -1.914 -1.733 1.00 0.00 C ATOM 1703 CG1 VAL A 498 0.601 -1.853 -3.189 1.00 0.00 C ATOM 1704 CG2 VAL A 498 0.156 -0.518 -1.125 1.00 0.00 C ATOM 0 H VAL A 498 -0.937 -2.900 0.434 1.00 0.00 H new ATOM 0 HA VAL A 498 -1.947 -2.003 -2.161 1.00 0.00 H new ATOM 0 HB VAL A 498 0.888 -2.523 -1.188 1.00 0.00 H new ATOM 0 HG11 VAL A 498 1.578 -1.375 -3.258 1.00 0.00 H new ATOM 0 HG12 VAL A 498 0.662 -2.863 -3.593 1.00 0.00 H new ATOM 0 HG13 VAL A 498 -0.126 -1.277 -3.761 1.00 0.00 H new ATOM 0 HG21 VAL A 498 1.141 -0.065 -1.236 1.00 0.00 H new ATOM 0 HG22 VAL A 498 -0.585 0.096 -1.636 1.00 0.00 H new ATOM 0 HG23 VAL A 498 -0.096 -0.584 -0.066 1.00 0.00 H new ATOM 1714 N HIS A 499 -1.931 -4.225 -3.152 1.00 0.00 N ATOM 1715 CA HIS A 499 -1.977 -5.483 -3.805 1.00 0.00 C ATOM 1716 C HIS A 499 -1.398 -5.364 -5.165 1.00 0.00 C ATOM 1717 O HIS A 499 -1.624 -4.368 -5.887 1.00 0.00 O ATOM 1718 CB HIS A 499 -3.388 -6.079 -3.845 1.00 0.00 C ATOM 1719 CG HIS A 499 -3.811 -6.692 -2.546 1.00 0.00 C ATOM 1720 ND1 HIS A 499 -4.600 -6.070 -1.605 1.00 0.00 N ATOM 1721 CD2 HIS A 499 -3.521 -7.910 -2.037 1.00 0.00 C ATOM 1722 CE1 HIS A 499 -4.746 -6.910 -0.578 1.00 0.00 C ATOM 1723 NE2 HIS A 499 -4.116 -8.040 -0.793 1.00 0.00 N ATOM 0 H HIS A 499 -2.549 -3.523 -3.559 1.00 0.00 H new ATOM 0 HA HIS A 499 -1.376 -6.181 -3.222 1.00 0.00 H new ATOM 0 HB2 HIS A 499 -4.097 -5.297 -4.117 1.00 0.00 H new ATOM 0 HB3 HIS A 499 -3.432 -6.837 -4.627 1.00 0.00 H new ATOM 0 HD1 HIS A 499 -5.001 -5.135 -1.679 1.00 0.00 H new ATOM 0 HD2 HIS A 499 -2.920 -8.664 -2.524 1.00 0.00 H new ATOM 0 HE1 HIS A 499 -5.311 -6.688 0.315 1.00 0.00 H new ATOM 1731 N PHE A 500 -0.630 -6.333 -5.497 1.00 0.00 N ATOM 1732 CA PHE A 500 0.046 -6.385 -6.740 1.00 0.00 C ATOM 1733 C PHE A 500 -0.749 -7.274 -7.650 1.00 0.00 C ATOM 1734 O PHE A 500 -0.915 -8.463 -7.341 1.00 0.00 O ATOM 1735 CB PHE A 500 1.452 -6.981 -6.556 1.00 0.00 C ATOM 1736 CG PHE A 500 2.404 -6.218 -5.649 1.00 0.00 C ATOM 1737 CD1 PHE A 500 2.096 -5.971 -4.323 1.00 0.00 C ATOM 1738 CD2 PHE A 500 3.631 -5.791 -6.123 1.00 0.00 C ATOM 1739 CE1 PHE A 500 2.980 -5.320 -3.497 1.00 0.00 C ATOM 1740 CE2 PHE A 500 4.514 -5.135 -5.301 1.00 0.00 C ATOM 1741 CZ PHE A 500 4.191 -4.901 -3.984 1.00 0.00 C ATOM 0 H PHE A 500 -0.448 -7.136 -4.895 1.00 0.00 H new ATOM 0 HA PHE A 500 0.145 -5.382 -7.156 1.00 0.00 H new ATOM 0 HB2 PHE A 500 1.344 -7.992 -6.163 1.00 0.00 H new ATOM 0 HB3 PHE A 500 1.915 -7.069 -7.539 1.00 0.00 H new ATOM 0 HD1 PHE A 500 1.144 -6.296 -3.930 1.00 0.00 H new ATOM 0 HD2 PHE A 500 3.898 -5.976 -7.153 1.00 0.00 H new ATOM 0 HE1 PHE A 500 2.721 -5.138 -2.464 1.00 0.00 H new ATOM 0 HE2 PHE A 500 5.465 -4.802 -5.689 1.00 0.00 H new ATOM 0 HZ PHE A 500 4.888 -4.390 -3.337 1.00 0.00 H new ATOM 1751 N PRO A 501 -1.316 -6.720 -8.742 1.00 0.00 N ATOM 1752 CA PRO A 501 -2.034 -7.514 -9.730 1.00 0.00 C ATOM 1753 C PRO A 501 -1.094 -8.565 -10.280 1.00 0.00 C ATOM 1754 O PRO A 501 -0.129 -8.244 -10.990 1.00 0.00 O ATOM 1755 CB PRO A 501 -2.402 -6.498 -10.824 1.00 0.00 C ATOM 1756 CG PRO A 501 -2.370 -5.178 -10.139 1.00 0.00 C ATOM 1757 CD PRO A 501 -1.304 -5.285 -9.090 1.00 0.00 C ATOM 0 HA PRO A 501 -2.910 -8.026 -9.333 1.00 0.00 H new ATOM 0 HB2 PRO A 501 -1.693 -6.532 -11.651 1.00 0.00 H new ATOM 0 HB3 PRO A 501 -3.388 -6.704 -11.241 1.00 0.00 H new ATOM 0 HG2 PRO A 501 -2.145 -4.378 -10.844 1.00 0.00 H new ATOM 0 HG3 PRO A 501 -3.337 -4.947 -9.691 1.00 0.00 H new ATOM 0 HD2 PRO A 501 -0.332 -4.971 -9.470 1.00 0.00 H new ATOM 0 HD3 PRO A 501 -1.525 -4.659 -8.226 1.00 0.00 H new ATOM 1846 N VAL A 508 3.700 -13.180 -6.179 1.00 0.00 N ATOM 1847 CA VAL A 508 3.999 -11.781 -6.224 1.00 0.00 C ATOM 1848 C VAL A 508 3.702 -11.248 -4.843 1.00 0.00 C ATOM 1849 O VAL A 508 2.538 -11.216 -4.429 1.00 0.00 O ATOM 1850 CB VAL A 508 3.166 -11.026 -7.292 1.00 0.00 C ATOM 1851 CG1 VAL A 508 3.629 -9.579 -7.393 1.00 0.00 C ATOM 1852 CG2 VAL A 508 3.281 -11.709 -8.649 1.00 0.00 C ATOM 0 HA VAL A 508 5.040 -11.629 -6.508 1.00 0.00 H new ATOM 0 HB VAL A 508 2.120 -11.043 -6.986 1.00 0.00 H new ATOM 0 HG11 VAL A 508 3.037 -9.059 -8.146 1.00 0.00 H new ATOM 0 HG12 VAL A 508 3.501 -9.088 -6.428 1.00 0.00 H new ATOM 0 HG13 VAL A 508 4.681 -9.553 -7.677 1.00 0.00 H new ATOM 0 HG21 VAL A 508 2.689 -11.162 -9.383 1.00 0.00 H new ATOM 0 HG22 VAL A 508 4.325 -11.722 -8.962 1.00 0.00 H new ATOM 0 HG23 VAL A 508 2.912 -12.732 -8.574 1.00 0.00 H new ATOM 1862 N ARG A 509 4.771 -10.901 -4.115 1.00 0.00 N ATOM 1863 CA ARG A 509 4.673 -10.451 -2.727 1.00 0.00 C ATOM 1864 C ARG A 509 3.747 -9.244 -2.624 1.00 0.00 C ATOM 1865 O ARG A 509 3.664 -8.466 -3.563 1.00 0.00 O ATOM 1866 CB ARG A 509 6.059 -10.101 -2.143 1.00 0.00 C ATOM 1867 CG ARG A 509 7.062 -11.263 -1.974 1.00 0.00 C ATOM 1868 CD ARG A 509 8.119 -11.362 -3.093 1.00 0.00 C ATOM 1869 NE ARG A 509 7.635 -11.895 -4.387 1.00 0.00 N ATOM 1870 CZ ARG A 509 8.313 -11.788 -5.562 1.00 0.00 C ATOM 1871 NH1 ARG A 509 9.498 -11.172 -5.603 1.00 0.00 N ATOM 1872 NH2 ARG A 509 7.833 -12.367 -6.658 1.00 0.00 N ATOM 0 H ARG A 509 5.725 -10.925 -4.474 1.00 0.00 H new ATOM 0 HA ARG A 509 4.259 -11.274 -2.144 1.00 0.00 H new ATOM 0 HB2 ARG A 509 6.517 -9.349 -2.785 1.00 0.00 H new ATOM 0 HB3 ARG A 509 5.909 -9.639 -1.167 1.00 0.00 H new ATOM 0 HG2 ARG A 509 7.573 -11.149 -1.018 1.00 0.00 H new ATOM 0 HG3 ARG A 509 6.508 -12.201 -1.930 1.00 0.00 H new ATOM 0 HD2 ARG A 509 8.536 -10.369 -3.263 1.00 0.00 H new ATOM 0 HD3 ARG A 509 8.935 -11.995 -2.742 1.00 0.00 H new ATOM 0 HE ARG A 509 6.734 -12.374 -4.398 1.00 0.00 H new ATOM 0 HH11 ARG A 509 9.898 -10.779 -4.751 1.00 0.00 H new ATOM 0 HH12 ARG A 509 10.002 -11.094 -6.486 1.00 0.00 H new ATOM 0 HH21 ARG A 509 6.958 -12.890 -6.617 1.00 0.00 H new ATOM 0 HH22 ARG A 509 8.339 -12.288 -7.540 1.00 0.00 H new ATOM 1886 N VAL A 510 3.089 -9.075 -1.490 1.00 0.00 N ATOM 1887 CA VAL A 510 2.089 -8.000 -1.345 1.00 0.00 C ATOM 1888 C VAL A 510 2.539 -7.064 -0.258 1.00 0.00 C ATOM 1889 O VAL A 510 3.314 -7.465 0.560 1.00 0.00 O ATOM 1890 CB VAL A 510 0.652 -8.549 -1.093 1.00 0.00 C ATOM 1891 CG1 VAL A 510 0.097 -9.184 -2.356 1.00 0.00 C ATOM 1892 CG2 VAL A 510 0.678 -9.573 0.006 1.00 0.00 C ATOM 0 H VAL A 510 3.217 -9.653 -0.660 1.00 0.00 H new ATOM 0 HA VAL A 510 2.023 -7.452 -2.285 1.00 0.00 H new ATOM 0 HB VAL A 510 0.013 -7.716 -0.801 1.00 0.00 H new ATOM 0 HG11 VAL A 510 -0.907 -9.562 -2.162 1.00 0.00 H new ATOM 0 HG12 VAL A 510 0.057 -8.439 -3.151 1.00 0.00 H new ATOM 0 HG13 VAL A 510 0.742 -10.007 -2.663 1.00 0.00 H new ATOM 0 HG21 VAL A 510 -0.330 -9.951 0.175 1.00 0.00 H new ATOM 0 HG22 VAL A 510 1.331 -10.397 -0.280 1.00 0.00 H new ATOM 0 HG23 VAL A 510 1.052 -9.115 0.922 1.00 0.00 H new ATOM 1902 N LEU A 511 2.057 -5.838 -0.222 1.00 0.00 N ATOM 1903 CA LEU A 511 2.683 -4.855 0.654 1.00 0.00 C ATOM 1904 C LEU A 511 1.662 -4.026 1.439 1.00 0.00 C ATOM 1905 O LEU A 511 0.559 -3.774 0.969 1.00 0.00 O ATOM 1906 CB LEU A 511 3.645 -3.994 -0.236 1.00 0.00 C ATOM 1907 CG LEU A 511 4.458 -2.836 0.362 1.00 0.00 C ATOM 1908 CD1 LEU A 511 5.579 -2.495 -0.610 1.00 0.00 C ATOM 1909 CD2 LEU A 511 3.597 -1.594 0.541 1.00 0.00 C ATOM 0 H LEU A 511 1.263 -5.501 -0.766 1.00 0.00 H new ATOM 0 HA LEU A 511 3.258 -5.351 1.436 1.00 0.00 H new ATOM 0 HB2 LEU A 511 4.358 -4.681 -0.692 1.00 0.00 H new ATOM 0 HB3 LEU A 511 3.043 -3.577 -1.044 1.00 0.00 H new ATOM 0 HG LEU A 511 4.842 -3.142 1.335 1.00 0.00 H new ATOM 0 HD11 LEU A 511 6.172 -1.674 -0.208 1.00 0.00 H new ATOM 0 HD12 LEU A 511 6.216 -3.368 -0.751 1.00 0.00 H new ATOM 0 HD13 LEU A 511 5.152 -2.199 -1.568 1.00 0.00 H new ATOM 0 HD21 LEU A 511 4.200 -0.791 0.966 1.00 0.00 H new ATOM 0 HD22 LEU A 511 3.205 -1.280 -0.427 1.00 0.00 H new ATOM 0 HD23 LEU A 511 2.768 -1.819 1.212 1.00 0.00 H new ATOM 1921 N MET A 512 2.025 -3.640 2.648 1.00 0.00 N ATOM 1922 CA MET A 512 1.174 -2.776 3.454 1.00 0.00 C ATOM 1923 C MET A 512 1.762 -1.379 3.497 1.00 0.00 C ATOM 1924 O MET A 512 2.917 -1.207 3.872 1.00 0.00 O ATOM 1925 CB MET A 512 1.032 -3.308 4.880 1.00 0.00 C ATOM 1926 CG MET A 512 0.267 -2.362 5.807 1.00 0.00 C ATOM 1927 SD MET A 512 -1.442 -2.074 5.290 1.00 0.00 S ATOM 1928 CE MET A 512 -2.168 -3.671 5.631 1.00 0.00 C ATOM 0 H MET A 512 2.901 -3.909 3.095 1.00 0.00 H new ATOM 0 HA MET A 512 0.185 -2.753 2.996 1.00 0.00 H new ATOM 0 HB2 MET A 512 0.520 -4.270 4.852 1.00 0.00 H new ATOM 0 HB3 MET A 512 2.024 -3.487 5.294 1.00 0.00 H new ATOM 0 HG2 MET A 512 0.269 -2.774 6.816 1.00 0.00 H new ATOM 0 HG3 MET A 512 0.791 -1.407 5.852 1.00 0.00 H new ATOM 0 HE1 MET A 512 -2.550 -4.102 4.706 1.00 0.00 H new ATOM 0 HE2 MET A 512 -1.411 -4.332 6.053 1.00 0.00 H new ATOM 0 HE3 MET A 512 -2.986 -3.555 6.342 1.00 0.00 H new ATOM 1938 N LEU A 513 0.987 -0.401 3.114 1.00 0.00 N ATOM 1939 CA LEU A 513 1.441 0.959 3.118 1.00 0.00 C ATOM 1940 C LEU A 513 0.844 1.712 4.295 1.00 0.00 C ATOM 1941 O LEU A 513 -0.377 1.715 4.511 1.00 0.00 O ATOM 1942 CB LEU A 513 1.104 1.663 1.799 1.00 0.00 C ATOM 1943 CG LEU A 513 1.604 3.103 1.670 1.00 0.00 C ATOM 1944 CD1 LEU A 513 3.093 3.153 1.866 1.00 0.00 C ATOM 1945 CD2 LEU A 513 1.243 3.688 0.322 1.00 0.00 C ATOM 0 H LEU A 513 0.027 -0.526 2.792 1.00 0.00 H new ATOM 0 HA LEU A 513 2.526 0.952 3.222 1.00 0.00 H new ATOM 0 HB2 LEU A 513 1.521 1.078 0.979 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.021 1.661 1.673 1.00 0.00 H new ATOM 0 HG LEU A 513 1.118 3.699 2.443 1.00 0.00 H new ATOM 0 HD11 LEU A 513 3.438 4.183 1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 513 3.342 2.776 2.858 1.00 0.00 H new ATOM 0 HD13 LEU A 513 3.580 2.537 1.110 1.00 0.00 H new ATOM 0 HD21 LEU A 513 1.611 4.712 0.259 1.00 0.00 H new ATOM 0 HD22 LEU A 513 1.698 