USER MOD reduce.3.24.130724 H: found=0, std=0, add=1107, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1110 hydrogens (8 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 494 SER OG : rot -139:sc= -0.3 USER MOD Set 1.2: A 498 MET CE :methyl -144:sc= -0.951 (180deg=-0.0447) USER MOD Set 2.1: A 485 TYR OH : rot 70:sc= 0.118 USER MOD Set 2.2: A 486 ASN : amide:sc= -4.83! C(o=-4.7!,f=-7.1!) USER MOD Set 3.1: A 419 HIS : no HE2:sc= 1.08 K(o=1.1,f=-4.2!) USER MOD Set 3.2: A 421 MET CE :methyl -155:sc= -0.0165 (180deg=-0.157) USER MOD Set 4.1: A 408 LYS NZ :NH3+ -151:sc= 0.619 (180deg=-0.629!) USER MOD Set 4.2: A1228 4IP O6 : rot -20:sc= -2.27! USER MOD Set 5.1: A 400 LYS NZ :NH3+ 152:sc= -4.58! (180deg=-7.23!) USER MOD Set 5.2: A 405 SER OG : rot -165:sc= -2.99! USER MOD Set 6.1: A 386 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 452 ASN :FLIP amide:sc= -2.23! C(o=-2.8!,f=-2.2!) USER MOD Single : A 364 SER OG : rot -129:sc= 0.0829! USER MOD Single : A 365 HIS : no HD1:sc= -0.268 X(o=-0.27,f=-0.0048) USER MOD Single : A 366 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 370 THR OG1 : rot -67:sc= 0.738 USER MOD Single : A 371 SER OG : rot 180:sc= -0.23 USER MOD Single : A 378 TYR OH : rot 180:sc= 0 USER MOD Single : A 380 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 383 LYS NZ :NH3+ 159:sc= -1.15! (180deg=-2.32!) USER MOD Single : A 385 LYS NZ :NH3+ -139:sc= -1.01! (180deg=-3.29!) USER MOD Single : A 388 THR OG1 : rot 180:sc= 0 USER MOD Single : A 390 LYS NZ :NH3+ -160:sc= -0.0551 (180deg=-0.577) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 393 LYS NZ :NH3+ 150:sc= -7.73! (180deg=-10.4!) USER MOD Single : A 394 GLN :FLIP amide:sc= -6.94! C(o=-11!,f=-6.9!) USER MOD Single : A 395 TYR OH : rot 120:sc= -0.533 USER MOD Single : A 397 CYS SG : rot -100:sc= -0.219 USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 402 THR OG1 : rot 2:sc= 0.179! USER MOD Single : A 403 SER OG : rot 180:sc= 0 USER MOD Single : A 406 CYS SG : rot -35:sc= -1.03! USER MOD Single : A 407 TYR OH : rot 78:sc= 0.282 USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 410 LYS NZ :NH3+ -165:sc=-0.00264 (180deg=-0.281) USER MOD Single : A 413 SER OG : rot 180:sc= 0 USER MOD Single : A 414 SER OG : rot 180:sc= 0.00655 USER MOD Single : A 416 THR OG1 : rot 180:sc= -0.566 USER MOD Single : A 420 GLN :FLIP amide:sc= -3.02! C(o=-4.6!,f=-3!) USER MOD Single : A 422 ASN : amide:sc= 0.256 K(o=0.26,f=-6.3!) USER MOD Single : A 426 CYS SG : rot 180:sc= 0.0839 USER MOD Single : A 429 THR OG1 : rot 180:sc= -0.3 USER MOD Single : A 433 ASN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 437 GLN : amide:sc= -2.93! C(o=-2.9!,f=-2.5!) USER MOD Single : A 438 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 440 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 442 LYS NZ :NH3+ 145:sc= -0.351 (180deg=-2.04!) USER MOD Single : A 451 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 458 CYS SG : rot 35:sc= -2.84 USER MOD Single : A 460 ASN : amide:sc= -3.66! C(o=-3.7!,f=-4.6!) USER MOD Single : A 462 LYS NZ :NH3+ 157:sc= -0.0423 (180deg=-0.61) USER MOD Single : A 463 GLN : amide:sc= -3.18! C(o=-3.2!,f=-4.7!) USER MOD Single : A 464 TYR OH : rot -45:sc= 0.324 USER MOD Single : A 466 HIS : no HD1:sc= -0.012 X(o=-0.012,f=-0.0056) USER MOD Single : A 468 MET CE :methyl -151:sc= -0.251 (180deg=-1.68!) USER MOD Single : A 471 CYS SG : rot 42:sc= -0.966! USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 476 LYS NZ :NH3+ -135:sc= -1.57 (180deg=-4.13!) USER MOD Single : A 478 LYS NZ :NH3+ -140:sc= -2.63 (180deg=-4.62!) USER MOD Single : A 479 THR OG1 : rot -131:sc= 1.63 USER MOD Single : A 480 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 SER OG : rot 180:sc= 0 USER MOD Single : A 490 GLN : amide:sc= -0.31 K(o=-0.31,f=-2.7!) USER MOD Single : A 491 ASN : amide:sc= -2.72! C(o=-2.7!,f=-4.9!) USER MOD Single : A 497 LYS NZ :NH3+ -161:sc= -1.2 (180deg=-1.99!) USER MOD Single : A 499 GLN :FLIP amide:sc= -3.03! C(o=-4.4!,f=-3!) USER MOD Single : A 500 HIS :FLIP no HD1:sc= -0.615 F(o=-1.8!,f=-0.61) USER MOD Single : A1228 4IP O2 : rot -100:sc= 0.71! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 363 -15.230 -19.039 12.601 1.00 0.00 N ATOM 2 CA GLY A 363 -13.715 -19.154 12.439 1.00 0.00 C ATOM 3 C GLY A 363 -13.137 -20.400 11.864 1.00 0.00 C ATOM 4 O GLY A 363 -11.957 -20.666 11.989 1.00 0.00 O ATOM 0 HA2 GLY A 363 -13.388 -18.323 11.815 1.00 0.00 H new ATOM 0 HA3 GLY A 363 -13.268 -19.009 13.423 1.00 0.00 H new ATOM 10 N SER A 364 -13.946 -21.196 11.219 1.00 0.00 N ATOM 11 CA SER A 364 -13.435 -22.462 10.618 1.00 0.00 C ATOM 12 C SER A 364 -12.898 -22.182 9.213 1.00 0.00 C ATOM 13 O SER A 364 -12.499 -21.079 8.897 1.00 0.00 O ATOM 14 CB SER A 364 -14.576 -23.475 10.529 1.00 0.00 C ATOM 15 OG SER A 364 -14.107 -24.659 9.897 1.00 0.00 O ATOM 0 H SER A 364 -14.942 -21.024 11.082 1.00 0.00 H new ATOM 0 HA SER A 364 -12.634 -22.862 11.240 1.00 0.00 H new ATOM 0 HB2 SER A 364 -14.951 -23.706 11.526 1.00 0.00 H new ATOM 0 HB3 SER A 364 -15.408 -23.054 9.965 1.00 0.00 H new ATOM 0 HG SER A 364 -14.715 -24.904 9.168 1.00 0.00 H new ATOM 21 N HIS A 365 -12.887 -23.176 8.368 1.00 0.00 N ATOM 22 CA HIS A 365 -12.379 -22.978 6.981 1.00 0.00 C ATOM 23 C HIS A 365 -10.975 -22.372 7.024 1.00 0.00 C ATOM 24 O HIS A 365 -10.806 -21.172 6.944 1.00 0.00 O ATOM 25 CB HIS A 365 -13.312 -22.037 6.217 1.00 0.00 C ATOM 26 CG HIS A 365 -12.814 -21.883 4.807 1.00 0.00 C ATOM 27 ND1 HIS A 365 -13.178 -22.758 3.793 1.00 0.00 N ATOM 28 CD2 HIS A 365 -11.976 -20.963 4.225 1.00 0.00 C ATOM 29 CE1 HIS A 365 -12.565 -22.351 2.666 1.00 0.00 C ATOM 30 NE2 HIS A 365 -11.822 -21.263 2.876 1.00 0.00 N ATOM 0 H HIS A 365 -13.209 -24.120 8.579 1.00 0.00 H new ATOM 0 HA HIS A 365 -12.343 -23.943 6.476 1.00 0.00 H new ATOM 0 HB2 HIS A 365 -14.327 -22.434 6.215 1.00 0.00 H new ATOM 0 HB3 HIS A 365 -13.351 -21.065 6.710 1.00 0.00 H new ATOM 0 HD2 HIS A 365 -11.509 -20.134 4.736 1.00 0.00 H new ATOM 0 HE1 HIS A 365 -12.663 -22.844 1.710 1.00 0.00 H new ATOM 0 HE2 HIS A 365 -11.260 -20.758 2.191 1.00 0.00 H new ATOM 39 N MET A 366 -9.969 -23.195 7.139 1.00 0.00 N ATOM 40 CA MET A 366 -8.571 -22.675 7.174 1.00 0.00 C ATOM 41 C MET A 366 -8.431 -21.607 8.261 1.00 0.00 C ATOM 42 O MET A 366 -8.866 -20.484 8.101 1.00 0.00 O ATOM 43 CB MET A 366 -8.224 -22.065 5.814 1.00 0.00 C ATOM 44 CG MET A 366 -6.765 -21.605 5.814 1.00 0.00 C ATOM 45 SD MET A 366 -6.279 -21.147 4.131 1.00 0.00 S ATOM 46 CE MET A 366 -6.755 -19.404 4.227 1.00 0.00 C ATOM 0 H MET A 366 -10.055 -24.209 7.211 1.00 0.00 H new ATOM 0 HA MET A 366 -7.891 -23.497 7.396 1.00 0.00 H new ATOM 0 HB2 MET A 366 -8.384 -22.798 5.024 1.00 0.00 H new ATOM 0 HB3 MET A 366 -8.882 -21.221 5.604 1.00 0.00 H new ATOM 0 HG2 MET A 366 -6.640 -20.755 6.484 1.00 0.00 H new ATOM 0 HG3 MET A 366 -6.121 -22.402 6.186 1.00 0.00 H new ATOM 0 HE1 MET A 366 -6.539 -18.915 3.277 1.00 0.00 H new ATOM 0 HE2 MET A 366 -7.821 -19.329 4.439 1.00 0.00 H new ATOM 0 HE3 MET A 366 -6.192 -18.916 5.022 1.00 0.00 H new ATOM 56 N GLY A 367 -7.812 -21.944 9.361 1.00 0.00 N ATOM 57 CA GLY A 367 -7.628 -20.943 10.452 1.00 0.00 C ATOM 58 C GLY A 367 -6.395 -20.093 10.143 1.00 0.00 C ATOM 59 O GLY A 367 -6.488 -19.046 9.533 1.00 0.00 O ATOM 0 H GLY A 367 -7.426 -22.869 9.551 1.00 0.00 H new ATOM 0 HA2 GLY A 367 -8.511 -20.310 10.535 1.00 0.00 H new ATOM 0 HA3 GLY A 367 -7.507 -21.448 11.410 1.00 0.00 H new ATOM 63 N ASP A 368 -5.237 -20.542 10.548 1.00 0.00 N ATOM 64 CA ASP A 368 -3.991 -19.769 10.267 1.00 0.00 C ATOM 65 C ASP A 368 -4.210 -18.288 10.585 1.00 0.00 C ATOM 66 O ASP A 368 -3.872 -17.421 9.804 1.00 0.00 O ATOM 67 CB ASP A 368 -3.629 -19.920 8.790 1.00 0.00 C ATOM 68 CG ASP A 368 -3.536 -21.406 8.434 1.00 0.00 C ATOM 69 OD1 ASP A 368 -3.988 -22.215 9.227 1.00 0.00 O ATOM 70 OD2 ASP A 368 -3.015 -21.709 7.373 1.00 0.00 O ATOM 0 H ASP A 368 -5.099 -21.412 11.062 1.00 0.00 H new ATOM 0 HA ASP A 368 -3.183 -20.152 10.890 1.00 0.00 H new ATOM 0 HB2 ASP A 368 -4.381 -19.433 8.169 1.00 0.00 H new ATOM 0 HB3 ASP A 368 -2.679 -19.426 8.586 1.00 0.00 H new ATOM 75 N ILE A 369 -4.773 -17.990 11.723 1.00 0.00 N ATOM 76 CA ILE A 369 -5.010 -16.564 12.085 1.00 0.00 C ATOM 77 C ILE A 369 -3.675 -15.816 12.103 1.00 0.00 C ATOM 78 O ILE A 369 -3.616 -14.625 11.874 1.00 0.00 O ATOM 79 CB ILE A 369 -5.655 -16.472 13.474 1.00 0.00 C ATOM 80 CG1 ILE A 369 -6.921 -17.353 13.532 1.00 0.00 C ATOM 81 CG2 ILE A 369 -6.045 -15.015 13.746 1.00 0.00 C ATOM 82 CD1 ILE A 369 -6.570 -18.845 13.712 1.00 0.00 C ATOM 0 H ILE A 369 -5.079 -18.671 12.418 1.00 0.00 H new ATOM 0 HA ILE A 369 -5.678 -16.118 11.348 1.00 0.00 H new ATOM 0 HB ILE A 369 -4.944 -16.819 14.224 1.00 0.00 H new ATOM 0 HG12 ILE A 369 -7.554 -17.026 14.357 1.00 0.00 H new ATOM 0 HG13 ILE A 369 -7.497 -17.223 12.616 1.00 0.00 H new ATOM 0 HG21 ILE A 369 -6.505 -14.939 14.731 1.00 0.00 H new ATOM 0 HG22 ILE A 369 -5.154 -14.387 13.712 1.00 0.00 H new ATOM 0 HG23 ILE A 369 -6.754 -14.681 12.988 1.00 0.00 H new ATOM 0 HD11 ILE A 369 -7.487 -19.433 13.748 1.00 0.00 H new ATOM 0 HD12 ILE A 369 -5.958 -19.179 12.874 1.00 0.00 H new ATOM 0 HD13 ILE A 369 -6.016 -18.979 14.641 1.00 0.00 H new ATOM 94 N THR A 370 -2.603 -16.504 12.384 1.00 0.00 N ATOM 95 CA THR A 370 -1.274 -15.833 12.428 1.00 0.00 C ATOM 96 C THR A 370 -0.727 -15.669 11.010 1.00 0.00 C ATOM 97 O THR A 370 0.110 -16.429 10.564 1.00 0.00 O ATOM 98 CB THR A 370 -0.306 -16.684 13.254 1.00 0.00 C ATOM 99 OG1 THR A 370 1.031 -16.298 12.965 1.00 0.00 O ATOM 100 CG2 THR A 370 -0.500 -18.161 12.906 1.00 0.00 C ATOM 0 H THR A 370 -2.590 -17.504 12.585 1.00 0.00 H new ATOM 0 HA THR A 370 -1.381 -14.849 12.885 1.00 0.00 H new ATOM 0 HB THR A 370 -0.505 -16.533 14.315 1.00 0.00 H new ATOM 0 HG1 THR A 370 1.247 -16.535 12.039 1.00 0.00 H new ATOM 0 HG21 THR A 370 0.189 -18.767 13.494 1.00 0.00 H new ATOM 0 HG22 THR A 370 -1.525 -18.456 13.131 1.00 0.00 H new ATOM 0 HG23 THR A 370 -0.303 -18.314 11.845 1.00 0.00 H new ATOM 108 N SER A 371 -1.186 -14.673 10.301 1.00 0.00 N ATOM 109 CA SER A 371 -0.687 -14.441 8.912 1.00 0.00 C ATOM 110 C SER A 371 0.843 -14.542 8.912 1.00 0.00 C ATOM 111 O SER A 371 1.525 -13.719 9.484 1.00 0.00 O ATOM 112 CB SER A 371 -1.114 -13.044 8.452 1.00 0.00 C ATOM 113 OG SER A 371 -0.968 -12.131 9.532 1.00 0.00 O ATOM 0 H SER A 371 -1.888 -14.007 10.624 1.00 0.00 H new ATOM 0 HA SER A 371 -1.102 -15.186 8.233 1.00 0.00 H new ATOM 0 HB2 SER A 371 -0.506 -12.725 7.606 1.00 0.00 H new ATOM 0 HB3 SER A 371 -2.149 -13.061 8.112 1.00 0.00 H new ATOM 0 HG SER A 371 -1.239 -11.235 9.242 1.00 0.00 H new ATOM 119 N ILE A 372 1.384 -15.563 8.305 1.00 0.00 N ATOM 120 CA ILE A 372 2.869 -15.730 8.308 1.00 0.00 C ATOM 121 C ILE A 372 3.558 -14.485 7.712 1.00 0.00 C ATOM 122 O ILE A 372 4.553 -14.025 8.237 1.00 0.00 O ATOM 123 CB ILE A 372 3.269 -17.008 7.517 1.00 0.00 C ATOM 124 CG1 ILE A 372 2.062 -17.956 7.420 1.00 0.00 C ATOM 125 CG2 ILE A 372 4.423 -17.731 8.231 1.00 0.00 C ATOM 126 CD1 ILE A 372 2.496 -19.287 6.807 1.00 0.00 C ATOM 0 H ILE A 372 0.866 -16.288 7.808 1.00 0.00 H new ATOM 0 HA ILE A 372 3.203 -15.842 9.340 1.00 0.00 H new ATOM 0 HB ILE A 372 3.590 -16.717 6.517 1.00 0.00 H new ATOM 0 HG12 ILE A 372 1.638 -18.122 8.410 1.00 0.00 H new ATOM 0 HG13 ILE A 372 1.280 -17.503 6.811 1.00 0.00 H new ATOM 0 HG21 ILE A 372 4.696 -18.624 7.669 1.00 0.00 H new ATOM 0 HG22 ILE A 372 5.284 -17.066 8.296 1.00 0.00 H new ATOM 0 HG23 ILE A 372 4.108 -18.016 9.235 1.00 0.00 H new ATOM 0 HD11 ILE A 372 1.637 -19.954 6.741 1.00 0.00 H new ATOM 0 HD12 ILE A 372 2.899 -19.114 5.809 1.00 0.00 H new ATOM 0 HD13 ILE A 372 3.263 -19.743 7.433 1.00 0.00 H new ATOM 138 N PRO A 373 3.051 -13.943 6.629 1.00 0.00 N ATOM 139 CA PRO A 373 3.641 -12.747 5.972 1.00 0.00 C ATOM 140 C PRO A 373 2.946 -11.444 6.395 1.00 0.00 C ATOM 141 O PRO A 373 2.135 -10.907 5.666 1.00 0.00 O ATOM 142 CB PRO A 373 3.375 -13.040 4.495 1.00 0.00 C ATOM 143 CG PRO A 373 2.056 -13.775 4.480 1.00 0.00 C ATOM 144 CD PRO A 373 1.863 -14.392 5.887 1.00 0.00 C ATOM 0 HA PRO A 373 4.690 -12.595 6.227 1.00 0.00 H new ATOM 0 HB2 PRO A 373 3.322 -12.120 3.912 1.00 0.00 H new ATOM 0 HB3 PRO A 373 4.171 -13.646 4.062 1.00 0.00 H new ATOM 0 HG2 PRO A 373 1.238 -13.094 4.242 1.00 0.00 H new ATOM 0 HG3 PRO A 373 2.057 -14.552 3.715 1.00 0.00 H new ATOM 0 HD2 PRO A 373 0.943 -14.043 6.355 1.00 0.00 H new ATOM 0 HD3 PRO A 373 1.805 -15.480 5.843 1.00 0.00 H new ATOM 152 N GLU A 374 3.235 -10.934 7.566 1.00 0.00 N ATOM 153 CA GLU A 374 2.563 -9.678 8.011 1.00 0.00 C ATOM 154 C GLU A 374 3.275 -8.450 7.478 1.00 0.00 C ATOM 155 O GLU A 374 4.466 -8.266 7.639 1.00 0.00 O ATOM 156 CB GLU A 374 2.541 -9.603 9.532 1.00 0.00 C ATOM 157 CG GLU A 374 2.074 -10.947 10.091 1.00 0.00 C ATOM 158 CD GLU A 374 3.264 -11.905 10.224 1.00 0.00 C ATOM 159 OE1 GLU A 374 4.280 -11.652 9.599 1.00 0.00 O ATOM 160 OE2 GLU A 374 3.143 -12.871 10.960 1.00 0.00 O ATOM 0 H GLU A 374 3.902 -11.330 8.228 1.00 0.00 H new ATOM 0 HA GLU A 374 1.546 -9.698 7.619 1.00 0.00 H new ATOM 0 HB2 GLU A 374 3.534 -9.362 9.911 1.00 0.00 H new ATOM 0 HB3 GLU A 374 1.873 -8.807 9.860 1.00 0.00 H new ATOM 0 HG2 GLU A 374 1.604 -10.801 11.064 1.00 0.00 H new ATOM 0 HG3 GLU A 374 1.320 -11.381 9.434 1.00 0.00 H new ATOM 167 N LEU A 375 2.517 -7.593 6.880 1.00 0.00 N ATOM 168 CA LEU A 375 3.069 -6.308 6.345 1.00 0.00 C ATOM 169 C LEU A 375 1.964 -5.255 6.426 1.00 0.00 C ATOM 170 O LEU A 375 0.966 -5.346 5.740 1.00 0.00 O ATOM 171 CB LEU A 375 3.535 -6.496 4.877 1.00 0.00 C ATOM 172 CG LEU A 375 4.199 -5.214 4.272 1.00 0.00 C ATOM 173 CD1 LEU A 375 3.155 -4.329 3.572 1.00 0.00 C ATOM 174 CD2 LEU A 375 4.912 -4.369 5.336 1.00 0.00 C ATOM 0 H LEU A 375 1.516 -7.720 6.730 1.00 0.00 H new ATOM 0 HA LEU A 375 3.933 -5.991 6.930 1.00 0.00 H new ATOM 0 HB2 LEU A 375 4.245 -7.321 4.831 1.00 0.00 H new ATOM 0 HB3 LEU A 375 2.679 -6.778 4.264 1.00 0.00 H new ATOM 0 HG LEU A 375 4.936 -5.569 3.551 1.00 0.00 H new ATOM 0 HD11 LEU A 375 3.644 -3.446 3.161 1.00 0.00 H new ATOM 0 HD12 LEU A 375 2.683 -4.891 2.766 1.00 0.00 H new ATOM 0 HD13 LEU A 375 2.397 -4.022 4.292 1.00 0.00 H new ATOM 0 