3.090 -0.468 1.00 0.00 H new ATOM 0 HD23 LEU A 513 0.160 3.684 0.202 1.00 0.00 H new ATOM 1957 N LEU A 514 1.704 2.327 5.044 1.00 0.00 N ATOM 1958 CA LEU A 514 1.354 3.083 6.204 1.00 0.00 C ATOM 1959 C LEU A 514 2.019 4.432 6.149 1.00 0.00 C ATOM 1960 O LEU A 514 3.085 4.588 5.566 1.00 0.00 O ATOM 1961 CB LEU A 514 1.801 2.327 7.453 1.00 0.00 C ATOM 1962 CG LEU A 514 0.961 1.111 7.833 1.00 0.00 C ATOM 1963 CD1 LEU A 514 1.642 0.318 8.926 1.00 0.00 C ATOM 1964 CD2 LEU A 514 -0.413 1.549 8.307 1.00 0.00 C ATOM 0 H LEU A 514 2.707 2.316 4.857 1.00 0.00 H new ATOM 0 HA LEU A 514 0.274 3.224 6.238 1.00 0.00 H new ATOM 0 HB2 LEU A 514 2.831 2.002 7.308 1.00 0.00 H new ATOM 0 HB3 LEU A 514 1.801 3.021 8.293 1.00 0.00 H new ATOM 0 HG LEU A 514 0.854 0.481 6.950 1.00 0.00 H new ATOM 0 HD11 LEU A 514 1.029 -0.546 9.185 1.00 0.00 H new ATOM 0 HD12 LEU A 514 2.617 -0.021 8.576 1.00 0.00 H new ATOM 0 HD13 LEU A 514 1.771 0.948 9.806 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -1.002 0.672 8.575 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -0.308 2.196 9.178 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -0.917 2.094 7.509 1.00 0.00 H new ATOM 1976 N TYR A 515 1.391 5.400 6.697 1.00 0.00 N ATOM 1977 CA TYR A 515 1.961 6.700 6.757 1.00 0.00 C ATOM 1978 C TYR A 515 2.492 6.937 8.140 1.00 0.00 C ATOM 1979 O TYR A 515 1.789 6.713 9.118 1.00 0.00 O ATOM 1980 CB TYR A 515 0.917 7.754 6.405 1.00 0.00 C ATOM 1981 CG TYR A 515 1.387 9.171 6.605 1.00 0.00 C ATOM 1982 CD1 TYR A 515 0.837 9.966 7.601 1.00 0.00 C ATOM 1983 CD2 TYR A 515 2.399 9.703 5.827 1.00 0.00 C ATOM 1984 CE1 TYR A 515 1.284 11.246 7.811 1.00 0.00 C ATOM 1985 CE2 TYR A 515 2.849 10.983 6.028 1.00 0.00 C ATOM 1986 CZ TYR A 515 2.290 11.752 7.022 1.00 0.00 C ATOM 1987 OH TYR A 515 2.741 13.028 7.238 1.00 0.00 O ATOM 0 H TYR A 515 0.466 5.320 7.119 1.00 0.00 H new ATOM 0 HA TYR A 515 2.775 6.773 6.036 1.00 0.00 H new ATOM 0 HB2 TYR A 515 0.620 7.624 5.364 1.00 0.00 H new ATOM 0 HB3 TYR A 515 0.028 7.588 7.013 1.00 0.00 H new ATOM 0 HD1 TYR A 515 0.045 9.571 8.220 1.00 0.00 H new ATOM 0 HD2 TYR A 515 2.842 9.100 5.048 1.00 0.00 H new ATOM 0 HE1 TYR A 515 0.848 11.852 8.591 1.00 0.00 H new ATOM 0 HE2 TYR A 515 3.638 11.385 5.409 1.00 0.00 H new ATOM 0 HH TYR A 515 3.454 13.236 6.598 1.00 0.00 H new ATOM 1997 N SER A 516 3.712 7.359 8.240 1.00 0.00 N ATOM 1998 CA SER A 516 4.256 7.696 9.501 1.00 0.00 C ATOM 1999 C SER A 516 4.315 9.200 9.590 1.00 0.00 C ATOM 2000 O SER A 516 5.074 9.848 8.848 1.00 0.00 O ATOM 2001 CB SER A 516 5.664 7.096 9.656 1.00 0.00 C ATOM 2002 OG SER A 516 6.231 7.404 10.925 1.00 0.00 O ATOM 0 H SER A 516 4.349 7.477 7.452 1.00 0.00 H new ATOM 0 HA SER A 516 3.634 7.293 10.300 1.00 0.00 H new ATOM 0 HB2 SER A 516 5.614 6.014 9.533 1.00 0.00 H new ATOM 0 HB3 SER A 516 6.311 7.477 8.866 1.00 0.00 H new ATOM 0 HG SER A 516 7.124 7.006 10.990 1.00 0.00 H new ATOM 2008 N SER A 517 3.478 9.756 10.448 1.00 0.00 N ATOM 2009 CA SER A 517 3.468 11.167 10.719 1.00 0.00 C ATOM 2010 C SER A 517 4.741 11.541 11.487 1.00 0.00 C ATOM 2011 O SER A 517 5.188 12.674 11.452 1.00 0.00 O ATOM 2012 CB SER A 517 2.194 11.558 11.486 1.00 0.00 C ATOM 2013 OG SER A 517 2.020 12.978 11.548 1.00 0.00 O ATOM 0 H SER A 517 2.783 9.229 10.977 1.00 0.00 H new ATOM 0 HA SER A 517 3.458 11.725 9.783 1.00 0.00 H new ATOM 0 HB2 SER A 517 1.327 11.107 11.003 1.00 0.00 H new ATOM 0 HB3 SER A 517 2.241 11.154 12.497 1.00 0.00 H new ATOM 0 HG SER A 517 2.303 13.304 12.428 1.00 0.00 H new ATOM 2019 N LYS A 518 5.334 10.545 12.145 1.00 0.00 N ATOM 2020 CA LYS A 518 6.561 10.725 12.911 1.00 0.00 C ATOM 2021 C LYS A 518 7.693 11.151 11.986 1.00 0.00 C ATOM 2022 O LYS A 518 8.468 12.061 12.302 1.00 0.00 O ATOM 2023 CB LYS A 518 6.952 9.406 13.594 1.00 0.00 C ATOM 2024 CG LYS A 518 5.961 8.881 14.632 1.00 0.00 C ATOM 2025 CD LYS A 518 5.915 9.738 15.895 1.00 0.00 C ATOM 2026 CE LYS A 518 7.242 9.721 16.659 1.00 0.00 C ATOM 2027 NZ LYS A 518 7.651 8.350 17.069 1.00 0.00 N ATOM 0 H LYS A 518 4.974 9.591 12.160 1.00 0.00 H new ATOM 0 HA LYS A 518 6.390 11.494 13.664 1.00 0.00 H new ATOM 0 HB2 LYS A 518 7.083 8.644 12.825 1.00 0.00 H new ATOM 0 HB3 LYS A 518 7.920 9.541 14.077 1.00 0.00 H new ATOM 0 HG2 LYS A 518 4.966 8.841 14.189 1.00 0.00 H new ATOM 0 HG3 LYS A 518 6.231 7.860 14.901 1.00 0.00 H new ATOM 0 HD2 LYS A 518 5.667 10.765 15.626 1.00 0.00 H new ATOM 0 HD3 LYS A 518 5.119 9.378 16.547 1.00 0.00 H new ATOM 0 HE2 LYS A 518 8.022 10.157 16.034 1.00 0.00 H new ATOM 0 HE3 LYS A 518 7.155 10.350 17.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 518 8.469 8.408 17.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 518 6.861 7.884 17.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 518 7.910 7.798 16.226 1.00 0.00 H new ATOM 2041 N LYS A 519 7.768 10.502 10.844 1.00 0.00 N ATOM 2042 CA LYS A 519 8.806 10.785 9.872 1.00 0.00 C ATOM 2043 C LYS A 519 8.265 11.623 8.707 1.00 0.00 C ATOM 2044 O LYS A 519 9.020 12.014 7.822 1.00 0.00 O ATOM 2045 CB LYS A 519 9.378 9.477 9.326 1.00 0.00 C ATOM 2046 CG LYS A 519 10.042 8.565 10.337 1.00 0.00 C ATOM 2047 CD LYS A 519 11.221 9.238 10.993 1.00 0.00 C ATOM 2048 CE LYS A 519 11.971 8.276 11.880 1.00 0.00 C ATOM 2049 NZ LYS A 519 13.037 8.944 12.636 1.00 0.00 N ATOM 0 H LYS A 519 7.117 9.768 10.563 1.00 0.00 H new ATOM 0 HA LYS A 519 9.588 11.353 10.375 1.00 0.00 H new ATOM 0 HB2 LYS A 519 8.571 8.925 8.844 1.00 0.00 H new ATOM 0 HB3 LYS A 519 10.106 9.718 8.552 1.00 0.00 H new ATOM 0 HG2 LYS A 519 9.318 8.274 11.098 1.00 0.00 H new ATOM 0 HG3 LYS A 519 10.371 7.651 9.844 1.00 0.00 H new ATOM 0 HD2 LYS A 519 11.891 9.631 10.228 1.00 0.00 H new ATOM 0 HD3 LYS A 519 10.877 10.088 11.582 1.00 0.00 H new ATOM 0 HE2 LYS A 519 11.275 7.804 12.574 1.00 0.00 H new ATOM 0 HE3 LYS A 519 12.402 7.481 11.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 13.528 8.248 13.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 13.716 9.373 11.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 12.624 9.686 13.237 1.00 0.00 H new ATOM 2063 N LYS A 520 6.948 11.863 8.722 1.00 0.00 N ATOM 2064 CA LYS A 520 6.213 12.602 7.664 1.00 0.00 C ATOM 2065 C LYS A 520 6.344 11.911 6.302 1.00 0.00 C ATOM 2066 O LYS A 520 6.207 12.539 5.250 1.00 0.00 O ATOM 2067 CB LYS A 520 6.652 14.080 7.587 1.00 0.00 C ATOM 2068 CG LYS A 520 6.384 14.880 8.858 1.00 0.00 C ATOM 2069 CD LYS A 520 4.904 14.878 9.227 1.00 0.00 C ATOM 2070 CE LYS A 520 4.655 15.635 10.518 1.00 0.00 C ATOM 2071 NZ LYS A 520 3.251 15.520 10.976 1.00 0.00 N ATOM 0 H LYS A 520 6.343 11.547 9.480 1.00 0.00 H new ATOM 0 HA LYS A 520 5.158 12.591 7.940 1.00 0.00 H new ATOM 0 HB2 LYS A 520 7.718 14.119 7.365 1.00 0.00 H new ATOM 0 HB3 LYS A 520 6.135 14.558 6.755 1.00 0.00 H new ATOM 0 HG2 LYS A 520 6.964 14.461 9.680 1.00 0.00 H new ATOM 0 HG3 LYS A 520 6.723 15.907 8.719 1.00 0.00 H new ATOM 0 HD2 LYS A 520 4.326 15.330 8.421 1.00 0.00 H new ATOM 0 HD3 LYS A 520 4.555 13.851 9.333 1.00 0.00 H new ATOM 0 HE2 LYS A 520 5.320 15.255 11.293 1.00 0.00 H new ATOM 0 HE3 LYS A 520 4.903 16.687 10.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 520 3.138 16.025 11.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 520 2.618 15.937 10.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 520 3.010 14.517 11.108 1.00 0.00 H new ATOM 2085 N ILE A 521 6.487 10.600 6.340 1.00 0.00 N ATOM 2086 CA ILE A 521 6.719 9.792 5.138 1.00 0.00 C ATOM 2087 C ILE A 521 5.962 8.498 5.207 1.00 0.00 C ATOM 2088 O ILE A 521 5.424 8.144 6.265 1.00 0.00 O ATOM 2089 CB ILE A 521 8.236 9.526 4.812 1.00 0.00 C ATOM 2090 CG1 ILE A 521 9.041 8.988 6.019 1.00 0.00 C ATOM 2091 CG2 ILE A 521 8.906 10.757 4.227 1.00 0.00 C ATOM 2092 CD1 ILE A 521 8.729 7.560 6.459 1.00 0.00 C ATOM 0 H ILE A 521 6.447 10.056 7.202 1.00 0.00 H new ATOM 0 HA ILE A 521 6.341 10.395 4.312 1.00 0.00 H new ATOM 0 HB ILE A 521 8.239 8.737 4.060 1.00 0.00 H new ATOM 0 HG12 ILE A 521 10.102 9.047 5.776 1.00 0.00 H new ATOM 0 HG13 ILE A 521 8.871 9.652 6.867 1.00 0.00 H new ATOM 0 HG21 ILE A 521 9.952 10.536 4.015 1.00 0.00 H new ATOM 0 HG22 ILE A 521 8.401 11.042 3.304 1.00 0.00 H new ATOM 0 HG23 ILE A 521 8.847 11.578 4.942 1.00 0.00 H new ATOM 0 HD11 ILE A 521 9.355 7.297 7.312 1.00 0.00 H new ATOM 0 HD12 ILE A 521 7.679 7.488 6.744 1.00 0.00 H new ATOM 0 HD13 ILE A 521 8.929 6.874 5.636 1.00 0.00 H new ATOM 2104 N PHE A 522 5.902 7.800 4.118 1.00 0.00 N ATOM 2105 CA PHE A 522 5.195 6.571 4.080 1.00 0.00 C ATOM 2106 C PHE A 522 6.163 5.419 4.291 1.00 0.00 C ATOM 2107 O PHE A 522 7.292 5.440 3.806 1.00 0.00 O ATOM 2108 CB PHE A 522 4.424 6.429 2.780 1.00 0.00 C ATOM 2109 CG PHE A 522 3.322 7.433 2.577 1.00 0.00 C ATOM 2110 CD1 PHE A 522 3.605 8.750 2.240 1.00 0.00 C ATOM 2111 CD2 PHE A 522 2.002 7.053 2.704 1.00 0.00 C ATOM 2112 CE1 PHE A 522 2.594 9.658 2.039 1.00 0.00 C ATOM 2113 CE2 PHE A 522 0.986 7.960 2.503 1.00 0.00 C ATOM 2114 CZ PHE A 522 1.282 9.265 2.171 1.00 0.00 C ATOM 0 H PHE A 522 6.341 8.068 3.237 1.00 0.00 H new ATOM 0 HA PHE A 522 4.462 6.554 4.887 1.00 0.00 H new ATOM 0 HB2 PHE A 522 5.125 6.510 1.949 1.00 0.00 H new ATOM 0 HB3 PHE A 522 3.994 5.428 2.738 1.00 0.00 H new ATOM 0 HD1 PHE A 522 4.633 9.064 2.135 1.00 0.00 H new ATOM 0 HD2 PHE A 522 1.763 6.032 2.964 1.00 0.00 H new ATOM 0 HE1 PHE A 522 2.829 10.679 1.778 1.00 0.00 H new ATOM 0 HE2 PHE A 522 -0.043 7.649 2.605 1.00 0.00 H new ATOM 0 HZ PHE A 522 0.486 9.977 2.015 1.00 0.00 H new ATOM 2124 N MET A 523 5.742 4.463 5.049 1.00 0.00 N ATOM 2125 CA MET A 523 6.531 3.309 5.391 1.00 0.00 C ATOM 2126 C MET A 523 5.673 2.079 5.327 1.00 0.00 C ATOM 2127 O MET A 523 4.461 2.184 5.203 1.00 0.00 O ATOM 2128 CB MET