HD21 LEU A 375 5.356 -3.491 4.866 1.00 0.00 H new ATOM 0 HD22 LEU A 375 4.193 -4.052 6.091 1.00 0.00 H new ATOM 0 HD23 LEU A 375 5.695 -4.963 5.808 1.00 0.00 H new ATOM 186 N ALA A 376 2.114 -4.260 7.259 1.00 0.00 N ATOM 187 CA ALA A 376 1.044 -3.227 7.362 1.00 0.00 C ATOM 188 C ALA A 376 1.589 -1.949 7.999 1.00 0.00 C ATOM 189 O ALA A 376 2.626 -1.944 8.632 1.00 0.00 O ATOM 190 CB ALA A 376 -0.098 -3.774 8.218 1.00 0.00 C ATOM 0 H ALA A 376 2.921 -4.119 7.866 1.00 0.00 H new ATOM 0 HA ALA A 376 0.683 -2.990 6.361 1.00 0.00 H new ATOM 0 HB1 ALA A 376 -0.885 -3.024 8.298 1.00 0.00 H new ATOM 0 HB2 ALA A 376 -0.501 -4.674 7.754 1.00 0.00 H new ATOM 0 HB3 ALA A 376 0.276 -4.015 9.213 1.00 0.00 H new ATOM 196 N ASP A 377 0.884 -0.865 7.832 1.00 0.00 N ATOM 197 CA ASP A 377 1.329 0.428 8.422 1.00 0.00 C ATOM 198 C ASP A 377 0.165 1.420 8.397 1.00 0.00 C ATOM 199 O ASP A 377 -0.828 1.210 7.729 1.00 0.00 O ATOM 200 CB ASP A 377 2.490 0.997 7.602 1.00 0.00 C ATOM 201 CG ASP A 377 3.000 2.278 8.262 1.00 0.00 C ATOM 202 OD1 ASP A 377 2.992 2.336 9.481 1.00 0.00 O ATOM 203 OD2 ASP A 377 3.388 3.180 7.538 1.00 0.00 O ATOM 0 H ASP A 377 0.011 -0.819 7.307 1.00 0.00 H new ATOM 0 HA ASP A 377 1.656 0.263 9.449 1.00 0.00 H new ATOM 0 HB2 ASP A 377 3.295 0.265 7.534 1.00 0.00 H new ATOM 0 HB3 ASP A 377 2.162 1.205 6.584 1.00 0.00 H new ATOM 208 N TYR A 378 0.290 2.514 9.096 1.00 0.00 N ATOM 209 CA TYR A 378 -0.794 3.542 9.088 1.00 0.00 C ATOM 210 C TYR A 378 -0.542 4.442 7.882 1.00 0.00 C ATOM 211 O TYR A 378 0.560 4.908 7.674 1.00 0.00 O ATOM 212 CB TYR A 378 -0.755 4.364 10.393 1.00 0.00 C ATOM 213 CG TYR A 378 0.638 4.329 10.976 1.00 0.00 C ATOM 214 CD1 TYR A 378 1.060 3.207 11.698 1.00 0.00 C ATOM 215 CD2 TYR A 378 1.504 5.414 10.797 1.00 0.00 C ATOM 216 CE1 TYR A 378 2.349 3.168 12.241 1.00 0.00 C ATOM 217 CE2 TYR A 378 2.794 5.376 11.340 1.00 0.00 C ATOM 218 CZ TYR A 378 3.216 4.253 12.063 1.00 0.00 C ATOM 219 OH TYR A 378 4.486 4.213 12.598 1.00 0.00 O ATOM 0 H TYR A 378 1.098 2.743 9.675 1.00 0.00 H new ATOM 0 HA TYR A 378 -1.777 3.076 9.023 1.00 0.00 H new ATOM 0 HB2 TYR A 378 -1.050 5.394 10.194 1.00 0.00 H new ATOM 0 HB3 TYR A 378 -1.470 3.960 11.110 1.00 0.00 H new ATOM 0 HD1 TYR A 378 0.391 2.371 11.836 1.00 0.00 H new ATOM 0 HD2 TYR A 378 1.177 6.280 10.240 1.00 0.00 H new ATOM 0 HE1 TYR A 378 2.675 2.301 12.797 1.00 0.00 H new ATOM 0 HE2 TYR A 378 3.463 6.212 11.201 1.00 0.00 H new ATOM 0 HH TYR A 378 4.958 5.044 12.382 1.00 0.00 H new ATOM 229 N ILE A 379 -1.527 4.659 7.054 1.00 0.00 N ATOM 230 CA ILE A 379 -1.280 5.487 5.843 1.00 0.00 C ATOM 231 C ILE A 379 -2.581 6.160 5.376 1.00 0.00 C ATOM 232 O ILE A 379 -3.667 5.749 5.726 1.00 0.00 O ATOM 233 CB ILE A 379 -0.679 4.531 4.768 1.00 0.00 C ATOM 234 CG1 ILE A 379 0.704 5.035 4.328 1.00 0.00 C ATOM 235 CG2 ILE A 379 -1.584 4.412 3.530 1.00 0.00 C ATOM 236 CD1 ILE A 379 1.440 3.977 3.485 1.00 0.00 C ATOM 0 H ILE A 379 -2.477 4.305 7.161 1.00 0.00 H new ATOM 0 HA ILE A 379 -0.583 6.301 6.042 1.00 0.00 H new ATOM 0 HB ILE A 379 -0.595 3.546 5.226 1.00 0.00 H new ATOM 0 HG12 ILE A 379 0.593 5.952 3.749 1.00 0.00 H new ATOM 0 HG13 ILE A 379 1.300 5.283 5.206 1.00 0.00 H new ATOM 0 HG21 ILE A 379 -1.126 3.736 2.808 1.00 0.00 H new ATOM 0 HG22 ILE A 379 -2.557 4.020 3.827 1.00 0.00 H new ATOM 0 HG23 ILE A 379 -1.712 5.395 3.077 1.00 0.00 H new ATOM 0 HD11 ILE A 379 2.415 4.362 3.188 1.00 0.00 H new ATOM 0 HD12 ILE A 379 1.572 3.070 4.074 1.00 0.00 H new ATOM 0 HD13 ILE A 379 0.854 3.749 2.595 1.00 0.00 H new ATOM 248 N LYS A 380 -2.459 7.195 4.577 1.00 0.00 N ATOM 249 CA LYS A 380 -3.659 7.920 4.063 1.00 0.00 C ATOM 250 C LYS A 380 -3.451 8.235 2.586 1.00 0.00 C ATOM 251 O LYS A 380 -2.342 8.456 2.142 1.00 0.00 O ATOM 252 CB LYS A 380 -3.855 9.219 4.848 1.00 0.00 C ATOM 253 CG LYS A 380 -2.587 10.073 4.749 1.00 0.00 C ATOM 254 CD LYS A 380 -2.652 11.227 5.761 1.00 0.00 C ATOM 255 CE LYS A 380 -2.590 10.693 7.204 1.00 0.00 C ATOM 256 NZ LYS A 380 -1.927 11.709 8.071 1.00 0.00 N ATOM 0 H LYS A 380 -1.566 7.570 4.257 1.00 0.00 H new ATOM 0 HA LYS A 380 -4.546 7.298 4.185 1.00 0.00 H new ATOM 0 HB2 LYS A 380 -4.709 9.770 4.453 1.00 0.00 H new ATOM 0 HB3 LYS A 380 -4.075 8.996 5.892 1.00 0.00 H new ATOM 0 HG2 LYS A 380 -1.708 9.458 4.942 1.00 0.00 H new ATOM 0 HG3 LYS A 380 -2.483 10.469 3.739 1.00 0.00 H new ATOM 0 HD2 LYS A 380 -1.825 11.916 5.588 1.00 0.00 H new ATOM 0 HD3 LYS A 380 -3.573 11.792 5.617 1.00 0.00 H new ATOM 0 HE2 LYS A 380 -3.595 10.483 7.571 1.00 0.00 H new ATOM 0 HE3 LYS A 380 -2.037 9.754 7.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 380 -1.881 11.355 9.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 380 -0.964 11.888 7.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 380 -2.473 12.594 8.048 1.00 0.00 H new ATOM 270 N VAL A 381 -4.507 8.225 1.812 1.00 0.00 N ATOM 271 CA VAL A 381 -4.370 8.488 0.345 1.00 0.00 C ATOM 272 C VAL A 381 -5.494 9.409 -0.151 1.00 0.00 C ATOM 273 O VAL A 381 -6.564 9.483 0.421 1.00 0.00 O ATOM 274 CB VAL A 381 -4.428 7.137 -0.386 1.00 0.00 C ATOM 275 CG1 VAL A 381 -5.480 6.246 0.282 1.00 0.00 C ATOM 276 CG2 VAL A 381 -4.779 7.338 -1.869 1.00 0.00 C ATOM 0 H VAL A 381 -5.459 8.046 2.132 1.00 0.00 H new ATOM 0 HA VAL A 381 -3.422 8.988 0.145 1.00 0.00 H new ATOM 0 HB VAL A 381 -3.450 6.660 -0.327 1.00 0.00 H new ATOM 0 HG11 VAL A 381 -5.525 5.287 -0.233 1.00 0.00 H new ATOM 0 HG12 VAL A 381 -5.211 6.085 1.326 1.00 0.00 H new ATOM 0 HG13 VAL A 381 -6.454 6.732 0.229 1.00 0.00 H new ATOM 0 HG21 VAL A 381 -4.815 6.370 -2.369 1.00 0.00 H new ATOM 0 HG22 VAL A 381 -5.751 7.825 -1.950 1.00 0.00 H new ATOM 0 HG23 VAL A 381 -4.020 7.962 -2.341 1.00 0.00 H new ATOM 286 N PHE A 382 -5.245 10.087 -1.241 1.00 0.00 N ATOM 287 CA PHE A 382 -6.266 10.995 -1.848 1.00 0.00 C ATOM 288 C PHE A 382 -6.189 10.798 -3.365 1.00 0.00 C ATOM 289 O PHE A 382 -5.109 10.700 -3.916 1.00 0.00 O ATOM 290 CB PHE A 382 -5.940 12.446 -1.470 1.00 0.00 C ATOM 291 CG PHE A 382 -6.722 13.404 -2.343 1.00 0.00 C ATOM 292 CD1 PHE A 382 -8.119 13.338 -2.375 1.00 0.00 C ATOM 293 CD2 PHE A 382 -6.050 14.359 -3.119 1.00 0.00 C ATOM 294 CE1 PHE A 382 -8.845 14.224 -3.179 1.00 0.00 C ATOM 295 CE2 PHE A 382 -6.776 15.245 -3.923 1.00 0.00 C ATOM 296 CZ PHE A 382 -8.173 15.178 -3.954 1.00 0.00 C ATOM 0 H PHE A 382 -4.360 10.049 -1.746 1.00 0.00 H new ATOM 0 HA PHE A 382 -7.271 10.772 -1.489 1.00 0.00 H new ATOM 0 HB2 PHE A 382 -6.182 12.619 -0.421 1.00 0.00 H new ATOM 0 HB3 PHE A 382 -4.871 12.628 -1.585 1.00 0.00 H new ATOM 0 HD1 PHE A 382 -8.638 12.602 -1.778 1.00 0.00 H new ATOM 0 HD2 PHE A 382 -4.971 14.411 -3.096 1.00 0.00 H new ATOM 0 HE1 PHE A 382 -9.924 14.172 -3.202 1.00 0.00 H new ATOM 0 HE2 PHE A 382 -6.258 15.981 -4.520 1.00 0.00 H new ATOM 0 HZ PHE A 382 -8.733 15.861 -4.575 1.00 0.00 H new ATOM 306 N LYS A 383 -7.310 10.686 -4.051 1.00 0.00 N ATOM 307 CA LYS A 383 -7.249 10.437 -5.531 1.00 0.00 C ATOM 308 C LYS A 383 -8.372 11.202 -6.272 1.00 0.00 C ATOM 309 O LYS A 383 -9.256 11.756 -5.649 1.00 0.00 O ATOM 310 CB LYS A 383 -7.356 8.906 -5.788 1.00 0.00 C ATOM 311 CG LYS A 383 -7.806 8.166 -4.518 1.00 0.00 C ATOM 312 CD LYS A 383 -7.790 6.660 -4.783 1.00 0.00 C ATOM 313 CE LYS A 383 -8.150 5.893 -3.500 1.00 0.00 C ATOM 314 NZ LYS A 383 -9.038 6.727 -2.641 1.00 0.00 N ATOM 0 H LYS A 383 -8.248 10.755 -3.656 1.00 0.00 H new ATOM 0 HA LYS A 383 -6.299 10.805 -5.919 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -8.065 8.717 -6.594 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -6.391 8.520 -6.116 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -7.144 8.408 -3.687 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -8.808 8.487 -4.231 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -8.499 6.415 -5.574 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -6.804 6.355 -5.133 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -8.649 4.958 -3.753 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -7.243 5.633 -2.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -9.557 6.114 -1.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -8.463 7.407 -2.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -9.715 7.243 -3.239 1.00 0.00 H new ATOM 328 N PRO A 384 -8.333 11.243 -7.603 1.00 0.00 N ATOM 329 CA PRO A 384 -9.359 11.970 -8.424 1.00 0.00 C ATOM 330 C PRO A 384 -10.765 11.416 -8.214 1.00 0.00 C ATOM 331 O PRO A 384 -11.744 12.121 -8.360 1.00 0.00 O ATOM 332 CB PRO A 384 -8.901 11.765 -9.880 1.00 0.00 C ATOM 333 CG PRO A 384 -7.456 11.422 -9.774 1.00 0.00 C ATOM 334 CD PRO A 384 -7.326 10.614 -8.484 1.00 0.00 C ATOM 0 HA PRO A 384 -9.422 13.022 -8.144 1.00 0.00 H new ATOM 0 HB2 PRO A 384 -9.464 10.967 -10.364 1.00 0.00 H new ATOM 0 HB3 PRO A 384 -9.052 12.666 -10.474 1.00 0.00 H new ATOM 0 HG2 PRO A 384 -7.125 10.842 -10.636 1.00 0.00 H new ATOM 0 HG3 PRO A 384 -6.840 12.321 -9.739 1.00 0.00 H new ATOM 0 HD2 PRO A 384 -7.534 9.556 -8.646 1.00 0.00 H new ATOM 0 HD3 PRO A 384 -6.322 10.681 -8.064 1.00 0.00 H new ATOM 342 N LYS A 385 -10.880 10.175 -7.829 1.00 0.00 N ATOM 343 CA LYS A 385 -12.217 9.616 -7.564 1.00 0.00 C ATOM 344 C LYS A 385 -13.078 9.580 -8.827 1.00 0.00 C ATOM 345 O LYS A 385 -13.172 10.535 -9.573 1.00 0.00 O ATOM 346 CB LYS A 385 -12.868 10.501 -6.486 1.00 0.00 C ATOM 347 CG LYS A 385 -13.439 9.648 -5.375 1.00 0.00 C ATOM 348 CD LYS A 385 -12.305 9.019 -4.532 1.00 0.00 C ATOM 349 CE LYS A 385 -11.876 9.961 -3.401 1.00 0.00 C ATOM 350 NZ LYS A 385 -10.982 11.020 -3.947 1.00 0.00 N ATOM 0 H LYS A 385 -10.101 9.531 -7.689 1.00 0.00 H new ATOM 0 HA LYS A 385 -12.130 8.584 -7.225 1.00 0.00 H new ATOM 0 HB2 LYS A 385 -12.129 11.192 -6.079 1.00 0.00 H new ATOM 0 HB3 LYS A 385 -13.658 11.105 -6.931 1.00 0.00 H new ATOM 0 HG2 LYS A 385 -14.080 10.255 -4.736 1.00 0.00 H new ATOM 0 HG3 LYS A 385 -14.064 8.861 -5.798 1.00 0.00 H new ATOM 0 HD2 LYS A 385 -12.641 8.071 -4.113 1.00 0.00 H new ATOM 0 HD3 LYS A 385 -11.450 8.799 -5.172 1.00 0.00 H new ATOM 0 HE2 LYS A 385 -12.753 10.414 -2.938 1.00 0.00 H new ATOM 0 HE3 LYS A 385 -11.359 9.400 -2.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 385 -10.200 11.190 -3.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 385 -10.598 10.712 -4.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 385 -11.523 11.898 -4.077 1.00 0.00 H new ATOM 364 N LYS A 386 -13.723 8.465 -9.043 1.00 0.00 N ATOM 365 CA LYS A 386 -14.616 8.312 -10.229 1.00 0.00 C ATOM 366 C LYS A 386 -16.071 8.628 -9.822 1.00 0.00 C ATOM 367 O LYS A 386 -16.570 9.705 -10.081 1.00 0.00 O ATOM 368 CB LYS A 386 -14.525 6.866 -10.765 1.00 0.00 C ATOM 369 CG LYS A 386 -13.114 6.313 -10.559 1.00 0.00 C ATOM 370 CD LYS A 386 -13.053 4.885 -11.117 1.00 0.00 C ATOM 371 CE LYS A 386 -11.618 4.322 -11.029 1.00 0.00 C ATOM 372 NZ LYS A 386 -11.000 4.351 -12.384 1.00 0.00 N ATOM 0 H LYS A 386 -13.669 7.643 -8.441 1.00 0.00 H new ATOM 0 HA LYS A 386 -14.302 9.003 -11.011 1.00 0.00 H new ATOM 0 HB2 LYS A 386 -15.250 6.234 -10.251 1.00 0.00 H new ATOM 0 HB3 LYS A 386 -14.780 6.847 -11.825 1.00 0.00 H new ATOM 0 HG2 LYS A 386 -12.384 6.946 -11.063 1.00 0.00 H new ATOM 0 HG3 LYS A 386 -12.860 6.315 -9.499 1.00 0.00 H new ATOM 0 HD2 LYS A 386 -13.735 4.243 -10.560 1.00 0.00 H new ATOM 0 HD3 LYS A 386 -13.387 4.881 -12.155 1.00 0.00 H new ATOM 0 HE2 LYS A 386 -11.024 4.913 -10.332 1.00 0.00 H new ATOM 0 HE3 LYS A 386 -11.637 3.302 -10.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 386 -10.033 3.973 -12.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 386 -11.565 3.770 -13.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 386 -10.971 5.331 -12.731 1.00 0.00 H new ATOM 386 N LEU A 387 -16.758 7.691 -9.199 1.00 0.00 N ATOM 387 CA LEU A 387 -18.189 7.924 -8.786 1.00 0.00 C ATOM 388 C LEU A 387 -18.309 8.159 -7.269 1.00 0.00 C ATOM 389 O LEU A 387 -18.599 9.251 -6.824 1.00 0.00 O ATOM 390 CB LEU A 387 -19.034 6.702 -9.183 1.00 0.00 C ATOM 391 CG LEU A 387 -20.531 7.085 -9.248 1.00 0.00 C ATOM 392 CD1 LEU A 387 -20.878 7.645 -10.636 1.00 0.00 C ATOM 393 CD2 LEU A 387 -21.396 5.846 -8.982 1.00 0.00 C ATOM 0 H LEU A 387 -16.388 6.771 -8.958 1.00 0.00 H new ATOM 0 HA LEU A 387 -18.550 8.818 -9.294 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -18.706 6.323 -10.151 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -18.888 5.899 -8.460 1.00 0.00 H new ATOM 0 HG LEU A 387 -20.727 7.845 -8.491 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -21.935 7.910 -10.667 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -20.275 8.532 -10.832 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -20.671 6.891 -11.395 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -22.450 6.121 -9.029 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -21.185 5.087 -9.735 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -21.168 5.449 -7.993 1.00 0.00 H new ATOM 405 N THR A 388 -18.106 7.135 -6.474 1.00 0.00 N ATOM 406 CA THR A 388 -18.226 7.289 -4.997 1.00 0.00 C ATOM 407 C THR A 388 -17.085 8.172 -4.525 1.00 0.00 C ATOM 408 O THR A 388 -16.286 8.608 -5.324 1.00 0.00 O ATOM 409 CB THR A 388 -18.133 5.907 -4.335 1.00 0.00 C ATOM 410 OG1 THR A 388 -18.919 4.983 -5.071 1.00 0.00 O ATOM 411 CG2 THR A 388 -18.646 5.967 -2.892 1.00 0.00 C ATOM 0 H THR A 388 -17.861 6.197 -6.790 1.00 0.00 H new ATOM 0 HA THR A 388 -19.182 7.741 -4.730 1.00 0.00 H new ATOM 0 HB THR A 388 -17.090 5.590 -4.326 1.00 0.00 H new ATOM 0 HG1 THR A 388 -18.861 4.099 -4.653 1.00 0.00 H new ATOM 0 HG21 THR A 388 -18.573 4.979 -2.438 1.00 0.00 H new ATOM 0 HG22 THR A 388 -18.044 6.674 -2.321 1.00 0.00 H new ATOM 0 HG23 THR A 388 -19.687 6.291 -2.889 1.00 0.00 H new ATOM 419 N LEU A 389 -16.985 8.464 -3.256 1.00 0.00 N ATOM 420 CA LEU A 389 -15.868 9.339 -2.838 1.00 0.00 C ATOM 421 C LEU A 389 -15.665 9.361 -1.328 1.00 0.00 C ATOM 422 O LEU A 389 -16.211 8.575 -0.585 1.00 0.00 O ATOM 423 CB LEU A 389 -16.154 10.762 -3.334 1.00 0.00 C ATOM 424 CG LEU A 389 -17.470 11.291 -2.703 1.00 0.00 C ATOM 425 CD1 LEU A 389 -17.178 12.208 -1.505 1.00 0.00 C ATOM 426 CD2 LEU A 389 -18.274 12.083 -3.745 1.00 0.00 C ATOM 0 H LEU A 389 -17.610 8.144 -2.516 1.00 0.00 H new ATOM 0 HA LEU A 389 -14.952 8.942 -3.274 1.00 0.00 H new ATOM 0 HB2 LEU A 389 -15.326 11.420 -3.072 1.00 0.00 H new ATOM 0 HB3 LEU A 389 -16.235 10.768 -4.421 1.00 0.00 H new ATOM 0 HG LEU A 389 -18.044 10.430 -2.362 1.00 0.00 H new ATOM 0 HD11 LEU A 389 -18.117 12.564 -1.082 1.00 0.00 H new ATOM 0 HD12 LEU A 389 -16.627 11.652 -0.747 1.00 0.00 H new ATOM 0 HD13 LEU A 389 -16.583 13.059 -1.835 1.00 0.00 H new ATOM 0 HD21 LEU A 389 -19.195 12.450 -3.292 1.00 0.00 H new ATOM 0 HD22 LEU A 389 -17.681 12.928 -4.097 1.00 0.00 H new ATOM 0 HD23 LEU A 389 -18.517 11.435 -4.587 1.00 0.00 H new ATOM 438 N LYS A 390 -14.843 10.285 -0.918 1.00 0.00 N ATOM 439 CA LYS A 390 -14.470 10.490 0.514 1.00 0.00 C ATOM 440 C LYS A 390 -13.170 11.314 0.507 1.00 0.00 C ATOM 441 O LYS A 390 -13.045 12.310 1.192 1.00 0.00 O ATOM 442 CB LYS A 390 -14.231 9.133 1.231 1.00 0.00 C ATOM 443 CG LYS A 390 -15.382 8.830 2.204 1.00 0.00 C ATOM 444 CD LYS A 390 -15.216 7.418 2.772 1.00 0.00 C ATOM 445 CE LYS A 390 -16.497 7.005 3.501 1.00 0.00 C ATOM 446 NZ LYS A 390 -16.939 8.111 4.396 1.00 0.00 N ATOM 0 H LYS A 390 -14.390 10.943 -1.552 1.00 0.00 H new ATOM 0 HA LYS A 390 -15.271 10.999 1.050 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -14.150 8.334 0.494 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -13.286 9.163 1.774 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -15.389 9.560 3.013 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -16.339 8.916 1.689 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -15.000 6.715 1.968 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -14.369 7.388 3.458 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -17.280 6.772 2.779 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -16.321 6.100 4.