A 523 7.218 3.470 6.772 1.00 0.00 C ATOM 2129 CG MET A 523 6.345 3.996 7.919 1.00 0.00 C ATOM 2130 SD MET A 523 5.038 2.879 8.474 1.00 0.00 S ATOM 2131 CE MET A 523 5.985 1.472 9.059 1.00 0.00 C ATOM 0 H MET A 523 4.811 4.455 5.465 1.00 0.00 H new ATOM 0 HA MET A 523 7.337 3.206 4.664 1.00 0.00 H new ATOM 0 HB2 MET A 523 7.620 2.501 7.067 1.00 0.00 H new ATOM 0 HB3 MET A 523 8.066 4.144 6.653 1.00 0.00 H new ATOM 0 HG2 MET A 523 6.989 4.224 8.768 1.00 0.00 H new ATOM 0 HG3 MET A 523 5.888 4.934 7.604 1.00 0.00 H new ATOM 0 HE1 MET A 523 5.346 0.830 9.665 1.00 0.00 H new ATOM 0 HE2 MET A 523 6.363 0.908 8.206 1.00 0.00 H new ATOM 0 HE3 MET A 523 6.823 1.823 9.662 1.00 0.00 H new ATOM 2141 N GLY A 524 6.272 0.934 5.342 1.00 0.00 N ATOM 2142 CA GLY A 524 5.494 -0.254 5.309 1.00 0.00 C ATOM 2143 C GLY A 524 6.350 -1.475 5.305 1.00 0.00 C ATOM 2144 O GLY A 524 7.571 -1.372 5.184 1.00 0.00 O ATOM 0 H GLY A 524 7.282 0.799 5.376 1.00 0.00 H new ATOM 0 HA2 GLY A 524 4.830 -0.278 6.173 1.00 0.00 H new ATOM 0 HA3 GLY A 524 4.862 -0.250 4.421 1.00 0.00 H new ATOM 2148 N LEU A 525 5.757 -2.597 5.530 1.00 0.00 N ATOM 2149 CA LEU A 525 6.426 -3.854 5.353 1.00 0.00 C ATOM 2150 C LEU A 525 5.766 -4.607 4.240 1.00 0.00 C ATOM 2151 O LEU A 525 4.526 -4.518 4.063 1.00 0.00 O ATOM 2152 CB LEU A 525 6.528 -4.722 6.623 1.00 0.00 C ATOM 2153 CG LEU A 525 7.394 -4.182 7.768 1.00 0.00 C ATOM 2154 CD1 LEU A 525 6.666 -3.099 8.545 1.00 0.00 C ATOM 2155 CD2 LEU A 525 7.818 -5.298 8.696 1.00 0.00 C ATOM 0 H LEU A 525 4.790 -2.676 5.844 1.00 0.00 H new ATOM 0 HA LEU A 525 7.461 -3.620 5.102 1.00 0.00 H new ATOM 0 HB2 LEU A 525 5.520 -4.881 7.006 1.00 0.00 H new ATOM 0 HB3 LEU A 525 6.917 -5.699 6.335 1.00 0.00 H new ATOM 0 HG LEU A 525 8.287 -3.741 7.325 1.00 0.00 H new ATOM 0 HD11 LEU A 525 7.305 -2.736 9.350 1.00 0.00 H new ATOM 0 HD12 LEU A 525 6.421 -2.274 7.876 1.00 0.00 H new ATOM 0 HD13 LEU A 525 5.748 -3.509 8.967 1.00 0.00 H new ATOM 0 HD21 LEU A 525 8.431 -4.890 9.500 1.00 0.00 H new ATOM 0 HD22 LEU A 525 6.934 -5.774 9.120 1.00 0.00 H new ATOM 0 HD23 LEU A 525 8.395 -6.036 8.138 1.00 0.00 H new ATOM 2167 N ILE A 526 6.548 -5.264 3.437 1.00 0.00 N ATOM 2168 CA ILE A 526 5.986 -6.086 2.409 1.00 0.00 C ATOM 2169 C ILE A 526 6.067 -7.571 2.800 1.00 0.00 C ATOM 2170 O ILE A 526 7.171 -8.160 2.885 1.00 0.00 O ATOM 2171 CB ILE A 526 6.634 -5.804 1.002 1.00 0.00 C ATOM 2172 CG1 ILE A 526 6.176 -6.816 -0.059 1.00 0.00 C ATOM 2173 CG2 ILE A 526 8.143 -5.740 1.072 1.00 0.00 C ATOM 2174 CD1 ILE A 526 6.694 -6.537 -1.452 1.00 0.00 C ATOM 0 H ILE A 526 7.567 -5.248 3.473 1.00 0.00 H new ATOM 0 HA ILE A 526 4.932 -5.825 2.312 1.00 0.00 H new ATOM 0 HB ILE A 526 6.278 -4.821 0.694 1.00 0.00 H new ATOM 0 HG12 ILE A 526 6.499 -7.812 0.243 1.00 0.00 H new ATOM 0 HG13 ILE A 526 5.086 -6.829 -0.085 1.00 0.00 H new ATOM 0 HG21 ILE A 526 8.545 -5.544 0.078 1.00 0.00 H new ATOM 0 HG22 ILE A 526 8.442 -4.940 1.749 1.00 0.00 H new ATOM 0 HG23 ILE A 526 8.531 -6.690 1.439 1.00 0.00 H new ATOM 0 HD11 ILE A 526 6.323 -7.299 -2.138 1.00 0.00 H new ATOM 0 HD12 ILE A 526 6.349 -5.556 -1.779 1.00 0.00 H new ATOM 0 HD13 ILE A 526 7.784 -6.555 -1.445 1.00 0.00 H new ATOM 2186 N PRO A 527 4.908 -8.166 3.135 1.00 0.00 N ATOM 2187 CA PRO A 527 4.786 -9.587 3.381 1.00 0.00 C ATOM 2188 C PRO A 527 5.025 -10.441 2.131 1.00 0.00 C ATOM 2189 O PRO A 527 4.461 -10.193 1.007 1.00 0.00 O ATOM 2190 CB PRO A 527 3.345 -9.762 3.875 1.00 0.00 C ATOM 2191 CG PRO A 527 2.965 -8.420 4.360 1.00 0.00 C ATOM 2192 CD PRO A 527 3.646 -7.469 3.442 1.00 0.00 C ATOM 0 HA PRO A 527 5.539 -9.921 4.095 1.00 0.00 H new ATOM 0 HB2 PRO A 527 2.687 -10.097 3.073 1.00 0.00 H new ATOM 0 HB3 PRO A 527 3.284 -10.505 4.670 1.00 0.00 H new ATOM 0 HG2 PRO A 527 1.884 -8.284 4.337 1.00 0.00 H new ATOM 0 HG3 PRO A 527 3.283 -8.269 5.391 1.00 0.00 H new ATOM 0 HD2 PRO A 527 3.058 -7.281 2.544 1.00 0.00 H new ATOM 0 HD3 PRO A 527 3.821 -6.503 3.916 1.00 0.00 H new ATOM 2200 N TYR A 528 5.852 -11.447 2.340 1.00 0.00 N ATOM 2201 CA TYR A 528 6.218 -12.410 1.329 1.00 0.00 C ATOM 2202 C TYR A 528 5.051 -13.312 1.066 1.00 0.00 C ATOM 2203 O TYR A 528 4.765 -13.688 -0.069 1.00 0.00 O ATOM 2204 CB TYR A 528 7.356 -13.295 1.835 1.00 0.00 C ATOM 2205 CG TYR A 528 8.522 -12.564 2.417 1.00 0.00 C ATOM 2206 CD1 TYR A 528 9.493 -12.037 1.607 1.00 0.00 C ATOM 2207 CD2 TYR A 528 8.654 -12.413 3.791 1.00 0.00 C ATOM 2208 CE1 TYR A 528 10.565 -11.378 2.138 1.00 0.00 C ATOM 2209 CE2 TYR A 528 9.730 -11.748 4.330 1.00 0.00 C ATOM 2210 CZ TYR A 528 10.683 -11.233 3.499 1.00 0.00 C ATOM 2211 OH TYR A 528 11.771 -10.558 4.025 1.00 0.00 O ATOM 0 H TYR A 528 6.297 -11.618 3.242 1.00 0.00 H new ATOM 0 HA TYR A 528 6.520 -11.871 0.431 1.00 0.00 H new ATOM 0 HB2 TYR A 528 6.959 -13.973 2.591 1.00 0.00 H new ATOM 0 HB3 TYR A 528 7.710 -13.911 1.009 1.00 0.00 H new ATOM 0 HD1 TYR A 528 9.410 -12.144 0.536 1.00 0.00 H new ATOM 0 HD2 TYR A 528 7.900 -12.824 4.446 1.00 0.00 H new ATOM 0 HE1 TYR A 528 11.323 -10.969 1.486 1.00 0.00 H new ATOM 0 HE2 TYR A 528 9.820 -11.634 5.400 1.00 0.00 H new ATOM 0 HH TYR A 528 11.705 -10.542 5.003 1.00 0.00 H new ATOM 2221 N ASP A 529 4.374 -13.644 2.134 1.00 0.00 N ATOM 2222 CA ASP A 529 3.304 -14.587 2.088 1.00 0.00 C ATOM 2223 C ASP A 529 2.040 -13.892 1.632 1.00 0.00 C ATOM 2224 O ASP A 529 1.274 -13.357 2.451 1.00 0.00 O ATOM 2225 CB ASP A 529 3.099 -15.214 3.463 1.00 0.00 C ATOM 2226 CG ASP A 529 2.389 -16.536 3.408 1.00 0.00 C ATOM 2227 OD1 ASP A 529 2.981 -17.538 3.867 1.00 0.00 O ATOM 2228 OD2 ASP A 529 1.261 -16.617 2.894 1.00 0.00 O ATOM 0 H ASP A 529 4.556 -13.262 3.062 1.00 0.00 H new ATOM 0 HA ASP A 529 3.550 -15.379 1.381 1.00 0.00 H new ATOM 0 HB2 ASP A 529 4.069 -15.349 3.942 1.00 0.00 H new ATOM 0 HB3 ASP A 529 2.528 -14.527 4.087 1.00 0.00 H new ATOM 2233 N GLN A 530 1.861 -13.832 0.328 1.00 0.00 N ATOM 2234 CA GLN A 530 0.703 -13.191 -0.247 1.00 0.00 C ATOM 2235 C GLN A 530 -0.554 -13.956 0.090 1.00 0.00 C ATOM 2236 O GLN A 530 -1.586 -13.367 0.358 1.00 0.00 O ATOM 2237 CB GLN A 530 0.881 -12.892 -1.766 1.00 0.00 C ATOM 2238 CG GLN A 530 1.216 -14.079 -2.668 1.00 0.00 C ATOM 2239 CD GLN A 530 0.038 -14.996 -2.968 1.00 0.00 C ATOM 2240 OE1 GLN A 530 -1.121 -14.561 -3.046 1.00 0.00 O ATOM 2241 NE2 GLN A 530 0.309 -16.259 -3.093 1.00 0.00 N ATOM 0 H GLN A 530 2.510 -14.223 -0.355 1.00 0.00 H new ATOM 0 HA GLN A 530 0.594 -12.208 0.210 1.00 0.00 H new ATOM 0 HB2 GLN A 530 -0.039 -12.436 -2.132 1.00 0.00 H new ATOM 0 HB3 GLN A 530 1.671 -12.149 -1.876 1.00 0.00 H new ATOM 0 HG2 GLN A 530 1.616 -13.702 -3.609 1.00 0.00 H new ATOM 0 HG3 GLN A 530 2.006 -14.665 -2.198 1.00 0.00 H new ATOM 0 HE21 GLN A 530 1.274 -16.583 -3.023 1.00 0.00 H new ATOM 0 HE22 GLN A 530 -0.443 -16.928 -3.261 1.00 0.00 H new ATOM 2250 N SER A 531 -0.424 -15.267 0.158 1.00 0.00 N ATOM 2251 CA SER A 531 -1.516 -16.129 0.505 1.00 0.00 C ATOM 2252 C SER A 531 -2.083 -15.788 1.893 1.00 0.00 C ATOM 2253 O SER A 531 -3.288 -15.613 2.054 1.00 0.00 O ATOM 2254 CB SER A 531 -1.070 -17.598 0.370 1.00 0.00 C ATOM 2255 OG SER A 531 0.320 -17.767 0.736 1.00 0.00 O ATOM 0 H SER A 531 0.451 -15.758 -0.029 1.00 0.00 H new ATOM 0 HA SER A 531 -2.342 -15.971 -0.189 1.00 0.00 H new ATOM 0 HB2 SER A 531 -1.693 -18.228 1.004 1.00 0.00 H new ATOM 0 HB3 SER A 531 -1.220 -17.932 -0.657 1.00 0.00 H new ATOM 0 HG SER A 531 0.454 -17.469 1.660 1.00 0.00 H new ATOM 2261 N GLY A 532 -1.201 -15.612 2.857 1.00 0.00 N ATOM 2262 CA GLY A 532 -1.606 -15.284 4.188 1.00 0.00 C ATOM 2263 C GLY A 532 -2.060 -13.846 4.338 1.00 0.00 C ATOM 2264 O GLY A 532 -2.961 -13.565 5.128 1.00 0.00 O ATOM 0 H GLY A 532 -0.192 -15.694 2.730 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -2.417 -15.947 4.488 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -0.775 -15.469 4.869 1.00 0.00 H new ATOM 2268 N PHE A 533 -1.439 -12.933 3.605 1.00 0.00 N ATOM 2269 CA PHE A 533 -1.804 -11.516 3.701 1.00 0.00 C ATOM 2270 C PHE A 533 -3.168 -11.275 3.086 1.00 0.00 C ATOM 2271 O PHE A 533 -4.033 -10.651 3.701 1.00 0.00 O ATOM 2272 CB PHE A 533 -0.756 -10.642 3.005 1.00 0.00 C ATOM 2273 CG PHE A 533 -0.996 -9.144 3.097 1.00 0.00 C ATOM 2274 CD1 PHE A 533 -1.672 -8.462 2.088 1.00 0.00 C ATOM 2275 CD2 PHE A 533 -0.525 -8.420 4.175 1.00 0.00 C ATOM 2276 CE1 PHE A 533 -1.865 -7.099 2.157 1.00 0.00 C ATOM 2277 CE2 PHE A 533 -0.722 -7.055 4.252 1.00 0.00 C ATOM 2278 CZ PHE A 533 -1.392 -6.395 3.239 1.00 0.00 C ATOM 0 H PHE A 533 -0.689 -13.138 2.944 1.00 0.00 H new ATOM 0 HA PHE A 533 -1.842 -11.246 4.756 1.00 0.00 H new ATOM 0 HB2 PHE A 533 0.221 -10.864 3.434 1.00 0.00 H new ATOM 0 HB3 PHE A 533 -0.713 -10.923 1.953 1.00 0.00 H new ATOM 0 HD1 PHE A 533 -2.051 -9.010 1.238 1.00 0.00 H new ATOM 0 HD2 PHE A 533 0.004 -8.928 4.968 1.00 0.00 H new ATOM 0 HE1 PHE A 533 -2.387 -6.585 1.363 1.00 0.00 H new ATOM 0 HE2 PHE A 533 -0.352 -6.503 5.104 1.00 0.00 H new ATOM 0 HZ PHE A 533 -1.544 -5.327 3.297 1.00 0.00 H new ATOM 2288 N VAL A 534 -3.370 -11.810 1.897 1.00 0.00 N ATOM 2289 CA VAL A 534 -4.614 -11.649 1.176 1.00 0.00 C ATOM 2290 C VAL A 534 -5.755 -12.331 1.940 1.00 0.00 C ATOM 2291 O VAL A 534 -6.873 -11.814 1.993 1.00 0.00 O ATOM 2292 CB VAL A 534 -4.505 -12.148 -0.304 1.00 0.00 C ATOM 2293 CG1 VAL A 534 -5.835 -12.007 -1.040 1.00 0.00 C ATOM 2294 CG2 VAL A 534 -3.418 -11.361 -1.048 1.00 0.00 C ATOM 0 H VAL A 534 -2.673 -12.369 1.405 1.00 0.00 H new ATOM 0 HA VAL A 534 -4.839 -10.584 1.114 1.00 0.00 H new ATOM 0 HB VAL A 534 -4.239 -13.205 -0.279 1.00 0.00 H new ATOM 0 HG11 VAL A 534 -5.723 -12.362 -2.064 1.00 0.00 H new ATOM 0 HG12 VAL A 534 -6.597 -12.598 -0.532 1.00 0.00 H new ATOM 0 HG13 VAL A 534 -6.136 -10.959 -1.050 1.00 0.00 H new ATOM 0 HG21 VAL A 534 -3.351 -11.716 -2.076 1.00 0.00 H new ATOM 0 HG22 VAL A 534 -3.671 -10.301 -1.046 1.00 0.00 H new ATOM 0 HG23 VAL A 534 -2.459 -11.506 -0.551 1.00 0.00 H new ATOM 2304 N ASN A 535 -5.454 -13.486 2.545 1.00 0.00 N ATOM 2305 CA ASN A 535 -6.422 -14.208 3.392 1.00 0.00 C ATOM 2306 C ASN A 535 -6.856 -13.314 4.559 1.00 0.00 C ATOM 2307 O ASN A 535 -8.046 -13.127 4.789 1.00 0.00 O ATOM 2308 CB ASN A 535 -5.770 -15.509 3.947 1.00 0.00 C ATOM 2309 CG ASN A 535 -6.686 -16.398 4.818 1.00 0.00 C ATOM 2310 OD1 ASN A 535 -7.603 -15.935 5.497 1.00 0.00 O ATOM 2311 ND2 ASN A 535 -6.420 -17.679 4.814 1.00 0.00 N ATOM 0 H ASN A 535 -4.547 -13.945 2.466 1.00 0.00 H new ATOM 0 HA ASN A 535 -7.294 -14.470 2.793 1.00 0.00 H new ATOM 0 HB2 ASN A 535 -5.413 -16.102 3.105 1.00 0.00 H new ATOM 0 HB3 ASN A 535 -4.896 -15.233 4.536 1.00 0.00 H new ATOM 0 HD21 ASN A 535 -6.977 -18.317 5.382 1.00 0.00 H new ATOM 0 HD22 ASN A 535 -5.655 -18.039 4.243 1.00 0.00 H new ATOM 2318 N GLY A 536 -5.882 -12.706 5.235 1.00 0.00 N ATOM 2319 CA GLY A 536 -6.173 -11.860 6.383 1.00 0.00 C ATOM 2320 C GLY A 536 -6.925 -10.609 5.994 1.00 0.00 C ATOM 2321 O GLY A 536 -7.924 -10.242 6.624 1.00 0.00 O ATOM 0 H GLY A 536 -4.891 -12.785 5.006 1.00 0.00 H new ATOM 0 HA2 GLY A 536 -6.760 -12.424 7.108 1.00 0.00 H new ATOM 0 HA3 GLY A 536 -5.240 -11.583 6.874 1.00 0.00 H new ATOM 2325 N ILE A 537 -6.475 -9.983 4.927 1.00 0.00 N ATOM 2326 CA ILE A 537 -7.086 -8.769 4.428 1.00 0.00 C ATOM 2327 C ILE A 537 -8.488 -9.041 3.862 1.00 0.00 C ATOM 2328 O ILE A 537 -9.317 -8.152 3.827 1.00 0.00 O ATOM 2329 CB ILE A 537 -6.155 -8.033 3.392 1.00 0.00 C ATOM 2330 CG1 ILE A 537 -4.865 -7.551 4.072 1.00 0.00 C ATOM 2331 CG2 ILE A 537 -6.847 -6.852 2.713 1.00 0.00 C ATOM 2332 CD1 ILE A 537 -5.084 -6.522 5.172 1.00 0.00 C ATOM 0 H ILE A 537 -5.675 -10.302 4.381 1.00 0.00 H new ATOM 0 HA ILE A 537 -7.210 -8.090 5.272 1.00 0.00 H new ATOM 0 HB ILE A 537 -5.915 -8.763 2.619 1.00 0.00 H new ATOM 0 HG12 ILE A 537 -4.347 -8.412 4.494 1.00 0.00 H new ATOM 0 HG13 ILE A 537 -4.207 -7.123 3.315 1.00 0.00 H new ATOM 0 HG21 ILE A 537 -6.159 -6.382 2.010 1.00 0.00 H new ATOM 0 HG22 ILE A 537 -7.728 -7.205 2.177 1.00 0.00 H new ATOM 0 HG23 ILE A 537 -7.148 -6.124 3.467 1.00 0.00 H new ATOM 0 HD11 ILE A 537 -4.123 -6.236 5.599 1.00 0.00 H new ATOM 0 HD12 ILE A 537 -5.572 -5.641 4.755 1.00 0.00 H new ATOM 0 HD13 ILE A 537 -5.714 -6.951 5.951 1.00 0.00 H new ATOM 2344 N ARG A 538 -8.768 -10.285 3.481 1.00 0.00 N ATOM 2345 CA ARG A 538 -10.088 -10.639 2.958 1.00 0.00 C ATOM 2346 C ARG A 538 -11.172 -10.371 4.003 1.00 0.00 C ATOM 2347 O ARG A 538 -12.238 -9.835 3.675 1.00 0.00 O ATOM 2348 CB ARG A 538 -10.151 -12.094 2.475 1.00 0.00 C ATOM 2349 CG ARG A 538 -11.486 -12.445 1.841 1.00 0.00 C ATOM 2350 CD ARG A 538 -11.501 -13.836 1.245 1.00 0.00 C ATOM 2351 NE ARG A 538 -12.783 -14.103 0.579 1.00 0.00 N ATOM 2352 CZ ARG A 538 -12.937 -14.728 -0.600 1.00 0.00 C ATOM 2353 NH1 ARG A 538 -11.897 -15.271 -1.220 1.00 0.00 N ATOM 2354 NH2 ARG A 538 -14.145 -14.803 -1.149 1.00 0.00 N ATOM 0 H ARG A 538 -8.106 -11.060 3.523 1.00 0.00 H new ATOM 0 HA ARG A 538 -10.270 -10.004 2.091 1.00 0.00 H new ATOM 0 HB2 ARG A 538 -9.354 -12.267 1.752 1.00 0.00 H new ATOM 0 HB3 ARG A 538 -9.968 -12.760 3.318 1.00 0.00 H new ATOM 0 HG2 ARG A 538 -12.272 -12.367 2.592 1.00 0.00 H new ATOM 0 HG3 ARG A 538 -11.716 -11.718 1.062 1.00 0.00 H new ATOM 0 HD2 ARG A 538 -10.686 -13.939 0.529 1.00 0.00 H new ATOM 0 HD3 ARG A 538 -11.332 -14.574 2.029 1.00 0.00 H new ATOM 0 HE ARG A 538 -13.629 -13.787 1.053 1.00 0.00 H new ATOM 0 HH11 ARG A 538 -10.968 -15.216 -0.802 1.00 0.00 H new ATOM 0 HH12 ARG A 538 -12.026 -15.743 -2.115 1.00 0.00 H new ATOM 0 HH21 ARG A 538 -14.947 -14.388 -0.675 1.00 0.00 H new ATOM 0 HH22 ARG A 538 -14.270 -15.276 -2.044 1.00 0.00 H new ATOM 2368 N GLN A 539 -10.872 -10.693 5.264 1.00 0.00 N ATOM 2369 CA GLN A 539 -11.798 -10.423 6.361 1.00 0.00 C ATOM 2370 C GLN A 539 -11.999 -8.926 6.505 1.00 0.00 C ATOM 2371 O GLN A 539 -13.109 -8.447 6.747 1.00 0.00 O ATOM 2372 CB GLN A 539 -11.314 -11.009 7.699 1.00 0.00 C ATOM 2373 CG GLN A 539 -11.438 -12.526 7.845 1.00 0.00 C ATOM 2374 CD GLN A 539 -10.593 -13.312 6.876 1.00 0.00 C ATOM 2375 OE1 GLN A 539 -11.037 -13.653 5.775 1.00 0.00 O ATOM 2376 NE2 GLN A 539 -9.384 -13.610 7.264 1.00 0.00 N ATOM 0 H GLN A 539 -9.999 -11.139 5.547 1.00 0.00 H new ATOM 0 HA GLN A 539 -12.742 -10.910 6.114 1.00 0.00 H new ATOM 0 HB2 GLN A 539 -10.268 -10.734 7.837 1.00 0.00 H new ATOM 0 HB3 GLN A 539 -11.877 -10.538 8.505 1.00 0.00 H new ATOM 0 HG2 GLN A 539 -11.160 -12.806 8.861 1.00 0.00 H new ATOM 0 HG3 GLN A 539 -12.482 -12.808 7.711 1.00 0.00 H new ATOM 0 HE21 GLN A 539 -9.054 -13.310 8.181 1.00 0.00 H new ATOM 0 HE22 GLN A 539 -8.768 -14.143 