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -17.580 7.734 5.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -16.109 8.540 4.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -17.437 8.832 3.836 1.00 0.00 H new ATOM 460 N GLY A 391 -12.214 10.897 -0.289 1.00 0.00 N ATOM 461 CA GLY A 391 -10.915 11.631 -0.388 1.00 0.00 C ATOM 462 C GLY A 391 -10.262 11.731 1.005 1.00 0.00 C ATOM 463 O GLY A 391 -10.937 11.692 2.014 1.00 0.00 O ATOM 0 H GLY A 391 -12.281 10.069 -0.881 1.00 0.00 H new ATOM 0 HA2 GLY A 391 -10.247 11.114 -1.076 1.00 0.00 H new ATOM 0 HA3 GLY A 391 -11.081 12.629 -0.794 1.00 0.00 H new ATOM 467 N TYR A 392 -8.955 11.871 1.071 1.00 0.00 N ATOM 468 CA TYR A 392 -8.267 11.985 2.392 1.00 0.00 C ATOM 469 C TYR A 392 -8.863 10.998 3.408 1.00 0.00 C ATOM 470 O TYR A 392 -9.727 11.343 4.189 1.00 0.00 O ATOM 471 CB TYR A 392 -8.418 13.429 2.916 1.00 0.00 C ATOM 472 CG TYR A 392 -7.193 14.252 2.561 1.00 0.00 C ATOM 473 CD1 TYR A 392 -7.004 14.701 1.248 1.00 0.00 C ATOM 474 CD2 TYR A 392 -6.248 14.561 3.548 1.00 0.00 C ATOM 475 CE1 TYR A 392 -5.871 15.460 0.923 1.00 0.00 C ATOM 476 CE2 TYR A 392 -5.116 15.319 3.223 1.00 0.00 C ATOM 477 CZ TYR A 392 -4.928 15.768 1.911 1.00 0.00 C ATOM 478 OH TYR A 392 -3.812 16.516 1.592 1.00 0.00 O ATOM 0 H TYR A 392 -8.337 11.911 0.260 1.00 0.00 H new ATOM 0 HA TYR A 392 -7.212 11.743 2.262 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -9.309 13.887 2.486 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -8.555 13.418 3.997 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.731 14.463 0.486 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -6.393 14.214 4.561 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -5.726 15.807 -0.089 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -4.388 15.557 3.985 1.00 0.00 H new ATOM 0 HH TYR A 392 -3.261 16.640 2.393 1.00 0.00 H new ATOM 488 N LYS A 393 -8.378 9.788 3.429 1.00 0.00 N ATOM 489 CA LYS A 393 -8.873 8.791 4.420 1.00 0.00 C ATOM 490 C LYS A 393 -7.708 7.876 4.811 1.00 0.00 C ATOM 491 O LYS A 393 -6.787 7.668 4.054 1.00 0.00 O ATOM 492 CB LYS A 393 -10.081 8.007 3.849 1.00 0.00 C ATOM 493 CG LYS A 393 -9.674 6.734 3.091 1.00 0.00 C ATOM 494 CD LYS A 393 -8.863 7.111 1.851 1.00 0.00 C ATOM 495 CE LYS A 393 -9.750 7.810 0.796 1.00 0.00 C ATOM 496 NZ LYS A 393 -9.412 9.254 0.771 1.00 0.00 N ATOM 0 H LYS A 393 -7.655 9.444 2.798 1.00 0.00 H new ATOM 0 HA LYS A 393 -9.234 9.292 5.318 1.00 0.00 H new ATOM 0 HB2 LYS A 393 -10.750 7.737 4.666 1.00 0.00 H new ATOM 0 HB3 LYS A 393 -10.643 8.657 3.179 1.00 0.00 H new ATOM 0 HG2 LYS A 393 -9.085 6.085 3.739 1.00 0.00 H new ATOM 0 HG3 LYS A 393 -10.562 6.173 2.800 1.00 0.00 H new ATOM 0 HD2 LYS A 393 -8.043 7.771 2.136 1.00 0.00 H new ATOM 0 HD3 LYS A 393 -8.416 6.216 1.419 1.00 0.00 H new ATOM 0 HE2 LYS A 393 -9.588 7.367 -0.187 1.00 0.00 H new ATOM 0 HE3 LYS A 393 -10.804 7.673 1.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 393 -9.573 9.632 -0.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 393 -10.013 9.763 1.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 393 -8.413 9.381 1.030 1.00 0.00 H new ATOM 510 N GLN A 394 -7.732 7.358 6.004 1.00 0.00 N ATOM 511 CA GLN A 394 -6.616 6.483 6.480 1.00 0.00 C ATOM 512 C GLN A 394 -6.833 5.042 5.993 1.00 0.00 C ATOM 513 O GLN A 394 -7.861 4.448 6.254 1.00 0.00 O ATOM 514 CB GLN A 394 -6.583 6.526 8.031 1.00 0.00 C ATOM 515 CG GLN A 394 -5.303 7.215 8.533 1.00 0.00 C ATOM 516 CD GLN A 394 -4.088 6.326 8.256 1.00 0.00 C ATOM 517 OE1 GLN A 394 -4.262 5.061 7.980 1.00 0.00 O flip ATOM 518 NE2 GLN A 394 -2.965 6.787 8.293 1.00 0.00 N flip ATOM 0 H GLN A 394 -8.482 7.502 6.680 1.00 0.00 H new ATOM 0 HA GLN A 394 -5.667 6.840 6.081 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -7.458 7.059 8.403 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -6.635 5.512 8.428 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -5.180 8.178 8.037 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -5.382 7.414 9.602 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -2.826 7.774 8.508 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -2.161 6.187 8.109 1.00 0.00 H new ATOM 527 N TYR A 395 -5.860 4.468 5.311 1.00 0.00 N ATOM 528 CA TYR A 395 -6.000 3.048 4.833 1.00 0.00 C ATOM 529 C TYR A 395 -4.889 2.207 5.447 1.00 0.00 C ATOM 530 O TYR A 395 -3.716 2.426 5.219 1.00 0.00 O ATOM 531 CB TYR A 395 -5.886 2.968 3.295 1.00 0.00 C ATOM 532 CG TYR A 395 -7.251 2.797 2.642 1.00 0.00 C ATOM 533 CD1 TYR A 395 -8.101 1.747 3.026 1.00 0.00 C ATOM 534 CD2 TYR A 395 -7.659 3.689 1.649 1.00 0.00 C ATOM 535 CE1 TYR A 395 -9.353 1.602 2.416 1.00 0.00 C ATOM 536 CE2 TYR A 395 -8.909 3.544 1.041 1.00 0.00 C ATOM 537 CZ TYR A 395 -9.756 2.502 1.425 1.00 0.00 C ATOM 538 OH TYR A 395 -10.989 2.361 0.824 1.00 0.00 O ATOM 0 H TYR A 395 -4.979 4.920 5.066 1.00 0.00 H new ATOM 0 HA TYR A 395 -6.980 2.677 5.134 1.00 0.00 H new ATOM 0 HB2 TYR A 395 -5.412 3.873 2.917 1.00 0.00 H new ATOM 0 HB3 TYR A 395 -5.243 2.132 3.020 1.00 0.00 H new ATOM 0 HD1 TYR A 395 -7.789 1.052 3.791 1.00 0.00 H new ATOM 0 HD2 TYR A 395 -7.006 4.495 1.349 1.00 0.00 H new ATOM 0 HE1 TYR A 395 -10.007 0.795 2.711 1.00 0.00 H new ATOM 0 HE2 TYR A 395 -9.220 4.238 0.274 1.00 0.00 H new ATOM 0 HH TYR A 395 -11.523 3.168 0.980 1.00 0.00 H new ATOM 548 N TRP A 396 -5.276 1.232 6.198 1.00 0.00 N ATOM 549 CA TRP A 396 -4.298 0.301 6.839 1.00 0.00 C ATOM 550 C TRP A 396 -4.645 -1.117 6.385 1.00 0.00 C ATOM 551 O TRP A 396 -5.494 -1.769 6.956 1.00 0.00 O ATOM 552 CB TRP A 396 -4.399 0.421 8.379 1.00 0.00 C ATOM 553 CG TRP A 396 -5.669 1.121 8.743 1.00 0.00 C ATOM 554 CD1 TRP A 396 -6.903 0.750 8.335 1.00 0.00 C ATOM 555 CD2 TRP A 396 -5.845 2.312 9.556 1.00 0.00 C ATOM 556 NE1 TRP A 396 -7.830 1.630 8.861 1.00 0.00 N ATOM 557 CE2 TRP A 396 -7.226 2.612 9.621 1.00 0.00 C ATOM 558 CE3 TRP A 396 -4.949 3.151 10.242 1.00 0.00 C ATOM 559 CZ2 TRP A 396 -7.701 3.705 10.342 1.00 0.00 C ATOM 560 CZ3 TRP A 396 -5.425 4.253 10.969 1.00 0.00 C ATOM 561 CH2 TRP A 396 -6.799 4.530 11.018 1.00 0.00 C ATOM 0 H TRP A 396 -6.253 1.027 6.407 1.00 0.00 H new ATOM 0 HA TRP A 396 -3.276 0.546 6.549 1.00 0.00 H new ATOM 0 HB2 TRP A 396 -4.374 -0.569 8.834 1.00 0.00 H new ATOM 0 HB3 TRP A 396 -3.543 0.972 8.768 1.00 0.00 H new ATOM 0 HD1 TRP A 396 -7.128 -0.095 7.702 1.00 0.00 H new ATOM 0 HE1 TRP A 396 -8.836 1.562 8.707 1.00 0.00 H new ATOM 0 HE3 TRP A 396 -3.889 2.946 10.209 1.00 0.00 H new ATOM 0 HZ2 TRP A 396 -8.760 3.913 10.378 1.00 0.00 H new ATOM 0 HZ3 TRP A 396 -4.729 4.891 11.494 1.00 0.00 H new ATOM 0 HH2 TRP A 396 -7.159 5.380 11.578 1.00 0.00 H new ATOM 572 N CYS A 397 -4.000 -1.601 5.361 1.00 0.00 N ATOM 573 CA CYS A 397 -4.298 -2.976 4.872 1.00 0.00 C ATOM 574 C CYS A 397 -3.315 -3.953 5.507 1.00 0.00 C ATOM 575 O CYS A 397 -2.360 -3.559 6.145 1.00 0.00 O ATOM 576 CB CYS A 397 -4.151 -3.014 3.352 1.00 0.00 C ATOM 577 SG CYS A 397 -2.405 -2.860 2.906 1.00 0.00 S ATOM 0 H CYS A 397 -3.278 -1.103 4.840 1.00 0.00 H new ATOM 0 HA CYS A 397 -5.316 -3.255 5.143 1.00 0.00 H new ATOM 0 HB2 CYS A 397 -4.555 -3.948 2.961 1.00 0.00 H new ATOM 0 HB3 CYS A 397 -4.725 -2.204 2.901 1.00 0.00 H new ATOM 0 HG CYS A 397 -2.154 -1.634 2.554 1.00 0.00 H new ATOM 583 N THR A 398 -3.542 -5.228 5.339 1.00 0.00 N ATOM 584 CA THR A 398 -2.621 -6.247 5.931 1.00 0.00 C ATOM 585 C THR A 398 -2.405 -7.369 4.921 1.00 0.00 C ATOM 586 O THR A 398 -3.331 -7.824 4.280 1.00 0.00 O ATOM 587 CB THR A 398 -3.243 -6.822 7.205 1.00 0.00 C ATOM 588 OG1 THR A 398 -2.558 -8.014 7.567 1.00 0.00 O ATOM 589 CG2 THR A 398 -4.720 -7.134 6.959 1.00 0.00 C ATOM 0 H THR A 398 -4.329 -5.611 4.815 1.00 0.00 H new ATOM 0 HA THR A 398 -1.667 -5.781 6.175 1.00 0.00 H new ATOM 0 HB THR A 398 -3.159 -6.094 8.012 1.00 0.00 H new ATOM 0 HG1 THR A 398 -2.954 -8.383 8.384 1.00 0.00 H new ATOM 0 HG21 THR A 398 -5.162 -7.544 7.868 1.00 0.00 H new ATOM 0 HG22 THR A 398 -5.244 -6.219 6.681 1.00 0.00 H new ATOM 0 HG23 THR A 398 -4.809 -7.862 6.153 1.00 0.00 H new ATOM 597 N PHE A 399 -1.187 -7.818 4.762 1.00 0.00 N ATOM 598 CA PHE A 399 -0.918 -8.909 3.779 1.00 0.00 C ATOM 599 C PHE A 399 -1.042 -10.271 4.476 1.00 0.00 C ATOM 600 O PHE A 399 -0.246 -10.627 5.322 1.00 0.00 O ATOM 601 CB PHE A 399 0.496 -8.723 3.193 1.00 0.00 C ATOM 602 CG PHE A 399 0.530 -9.122 1.728 1.00 0.00 C ATOM 603 CD1 PHE A 399 0.111 -10.400 1.346 1.00 0.00 C ATOM 604 CD2 PHE A 399 0.987 -8.217 0.760 1.00 0.00 C ATOM 605 CE1 PHE A 399 0.148 -10.776 -0.003 1.00 0.00 C ATOM 606 CE2 PHE A 399 1.024 -8.593 -0.587 1.00 0.00 C ATOM 607 CZ PHE A 399 0.605 -9.873 -0.969 1.00 0.00 C ATOM 0 H PHE A 399 -0.370 -7.478 5.268 1.00 0.00 H new ATOM 0 HA PHE A 399 -1.645 -8.869 2.968 1.00 0.00 H new ATOM 0 HB2 PHE A 399 0.804 -7.683 3.298 1.00 0.00 H new ATOM 0 HB3 PHE A 399 1.210 -9.325 3.755 1.00 0.00 H new ATOM 0 HD1 PHE A 399 -0.241 -11.098 2.091 1.00 0.00 H new ATOM 0 HD2 PHE A 399 1.311 -7.229 1.054 1.00 0.00 H new ATOM 0 HE1 PHE A 399 -0.176 -11.763 -0.297 1.00 0.00 H new ATOM 0 HE2 PHE A 399 1.376 -7.895 -1.333 1.00 0.00 H new ATOM 0 HZ PHE A 399 0.635 -10.163 -2.009 1.00 0.00 H new ATOM 617 N LYS A 400 -2.047 -11.028 4.123 1.00 0.00 N ATOM 618 CA LYS A 400 -2.257 -12.367 4.748 1.00 0.00 C ATOM 619 C LYS A 400 -1.584 -13.448 3.904 1.00 0.00 C ATOM 620 O LYS A 400 -0.878 -13.159 2.961 1.00 0.00 O ATOM 621 CB LYS A 400 -3.752 -12.660 4.838 1.00 0.00 C ATOM 622 CG LYS A 400 -4.487 -11.420 5.348 1.00 0.00 C ATOM 623 CD LYS A 400 -5.951 -11.777 5.653 1.00 0.00 C ATOM 624 CE LYS A 400 -6.825 -10.524 5.546 1.00 0.00 C ATOM 625 NZ LYS A 400 -6.746 -9.982 4.159 1.00 0.00 N ATOM 0 H LYS A 400 -2.740 -10.772 3.419 1.00 0.00 H new ATOM 0 HA LYS A 400 -1.821 -12.364 5.747 1.00 0.00 H new ATOM 0 HB2 LYS A 400 -4.136 -12.946 3.859 1.00 0.00 H new ATOM 0 HB3 LYS A 400 -3.928 -13.501 5.508 1.00 0.00 H new ATOM 0 HG2 LYS A 400 -4.000 -11.040 6.246 1.00 0.00 H new ATOM 0 HG3 LYS A 400 -4.443 -10.627 4.602 1.00 0.00 H new ATOM 0 HD2 LYS A 400 -6.302 -12.537 4.955 1.00 0.00 H new ATOM 0 HD3 LYS A 400 -6.030 -12.202 6.654 1.00 0.00 H new ATOM 0 HE2 LYS A 400 -7.858 -10.765 5.796 1.00 0.00 H new ATOM 0 HE3 LYS A 400 -6.492 -9.772 6.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 -7.626 -9.477 3.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 -5.942 -9.326 4.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 -6.614 -10.765 3.487 1.00 0.00 H new ATOM 639 N ASP A 401 -1.802 -14.691 4.259 1.00 0.00 N ATOM 640 CA ASP A 401 -1.196 -15.847 3.514 1.00 0.00 C ATOM 641 C ASP A 401 -0.992 -15.510 2.032 1.00 0.00 C ATOM 642 O ASP A 401 0.084 -15.676 1.492 1.00 0.00 O ATOM 643 CB ASP A 401 -2.143 -17.040 3.613 1.00 0.00 C ATOM 644 CG ASP A 401 -2.216 -17.515 5.066 1.00 0.00 C ATOM 645 OD1 ASP A 401 -1.174 -17.588 5.697 1.00 0.00 O ATOM 646 OD2 ASP A 401 -3.311 -17.797 5.522 1.00 0.00 O ATOM 0 H ASP A 401 -2.386 -14.961 5.050 1.00 0.00 H new ATOM 0 HA ASP A 401 -0.226 -16.073 3.956 1.00 0.00 H new ATOM 0 HB2 ASP A 401 -3.136 -16.760 3.261 1.00 0.00 H new ATOM 0 HB3 ASP A 401 -1.794 -17.849 2.972 1.00 0.00 H new ATOM 651 N THR A 402 -2.016 -15.042 1.372 1.00 0.00 N ATOM 652 CA THR A 402 -1.879 -14.701 -0.074 1.00 0.00 C ATOM 653 C THR A 402 -2.926 -13.655 -0.455 1.00 0.00 C ATOM 654 O THR A 402 -2.863 -13.061 -1.514 1.00 0.00 O ATOM 655 CB THR A 402 -2.097 -15.961 -0.914 1.00 0.00 C ATOM 656 OG1 THR A 402 -2.314 -15.590 -2.267 1.00 0.00 O ATOM 657 CG2 THR A 402 -3.316 -16.722 -0.390 1.00 0.00 C ATOM 0 H THR A 402 -2.941 -14.881 1.770 1.00 0.00 H new ATOM 0 HA THR A 402 -0.882 -14.302 -0.259 1.00 0.00 H new ATOM 0 HB THR A 402 -1.217 -16.601 -0.847 1.00 0.00 H new ATOM 0 HG1 THR A 402 -2.251 -14.616 -2.353 1.00 0.00 H new ATOM 0 HG21 THR A 402 -3.470 -17.619 -0.989 1.00 0.00 H new ATOM 0 HG22 THR A 402 -3.150 -17.004 0.650 1.00 0.00 H new ATOM 0 HG23 THR A 402 -4.198 -16.086 -0.456 1.00 0.00 H new ATOM 665 N SER A 403 -3.892 -13.429 0.400 1.00 0.00 N ATOM 666 CA SER A 403 -4.961 -12.422 0.095 1.00 0.00 C ATOM 667 C SER A 403 -4.737 -11.164 0.933 1.00 0.00 C ATOM 668 O SER A 403 -3.934 -11.147 1.844 1.00 0.00 O ATOM 669 CB SER A 403 -6.325 -13.019 0.435 1.00 0.00 C ATOM 670 OG SER A 403 -6.415 -14.323 -0.121 1.00 0.00 O ATOM 0 H SER A 403 -3.989 -13.899 1.300 1.00 0.00 H new ATOM 0 HA SER A 403 -4.924 -12.162 -0.963 1.00 0.00 H new ATOM 0 HB2 SER A 403 -6.458 -13.062 1.516 1.00 0.00 H new ATOM 0 HB3 SER A 403 -7.121 -12.387 0.041 1.00 0.00 H new ATOM 0 HG SER A 403 -7.288 -14.712 0.096 1.00 0.00 H new ATOM 676 N ILE A 404 -5.448 -10.108 0.621 1.00 0.00 N ATOM 677 CA ILE A 404 -5.298 -8.822 1.375 1.00 0.00 C ATOM 678 C ILE A 404 -6.649 -8.414 1.964 1.00 0.00 C ATOM 679 O ILE A 404 -7.683 -8.953 1.620 1.00 0.00 O ATOM 680 CB ILE A 404 -4.835 -7.716 0.417 1.00 0.00 C ATOM 681 CG1 ILE A 404 -3.659 -8.206 -0.441 1.00 0.00 C ATOM 682 CG2 ILE A 404 -4.423 -6.462 1.203 1.00 0.00 C ATOM 683 CD1 ILE A 404 -2.426 -8.521 0.416 1.00 0.00 C ATOM 0 H ILE A 404 -6.134 -10.081 -0.133 1.00 0.00 H new ATOM 0 HA ILE A 404 -4.567 -8.961 2.171 1.00 0.00 H new ATOM 0 HB ILE A 404 -5.667 -7.462 -0.239 1.00 0.00 H new ATOM 0 HG12 ILE A 404 -3.957 -9.098 -0.992 1.00 0.00 H new ATOM 0 HG13 ILE A 404 -3.405 -7.445 -1.179 1.00 0.00 H new ATOM 0 HG21 ILE A 404 -4.097 -5.688 0.508 1.00 0.00 H new ATOM 0 HG22 ILE A 404 -5.274 -6.098 1.779 1.00 0.00 H new ATOM 0 HG23 ILE A 404 -3.605 -6.709 1.880 1.00 0.00 H new ATOM 0 HD11 ILE A 404 -1.615 -8.865 -0.226 1.00 0.00 H new ATOM 0 HD12 ILE A 404 -2.113 -7.622 0.947 1.00 0.00 H new ATOM 0 HD13 ILE A 404 -2.673 -9.300 1.137 1.00 0.00 H new ATOM 695 N SER A 405 -6.635 -7.441 2.833 1.00 0.00 N ATOM 696 CA SER A 405 -7.900 -6.935 3.454 1.00 0.00 C ATOM 697 C SER A 405 -7.896 -5.407 3.346 1.00 0.00 C ATOM 698 O SER A 405 -6.852 -4.797 3.216 1.00 0.00 O ATOM 699 CB SER A 405 -7.972 -7.363 4.923 1.00 0.00 C ATOM 700 OG SER A 405 -8.565 -8.651 5.005 1.00 0.00 O ATOM 0 H SER A 405 -5.789 -6.965 3.146 1.00 0.00 H new ATOM 0 HA SER A 405 -8.768 -7.347 2.940 1.00 0.00 H new ATOM 0 HB2 SER A 405 -6.973 -7.381 5.358 1.00 0.00 H new ATOM 0 HB3 SER A 405 -8.557 -6.643 5.496 1.00 0.00 H new ATOM 0 HG SER A 405 -8.831 -8.830 5.931 1.00 0.00 H new ATOM 706 N CYS A 406 -9.050 -4.783 3.374 1.00 0.00 N ATOM 707 CA CYS A 406 -9.095 -3.291 3.239 1.00 0.00 C ATOM 708 C CYS A 406 -10.183 -2.683 4.135 1.00 0.00 C ATOM 709 O CYS A 406 -11.360 -2.796 3.858 1.00 0.00 O ATOM 710 CB CYS A 406 -9.399 -2.953 1.776 1.00 0.00 C ATOM 711 SG CYS A 406 -8.856 -1.265 1.419 1.00 0.00 S ATOM 0 H CYS A 406 -9.956 -5.238 3.484 1.00 0.00 H new ATOM 0 HA CYS A 406 -8.135 -2.876 3.547 1.00 0.00 H new ATOM 0 HB2 CYS A 406 -8.891 -3.657 1.116 1.00 0.00 H new ATOM 0 HB3 CYS A 406 -10.468 -3.051 1.584 1.00 0.00 H new ATOM 0 HG CYS A 406 -9.042 -0.519 2.467 1.00 0.00 H new ATOM 717 N TYR A 407 -9.791 -2.016 5.196 1.00 0.00 N ATOM 718 CA TYR A 407 -10.775 -1.369 6.104 1.00 0.00 C ATOM 719 C TYR A 407 -10.310 0.061 6.381 1.00 0.00 C ATOM 720 O TYR A 407 -9.128 0.344 6.410 1.00 0.00 O ATOM 721 CB TYR A 407 -10.834 -2.147 7.414 1.00 0.00 C ATOM 722 CG TYR A 407 -9.435 -2.429 7.911 1.00 0.00 C ATOM 723 CD1 TYR A 407 -8.667 -3.431 7.308 1.00 0.00 C ATOM 724 CD2 TYR A 407 -8.906 -1.689 8.978 1.00 0.00 C ATOM 725 CE1 TYR A 407 -7.371 -3.693 7.771 1.00 0.00 C ATOM 726 CE2 TYR A 407 -7.612 -1.951 9.440 1.00 0.00 C ATOM 727 CZ TYR A 407 -6.844 -2.954 8.837 1.00 0.00 C ATOM 728 OH TYR A 407 -5.564 -3.210 9.288 1.00 0.00 O ATOM 0 H TYR A 407 -8.816 -1.895 5.469 1.00 0.00 H new ATOM 0 HA TYR A 407 -11.764 -1.358 5.646 1.00 0.00 H new ATOM 0 HB2 TYR A 407 -11.386 -1.576 8.161 1.00 0.00 H new ATOM 0 HB3 TYR A 407 -11.372 -3.083 7.267 1.00 0.00 H new ATOM 0 HD1 TYR A 407 -9.073 -4.002 6.486 1.00 0.00 H new ATOM 0 HD2 TYR A 407 -9.499 -0.916 9.444 1.00 0.00 H new ATOM 0 HE1 TYR A 407 -6.778 -4.466 7.305 1.00 0.00 H new ATOM 0 HE2 TYR A 407 -7.206 -1.380 10.262 1.00 0.00 H new ATOM 0 HH TYR A 407 -4.914 -2.804 8.677 1.00 0.00 H new ATOM 738 N LYS A 408 -11.228 0.969 6.578 1.00 0.00 N ATOM 739 CA LYS A 408 -10.844 2.385 6.846 1.00 0.00 C ATOM 740 C LYS A 408 -10.845 2.637 8.353 1.00 0.00 C ATOM 741 O LYS A 408 -10.506 3.710 8.811 1.00 0.00 O ATOM 742 CB LYS A 408 -11.858 3.316 6.179 1.00 0.00 C ATOM 743 CG LYS A 408 -11.669 3.293 4.653 1.00 0.00 C ATOM 744 CD LYS A 408 -12.945 3.829 3.947 1.00 0.00 C ATOM 745 CE LYS A 408 -13.796 2.676 3.383 1.00 0.00 C ATOM 746 NZ LYS A 408 -15.228 3.091 3.353 1.00 0.00 N ATOM 0 H LYS A 408 -12.232 0.790 6.565 1.00 0.00 H new ATOM 0 HA LYS A 408 -9.848 2.575 6.445 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -12.871 3.005 6.433 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -11.733 4.332 6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -10.808 3.902 4.376 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.460 2.276 4.320 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -13.538 4.410 4.654 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -12.661 4.503 3.139 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -13.459 2.417 2.379 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -13.676 1.785 3.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -15.835 2.253 3.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -15.414 3.754 4.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -15.436 3.556 2.446 1.00 0.00 H new ATOM 760 N SER A 409 -11.229 1.662 9.131 1.00 0.00 N ATOM 761 CA SER A 409 -11.250 1.863 10.607 1.00 0.00 C ATOM 762 C SER A 409 -11.452 0.526 11.317 1.00 0.00 C ATOM 763 O SER A 409 -11.955 -0.425 10.752 1.00 0.00 O ATOM 764 CB SER A 409 -12.389 2.814 10.975 1.00 0.00 C ATOM 765 OG SER A 409 -12.197 3.284 12.302 1.00 0.00 O ATOM 0 H SER A 409 -11.527 0.741 8.811 1.00 0.00 H new ATOM 0 HA SER A 409 -10.298 2.291 10.921 1.00 0.00 H new ATOM 0 HB2 SER A 409 -12.417 3.653 10.280 1.00 0.00 H new ATOM 0 HB3 SER A 409 -13.347 2.301 10.894 1.00 0.00 H new ATOM 0 HG SER A 409 -12.925 3.896 12.541 1.00 0.00 H new ATOM 771 N LYS A 410 -11.069 0.455 12.563 1.00 0.00 N ATOM 772 CA LYS A 410 -11.242 -0.811 13.333 1.00 0.00 C ATOM 773 C LYS A 410 -12.673 -0.852 13.883 1.00 0.00 C ATOM 774 O LYS A 410 -13.099 -1.829 14.467 1.00 0.00 O ATOM 775 CB LYS A 410 -10.210 -0.895 14.492 1.00 0.00 C ATOM 776 CG LYS A 410 -9.621 0.486 14.823 1.00 0.00 C ATOM 777 CD LYS A 410 -10.717 1.418 15.353 1.00 0.00 C ATOM 778 CE LYS A 410 -10.173 2.846 15.443 1.00 0.00 C ATOM 779 NZ LYS A 410 -9.027 2.885 16.395 1.00 0.00 N ATOM 0 H LYS A 410 -10.642 1.222 13.083 1.00 0.00 H new ATOM 0 HA LYS A 410 -11.072 -1.666 12.678 1.00 0.00 H new ATOM 0 HB2 LYS A 410 -10.690 -1.309 15.379 1.00 0.00 H new ATOM 0 HB3 LYS A 410 -9.406 -1.578 14.216 1.00 0.00 H new ATOM 0 HG2 LYS A 410 -8.831 0.383 15.566 1.00 0.00 H new ATOM 0 HG3 LYS A 410 -9.166 0.918 13.932 1.00 0.00 H new ATOM 0 HD2 LYS A 410 -11.584 1.389 14.694 1.00 0.00 H new ATOM 0 HD3 LYS A 410 -11.051 1.082 16.335 1.00 0.00 H new ATOM 0 HE2 LYS A 410 -9.853 3.187 14.458 1.00 0.00 H new ATOM 0 HE3 LYS A 410 -10.958 3.525 15.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 410 -8.822 3.872 16.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 410 -9.269 2.348 17.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 410 -8.189 2.463 15.947 1.00 0.00 H new ATOM 793 N GLU A 411 -13.413 0.206 13.696 1.00 0.00 N ATOM 794 CA GLU A 411 -14.812 0.246 14.195 1.00 0.00 C ATOM 795 C GLU A 411 -15.540 -1.039 13.789 1.00 0.00 C ATOM 796 O GLU A 411 -16.242 -1.643 14.575 1.00 0.00 O ATOM 797 CB GLU A 411 -15.515 1.464 13.574 1.00 0.00 C ATOM 798 CG GLU A 411 -16.603 1.978 14.515 1.00 0.00 C ATOM 799 CD GLU A 411 -17.589 0.851 14.821 1.00 0.00 C ATOM 800 OE1 GLU A 411 -18.023 0.199 13.886 1.00 0.00 O ATOM 801 OE2 GLU A 411 -17.893 0.658 15.987 1.00 0.00 O ATOM 0 H GLU A 411 -13.104 1.050 13.215 1.00 0.00 H new ATOM 0 HA GLU A 411 -14.822 0.326 15.282 1.00 0.00 H new ATOM 0 HB2 GLU A 411 -14.789 2.253 13.380 1.00 0.00 H new ATOM 0 HB3 GLU A 411 -15.953 1.191 12.614 1.00 0.00 H new ATOM 0 HG2 GLU A 411 -16.156 2.345 15.439 1.00 0.00 H new ATOM 0 HG3 GLU A 411 -17.126 2.819 14.059 1.00 0.00 H new ATOM 808 N GLU A 412 -15.378 -1.448 12.558 1.00 0.00 N ATOM 809 CA GLU A 412 -16.057 -2.687 12.069 1.00 0.00 C ATOM 810 C GLU A 412 -15.974 -3.782 13.130 1.00 0.00 C ATOM 811 O GLU A 412 -16.967 -4.186 13.699 1.00 0.00 O ATOM 812 CB GLU A 412 -15.380 -3.168 10.780 1.00 0.00 C ATOM 813 CG GLU A 412 -15.053 -1.964 9.895 1.00 0.00 C ATOM 814 CD GLU A 412 -14.703 -2.445 8.487 1.00 0.00 C ATOM 815 OE1 GLU A 412 -15.620 -2.706 7.726 1.00 0.00 O ATOM 816 OE2 GLU A 412 -13.523 -2.542 8.192 1.00 0.00 O ATOM 0 H GLU A 412 -14.800 -0.974 11.864 1.00 0.00 H new ATOM 0 HA GLU A 412 -17.105 -2.464 11.869 1.00 0.00 H new ATOM 0 HB2 GLU A 412 -14.468 -3.716 11.018 1.00 0.00 H new ATOM 0 HB3 GLU A 412 -16.036 -3.857 10.247 1.00 0.00 H new ATOM 0 HG2 GLU A 412 -15.905 -1.285 9.857 1.00 0.00 H new ATOM 0 HG3 GLU A 412 -14.218 -1.405 10.318 1.00 0.00 H new ATOM 823 N SER A 413 -14.792 -4.249 13.397 1.00 0.00 N ATOM 824 CA SER A 413 -14.601 -5.314 14.423 1.00 0.00 C ATOM 825 C SER A 413 -15.524 -6.496 14.128 1.00 0.00 C ATOM 826 O SER A 413 -15.124 -7.480 13.538 1.00 0.00 O ATOM 827 CB SER A 413 -14.924 -4.749 15.806 1.00 0.00 C ATOM 828 OG SER A 413 -14.848 -5.793 16.767 1.00 0.00 O ATOM 0 H SER A 413 -13.934 -3.935 12.943 1.00 0.00 H new ATOM 0 HA SER A 413 -13.566 -5.655 14.397 1.00 0.00 H new ATOM 0 HB2 SER A 413 -14.223 -3.953 16.060 1.00 0.00 H new ATOM 0 HB3 SER A 413 -15.921 -4.308 15.808 1.00 0.00 H new ATOM 0 HG SER A 413 -15.053 -5.435 17.656 1.00 0.00 H new ATOM 834 N SER A 414 -16.755 -6.404 14.535 1.00 0.00 N ATOM 835 CA SER A 414 -17.713 -7.516 14.283 1.00 0.00 C ATOM 836 C SER A 414 -18.120 -7.510 12.809 1.00 0.00 C ATOM 837 O SER A 414 -18.956 -8.283 12.384 1.00 0.00 O ATOM 838 CB SER A 414 -18.953 -7.327 15.157 1.00 0.00 C ATOM 839 OG SER A 414 -19.443 -6.003 14.998 1.00 0.00 O ATOM 0 H SER A 414 -17.143 -5.604 15.034 1.00 0.00 H new ATOM 0 HA SER A 414 -17.241 -8.468 14.526 1.00 0.00 H new ATOM 0 HB2 SER A 414 -19.722 -8.047 14.878 1.00 0.00 H new ATOM 0 HB3 SER A 414 -18.707 -7.513 16.202 1.00 0.00 H new ATOM 0 HG SER A 414 -20.239 -5.880 15.556 1.00 0.00 H new ATOM 845 N GLY A 415 -17.528 -6.641 12.026 1.00 0.00 N ATOM 846 CA GLY A 415 -17.861 -6.563 10.569 1.00 0.00 C ATOM 847 C GLY A 415 -16.668 -7.061 9.754 1.00 0.00 C ATOM 848 O GLY A 415 -15.700 -7.556 10.298 1.00 0.00 O ATOM 0 H GLY A 415 -16.821 -5.975 12.338 1.00 0.00 H new ATOM 0 HA2 GLY A 415 -18.742 -7.167 10.352 1.00 0.00 H new ATOM 0 HA3 GLY A 415 -18.102 -5.536 10.293 1.00 0.00 H new ATOM 852 N THR A 416 -16.732 -6.934 8.450 1.00 0.00 N ATOM 853 CA THR A 416 -15.608 -7.395 7.573 1.00 0.00 C ATOM 854 C THR A 416 -15.157 -6.220 6.684 1.00 0.00 C ATOM 855 O THR A 416 -15.969 -5.404 6.295 1.00 0.00 O ATOM 856 CB THR A 416 -16.118 -8.546 6.698 1.00 0.00 C ATOM 857 OG1 THR A 416 -15.051 -9.073 5.923 1.00 0.00 O ATOM 858 CG2 THR A 416 -17.221 -8.036 5.771 1.00 0.00 C ATOM 0 H THR A 416 -17.523 -6.527 7.951 1.00 0.00 H new ATOM 0 HA THR A 416 -14.765 -7.736 8.173 1.00 0.00 H new ATOM 0 HB THR A 416 -16.517 -9.332 7.339 1.00 0.00 H new ATOM 0 HG1 THR A 416 -15.383 -9.809 5.367 1.00 0.00 H new ATOM 0 HG21 THR A 416 -17.582 -8.856 5.150 1.00 0.00 H new ATOM 0 HG22 THR A 416 -18.044 -7.642 6.367 1.00 0.00 H new ATOM 0 HG23 THR A 416 -16.824 -7.246 5.134 1.00 0.00 H new ATOM 866 N PRO A 417 -13.881 -6.110 6.371 1.00 0.00 N ATOM 867 CA PRO A 417 -13.373 -4.989 5.529 1.00 0.00 C ATOM 868 C PRO A 417 -14.247 -4.764 4.285 1.00 0.00 C ATOM 869 O PRO A 417 -14.847 -5.679 3.757 1.00 0.00 O ATOM 870 CB PRO A 417 -11.928 -5.391 5.143 1.00 0.00 C ATOM 871 CG PRO A 417 -11.643 -6.714 5.815 1.00 0.00 C ATOM 872 CD PRO A 417 -12.800 -7.022 6.777 1.00 0.00 C ATOM 0 HA PRO A 417 -13.399 -4.043 6.069 1.00 0.00 H new ATOM 0 HB2 PRO A 417 -11.828 -5.479 4.061 1.00 0.00 H new ATOM 0 HB3 PRO A 417 -11.217 -4.632 5.468 1.00 0.00 H new ATOM 0 HG2 PRO A 417 -11.546 -7.505 5.071 1.00 0.00 H new ATOM 0 HG3 PRO A 417 -10.699 -6.669 6.358 1.00 0.00 H new ATOM 0 HD2 PRO A 417 -13.112 -8.064 6.700 1.00 0.00 H new ATOM 0 HD3 PRO A 417 -12.508 -6.853 7.813 1.00 0.00 H new ATOM 880 N ALA A 418 -14.327 -3.544 3.827 1.00 0.00 N ATOM 881 CA ALA A 418 -15.165 -3.242 2.632 1.00 0.00 C ATOM 882 C ALA A 418 -14.824 -4.204 1.494 1.00 0.00 C ATOM 883 O ALA A 418 -15.697 -4.680 0.795 1.00 0.00 O ATOM 884 CB ALA A 418 -14.907 -1.804 2.178 1.00 0.00 C ATOM 0 H ALA A 418 -13.846 -2.740 4.231 1.00 0.00 H new ATOM 0 HA ALA A 418 -16.216 -3.361 2.896 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -15.520 -1.583 1.304 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -15.163 -1.116 2.984 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -13.854 -1.687 1.922 1.00 0.00 H new ATOM 890 N HIS A 419 -13.566 -4.496 1.291 1.00 0.00 N ATOM 891 CA HIS A 419 -13.187 -5.427 0.186 1.00 0.00 C ATOM 892 C HIS A 419 -11.939 -6.222 0.596 1.00 0.00 C ATOM 893 O HIS A 419 -11.012 -5.692 1.177 1.00 0.00 O ATOM 894 CB HIS A 419 -12.907 -4.598 -1.095 1.00 0.00 C ATOM 895 CG HIS A 419 -14.015 -4.790 -2.105 1.00 0.00 C ATOM 896 ND1 HIS A 419 -14.703 -3.721 -2.663 1.00 0.00 N ATOM 897 CD2 HIS A 419 -14.558 -5.920 -2.668 1.00 0.00 C ATOM 898 CE1 HIS A 419 -15.611 -4.225 -3.520 1.00 0.00 C ATOM 899 NE2 HIS A 419 -15.562 -5.558 -3.558 1.00 0.00 N ATOM 0 H HIS A 419 -12.787 -4.132 1.840 1.00 0.00 H new ATOM 0 HA HIS A 419 -13.998 -6.128 -0.012 1.00 0.00 H new ATOM 0 HB2 HIS A 419 -12.819 -3.542 -0.839 1.00 0.00 H new ATOM 0 HB3 HIS A 419 -11.955 -4.901 -1.530 1.00 0.00 H new ATOM 0 HD1 HIS A 419 -14.549 -2.733 -2.461 1.00 0.00 H new ATOM 0 HD2 HIS A 419 -14.252 -6.933 -2.452 1.00 0.00 H new ATOM 0 HE1 HIS A 419 -16.294 -3.625 -4.104 1.00 0.00 H new ATOM 908 N GLN A 420 -11.914 -7.493 0.281 1.00 0.00 N ATOM 909 CA GLN A 420 -10.737 -8.352 0.623 1.00 0.00 C ATOM 910 C GLN A 420 -10.358 -9.156 -0.626 1.00 0.00 C ATOM 911 O GLN A 420 -11.095 -10.020 -1.060 1.00 0.00 O ATOM 912 CB GLN A 420 -11.113 -9.314 1.772 1.00 0.00 C ATOM 913 CG GLN A 420 -12.208 -8.681 2.638 1.00 0.00 C ATOM 914 CD GLN A 420 -13.561 -8.821 1.938 1.00 0.00 C ATOM 915 OE1 GLN A 420 -14.294 -7.760 1.746 1.00 0.00 O flip ATOM 916 NE2 GLN A 420 -13.954 -9.908 1.561 1.00 0.00 N flip ATOM 0 H GLN A 420 -12.668 -7.978 -0.205 1.00 0.00 H new ATOM 0 HA GLN A 420 -9.897 -7.737 0.945 1.00 0.00 H new ATOM 0 HB2 GLN A 420 -11.461 -10.263 1.365 1.00 0.00 H new ATOM 0 HB3 GLN A 420 -10.235 -9.531 2.380 1.00 0.00 H new ATOM 0 HG2 GLN A 420 -12.240 -9.166 3.614 1.00 0.00 H new ATOM 0 HG3 GLN A 420 -11.985 -7.629 2.813 1.00 0.00 H new ATOM 0 HE21 GLN A 420 -13.380 -10.738 1.711 1.00 0.00 H new ATOM 0 HE22 GLN A 420 -14.857 -9.990 1.094 1.00 0.00 H new ATOM 925 N MET A 421 -9.228 -8.880 -1.217 1.00 0.00 N ATOM 926 CA MET A 421 -8.832 -9.629 -2.439 1.00 0.00 C ATOM 927 C MET A 421 -7.314 -9.562 -2.616 1.00 0.00 C ATOM 928 O MET A 421 -6.630 -8.824 -1.935 1.00 0.00 O ATOM 929 CB MET A 421 -9.521 -9.009 -3.654 1.00 0.00 C ATOM 930 CG MET A 421 -9.440 -7.484 -3.572 1.00 0.00 C ATOM 931 SD MET A 421 -10.125 -6.765 -5.090 1.00 0.00 S ATOM 932 CE MET A 421 -11.685 -6.157 -4.400 1.00 0.00 C ATOM 0 H MET A 421 -8.565 -8.170 -0.906 1.00 0.00 H new ATOM 0 HA MET A 421 -9.133 -10.672 -2.342 1.00 0.00 H new ATOM 0 HB2 MET A 421 -9.046 -9.359 -4.571 1.00 0.00 H new ATOM 0 HB3 MET A 421 -10.563 -9.326 -3.694 1.00 0.00 H new ATOM 0 HG2 MET A 421 -9.993 -7.125 -2.704 1.00 0.00 H new ATOM 0 HG3 MET A 421 -8.404 -7.170 -3.442 1.00 0.00 H new ATOM 0 HE1 MET A 421 -12.430 -6.085 -5.192 1.00 0.00 H new ATOM 0 HE2 MET A 421 -12.037 -6.847 -3.633 1.00 0.00 H new ATOM 0 HE3 MET A 421 -11.529 -5.172 -3.959 1.00 0.00 H new ATOM 942 N ASN A 422 -6.784 -10.334 -3.524 1.00 0.00 N ATOM 943 CA ASN A 422 -5.313 -10.332 -3.750 1.00 0.00 C ATOM 944 C ASN A 422 -4.933 -9.181 -4.686 1.00 0.00 C ATOM 945 O ASN A 422 -5.257 -9.191 -5.857 1.00 0.00 O ATOM 946 CB ASN A 422 -4.906 -11.662 -4.388 1.00 0.00 C ATOM 947 CG ASN A 422 -5.916 -12.036 -5.474 1.00 0.00 C ATOM 948 OD1 ASN A 422 -7.109 -12.022 -5.241 1.00 0.00 O ATOM 949 ND2 ASN A 422 -5.487 -12.370 -6.661 1.00 0.00 N ATOM 0 H ASN A 422 -7.311 -10.970 -4.123 1.00 0.00 H new ATOM 0 HA ASN A 422 -4.798 -10.203 -2.798 1.00 0.00 H new ATOM 0 HB2 ASN A 422 -3.907 -11.581 -4.817 1.00 0.00 H new ATOM 0 HB3 ASN A 422 -4.865 -12.444 -3.630 1.00 0.00 H new ATOM 0 HD21 ASN A 422 -6.153 -12.619 -7.392 1.00 0.00 H new ATOM 0 HD22 ASN A 422 -4.486 -12.382 -6.857 1.00 0.00 H new ATOM 956 N LEU A 423 -4.236 -8.196 -4.186 1.00 0.00 N ATOM 957 CA LEU A 423 -3.827 -7.057 -5.064 1.00 0.00 C ATOM 958 C LEU A 423 -2.582 -7.469 -5.857 1.00 0.00 C ATOM 959 O LEU A 423 -2.004 -6.683 -6.580 1.00 0.00 O ATOM 960 CB LEU A 423 -3.516 -5.815 -4.209 1.00 0.00 C ATOM 961 CG LEU A 423 -4.813 -5.069 -3.848 1.00 0.00 C ATOM 962 CD1 LEU A 423 -5.480 -4.477 -5.109 1.00 0.00 C ATOM 963 CD2 LEU A 423 -5.778 -6.036 -3.153 1.00 0.00 C ATOM 0 H LEU A 423 -3.933 -8.129 -3.214 1.00 0.00 H new ATOM 0 HA LEU A 423 -4.639 -6.812 -5.749 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -2.996 -6.114 -3.299 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -2.847 -5.149 -4.754 1.00 0.00 H new ATOM 0 HG LEU A 423 -4.567 -4.246 -3.177 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -6.394 -3.955 -4.826 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -4.796 -3.776 -5.588 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -5.721 -5.281 -5.804 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -6.698 -5.510 -2.896 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -6.009 -6.864 -3.823 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -5.315 -6.422 -2.245 1.00 0.00 H new ATOM 975 N ARG A 424 -2.171 -8.699 -5.721 1.00 0.00 N ATOM 976 CA ARG A 424 -0.970 -9.182 -6.457 1.00 0.00 C ATOM 977 C ARG A 424 -1.053 -8.751 -7.922 1.00 0.00 C ATOM 978 O ARG A 424 -2.097 -8.803 -8.542 1.00 0.00 O ATOM 979 CB ARG A 424 -0.916 -10.710 -6.361 1.00 0.00 C ATOM 980 CG ARG A 424 0.174 -11.272 -7.277 1.00 0.00 C ATOM 981 CD ARG A 424 0.369 -12.759 -6.961 1.00 0.00 C ATOM 982 NE ARG A 424 1.436 -13.330 -7.831 1.00 0.00 N ATOM 983 CZ ARG A 424 1.597 -14.625 -7.896 1.00 0.00 C ATOM 984 NH1 ARG A 424 0.812 -15.414 -7.213 1.00 0.00 N ATOM 985 NH2 ARG A 424 2.538 -15.132 -8.644 1.00 0.00 N ATOM 0 H ARG A 424 -2.620 -9.396 -5.126 1.00 0.00 H new ATOM 0 HA ARG A 424 -0.068 -8.755 -6.019 1.00 0.00 H new ATOM 0 HB2 ARG A 424 -0.721 -11.008 -5.331 1.00 0.00 H new ATOM 0 HB3 ARG A 424 -1.883 -11.131 -6.637 1.00 0.00 H new ATOM 0 HG2 ARG A 424 -0.108 -11.142 -8.322 1.00 0.00 H new ATOM 0 HG3 ARG A 424 1.108 -10.729 -7.129 1.00 0.00 H new ATOM 0 HD2 ARG A 424 0.638 -12.884 -5.912 1.00 0.00 H new ATOM 0 HD3 ARG A 424 -0.566 -13.298 -7.117 1.00 0.00 H new ATOM 0 HE ARG A 424 2.039 -12.712 -8.374 1.00 0.00 H new ATOM 0 HH11 ARG A 424 0.074 -15.019 -6.630 1.00 0.00 H new ATOM 0 HH12 ARG A 424 0.937 -16.425 -7.263 1.00 0.00 H new ATOM 0 HH21 ARG A 424 3.150 -14.517 -9.180 1.00 0.00 H new ATOM 0 HH22 ARG A 424 2.661 -16.143 -8.693 1.00 0.00 H new ATOM 999 N GLY A 425 0.050 -8.327 -8.475 1.00 0.00 N ATOM 1000 CA GLY A 425 0.069 -7.889 -9.908 1.00 0.00 C ATOM 1001 C GLY A 425 -0.007 -6.359 -9.999 1.00 0.00 C ATOM 1002 O GLY A 425 -0.423 -5.814 -11.002 1.00 0.00 O ATOM 0 H GLY A 425 0.948 -8.263 -7.995 1.00 0.00 H new ATOM 0 HA2 GLY A 425 0.979 -8.244 -10.392 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -0.770 -8.334 -10.442 1.00 0.00 H new ATOM 1006 N CYS A 426 0.390 -5.656 -8.967 1.00 0.00 N ATOM 1007 CA CYS A 426 0.336 -4.159 -9.008 1.00 0.00 C ATOM 1008 C CYS A 426 1.681 -3.607 -9.477 1.00 0.00 C ATOM 1009 O CYS A 426 2.694 -4.274 -9.405 1.00 0.00 O ATOM 1010 CB CYS A 426 0.034 -3.621 -7.611 1.00 0.00 C ATOM 1011 SG CYS A 426 1.313 -4.178 -6.458 1.00 0.00 S ATOM 0 H CYS A 426 0.749 -6.052 -8.098 1.00 0.00 H new ATOM 0 HA CYS A 426 -0.447 -3.848 -9.700 1.00 0.00 H new ATOM 0 HB2 CYS A 426 -0.004 -2.532 -7.630 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -0.945 -3.968 -7.280 1.00 0.00 H new ATOM 0 HG CYS A 426 1.056 -3.718 -5.270 1.00 0.00 H new ATOM 1017 N GLU A 427 1.706 -2.386 -9.952 1.00 0.00 N ATOM 1018 CA GLU A 427 2.991 -1.790 -10.418 1.00 0.00 C ATOM 1019 C GLU A 427 3.620 -1.020 -9.248 1.00 0.00 C ATOM 1020 O GLU A 427 3.022 -0.871 -8.202 1.00 0.00 O ATOM 1021 CB GLU A 427 2.699 -0.843 -11.600 1.00 0.00 C ATOM 1022 CG GLU A 427 3.883 -0.821 -12.582 1.00 0.00 C ATOM 1023 CD GLU A 427 3.833 0.448 -13.439 1.00 0.00 C ATOM 1024 OE1 GLU A 427 2.789 0.714 -14.011 1.00 0.00 O ATOM 1025 OE2 GLU A 427 4.841 1.133 -13.507 1.00 0.00 O ATOM 0 H GLU A 427 0.891 -1.778 -10.036 1.00 0.00 H new ATOM 0 HA GLU A 427 3.684 -2.563 -10.751 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.796 -1.167 -12.118 1.00 0.00 H new ATOM 0 HB3 GLU A 427 2.509 0.164 -11.228 1.00 0.00 H new ATOM 0 HG2 GLU A 427 4.823 -0.860 -12.031 1.00 0.00 H new ATOM 0 HG3 GLU A 427 3.851 -1.703 -13.222 1.00 0.00 H new ATOM 1032 N VAL A 428 4.819 -0.534 -9.411 1.00 0.00 N ATOM 1033 CA VAL A 428 5.481 0.221 -8.302 1.00 0.00 C ATOM 1034 C VAL A 428 6.476 1.242 -8.879 1.00 0.00 C ATOM 1035 O VAL A 428 7.308 0.923 -9.705 1.00 0.00 O ATOM 1036 CB VAL A 428 6.209 -0.774 -7.376 1.00 0.00 C ATOM 1037 CG1 VAL A 428 6.995 -1.789 -8.211 1.00 0.00 C ATOM 1038 CG2 VAL A 428 7.175 -0.028 -6.447 1.00 0.00 C ATOM 0 H VAL A 428 5.372 -0.625 -10.263 1.00 0.00 H new ATOM 0 HA VAL A 428 4.728 0.762 -7.728 1.00 0.00 H new ATOM 0 HB VAL A 428 5.463 -1.295 -6.776 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.506 -2.488 -7.548 1.00 0.00 H new ATOM 0 HG12 VAL A 428 6.309 -2.337 -8.857 1.00 0.00 H new ATOM 0 HG13 VAL A 428 7.730 -1.266 -8.823 1.00 0.00 H new ATOM 0 HG21 VAL A 428 7.682 -0.743 -5.799 1.00 0.00 H new ATOM 0 HG22 VAL A 428 7.913 0.507 -7.044 1.00 0.00 H new ATOM 0 HG23 VAL A 428 6.617 0.683 -5.837 1.00 0.00 H new ATOM 1048 N THR A 429 6.393 2.470 -8.434 1.00 0.00 N ATOM 1049 CA THR A 429 7.323 3.525 -8.928 1.00 0.00 C ATOM 1050 C THR A 429 7.450 4.612 -7.841 1.00 0.00 C ATOM 1051 O THR A 429 6.452 5.098 -7.349 1.00 0.00 O ATOM 1052 CB THR A 429 6.748 4.146 -10.206 1.00 0.00 C ATOM 1053 OG1 THR A 429 6.290 3.115 -11.068 1.00 0.00 O ATOM 1054 CG2 THR A 429 7.824 4.968 -10.913 1.00 0.00 C ATOM 0 H THR A 429 5.713 2.788 -7.743 1.00 0.00 H new ATOM 0 HA THR A 429 8.301 3.096 -9.144 1.00 0.00 H new ATOM 0 HB THR A 429 5.915 4.799 -9.946 1.00 0.00 H new ATOM 0 HG1 THR A 429 5.921 3.511 -11.885 1.00 0.00 H new ATOM 0 HG21 THR A 429 7.409 5.407 -11.820 1.00 0.00 H new ATOM 0 HG22 THR A 429 8.169 5.762 -10.251 1.00 0.00 H new ATOM 0 HG23 THR A 429 8.663 4.322 -11.173 1.00 0.00 H new ATOM 1062 N PRO A 430 8.649 4.995 -7.449 1.00 0.00 N ATOM 1063 CA PRO A 430 8.839 6.034 -6.391 1.00 0.00 C ATOM 1064 C PRO A 430 8.602 7.464 -6.900 1.00 0.00 C ATOM 1065 O PRO A 430 9.034 7.836 -7.973 1.00 0.00 O ATOM 1066 CB PRO A 430 10.304 5.847 -5.974 1.00 0.00 C ATOM 1067 CG PRO A 430 10.984 5.352 -7.209 1.00 0.00 C ATOM 1068 CD PRO A 430 9.948 4.497 -7.951 1.00 0.00 C ATOM 0 HA PRO A 430 8.125 5.913 -5.577 1.00 0.00 H new ATOM 0 HB2 PRO A 430 10.741 6.784 -5.629 1.00 0.00 H new ATOM 0 HB3 PRO A 430 10.396 5.132 -5.157 1.00 0.00 H new ATOM 0 HG2 PRO A 430 11.319 6.183 -7.829 1.00 0.00 H new ATOM 0 HG3 PRO A 430 11.867 4.764 -6.959 1.00 0.00 H new ATOM 0 HD2 PRO A 430 10.031 4.617 -9.031 1.00 0.00 H new ATOM 0 HD3 PRO A 430 10.079 3.436 -7.737 1.00 0.00 H new ATOM 1076 N ASP A 431 7.937 8.269 -6.115 1.00 0.00 N ATOM 1077 CA ASP A 431 7.682 9.683 -6.511 1.00 0.00 C ATOM 1078 C ASP A 431 7.581 10.515 -5.235 1.00 0.00 C ATOM 1079 O ASP A 431 6.508 10.737 -4.715 1.00 0.00 O ATOM 1080 CB ASP A 431 6.366 9.780 -7.290 1.00 0.00 C ATOM 1081 CG ASP A 431 6.572 9.285 -8.724 1.00 0.00 C ATOM 1082 OD1 ASP A 431 7.689 9.367 -9.206 1.00 0.00 O ATOM 1083 OD2 ASP A 431 5.605 8.835 -9.317 1.00 0.00 O ATOM 0 H ASP A 431 7.556 8.003 -5.207 1.00 0.00 H new ATOM 0 HA ASP A 431 8.489 10.048 -7.146 1.00 0.00 H new ATOM 0 HB2 ASP A 431 5.597 9.185 -6.797 1.00 0.00 H new ATOM 0 HB3 ASP A 431 6.014 10.811 -7.299 1.00 0.00 H new ATOM 1088 N VAL A 432 8.698 10.962 -4.720 1.00 0.00 N ATOM 1089 CA VAL A 432 8.695 11.770 -3.462 1.00 0.00 C ATOM 1090 C VAL A 432 9.511 13.044 -3.671 1.00 0.00 C ATOM 1091 O VAL A 432 10.627 13.010 -4.150 1.00 0.00 O ATOM 1092 CB VAL A 432 9.306 10.932 -2.326 1.00 0.00 C ATOM 1093 CG1 VAL A 432 10.592 10.259 -2.802 1.00 0.00 C ATOM 1094 CG2 VAL A 432 9.626 11.821 -1.113 1.00 0.00 C ATOM 0 H VAL A 432 9.622 10.800 -5.121 1.00 0.00 H new ATOM 0 HA VAL A 432 7.673 12.045 -3.200 1.00 0.00 H new ATOM 0 HB VAL A 432 8.580 10.173 -2.035 1.00 0.00 H new ATOM 0 HG11 VAL A 432 11.016 9.669 -1.990 1.00 0.00 H new ATOM 0 HG12 VAL A 432 10.370 9.607 -3.647 1.00 0.00 H new ATOM 0 HG13 VAL A 432 11.309 11.020 -3.109 1.00 0.00 H new ATOM 0 HG21 VAL A 432 10.057 11.212 -0.319 1.00 0.00 H new ATOM 0 HG22 VAL A 432 10.338 12.593 -1.405 1.00 0.00 H new ATOM 0 HG23 VAL A 432 8.710 12.290 -0.754 1.00 0.00 H new ATOM 1104 N ASN A 433 8.961 14.171 -3.299 1.00 0.00 N ATOM 1105 CA ASN A 433 9.700 15.457 -3.453 1.00 0.00 C ATOM 1106 C ASN A 433 10.417 15.751 -2.139 1.00 0.00 C ATOM 1107 O ASN A 433 9.801 16.103 -1.155 1.00 0.00 O ATOM 1108 CB ASN A 433 8.708 16.580 -3.759 1.00 0.00 C ATOM 1109 CG ASN A 433 8.171 16.419 -5.181 1.00 0.00 C ATOM 1110 OD1 ASN A 433 8.546 15.503 -5.886 1.00 0.00 O ATOM 1111 ND2 ASN A 433 7.297 17.275 -5.633 1.00 0.00 N ATOM 0 H ASN A 433 8.029 14.255 -2.894 1.00 0.00 H new ATOM 0 HA ASN A 433 10.419 15.388 -4.269 1.00 0.00 H new ATOM 0 HB2 ASN A 433 7.885 16.556 -3.044 1.00 0.00 H new ATOM 0 HB3 ASN A 433 9.196 17.549 -3.652 1.00 0.00 H new ATOM 0 HD21 ASN A 433 6.928 17.176 -6.579 1.00 0.00 H new ATOM 0 HD22 ASN A 433 6.983 18.044 -5.041 1.00 0.00 H new ATOM 1118 N ILE A 434 11.709 15.587 -2.103 1.00 0.00 N ATOM 1119 CA ILE A 434 12.445 15.833 -0.835 1.00 0.00 C ATOM 1120 C ILE A 434 12.434 17.322 -0.505 1.00 0.00 C ATOM 1121 O ILE A 434 12.359 17.708 0.643 1.00 0.00 O ATOM 1122 CB ILE A 434 13.892 15.345 -0.962 1.00 0.00 C ATOM 1123 CG1 ILE A 434 13.907 13.824 -1.187 1.00 0.00 C ATOM 1124 CG2 ILE A 434 14.654 15.673 0.328 1.00 0.00 C ATOM 1125 CD1 ILE A 434 13.383 13.471 -2.589 1.00 0.00 C ATOM 0 H ILE A 434 12.284 15.295 -2.893 1.00 0.00 H new ATOM 0 HA ILE A 434 11.952 15.284 -0.033 1.00 0.00 H new ATOM 0 HB ILE A 434 14.368 15.842 -1.807 1.00 0.00 H new ATOM 0 HG12 ILE A 434 14.922 13.445 -1.068 1.00 0.00 H new ATOM 0 HG13 ILE A 434 13.293 13.335 -0.431 1.00 0.00 H new ATOM 0 HG21 ILE A 434 15.684 15.327 0.240 1.00 0.00 H new ATOM 0 HG22 ILE A 434 14.646 16.751 0.491 1.00 0.00 H new ATOM 0 HG23 ILE A 434 14.174 15.175 1.171 1.00 0.00 H new ATOM 0 HD11 ILE A 434 13.404 12.390 -2.724 1.00 0.00 H new ATOM 0 HD12 ILE A 434 12.360 13.831 -2.696 1.00 0.00 H new ATOM 0 HD13 ILE A 434 14.014 13.942 -3.343 1.00 0.00 H new ATOM 1137 N SER A 435 12.500 18.169 -1.493 1.00 0.00 N ATOM 1138 CA SER A 435 12.479 19.629 -1.204 1.00 0.00 C ATOM 1139 C SER A 435 11.291 19.924 -0.286 1.00 0.00 C ATOM 1140 O SER A 435 11.334 20.810 0.544 1.00 0.00 O ATOM 1141 CB SER A 435 12.328 20.409 -2.511 1.00 0.00 C ATOM 1142 OG SER A 435 13.435 20.125 -3.356 1.00 0.00 O ATOM 0 H SER A 435 12.567 17.917 -2.479 1.00 0.00 H new ATOM 0 HA SER A 435 13.408 19.929 -0.720 1.00 0.00 H new ATOM 0 HB2 SER A 435 11.397 20.134 -3.007 1.00 0.00 H new ATOM 0 HB3 SER A 435 12.277 21.478 -2.306 1.00 0.00 H new ATOM 0 HG SER A 435 13.341 20.622 -4.196 1.00 0.00 H new ATOM 1148 N GLY A 436 10.234 19.161 -0.429 1.00 0.00 N ATOM 1149 CA GLY A 436 9.018 19.343 0.424 1.00 0.00 C ATOM 1150 C GLY A 436 8.751 18.047 1.191 1.00 0.00 C ATOM 1151 O GLY A 436 7.795 17.935 1.932 1.00 0.00 O ATOM 0 H GLY A 436 10.162 18.407 -1.113 1.00 0.00 H new ATOM 0 HA2 GLY A 436 9.166 20.169 1.120 1.00 0.00 H new ATOM 0 HA3 GLY A 436 8.158 19.598 -0.195 1.00 0.00 H new ATOM 1155 N GLN A 437 9.605 17.076 1.037 1.00 0.00 N ATOM 1156 CA GLN A 437 9.439 15.800 1.778 1.00 0.00 C ATOM 1157 C GLN A 437 8.078 15.148 1.480 1.00 0.00 C ATOM 1158 O GLN A 437 7.626 14.295 2.213 1.00 0.00 O ATOM 1159 CB GLN A 437 9.573 16.099 3.279 1.00 0.00 C ATOM 1160 CG GLN A 437 10.646 17.212 3.521 1.00 0.00 C ATOM 1161 CD GLN A 437 10.017 18.425 4.223 1.00 0.00 C ATOM 1162 OE1 GLN A 437 10.629 19.038 5.075 1.00 0.00 O ATOM 1163 NE2 GLN A 437 8.812 18.794 3.890 1.00 0.00 N ATOM 0 H GLN A 437 10.419 17.114 0.423 1.00 0.00 H new ATOM 0 HA GLN A 437 10.207 15.095 1.460 1.00 0.00 H new ATOM 0 HB2 GLN A 437 8.611 16.419 3.680 1.00 0.00 H new ATOM 0 HB3 GLN A 437 9.855 15.192 3.813 1.00 0.00 H new ATOM 0 HG2 GLN A 437 11.459 16.815 4.128 1.00 0.00 H new ATOM 0 HG3 GLN A 437 11.080 17.520 2.570 1.00 0.00 H new ATOM 0 HE21 GLN A 437 8.300 18.278 3.174 1.00 0.00 H new ATOM 0 HE22 GLN A 437 8.381 19.599 4.345 1.00 0.00 H new ATOM 1172 N LYS A 438 7.425 15.525 0.415 1.00 0.00 N ATOM 1173 CA LYS A 438 6.103 14.891 0.099 1.00 0.00 C ATOM 1174 C LYS A 438 6.330 13.426 -0.303 1.00 0.00 C ATOM 1175 O LYS A 438 6.662 13.138 -1.432 1.00 0.00 O ATOM 1176 CB LYS A 438 5.421 15.645 -1.081 1.00 0.00 C ATOM 1177 CG LYS A 438 4.158 16.443 -0.622 1.00 0.00 C ATOM 1178 CD LYS A 438 4.448 17.950 -0.600 1.00 0.00 C ATOM 1179 CE LYS A 438 5.564 18.242 0.403 1.00 0.00 C ATOM 1180 NZ LYS A 438 5.551 19.691 0.755 1.00 0.00 N ATOM 0 H LYS A 438 7.740 16.235 -0.246 1.00 0.00 H new ATOM 0 HA LYS A 438 5.460 14.942 0.978 1.00 0.00 H new ATOM 0 HB2 LYS A 438 6.137 16.331 -1.534 1.00 0.00 H new ATOM 0 HB3 LYS A 438 5.136 14.928 -1.851 1.00 0.00 H new ATOM 0 HG2 LYS A 438 3.327 16.237 -1.296 1.00 0.00 H new ATOM 0 HG3 LYS A 438 3.853 16.112 0.371 1.00 0.00 H new ATOM 0 HD2 LYS A 438 4.740 18.289 -1.594 1.00 0.00 H new ATOM 0 HD3 LYS A 438 3.547 18.500 -0.328 1.00 0.00 H new ATOM 0 HE2 LYS A 438 5.428 17.638 1.300 1.00 0.00 H new ATOM 0 HE3 LYS A 438 6.530 17.969 -0.