6.650 1.00 0.00 H new ATOM 2385 N VAL A 540 -10.923 -8.195 6.310 1.00 0.00 N ATOM 2386 CA VAL A 540 -10.943 -6.752 6.375 1.00 0.00 C ATOM 2387 C VAL A 540 -11.816 -6.192 5.246 1.00 0.00 C ATOM 2388 O VAL A 540 -12.720 -5.406 5.496 1.00 0.00 O ATOM 2389 CB VAL A 540 -9.507 -6.165 6.271 1.00 0.00 C ATOM 2390 CG1 VAL A 540 -9.521 -4.650 6.356 1.00 0.00 C ATOM 2391 CG2 VAL A 540 -8.605 -6.754 7.348 1.00 0.00 C ATOM 0 H VAL A 540 -10.005 -8.588 6.101 1.00 0.00 H new ATOM 0 HA VAL A 540 -11.361 -6.461 7.339 1.00 0.00 H new ATOM 0 HB VAL A 540 -9.107 -6.440 5.295 1.00 0.00 H new ATOM 0 HG11 VAL A 540 -8.502 -4.272 6.280 1.00 0.00 H new ATOM 0 HG12 VAL A 540 -10.120 -4.245 5.540 1.00 0.00 H new ATOM 0 HG13 VAL A 540 -9.952 -4.343 7.309 1.00 0.00 H new ATOM 0 HG21 VAL A 540 -7.605 -6.330 7.257 1.00 0.00 H new ATOM 0 HG22 VAL A 540 -9.011 -6.518 8.332 1.00 0.00 H new ATOM 0 HG23 VAL A 540 -8.552 -7.836 7.227 1.00 0.00 H new ATOM 2401 N ILE A 541 -11.565 -6.658 4.025 1.00 0.00 N ATOM 2402 CA ILE A 541 -12.280 -6.203 2.831 1.00 0.00 C ATOM 2403 C ILE A 541 -13.770 -6.484 2.928 1.00 0.00 C ATOM 2404 O ILE A 541 -14.572 -5.595 2.691 1.00 0.00 O ATOM 2405 CB ILE A 541 -11.736 -6.889 1.539 1.00 0.00 C ATOM 2406 CG1 ILE A 541 -10.261 -6.543 1.313 1.00 0.00 C ATOM 2407 CG2 ILE A 541 -12.571 -6.502 0.307 1.00 0.00 C ATOM 2408 CD1 ILE A 541 -9.632 -7.251 0.122 1.00 0.00 C ATOM 0 H ILE A 541 -10.856 -7.366 3.833 1.00 0.00 H new ATOM 0 HA ILE A 541 -12.115 -5.127 2.772 1.00 0.00 H new ATOM 0 HB ILE A 541 -11.820 -7.966 1.681 1.00 0.00 H new ATOM 0 HG12 ILE A 541 -10.169 -5.466 1.172 1.00 0.00 H new ATOM 0 HG13 ILE A 541 -9.698 -6.796 2.211 1.00 0.00 H new ATOM 0 HG21 ILE A 541 -12.167 -6.996 -0.576 1.00 0.00 H new ATOM 0 HG22 ILE A 541 -13.605 -6.814 0.456 1.00 0.00 H new ATOM 0 HG23 ILE A 541 -12.534 -5.422 0.167 1.00 0.00 H new ATOM 0 HD11 ILE A 541 -8.588 -6.952 0.031 1.00 0.00 H new ATOM 0 HD12 ILE A 541 -9.689 -8.330 0.268 1.00 0.00 H new ATOM 0 HD13 ILE A 541 -10.168 -6.979 -0.787 1.00 0.00 H new ATOM 2420 N THR A 542 -14.136 -7.687 3.346 1.00 0.00 N ATOM 2421 CA THR A 542 -15.539 -8.038 3.406 1.00 0.00 C ATOM 2422 C THR A 542 -16.258 -7.183 4.467 1.00 0.00 C ATOM 2423 O THR A 542 -17.385 -6.708 4.251 1.00 0.00 O ATOM 2424 CB THR A 542 -15.776 -9.587 3.602 1.00 0.00 C ATOM 2425 OG1 THR A 542 -17.170 -9.907 3.503 1.00 0.00 O ATOM 2426 CG2 THR A 542 -15.248 -10.089 4.938 1.00 0.00 C ATOM 0 H THR A 542 -13.492 -8.421 3.642 1.00 0.00 H new ATOM 0 HA THR A 542 -15.982 -7.808 2.437 1.00 0.00 H new ATOM 0 HB THR A 542 -15.223 -10.085 2.805 1.00 0.00 H new ATOM 0 HG1 THR A 542 -17.294 -10.871 3.626 1.00 0.00 H new ATOM 0 HG21 THR A 542 -15.435 -11.159 5.024 1.00 0.00 H new ATOM 0 HG22 THR A 542 -14.176 -9.902 4.999 1.00 0.00 H new ATOM 0 HG23 THR A 542 -15.754 -9.566 5.749 1.00 0.00 H new ATOM 2434 N ASN A 543 -15.584 -6.939 5.574 1.00 0.00 N ATOM 2435 CA ASN A 543 -16.130 -6.083 6.615 1.00 0.00 C ATOM 2436 C ASN A 543 -16.204 -4.620 6.151 1.00 0.00 C ATOM 2437 O ASN A 543 -17.196 -3.935 6.382 1.00 0.00 O ATOM 2438 CB ASN A 543 -15.349 -6.233 7.934 1.00 0.00 C ATOM 2439 CG ASN A 543 -15.770 -5.233 8.998 1.00 0.00 C ATOM 2440 OD1 ASN A 543 -16.738 -5.438 9.735 1.00 0.00 O ATOM 2441 ND2 ASN A 543 -15.016 -4.179 9.130 1.00 0.00 N ATOM 0 H ASN A 543 -14.660 -7.319 5.778 1.00 0.00 H new ATOM 0 HA ASN A 543 -17.151 -6.409 6.813 1.00 0.00 H new ATOM 0 HB2 ASN A 543 -15.489 -7.243 8.319 1.00 0.00 H new ATOM 0 HB3 ASN A 543 -14.284 -6.113 7.734 1.00 0.00 H new ATOM 0 HD21 ASN A 543 -15.219 -3.495 9.859 1.00 0.00 H new ATOM 0 HD22 ASN A 543 -14.223 -4.038 8.505 1.00 0.00 H new ATOM 2448 N LEU A 544 -15.167 -4.167 5.462 1.00 0.00 N ATOM 2449 CA LEU A 544 -15.076 -2.792 4.976 1.00 0.00 C ATOM 2450 C LEU A 544 -16.111 -2.548 3.860 1.00 0.00 C ATOM 2451 O LEU A 544 -16.670 -1.467 3.761 1.00 0.00 O ATOM 2452 CB LEU A 544 -13.609 -2.486 4.529 1.00 0.00 C ATOM 2453 CG LEU A 544 -13.207 -1.018 4.195 1.00 0.00 C ATOM 2454 CD1 LEU A 544 -13.705 -0.573 2.833 1.00 0.00 C ATOM 2455 CD2 LEU A 544 -13.702 -0.061 5.274 1.00 0.00 C ATOM 0 H LEU A 544 -14.360 -4.743 5.222 1.00 0.00 H new ATOM 0 HA LEU A 544 -15.318 -2.096 5.779 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -12.945 -2.836 5.320 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -13.402 -3.092 3.647 1.00 0.00 H new ATOM 0 HG LEU A 544 -12.118 -0.993 4.166 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -13.397 0.457 2.652 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -13.284 -1.219 2.063 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -14.793 -0.637 2.805 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -13.409 0.958 5.019 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -14.788 -0.120 5.342 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -13.263 -0.335 6.233 1.00 0.00 H new