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 6.310 19.889 1.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 5.700 20.258 -0.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 4.633 19.937 1.177 1.00 0.00 H new ATOM 1194 N PHE A 439 6.120 12.502 0.593 1.00 0.00 N ATOM 1195 CA PHE A 439 6.304 11.062 0.229 1.00 0.00 C ATOM 1196 C PHE A 439 5.042 10.562 -0.472 1.00 0.00 C ATOM 1197 O PHE A 439 3.981 10.543 0.113 1.00 0.00 O ATOM 1198 CB PHE A 439 6.502 10.201 1.477 1.00 0.00 C ATOM 1199 CG PHE A 439 7.683 10.658 2.293 1.00 0.00 C ATOM 1200 CD1 PHE A 439 7.563 11.798 3.074 1.00 0.00 C ATOM 1201 CD2 PHE A 439 8.878 9.918 2.305 1.00 0.00 C ATOM 1202 CE1 PHE A 439 8.623 12.219 3.878 1.00 0.00 C ATOM 1203 CE2 PHE A 439 9.945 10.346 3.103 1.00 0.00 C ATOM 1204 CZ PHE A 439 9.813 11.495 3.891 1.00 0.00 C ATOM 0 H PHE A 439 5.831 12.676 1.556 1.00 0.00 H new ATOM 0 HA PHE A 439 7.181 10.985 -0.414 1.00 0.00 H new ATOM 0 HB2 PHE A 439 5.601 10.237 2.090 1.00 0.00 H new ATOM 0 HB3 PHE A 439 6.645 9.161 1.182 1.00 0.00 H new ATOM 0 HD1 PHE A 439 6.643 12.364 3.060 1.00 0.00 H new ATOM 0 HD2 PHE A 439 8.972 9.026 1.703 1.00 0.00 H new ATOM 0 HE1 PHE A 439 8.521 13.104 4.489 1.00 0.00 H new ATOM 0 HE2 PHE A 439 10.871 9.789 3.111 1.00 0.00 H new ATOM 0 HZ PHE A 439 10.635 11.821 4.510 1.00 0.00 H new ATOM 1214 N ASN A 440 5.143 10.150 -1.711 1.00 0.00 N ATOM 1215 CA ASN A 440 3.935 9.638 -2.440 1.00 0.00 C ATOM 1216 C ASN A 440 4.253 8.290 -3.093 1.00 0.00 C ATOM 1217 O ASN A 440 4.833 8.237 -4.160 1.00 0.00 O ATOM 1218 CB ASN A 440 3.538 10.642 -3.527 1.00 0.00 C ATOM 1219 CG ASN A 440 2.112 10.351 -4.005 1.00 0.00 C ATOM 1220 OD1 ASN A 440 1.172 10.440 -3.241 1.00 0.00 O ATOM 1221 ND2 ASN A 440 1.914 10.006 -5.249 1.00 0.00 N ATOM 0 H ASN A 440 6.008 10.145 -2.252 1.00 0.00 H new ATOM 0 HA ASN A 440 3.115 9.512 -1.733 1.00 0.00 H new ATOM 0 HB2 ASN A 440 3.601 11.658 -3.137 1.00 0.00 H new ATOM 0 HB3 ASN A 440 4.232 10.579 -4.365 1.00 0.00 H new ATOM 0 HD21 ASN A 440 0.969 9.811 -5.580 1.00 0.00 H new ATOM 0 HD22 ASN A 440 2.704 9.932 -5.890 1.00 0.00 H new ATOM 1228 N ILE A 441 3.854 7.198 -2.493 1.00 0.00 N ATOM 1229 CA ILE A 441 4.123 5.882 -3.137 1.00 0.00 C ATOM 1230 C ILE A 441 3.259 5.826 -4.394 1.00 0.00 C ATOM 1231 O ILE A 441 2.055 5.784 -4.310 1.00 0.00 O ATOM 1232 CB ILE A 441 3.746 4.706 -2.201 1.00 0.00 C ATOM 1233 CG1 ILE A 441 4.088 5.027 -0.733 1.00 0.00 C ATOM 1234 CG2 ILE A 441 4.493 3.438 -2.636 1.00 0.00 C ATOM 1235 CD1 ILE A 441 5.601 5.014 -0.516 1.00 0.00 C ATOM 0 H ILE A 441 3.362 7.161 -1.600 1.00 0.00 H new ATOM 0 HA ILE A 441 5.185 5.788 -3.365 1.00 0.00 H new ATOM 0 HB ILE A 441 2.670 4.547 -2.275 1.00 0.00 H new ATOM 0 HG12 ILE A 441 3.686 6.004 -0.466 1.00 0.00 H new ATOM 0 HG13 ILE A 441 3.615 4.297 -0.076 1.00 0.00 H new ATOM 0 HG21 ILE A 441 4.225 2.613 -1.975 1.00 0.00 H new ATOM 0 HG22 ILE A 441 4.217 3.187 -3.660 1.00 0.00 H new ATOM 0 HG23 ILE A 441 5.568 3.612 -2.582 1.00 0.00 H new ATOM 0 HD11 ILE A 441 5.821 5.243 0.527 1.00 0.00 H new ATOM 0 HD12 ILE A 441 5.995 4.028 -0.762 1.00 0.00 H new ATOM 0 HD13 ILE A 441 6.067 5.762 -1.158 1.00 0.00 H new ATOM 1247 N LYS A 442 3.847 5.842 -5.555 1.00 0.00 N ATOM 1248 CA LYS A 442 3.021 5.818 -6.793 1.00 0.00 C ATOM 1249 C LYS A 442 2.570 4.380 -7.066 1.00 0.00 C ATOM 1250 O LYS A 442 3.280 3.601 -7.673 1.00 0.00 O ATOM 1251 CB LYS A 442 3.871 6.348 -7.968 1.00 0.00 C ATOM 1252 CG LYS A 442 2.991 7.092 -8.982 1.00 0.00 C ATOM 1253 CD LYS A 442 1.967 6.129 -9.579 1.00 0.00 C ATOM 1254 CE LYS A 442 1.147 6.850 -10.651 1.00 0.00 C ATOM 1255 NZ LYS A 442 -0.009 5.996 -11.046 1.00 0.00 N ATOM 0 H LYS A 442 4.856 5.870 -5.701 1.00 0.00 H new ATOM 0 HA LYS A 442 2.139 6.448 -6.676 1.00 0.00 H new ATOM 0 HB2 LYS A 442 4.645 7.017 -7.591 1.00 0.00 H new ATOM 0 HB3 LYS A 442 4.379 5.518 -8.460 1.00 0.00 H new ATOM 0 HG2 LYS A 442 2.482 7.924 -8.495 1.00 0.00 H new ATOM 0 HG3 LYS A 442 3.610 7.516 -9.773 1.00 0.00 H new ATOM 0 HD2 LYS A 442 2.474 5.267 -10.013 1.00 0.00 H new ATOM 0 HD3 LYS A 442 1.309 5.751 -8.796 1.00 0.00 H new ATOM 0 HE2 LYS A 442 0.793 7.808 -10.271 1.00 0.00 H new ATOM 0 HE3 LYS A 442 1.770 7.063 -11.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 -0.829 6.599 -11.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 0.241 5.441 -11.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 -0.247 5.351 -10.266 1.00 0.00 H new ATOM 1269 N LEU A 443 1.383 4.025 -6.631 1.00 0.00 N ATOM 1270 CA LEU A 443 0.879 2.635 -6.879 1.00 0.00 C ATOM 1271 C LEU A 443 0.000 2.666 -8.136 1.00 0.00 C ATOM 1272 O LEU A 443 -0.879 3.494 -8.263 1.00 0.00 O ATOM 1273 CB LEU A 443 0.058 2.156 -5.647 1.00 0.00 C ATOM 1274 CG LEU A 443 0.562 0.799 -5.112 1.00 0.00 C ATOM 1275 CD1 LEU A 443 0.280 -0.304 -6.143 1.00 0.00 C ATOM 1276 CD2 LEU A 443 2.073 0.859 -4.788 1.00 0.00 C ATOM 0 H LEU A 443 0.745 4.633 -6.118 1.00 0.00 H new ATOM 0 HA LEU A 443 1.707 1.942 -7.028 1.00 0.00 H new ATOM 0 HB2 LEU A 443 0.120 2.904 -4.856 1.00 0.00 H new ATOM 0 HB3 LEU A 443 -0.993 2.070 -5.922 1.00 0.00 H new ATOM 0 HG LEU A 443 0.029 0.571 -4.189 1.00 0.00 H new ATOM 0 HD11 LEU A 443 0.638 -1.260 -5.760 1.00 0.00 H new ATOM 0 HD12 LEU A 443 -0.793 -0.365 -6.326 1.00 0.00 H new ATOM 0 HD13 LEU A 443 0.795 -0.071 -7.075 1.00 0.00 H new ATOM 0 HD21 LEU A 443 2.403 -0.110 -4.413 1.00 0.00 H new ATOM 0 HD22 LEU A 443 2.629 1.107 -5.692 1.00 0.00 H new ATOM 0 HD23 LEU A 443 2.253 1.622 -4.031 1.00 0.00 H new ATOM 1288 N LEU A 444 0.230 1.777 -9.070 1.00 0.00 N ATOM 1289 CA LEU A 444 -0.600 1.767 -10.316 1.00 0.00 C ATOM 1290 C LEU A 444 -0.937 0.322 -10.678 1.00 0.00 C ATOM 1291 O LEU A 444 -0.183 -0.589 -10.399 1.00 0.00 O ATOM 1292 CB LEU A 444 0.176 2.437 -11.459 1.00 0.00 C ATOM 1293 CG LEU A 444 -0.690 2.496 -12.724 1.00 0.00 C ATOM 1294 CD1 LEU A 444 -1.934 3.359 -12.468 1.00 0.00 C ATOM 1295 CD2 LEU A 444 0.133 3.097 -13.870 1.00 0.00 C ATOM 0 H LEU A 444 0.954 1.060 -9.025 1.00 0.00 H new ATOM 0 HA LEU A 444 -1.524 2.321 -10.152 1.00 0.00 H new ATOM 0 HB2 LEU A 444 0.473 3.444 -11.165 1.00 0.00 H new ATOM 0 HB3 LEU A 444 1.091 1.881 -11.662 1.00 0.00 H new ATOM 0 HG LEU A 444 -1.010 1.489 -12.992 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -2.543 3.396 -13.371 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -2.516 2.926 -11.655 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -1.627 4.369 -12.196 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -0.477 3.141 -14.772 1.00 0.00 H new ATOM 0 HD22 LEU A 444 0.454 4.103 -13.599 1.00 0.00 H new ATOM 0 HD23 LEU A 444 1.008 2.474 -14.055 1.00 0.00 H new ATOM 1307 N ILE A 445 -2.081 0.098 -11.278 1.00 0.00 N ATOM 1308 CA ILE A 445 -2.481 -1.297 -11.633 1.00 0.00 C ATOM 1309 C ILE A 445 -3.292 -1.296 -12.946 1.00 0.00 C ATOM 1310 O ILE A 445 -4.252 -0.561 -13.066 1.00 0.00 O ATOM 1311 CB ILE A 445 -3.373 -1.845 -10.514 1.00 0.00 C ATOM 1312 CG1 ILE A 445 -2.727 -1.555 -9.153 1.00 0.00 C ATOM 1313 CG2 ILE A 445 -3.552 -3.355 -10.693 1.00 0.00 C ATOM 1314 CD1 ILE A 445 -3.534 -2.238 -8.048 1.00 0.00 C ATOM 0 H ILE A 445 -2.753 0.820 -11.536 1.00 0.00 H new ATOM 0 HA ILE A 445 -1.588 -1.910 -11.757 1.00 0.00 H new ATOM 0 HB ILE A 445 -4.349 -1.361 -10.558 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -1.699 -1.916 -9.143 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -2.689 -0.480 -8.978 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -4.187 -3.743 -9.896 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -4.018 -3.554 -11.658 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -2.579 -3.844 -10.652 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -3.075 -2.032 -7.081 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -4.555 -1.856 -8.054 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -3.549 -3.314 -8.220 1.00 0.00 H new ATOM 1326 N PRO A 446 -2.947 -2.118 -13.920 1.00 0.00 N ATOM 1327 CA PRO A 446 -3.716 -2.179 -15.203 1.00 0.00 C ATOM 1328 C PRO A 446 -5.065 -2.891 -15.010 1.00 0.00 C ATOM 1329 O PRO A 446 -5.133 -3.942 -14.404 1.00 0.00 O ATOM 1330 CB PRO A 446 -2.798 -2.980 -16.136 1.00 0.00 C ATOM 1331 CG PRO A 446 -2.012 -3.864 -15.224 1.00 0.00 C ATOM 1332 CD PRO A 446 -1.807 -3.065 -13.931 1.00 0.00 C ATOM 0 HA PRO A 446 -3.961 -1.192 -15.595 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -3.374 -3.563 -16.854 1.00 0.00 H new ATOM 0 HB3 PRO A 446 -2.145 -2.322 -16.710 1.00 0.00 H new ATOM 0 HG2 PRO A 446 -2.545 -4.794 -15.027 1.00 0.00 H new ATOM 0 HG3 PRO A 446 -1.055 -4.134 -15.671 1.00 0.00 H new ATOM 0 HD2 PRO A 446 -1.816 -3.713 -13.054 1.00 0.00 H new ATOM 0 HD3 PRO A 446 -0.851 -2.541 -13.931 1.00 0.00 H new ATOM 1340 N VAL A 447 -6.141 -2.326 -15.507 1.00 0.00 N ATOM 1341 CA VAL A 447 -7.481 -2.978 -15.329 1.00 0.00 C ATOM 1342 C VAL A 447 -8.349 -2.764 -16.572 1.00 0.00 C ATOM 1343 O VAL A 447 -7.923 -2.191 -17.555 1.00 0.00 O ATOM 1344 CB VAL A 447 -8.179 -2.369 -14.110 1.00 0.00 C ATOM 1345 CG1 VAL A 447 -7.239 -2.437 -12.909 1.00 0.00 C ATOM 1346 CG2 VAL A 447 -8.532 -0.903 -14.386 1.00 0.00 C ATOM 0 H VAL A 447 -6.151 -1.447 -16.025 1.00 0.00 H new ATOM 0 HA VAL A 447 -7.338 -4.048 -15.181 1.00 0.00 H new ATOM 0 HB VAL A 447 -9.092 -2.927 -13.904 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -7.730 -2.005 -12.037 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -6.985 -3.477 -12.704 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -6.329 -1.878 -13.127 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -9.028 -0.478 -13.514 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -7.621 -0.342 -14.594 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -9.198 -0.845 -15.247 1.00 0.00 H new ATOM 1356 N ALA A 448 -9.571 -3.227 -16.527 1.00 0.00 N ATOM 1357 CA ALA A 448 -10.483 -3.063 -17.694 1.00 0.00 C ATOM 1358 C ALA A 448 -10.685 -1.575 -17.989 1.00 0.00 C ATOM 1359 O ALA A 448 -10.619 -1.147 -19.125 1.00 0.00 O ATOM 1360 CB ALA A 448 -11.832 -3.708 -17.376 1.00 0.00 C ATOM 0 H ALA A 448 -9.977 -3.714 -15.728 1.00 0.00 H new ATOM 0 HA ALA A 448 -10.043 -3.545 -18.567 1.00 0.00 H new ATOM 0 HB1 ALA A 448 -12.502 -3.590 -18.228 1.00 0.00 H new ATOM 0 HB2 ALA A 448 -11.689 -4.769 -17.172 1.00 0.00 H new ATOM 0 HB3 ALA A 448 -12.269 -3.226 -16.501 1.00 0.00 H new ATOM 1366 N GLU A 449 -10.922 -0.778 -16.982 1.00 0.00 N ATOM 1367 CA GLU A 449 -11.116 0.679 -17.229 1.00 0.00 C ATOM 1368 C GLU A 449 -9.847 1.223 -17.883 1.00 0.00 C ATOM 1369 O GLU A 449 -9.869 2.202 -18.603 1.00 0.00 O ATOM 1370 CB GLU A 449 -11.369 1.405 -15.896 1.00 0.00 C ATOM 1371 CG GLU A 449 -12.155 0.492 -14.952 1.00 0.00 C ATOM 1372 CD GLU A 449 -12.750 1.323 -13.812 1.00 0.00 C ATOM 1373 OE1 GLU A 449 -13.578 2.174 -14.093 1.00 0.00 O ATOM 1374 OE2 GLU A 449 -12.363 1.098 -12.676 1.00 0.00 O ATOM 0 H GLU A 449 -10.989 -1.070 -16.007 1.00 0.00 H new ATOM 0 HA GLU A 449 -11.975 0.840 -17.880 1.00 0.00 H new ATOM 0 HB2 GLU A 449 -10.421 1.687 -15.439 1.00 0.00 H new ATOM 0 HB3 GLU A 449 -11.924 2.326 -16.072 1.00 0.00 H new ATOM 0 HG2 GLU A 449 -12.950 -0.016 -15.499 1.00 0.00 H new ATOM 0 HG3 GLU A 449 -11.501 -0.281 -14.549 1.00 0.00 H new ATOM 1381 N GLY A 450 -8.740 0.584 -17.626 1.00 0.00 N ATOM 1382 CA GLY A 450 -7.443 1.033 -18.212 1.00 0.00 C ATOM 1383 C GLY A 450 -6.362 0.875 -17.150 1.00 0.00 C ATOM 1384 O GLY A 450 -5.619 -0.086 -17.140 1.00 0.00 O ATOM 0 H GLY A 450 -8.677 -0.240 -17.028 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -7.199 0.441 -19.094 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -7.511 2.072 -18.534 1.00 0.00 H new ATOM 1388 N MET A 451 -6.287 1.807 -16.240 1.00 0.00 N ATOM 1389 CA MET A 451 -5.274 1.723 -15.150 1.00 0.00 C ATOM 1390 C MET A 451 -5.849 2.381 -13.898 1.00 0.00 C ATOM 1391 O MET A 451 -6.278 3.518 -13.924 1.00 0.00 O ATOM 1392 CB MET A 451 -3.992 2.448 -15.566 1.00 0.00 C ATOM 1393 CG MET A 451 -3.562 1.990 -16.961 1.00 0.00 C ATOM 1394 SD MET A 451 -1.927 2.669 -17.335 1.00 0.00 S ATOM 1395 CE MET A 451 -2.085 2.682 -19.138 1.00 0.00 C ATOM 0 H MET A 451 -6.889 2.630 -16.205 1.00 0.00 H new ATOM 0 HA MET A 451 -5.036 0.678 -14.951 1.00 0.00 H new ATOM 0 HB2 MET A 451 -4.156 3.526 -15.562 1.00 0.00 H new ATOM 0 HB3 MET A 451 -3.199 2.244 -14.847 1.00 0.00 H new ATOM 0 HG2 MET A 451 -3.536 0.901 -17.007 1.00 0.00 H new ATOM 0 HG3 MET A 451 -4.286 2.323 -17.705 1.00 0.00 H new ATOM 0 HE1 MET A 451 -1.169 3.072 -19.581 1.00 0.00 H new ATOM 0 HE2 MET A 451 -2.257 1.667 -19.496 1.00 0.00 H new ATOM 0 HE3 MET A 451 -2.925 3.315 -19.425 1.00 0.00 H new ATOM 1405 N ASN A 452 -5.868 1.675 -12.800 1.00 0.00 N ATOM 1406 CA ASN A 452 -6.425 2.258 -11.545 1.00 0.00 C ATOM 1407 C ASN A 452 -5.312 3.010 -10.816 1.00 0.00 C ATOM 1408 O ASN A 452 -4.376 2.424 -10.310 1.00 0.00 O ATOM 1409 CB ASN A 452 -6.966 1.120 -10.659 1.00 0.00 C ATOM 1410 CG ASN A 452 -8.439 0.850 -10.992 1.00 0.00 C ATOM 1411 OD1 ASN A 452 -8.892 -0.371 -10.943 1.00 0.00 O flip ATOM 1412 ND2 ASN A 452 -9.182 1.760 -11.302 1.00 0.00 N flip ATOM 0 H ASN A 452 -5.522 0.719 -12.717 1.00 0.00 H new ATOM 0 HA ASN A 452 -7.237 2.948 -11.773 1.00 0.00 H new ATOM 0 HB2 ASN A 452 -6.378 0.216 -10.815 1.00 0.00 H new ATOM 0 HB3 ASN A 452 -6.866 1.388 -9.607 1.00 0.00 H new ATOM 0 HD21 ASN A 452 -8.829 2.716 -11.341 1.00 0.00 H new ATOM 0 HD22 ASN A 452 -10.159 1.568 -11.523 1.00 0.00 H new ATOM 1419 N GLU A 453 -5.411 4.310 -10.766 1.00 0.00 N ATOM 1420 CA GLU A 453 -4.363 5.111 -10.078 1.00 0.00 C ATOM 1421 C GLU A 453 -4.569 5.010 -8.561 1.00 0.00 C ATOM 1422 O GLU A 453 -5.654 5.181 -8.044 1.00 0.00 O ATOM 1423 CB GLU A 453 -4.415 6.570 -10.585 1.00 0.00 C ATOM 1424 CG GLU A 453 -5.452 7.409 -9.813 1.00 0.00 C ATOM 1425 CD GLU A 453 -5.985 8.533 -10.708 1.00 0.00 C ATOM 1426 OE1 GLU A 453 -5.201 9.382 -11.099 1.00 0.00 O ATOM 1427 OE2 GLU A 453 -7.172 8.522 -10.992 1.00 0.00 O ATOM 0 H GLU A 453 -6.174 4.851 -11.173 1.00 0.00 H new ATOM 0 HA GLU A 453 -3.369 4.724 -10.304 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -3.430 7.026 -10.482 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -4.660 6.577 -11.647 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -6.274 6.774 -9.484 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -4.997 7.831 -8.917 1.00 0.00 H new ATOM 1434 N ILE A 454 -3.528 4.691 -7.850 1.00 0.00 N ATOM 1435 CA ILE A 454 -3.626 4.532 -6.371 1.00 0.00 C ATOM 1436 C ILE A 454 -2.277 4.906 -5.774 1.00 0.00 C ATOM 1437 O ILE A 454 -1.269 4.338 -6.124 1.00 0.00 O ATOM 1438 CB ILE A 454 -3.925 3.059 -6.039 1.00 0.00 C ATOM 1439 CG1 ILE A 454 -5.382 2.713 -6.393 1.00 0.00 C ATOM 1440 CG2 ILE A 454 -3.674 2.772 -4.551 1.00 0.00 C ATOM 1441 CD1 ILE A 454 -6.389 3.532 -5.563 1.00 0.00 C ATOM 0 H ILE A 454 -2.597 4.531 -8.235 1.00 0.00 H new ATOM 0 HA ILE A 454 -4.418 5.164 -5.969 1.00 0.00 H new ATOM 0 HB ILE A 454 -3.255 2.439 -6.634 1.00 0.00 H new ATOM 0 HG12 ILE A 454 -5.551 2.899 -7.454 1.00 0.00 H new ATOM 0 HG13 ILE A 454 -5.553 1.650 -6.224 1.00 0.00 H new ATOM 0 HG21 ILE A 454 -3.892 1.725 -4.341 1.00 0.00 H new ATOM 0 HG22 ILE A 454 -2.631 2.981 -4.311 1.00 0.00 H new ATOM 0 HG23 ILE A 454 -4.320 3.406 -3.944 1.00 0.00 H new ATOM 0 HD11 ILE A 454 -7.404 3.255 -5.846 1.00 0.00 H new ATOM 0 HD12 ILE A 454 -6.239 3.327 -4.503 1.00 0.00 H new ATOM 0 HD13 ILE A 454 -6.237 4.595 -5.752 1.00 0.00 H new ATOM 1453 N TRP A 455 -2.238 5.842 -4.872 1.00 0.00 N ATOM 1454 CA TRP A 455 -0.926 6.230 -4.261 1.00 0.00 C ATOM 1455 C TRP A 455 -1.117 6.440 -2.753 1.00 0.00 C ATOM 1456 O TRP A 455 -2.221 6.612 -2.281 1.00 0.00 O ATOM 1457 CB TRP A 455 -0.388 7.514 -4.935 1.00 0.00 C ATOM 1458 CG TRP A 455 -1.105 7.775 -6.227 1.00 0.00 C ATOM 1459 CD1 TRP A 455 -1.092 6.993 -7.335 1.00 0.00 C ATOM 1460 CD2 TRP A 455 -1.925 8.914 -6.550 1.00 0.00 C ATOM 1461 NE1 TRP A 455 -1.883 7.590 -8.308 1.00 0.00 N ATOM 1462 CE2 TRP A 455 -2.408 8.786 -7.867 1.00 0.00 C ATOM 1463 CE3 TRP A 455 -2.286 10.029 -5.814 1.00 0.00 C ATOM 1464 CZ2 TRP A 455 -3.229 9.758 -8.436 1.00 0.00 C ATOM 1465 CZ3 TRP A 455 -3.111 11.017 -6.370 1.00 0.00 C ATOM 1466 CH2 TRP A 455 -3.582 10.883 -7.684 1.00 0.00 C ATOM 0 H TRP A 455 -3.049 6.357 -4.528 1.00 0.00 H new ATOM 0 HA TRP A 455 -0.195 5.437 -4.417 1.00 0.00 H new ATOM 0 HB2 TRP A 455 -0.516 8.364 -4.264 1.00 0.00 H new ATOM 0 HB3 TRP A 455 0.681 7.413 -5.121 1.00 0.00 H new ATOM 0 HD1 TRP A 455 -0.556 6.062 -7.443 1.00 0.00 H new ATOM 0 HE1 TRP A 455 -2.054 7.194 -9.232 1.00 0.00 H new ATOM 0 HE3 TRP A 455 -1.929 10.139 -4.801 1.00 0.00 H new ATOM 0 HZ2 TRP A 455 -3.589 9.643 -9.448 1.00 0.00 H new ATOM 0 HZ3 TRP A 455 -3.384 11.883 -5.785 1.00 0.00 H new ATOM 0 HH2 TRP A 455 -4.215 11.646 -8.114 1.00 0.00 H new ATOM 1477 N LEU A 456 -0.044 6.398 -1.998 1.00 0.00 N ATOM 1478 CA LEU A 456 -0.136 6.556 -0.511 1.00 0.00 C ATOM 1479 C LEU A 456 0.758 7.712 -0.045 1.00 0.00 C ATOM 1480 O LEU A 456 1.891 7.844 -0.466 1.00 0.00 O ATOM 1481 CB LEU A 456 0.339 5.255 0.164 1.00 0.00 C ATOM 1482 CG LEU A 456 -0.164 4.022 -0.609 1.00 0.00 C ATOM 1483 CD1 LEU A 456 0.510 2.765 -0.058 1.00 0.00 C ATOM 1484 CD2 LEU A 456 -1.679 3.892 -0.435 1.00 0.00 C ATOM 0 H LEU A 456 0.902 6.259 -2.353 1.00 0.00 H new ATOM 0 HA LEU A 456 -1.170 6.769 -0.239 1.00 0.00 H new ATOM 0 HB2 LEU A 456 1.428 5.241 0.211 1.00 0.00 H new ATOM 0 HB3 LEU A 456 -0.025 5.219 1.191 1.00 0.00 H new ATOM 0 HG LEU A 456 0.077 4.137 -1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 456 0.154 1.892 -0.605 1.00 0.00 H new ATOM 0 HD12 LEU A 456 1.590 2.851 -0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 456 0.267 2.655 0.999 1.00 0.00 H new ATOM 0 HD21 LEU A 456 -2.035 3.019 -0.982 1.00 0.00 H new ATOM 0 HD22 LEU A 456 -1.915 3.778 0.623 1.00 0.00 H new ATOM 0 HD23 LEU A 456 -2.168 4.786 -0.821 1.00 0.00 H new ATOM 1496 N ARG A 457 0.264 8.542 0.838 1.00 0.00 N ATOM 1497 CA ARG A 457 1.095 9.675 1.346 1.00 0.00 C ATOM 1498 C ARG A 457 1.924 9.193 2.548 1.00 0.00 C ATOM 1499 O ARG A 457 1.557 8.256 3.230 1.00 0.00 O ATOM 1500 CB ARG A 457 0.179 10.834 1.786 1.00 0.00 C ATOM 1501 CG ARG A 457 0.945 12.177 1.717 1.00 0.00 C ATOM 1502 CD ARG A 457 0.403 13.159 2.774 1.00 0.00 C ATOM 1503 NE ARG A 457 -1.026 12.848 3.068 1.00 0.00 N ATOM 1504 CZ ARG A 457 -1.966 13.210 2.237 1.00 0.00 C ATOM 1505 NH1 ARG A 457 -1.664 13.875 1.156 1.00 0.00 N ATOM 1506 NH2 ARG A 457 -3.210 12.913 2.493 1.00 0.00 N ATOM 0 H ARG A 457 -0.677 8.484 1.228 1.00 0.00 H new ATOM 0 HA ARG A 457 1.760 10.023 0.555 1.00 0.00 H new ATOM 0 HB2 ARG A 457 -0.701 10.876 1.144 1.00 0.00 H new ATOM 0 HB3 ARG A 457 -0.176 10.661 2.802 1.00 0.00 H new ATOM 0 HG2 ARG A 457 2.009 12.005 1.882 1.00 0.00 H new ATOM 0 HG3 ARG A 457 0.843 12.611 0.722 1.00 0.00 H new ATOM 0 HD2 ARG A 457 0.995 13.088 3.686 1.00 0.00 H new ATOM 0 HD3 ARG A 457 0.495 14.183 2.413 1.00 0.00 H new ATOM 0 HE ARG A 457 -1.270 12.349 3.924 1.00 0.00 H new ATOM 0 HH11 ARG A 457 -0.692 14.113 0.959 1.00 0.00 H new ATOM 0 HH12 ARG A 457 -2.400 14.157 0.508 1.00 0.00 H new ATOM 0 HH21 ARG A 457 -3.447 12.399 3.341 1.00 0.00 H new ATOM 0 HH22 ARG A 457 -3.945 13.195 1.845 1.00 0.00 H new ATOM 1520 N CYS A 458 3.034 9.830 2.815 1.00 0.00 N ATOM 1521 CA CYS A 458 3.888 9.420 3.975 1.00 0.00 C ATOM 1522 C CYS A 458 4.669 10.653 4.459 1.00 0.00 C ATOM 1523 O CYS A 458 4.574 11.712 3.872 1.00 0.00 O ATOM 1524 CB CYS A 458 4.839 8.264 3.570 1.00 0.00 C ATOM 1525 SG CYS A 458 4.503 7.755 1.863 1.00 0.00 S ATOM 0 H CYS A 458 3.390 10.621 2.278 1.00 0.00 H new ATOM 0 HA CYS A 458 3.266 9.047 4.789 1.00 0.00 H new ATOM 0 HB2 CYS A 458 5.876 8.585 3.665 1.00 0.00 H new ATOM 0 HB3 CYS A 458 4.704 7.418 4.244 1.00 0.00 H new ATOM 0 HG CYS A 458 4.164 8.794 1.159 1.00 0.00 H new ATOM 1531 N ASP A 459 5.410 10.542 5.537 1.00 0.00 N ATOM 1532 CA ASP A 459 6.161 11.722 6.064 1.00 0.00 C ATOM 1533 C ASP A 459 7.548 11.286 6.555 1.00 0.00 C ATOM 1534 O ASP A 459 8.177 11.977 7.332 1.00 0.00 O ATOM 1535 CB ASP A 459 5.371 12.313 7.238 1.00 0.00 C ATOM 1536 CG ASP A 459 5.840 13.744 7.518 1.00 0.00 C ATOM 1537 OD1 ASP A 459 6.919 13.897 8.065 1.00 0.00 O ATOM 1538 OD2 ASP A 459 5.108 14.662 7.183 1.00 0.00 O ATOM 0 H ASP A 459 5.526 9.683 6.074 1.00 0.00 H new ATOM 0 HA ASP A 459 6.284 12.463 5.274 1.00 0.00 H new ATOM 0 HB2 ASP A 459 4.305 12.309 7.009 1.00 0.00 H new ATOM 0 HB3 ASP A 459 5.508 11.696 8.126 1.00 0.00 H new ATOM 1543 N ASN A 460 8.036 10.145 6.127 1.00 0.00 N ATOM 1544 CA ASN A 460 9.384 9.695 6.607 1.00 0.00 C ATOM 1545 C ASN A 460 10.006 8.708 5.608 1.00 0.00 C ATOM 1546 O ASN A 460 9.320 8.092 4.817 1.00 0.00 O ATOM 1547 CB ASN A 460 9.246 9.000 7.979 1.00 0.00 C ATOM 1548 CG ASN A 460 8.134 9.662 8.796 1.00 0.00 C ATOM 1549 OD1 ASN A 460 8.319 10.729 9.346 1.00 0.00 O ATOM 1550 ND2 ASN A 460 6.977 9.066 8.900 1.00 0.00 N ATOM 0 H ASN A 460 7.568 9.514 5.476 1.00 0.00 H new ATOM 0 HA ASN A 460 10.028 10.570 6.697 1.00 0.00 H new ATOM 0 HB2 ASN A 460 9.024 7.942 7.839 1.00 0.00 H new ATOM 0 HB3 ASN A 460 10.190 9.058 8.521 1.00 0.00 H new ATOM 0 HD21 ASN A 460 6.229 9.496 9.443 1.00 0.00 H new ATOM 0 HD22 ASN A 460 6.822 8.170 8.438 1.00 0.00 H new ATOM 1557 N GLU A 461 11.303 8.542 5.661 1.00 0.00 N ATOM 1558 CA GLU A 461 11.975 7.580 4.740 1.00 0.00 C ATOM 1559 C GLU A 461 11.686 6.161 5.219 1.00 0.00 C ATOM 1560 O GLU A 461 11.622 5.232 4.439 1.00 0.00 O ATOM 1561 CB GLU A 461 13.486 7.823 4.729 1.00 0.00 C ATOM 1562 CG GLU A 461 14.006 7.890 6.163 1.00 0.00 C ATOM 1563 CD GLU A 461 15.508 8.186 6.153 1.00 0.00 C ATOM 1564 OE1 GLU A 461 16.271 7.270 5.892 1.00 0.00 O ATOM 1565 OE2 GLU A 461 15.869 9.322 6.408 1.00 0.00 O ATOM 0 H GLU A 461 11.925 9.032 6.304 1.00 0.00 H new ATOM 0 HA GLU A 461 11.595 7.719 3.728 1.00 0.00 H new ATOM 0 HB2 GLU A 461 13.989 7.023 4.186 1.00 0.00 H new ATOM 0 HB3 GLU A 461 13.711 8.753 4.206 1.00 0.00 H new ATOM 0 HG2 GLU A 461 13.476 8.665 6.716 1.00 0.00 H new ATOM 0 HG3 GLU A 461 13.815 6.946 6.674 1.00 0.00 H new ATOM 1572 N LYS A 462 11.494 5.988 6.498 1.00 0.00 N ATOM 1573 CA LYS A 462 11.189 4.631 7.020 1.00 0.00 C ATOM 1574 C LYS A 462 9.901 4.144 6.366 1.00 0.00 C ATOM 1575 O LYS A 462 9.835 3.064 5.814 1.00 0.00 O ATOM 1576 CB LYS A 462 10.980 4.696 8.532 1.00 0.00 C ATOM 1577 CG LYS A 462 12.245 5.213 9.212 1.00 0.00 C ATOM 1578 CD LYS A 462 11.931 5.523 10.674 1.00 0.00 C ATOM 1579 CE LYS A 462 13.161 6.137 11.343 1.00 0.00 C ATOM 1580 NZ LYS A 462 13.458 7.456 10.720 1.00 0.00 N ATOM 0 H LYS A 462 11.535 6.727 7.200 1.00 0.00 H new ATOM 0 HA LYS A 462 12.014 3.954 6.798 1.00 0.00 H new ATOM 0 HB2 LYS A 462 10.139 5.350 8.763 1.00 0.00 H new ATOM 0 HB3 LYS A 462 10.729 3.707 8.916 1.00 0.00 H new ATOM 0 HG2 LYS A 462 13.039 4.469 9.147 1.00 0.00 H new ATOM 0 HG3 LYS A 462 12.605 6.109 8.706 1.00 0.00 H new ATOM 0 HD2 LYS A 462 11.088 6.211 10.738 1.00 0.00 H new ATOM 0 HD3 LYS A 462 11.638 4.611 11.195 1.00 0.00 H new ATOM 0 HE2 LYS A 462 12.984 6.259 12.412 1.00 0.00 H new ATOM 0 HE3 LYS A 462 14.017 5.471 11.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 14.008 8.038 11.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 14.007 7.313 9.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 12.567 7.941 10.492 1.00 0.00 H new ATOM 1594 N GLN A 463 8.873 4.944 6.431 1.00 0.00 N ATOM 1595 CA GLN A 463 7.575 4.549 5.821 1.00 0.00 C ATOM 1596 C GLN A 463 7.813 4.116 4.367 1.00 0.00 C ATOM 1597 O GLN A 463 7.486 3.010 3.986 1.00 0.00 O ATOM 1598 CB GLN A 463 6.609 5.753 5.883 1.00 0.00 C ATOM 1599 CG GLN A 463 5.222 5.308 6.369 1.00 0.00 C ATOM 1600 CD GLN A 463 5.286 4.996 7.866 1.00 0.00 C ATOM 1601 OE1 GLN A 463 5.535 3.872 8.254 1.00 0.00 O ATOM 1602 NE2 GLN A 463 5.071 5.951 8.729 1.00 0.00 N ATOM 0 H GLN A 463 8.877 5.858 6.883 1.00 0.00 H new ATOM 0 HA GLN A 463 7.134 3.713 6.365 1.00 0.00 H new ATOM 0 HB2 GLN A 463 7.009 6.513 6.554 1.00 0.00 H new ATOM 0 HB3 GLN A 463 6.525 6.210 4.897 1.00 0.00 H new ATOM 0 HG2 GLN A 463 4.489 6.092 6.180 1.00 0.00 H new ATOM 0 HG3 GLN A 463 4.896 4.427 5.816 1.00 0.00 H new ATOM 0 HE21 GLN A 463 4.862 6.895 8.404 1.00 0.00 H new ATOM 0 HE22 GLN A 463 5.112 5.754 9.729 1.00 0.00 H new ATOM 1611 N TYR A 464 8.370 4.984 3.555 1.00 0.00 N ATOM 1612 CA TYR A 464 8.625 4.632 2.122 1.00 0.00 C ATOM 1613 C TYR A 464 9.139 3.180 2.003 1.00 0.00 C ATOM 1614 O TYR A 464 8.556 2.361 1.324 1.00 0.00 O ATOM 1615 CB TYR A 464 9.694 5.615 1.565 1.00 0.00 C ATOM 1616 CG TYR A 464 9.207 6.289 0.297 1.00 0.00 C ATOM 1617 CD1 TYR A 464 7.995 6.982 0.304 1.00 0.00 C ATOM 1618 CD2 TYR A 464 9.969 6.224 -0.877 1.00 0.00 C ATOM 1619 CE1 TYR A 464 7.540 7.612 -0.861 1.00 0.00 C ATOM 1620 CE2 TYR A 464 9.515 6.852 -2.042 1.00 0.00 C ATOM 1621 CZ TYR A 464 8.300 7.547 -2.034 1.00 0.00 C ATOM 1622 OH TYR A 464 7.851 8.168 -3.182 1.00 0.00 O ATOM 0 H TYR A 464 8.660 5.924 3.825 1.00 0.00 H new ATOM 0 HA TYR A 464 7.699 4.711 1.553 1.00 0.00 H new ATOM 0 HB2 TYR A 464 9.925 6.370 2.316 1.00 0.00 H new ATOM 0 HB3 TYR A 464 10.619 5.075 1.361 1.00 0.00 H new ATOM 0 HD1 TYR A 464 7.408 7.032 1.209 1.00 0.00 H new ATOM 0 HD2 TYR A 464 10.907 5.689 -0.883 1.00 0.00 H new ATOM 0 HE1 TYR A 464 6.602 8.148 -0.854 1.00 0.00 H new ATOM 0 HE2 TYR A 464 10.102 6.801 -2.947 1.00 0.00 H new ATOM 0 HH TYR A 464 6.901 7.966 -3.313 1.00 0.00 H new ATOM 1632 N ALA A 465 10.235 2.874 2.641 1.00 0.00 N ATOM 1633 CA ALA A 465 10.816 1.498 2.550 1.00 0.00 C ATOM 1634 C ALA A 465 9.752 0.410 2.770 1.00 0.00 C ATOM 1635 O ALA A 465 9.630 -0.507 1.984 1.00 0.00 O ATOM 1636 CB ALA A 465 11.912 1.344 3.608 1.00 0.00 C ATOM 0 H ALA A 465 10.760 3.522 3.228 1.00 0.00 H new ATOM 0 HA ALA A 465 11.224 1.373 1.547 1.00 0.00 H new ATOM 0 HB1 ALA A 465 12.339 0.343 3.546 1.00 0.00 H new ATOM 0 HB2 ALA A 465 12.693 2.083 3.433 1.00 0.00 H new ATOM 0 HB3 ALA A 465 11.485 1.496 4.599 1.00 0.00 H new ATOM 1642 N HIS A 466 9.016 0.472 3.847 1.00 0.00 N ATOM 1643 CA HIS A 466 8.006 -0.597 4.121 1.00 0.00 C ATOM 1644 C HIS A 466 7.139 -0.872 2.884 1.00 0.00 C ATOM 1645 O HIS A 466 7.158 -1.957 2.340 1.00 0.00 O ATOM 1646 CB HIS A 466 7.108 -0.156 5.290 1.00 0.00 C ATOM 1647 CG HIS A 466 7.822 -0.379 6.598 1.00 0.00 C ATOM 1648 ND1 HIS A 466 7.332 -1.239 7.570 1.00 0.00 N ATOM 1649 CD2 HIS A 466 8.989 0.137 7.107 1.00 0.00 C ATOM 1650 CE1 HIS A 466 8.194 -1.216 8.605 1.00 0.00 C ATOM 1651 NE2 HIS A 466 9.218 -0.394 8.371 1.00 0.00 N ATOM 0 H HIS A 466 9.068 1.212 4.547 1.00 0.00 H new ATOM 0 HA HIS A 466 8.535 -1.515 4.377 1.00 0.00 H new ATOM 0 HB2 HIS A 466 6.848 0.897 5.183 1.00 0.00 H new ATOM 0 HB3 HIS A 466 6.174 -0.718 5.275 1.00 0.00 H new ATOM 0 HD2 HIS A 466 9.629 0.846 6.603 1.00 0.00 H new ATOM 0 HE1 HIS A 466 8.071 -1.791 9.511 1.00 0.00 H new ATOM 0 HE2 HIS A 466 10.004 -0.196 8.990 1.00 0.00 H new ATOM 1660 N TRP A 467 6.366 0.083 2.447 1.00 0.00 N ATOM 1661 CA TRP A 467 5.485 -0.153 1.265 1.00 0.00 C ATOM 1662 C TRP A 467 6.318 -0.281 -0.019 1.00 0.00 C ATOM 1663 O TRP A 467 6.164 -1.237 -0.752 1.00 0.00 O ATOM 1664 CB TRP A 467 4.470 1.002 1.144 1.00 0.00 C ATOM 1665 CG TRP A 467 3.225 0.657 1.907 1.00 0.00 C ATOM 1666 CD1 TRP A 467 3.071 0.777 3.247 1.00 0.00 C ATOM 1667 CD2 TRP A 467 1.971 0.121 1.397 1.00 0.00 C ATOM 1668 NE1 TRP A 467 1.801 0.350 3.590 1.00 0.00 N ATOM 1669 CE2 TRP A 467 1.084 -0.060 2.484 1.00 0.00 C ATOM 1670 CE3 TRP A 467 1.519 -0.220 0.110 1.00 0.00 C ATOM 1671 CZ2 TRP A 467 -0.204 -0.560 2.302 1.00 0.00 C ATOM 1672 CZ3 TRP A 467 0.222 -0.725 -0.078 1.00 0.00 C ATOM 1673 CH2 TRP A 467 -0.638 -0.894 1.016 1.00 0.00 C ATOM 0 H TRP A 467 6.305 1.016 2.855 1.00 0.00 H new ATOM 0 HA TRP A 467 4.945 -1.090 1.405 1.00 0.00 H new ATOM 0 HB2 TRP A 467 4.904 1.923 1.533 1.00 0.00 H new ATOM 0 HB3 TRP A 467 4.229 1.180 0.096 1.00 0.00 H new ATOM 0 HD1 TRP A 467 3.817 1.146 3.935 1.00 0.00 H new ATOM 0 HE1 TRP A 467 1.439 0.339 4.543 1.00 0.00 H new ATOM 0 HE3 TRP A 467 2.173 -0.093 -0.740 1.00 0.00 H new ATOM 0 HZ2 TRP A 467 -0.862 -0.689 3.149 1.00 0.00 H new ATOM 0 HZ3 TRP A 467 -0.115 -0.985 -1.071 1.00 0.00 H new ATOM 0 HH2 TRP A 467 -1.635 -1.282 0.865 1.00 0.00 H new ATOM 1684 N MET A 468 7.183 0.666 -0.315 1.00 0.00 N ATOM 1685 CA MET A 468 7.998 0.559 -1.579 1.00 0.00 C ATOM 1686 C MET A 468 8.499 -0.879 -1.734 1.00 0.00 C ATOM 1687 O MET A 468 8.397 -1.473 -2.789 1.00 0.00 O ATOM 1688 CB MET A 468 9.214 1.508 -1.536 1.00 0.00 C ATOM 1689 CG MET A 468 8.792 2.939 -1.899 1.00 0.00 C ATOM 1690 SD MET A 468 8.185 3.012 -3.612 1.00 0.00 S ATOM 1691 CE MET A 468 9.692 2.456 -4.449 1.00 0.00 C ATOM 0 H MET A 468 7.360 1.496 0.251 1.00 0.00 H new ATOM 0 HA MET A 468 7.365 0.838 -2.421 1.00 0.00 H new ATOM 0 HB2 MET A 468 9.658 1.495 -0.541 1.00 0.00 H new ATOM 0 HB3 MET A 468 9.979 1.161 -2.231 1.00 0.00 H new ATOM 0 HG2 MET A 468 8.013 3.278 -1.217 1.00 0.00 H new ATOM 0 HG3 MET A 468 9.638 3.615 -1.778 1.00 0.00 H new ATOM 0 HE1 MET A 468 9.737 2.893 -5.446 1.00 0.00 H new ATOM 0 HE2 MET A 468 10.564 2.770 -3.875 1.00 0.00 H new ATOM 0 HE3 MET A 468 9.683 1.369 -4.530 1.00 0.00 H new ATOM 1701 N ALA A 469 9.013 -1.448 -0.684 1.00 0.00 N ATOM 1702 CA ALA A 469 9.488 -2.851 -0.764 1.00 0.00 C ATOM 1703 C ALA A 469 8.267 -3.760 -0.898 1.00 0.00 C ATOM 1704 O ALA A 469 8.209 -4.624 -1.750 1.00 0.00 O ATOM 1705 CB ALA A 469 10.254 -3.205 0.512 1.00 0.00 C ATOM 0 H ALA A 469 9.124 -1.001 0.226 1.00 0.00 H new ATOM 0 HA ALA A 469 10.150 -2.979 -1.620 1.00 0.00 H new ATOM 0 HB1 ALA A 469 10.603 -4.236 0.453 1.00 0.00 H new ATOM 0 HB2 ALA A 469 11.109 -2.538 0.620 1.00 0.00 H new ATOM 0 HB3 ALA A 469 9.596 -3.093 1.374 1.00 0.00 H new ATOM 1711 N ALA A 470 7.285 -3.559 -0.062 1.00 0.00 N ATOM 1712 CA ALA A 470 6.058 -4.398 -0.127 1.00 0.00 C ATOM 1713 C ALA A 470 5.554 -4.465 -1.568 1.00 0.00 C ATOM 1714 O ALA A 470 5.150 -5.499 -2.052 1.00 0.00 O ATOM 1715 CB ALA A 470 4.973 -3.782 0.755 1.00 0.00 C ATOM 0 H ALA A 470 7.281 -2.845 0.667 1.00 0.00 H new ATOM 0 HA ALA A 470 6.292 -5.403 0.224 1.00 0.00 H new ATOM 0 HB1 ALA A 470 4.074 -4.396 0.708 1.00 0.00 H new ATOM 0 HB2 ALA A 470 5.326 -3.733 1.785 1.00 0.00 H new ATOM 0 HB3 ALA A 470 4.745 -2.776 0.402 1.00 0.00 H new ATOM 1721 N CYS A 471 5.552 -3.353 -2.240 1.00 0.00 N ATOM 1722 CA CYS A 471 5.054 -3.323 -3.640 1.00 0.00 C ATOM 1723 C CYS A 471 6.103 -3.923 -4.582 1.00 0.00 C ATOM 1724 O CYS A 471 5.794 -4.369 -5.671 1.00 0.00 O ATOM 1725 CB CYS A 471 4.770 -1.865 -4.021 1.00 0.00 C ATOM 1726 SG CYS A 471 4.178 -0.982 -2.556 1.00 0.00 S ATOM 0 H CYS A 471 5.876 -2.456 -1.878 1.00 0.00 H new ATOM 0 HA CYS A 471 4.141 -3.913 -3.726 1.00 0.00 H new ATOM 0 HB2 CYS A 471 5.674 -1.393 -4.406 1.00 0.00 H new ATOM 0 HB3 CYS A 471 4.024 -1.821 -4.815 1.00 0.00 H new ATOM 0 HG CYS A 471 4.879 -1.339 -1.521 1.00 0.00 H new ATOM 1732 N ARG A 472 7.342 -3.930 -4.174 1.00 0.00 N ATOM 1733 CA ARG A 472 8.414 -4.486 -5.048 1.00 0.00 C ATOM 1734 C ARG A 472 8.329 -6.014 -5.093 1.00 0.00 C ATOM 1735 O ARG A 472 8.118 -6.613 -6.140 1.00 0.00 O ATOM 1736 CB ARG A 472 9.777 -4.075 -4.485 1.00 0.00 C ATOM 1737 CG ARG A 472 10.856 -4.236 -5.569 1.00 0.00 C ATOM 1738 CD ARG A 472 10.769 -3.100 -6.616 1.00 0.00 C ATOM 1739 NE ARG A 472 12.050 -2.336 -6.612 1.00 0.00 N ATOM 1740 CZ ARG A 472 13.127 -2.869 -7.124 1.00 0.00 C ATOM 1741 NH1 ARG A 472 13.079 -4.067 -7.638 1.00 0.00 N ATOM 1742 NH2 ARG A 472 14.251 -2.203 -7.122 1.00 0.00 N ATOM 0 H ARG A 472 7.659 -3.574 -3.272 1.00 0.00 H new ATOM 0 HA ARG A 472 8.288 -4.096 -6.058 1.00 0.00 H new ATOM 0 HB2 ARG A 472 9.743 -3.041 -4.143 1.00 0.00 H new ATOM 0 HB3 ARG A 472 10.024 -4.689 -3.619 1.00 0.00 H new ATOM 0 HG2 ARG A 472 11.843 -4.234 -5.107 1.00 0.00 H new ATOM 0 HG3 ARG A 472 10.738 -5.200 -6.064 1.00 0.00 H new ATOM 0 HD2 ARG A 472 10.581 -3.515 -7.606 1.00 0.00 H new ATOM 0 HD3 ARG A 472 9.935 -2.438 -6.384 1.00 0.00 H new ATOM 0 HE ARG A 472 12.085 -1.399 -6.210 1.00 0.00 H new ATOM 0 HH11 ARG A 472 12.201 -4.586 -7.640 1.00 0.00 H new ATOM 0 HH12 ARG A 472 13.919 -4.484 -8.038 1.00 0.00 H new ATOM 0 HH21 ARG A 472 14.288 -1.266 -6.720 1.00 0.00 H new ATOM 0 HH22 ARG A 472 15.092 -2.620 -7.522 1.00 0.00 H new ATOM 1756 N LEU A 473 8.496 -6.673 -3.979 1.00 0.00 N ATOM 1757 CA LEU A 473 8.423 -8.155 -4.038 1.00 0.00 C ATOM 1758 C LEU A 473 6.986 -8.562 -4.369 1.00 0.00 C ATOM 1759 O LEU A 473 6.750 -9.603 -4.944 1.00 0.00 O ATOM 1760 CB LEU A 473 8.942 -8.869 -2.756 1.00 0.00 C ATOM 1761 CG LEU A 473 8.595 -8.152 -1.437 1.00 0.00 C ATOM 1762 CD1 LEU A 473 9.600 -7.026 -1.141 1.00 0.00 C ATOM 1763 CD2 LEU A 473 7.171 -7.612 -1.462 1.00 0.00 C ATOM 0 H LEU A 473 8.674 -6.265 -3.061 1.00 0.00 H new ATOM 0 HA LEU A 473 9.100 -8.487 -4.825 1.00 0.00 H new ATOM 0 HB2 LEU A 473 8.529 -9.877 -2.725 1.00 0.00 H new ATOM 0 HB3 LEU A 473 10.025 -8.970 -2.825 1.00 0.00 H new ATOM 0 HG LEU A 473 8.661 -8.886 -0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 473 9.332 -6.536 -0.205 1.00 0.00 H new ATOM 0 HD12 LEU A 473 10.602 -7.446 -1.057 1.00 0.00 H new ATOM 0 HD13 LEU A 473 9.579 -6.297 -1.951 1.00 0.00 H new ATOM 0 HD21 LEU A 473 6.955 -7.111 -0.518 1.00 0.00 H new ATOM 0 HD22 LEU A 473 7.066 -6.902 -2.282 1.00 0.00 H new ATOM 0 HD23 LEU A 473 6.472 -8.436 -1.604 1.00 0.00 H new ATOM 1775 N ALA A 474 6.013 -7.740 -4.051 1.00 0.00 N ATOM 1776 CA ALA A 474 4.610 -8.105 -4.407 1.00 0.00 C ATOM 1777 C ALA A 474 4.590 -8.480 -5.886 1.00 0.00 C ATOM 1778 O ALA A 474 3.767 -9.248 -6.343 1.00 0.00 O ATOM 1779 CB ALA A 474 3.681 -6.913 -4.186 1.00 0.00 C ATOM 0 H ALA A 474 6.129 -6.848 -3.569 1.00 0.00 H new ATOM 0 HA ALA A 474 4.272 -8.933 -3.784 1.00 0.00 H new ATOM 0 HB1 ALA A 474 2.661 -7.193 -4.449 1.00 0.00 H new ATOM 0 HB2 ALA A 474 3.716 -6.614 -3.138 1.00 0.00 H new ATOM 0 HB3 ALA A 474 4.002 -6.081 -4.812 1.00 0.00 H new ATOM 1785 N SER A 475 5.515 -7.938 -6.632 1.00 0.00 N ATOM 1786 CA SER A 475 5.589 -8.249 -8.081 1.00 0.00 C ATOM 1787 C SER A 475 5.883 -9.738 -8.258 1.00 0.00 C ATOM 1788 O SER A 475 5.202 -10.425 -8.994 1.00 0.00 O ATOM 1789 CB SER A 475 6.704 -7.425 -8.724 1.00 0.00 C ATOM 1790 OG SER A 475 6.819 -7.779 -10.097 1.00 0.00 O ATOM 0 H SER A 475 6.226 -7.289 -6.293 1.00 0.00 H new ATOM 0 HA SER A 475 4.641 -8.004 -8.559 1.00 0.00 H new ATOM 0 HB2 SER A 475 6.487 -6.361 -8.628 1.00 0.00 H new ATOM 0 HB3 SER A 475 7.648 -7.606 -8.210 1.00 0.00 H new ATOM 0 HG SER A 475 7.532 -7.251 -10.512 1.00 0.00 H new ATOM 1796 N LYS A 476 6.889 -10.252 -7.596 1.00 0.00 N ATOM 1797 CA LYS A 476 7.189 -11.706 -7.759 1.00 0.00 C ATOM 1798 C LYS A 476 6.040 -12.537 -7.175 1.00 0.00 C ATOM 1799 O LYS A 476 6.093 -13.751 -7.150 1.00 0.00 O ATOM 1800 CB LYS A 476 8.511 -12.079 -7.070 1.00 0.00 C ATOM 1801 CG LYS A 476 8.500 -11.647 -5.597 1.00 0.00 C ATOM 1802 CD LYS A 476 9.529 -12.459 -4.792 1.00 0.00 C ATOM 1803 CE LYS A 476 10.951 -12.109 -5.246 1.00 0.00 C ATOM 1804 NZ LYS A 476 11.266 -12.827 -6.514 1.00 0.00 N ATOM 0 H LYS A 476 7.504 -9.740 -6.963 1.00 0.00 H new ATOM 0 HA LYS A 476 7.291 -11.920 -8.823 1.00 0.00 H new ATOM 0 HB2 LYS A 476 8.670 -13.155 -7.137 1.00 0.00 H new ATOM 0 HB3 LYS A 476 9.343 -11.601 -7.587 1.00 0.00 H new ATOM 0 HG2 LYS A 476 8.727 -10.584 -5.522 1.00 0.00 H new ATOM 0 HG3 LYS A 476 7.505 -11.791 -5.177 1.00 0.00 H new ATOM 0 HD2 LYS A 476 9.417 -12.249 -3.728 1.00 0.00 H new ATOM 0 HD3 LYS A 476 9.348 -13.525 -4.927 1.00 0.00 H new ATOM 0 HE2 LYS A 476 11.041 -11.033 -5.394 1.00 0.00 H new ATOM 0 HE3 LYS A 476 11.668 -12.385 -4.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 12.218 -13.241 -6.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 10.569 -13.583 -6.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 11.231 -12.158 -7.310 1.00 0.00 H new ATOM 1818 N GLY A 477 4.992 -11.897 -6.723 1.00 0.00 N ATOM 1819 CA GLY A 477 3.833 -12.657 -6.165 1.00 0.00 C ATOM 1820 C GLY A 477 4.089 -13.058 -4.708 1.00 0.00 C ATOM 1821 O GLY A 477 3.467 -13.968 -4.196 1.00 0.00 O ATOM 0 H GLY A 477 4.889 -10.882 -6.716 1.00 0.00 H new ATOM 0 HA2 GLY A 477 2.931 -12.048 -6.225 1.00 0.00 H new ATOM 0 HA3 GLY A 477 3.656 -13.549 -6.766 1.00 0.00 H new ATOM 1825 N LYS A 478 4.991 -12.389 -4.033 1.00 0.00 N ATOM 1826 CA LYS A 478 5.281 -12.728 -2.600 1.00 0.00 C ATOM 1827 C LYS A 478 5.377 -11.414 -1.808 1.00 0.00 C ATOM 1828 O LYS A 478 5.484 -10.355 -2.383 1.00 0.00 O ATOM 1829 CB LYS A 478 6.595 -13.547 -2.548 1.00 0.00 C ATOM 1830 CG LYS A 478 7.328 -13.414 -1.195 1.00 0.00 C ATOM 1831 CD LYS A 478 6.479 -13.998 -0.032 1.00 0.00 C ATOM 1832 CE LYS A 478 6.986 -15.396 0.352 1.00 0.00 C ATOM 1833 NZ LYS A 478 8.173 -15.268 1.245 1.00 0.00 N ATOM 0 H LYS A 478 5.542 -11.619 -4.412 1.00 0.00 H new ATOM 0 HA LYS A 478 4.493 -13.334 -2.154 1.00 0.00 H new ATOM 0 HB2 LYS A 478 6.371 -14.598 -2.733 1.00 0.00 H new ATOM 0 HB3 LYS A 478 7.256 -13.216 -3.349 1.00 0.00 H new ATOM 0 HG2 LYS A 478 8.285 -13.933 -1.245 1.00 0.00 H new ATOM 0 HG3 LYS A 478 7.545 -12.364 -0.998 1.00 0.00 H new ATOM 0 HD2 LYS A 478 6.530 -13.336 0.832 1.00 0.00 H new ATOM 0 HD3 LYS A 478 5.432 -14.053 -0.330 1.00 0.00 H new ATOM 0 HE2 LYS A 478 6.197 -15.954 0.856 1.00 0.00 H new ATOM 0 HE3 LYS A 478 7.251 -15.957 -0.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 478 8.879 -15.987 0.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 478 8.588 -14.321 1.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 478 7.880 -15.407 2.233 1.00 0.00 H new ATOM 1847 N THR A 479 5.312 -11.470 -0.496 1.00 0.00 N ATOM 1848 CA THR A 479 5.371 -10.218 0.329 1.00 0.00 C ATOM 1849 C THR A 479 6.780 -10.026 0.914 1.00 0.00 C ATOM 1850 O THR A 479 7.721 -10.683 0.524 1.00 0.00 O ATOM 1851 CB THR A 479 4.346 -10.343 1.470 1.00 0.00 C ATOM 1852 OG1 THR A 479 3.100 -10.755 0.924 1.00 0.00 O ATOM 1853 CG2 THR A 479 4.154 -8.998 2.203 1.00 0.00 C ATOM 0 H THR A 479 5.220 -12.333 0.040 1.00 0.00 H new ATOM 0 HA THR A 479 5.141 -9.355 -0.296 1.00 0.00 H new ATOM 0 HB THR A 479 4.716 -11.075 2.188 1.00 0.00 H new ATOM 0 HG1 THR A 479 2.386 -10.177 1.265 1.00 0.00 H new ATOM 0 HG21 THR A 479 3.424 -9.121 3.003 1.00 0.00 H new ATOM 0 HG22 THR A 479 5.105 -8.675 2.626 1.00 0.00 H new ATOM 0 HG23 THR A 479 3.797 -8.247 1.498 1.00 0.00 H new ATOM 1861 N MET A 480 6.933 -9.122 1.843 1.00 0.00 N ATOM 1862 CA MET A 480 8.280 -8.882 2.443 1.00 0.00 C ATOM 1863 C MET A 480 8.750 -10.120 3.217 1.00 0.00 C ATOM 1864 O MET A 480 9.685 -10.055 3.989 1.00 0.00 O ATOM 1865 CB MET A 480 8.203 -7.678 3.395 1.00 0.00 C ATOM 1866 CG MET A 480 7.389 -8.036 4.654 1.00 0.00 C ATOM 1867 SD MET A 480 8.504 -8.626 5.954 1.00 0.00 S ATOM 1868 CE MET A 480 8.892 -7.011 6.673 1.00 0.00 C ATOM 0 H MET A 480 6.184 -8.538 2.214 1.00 0.00 H new ATOM 0 HA MET A 480 8.993 -8.678 1.644 1.00 0.00 H new ATOM 0 HB2 MET A 480 9.208 -7.368 3.681 1.00 0.00 H new ATOM 0 HB3 MET A 480 7.742 -6.832 2.885 1.00 0.00 H new ATOM 0 HG2 MET A 480 6.838 -7.163 5.003 1.00 0.00 H new ATOM 0 HG3 MET A 480 6.653 -8.804 4.417 1.00 0.00 H new ATOM 0 HE1 MET A 480 9.579 -7.141 7.509 1.00 0.00 H new ATOM 0 HE2 MET A 480 9.356 -6.378 5.917 1.00 0.00 H new ATOM 0 HE3 MET A 480 7.975 -6.541 7.027 1.00 0.00 H new ATOM 1878 N ALA A 481 8.119 -11.250 3.021 1.00 0.00 N ATOM 1879 CA ALA A 481 8.543 -12.483 3.754 1.00 0.00 C ATOM 1880 C ALA A 481 9.580 -13.241 2.928 1.00 0.00 C ATOM 1881 O ALA A 481 10.061 -14.287 3.318 1.00 0.00 O ATOM 1882 CB ALA A 481 7.325 -13.377 3.988 1.00 0.00 C ATOM 0 H ALA A 481 7.330 -11.373 2.386 1.00 0.00 H new ATOM 0 HA ALA A 481 8.981 -12.203 4.712 1.00 0.00 H new ATOM 0 HB1 ALA A 481 7.631 -14.277 4.522 1.00 0.00 H new ATOM 0 HB2 ALA A 481 6.586 -12.837 4.580 1.00 0.00 H new ATOM 0 HB3 ALA A 481 6.888 -13.655 3.029 1.00 0.00 H new ATOM 1888 N ASP A 482 9.919 -12.721 1.790 1.00 0.00 N ATOM 1889 CA ASP A 482 10.919 -13.397 0.920 1.00 0.00 C ATOM 1890 C ASP A 482 12.297 -13.364 1.592 1.00 0.00 C ATOM 1891 O ASP A 482 12.516 -12.643 2.543 1.00 0.00 O ATOM 1892 CB ASP A 482 10.959 -12.653 -0.421 1.00 0.00 C ATOM 1893 CG ASP A 482 11.327 -13.617 -1.558 1.00 0.00 C ATOM 1894 OD1 ASP A 482 10.423 -14.204 -2.128 1.00 0.00 O ATOM 1895 OD2 ASP A 482 12.507 -13.749 -1.838 1.00 0.00 O ATOM 0 H ASP A 482 9.545 -11.848 1.418 1.00 0.00 H new ATOM 0 HA ASP A 482 10.645 -14.440 0.759 1.00 0.00 H new ATOM 0 HB2 ASP A 482 9.989 -12.199 -0.621 1.00 0.00 H new ATOM 0 HB3 ASP A 482 11.687 -11.843 -0.373 1.00 0.00 H new ATOM 1900 N SER A 483 13.225 -14.142 1.105 1.00 0.00 N ATOM 1901 CA SER A 483 14.588 -14.161 1.714 1.00 0.00 C ATOM 1902 C SER A 483 15.442 -13.038 1.117 1.00 0.00 C ATOM 1903 O SER A 483 16.348 -12.531 1.748 1.00 0.00 O ATOM 1904 CB SER A 483 15.251 -15.506 1.420 1.00 0.00 C ATOM 1905 OG SER A 483 14.325 -16.553 1.680 1.00 0.00 O ATOM 0 H SER A 483 13.099 -14.768 0.309 1.00 0.00 H new ATOM 0 HA SER A 483 14.503 -14.015 2.791 1.00 0.00 H new ATOM 0 HB2 SER A 483 15.578 -15.544 0.381 1.00 0.00 H new ATOM 0 HB3 SER A 483 16.140 -15.629 2.039 1.00 0.00 H new ATOM 0 HG SER A 483 14.747 -17.417 1.491 1.00 0.00 H new ATOM 1911 N SER A 484 15.167 -12.656 -0.100 1.00 0.00 N ATOM 1912 CA SER A 484 15.967 -11.576 -0.751 1.00 0.00 C ATOM 1913 C SER A 484 15.434 -10.203 -0.335 1.00 0.00 C ATOM 1914 O SER A 484 16.092 -9.196 -0.503 1.00 0.00 O ATOM 1915 CB SER A 484 15.866 -11.718 -2.270 1.00 0.00 C ATOM 1916 OG SER A 484 16.874 -10.926 -2.884 1.00 0.00 O ATOM 0 H SER A 484 14.420 -13.046 -0.675 1.00 0.00 H new ATOM 0 HA SER A 484 17.007 -11.665 -0.438 1.00 0.00 H new ATOM 0 HB2 SER A 484 15.983 -12.763 -2.558 1.00 0.00 H new ATOM 0 HB3 SER A 484 14.880 -11.402 -2.612 1.00 0.00 H new ATOM 0 HG SER A 484 16.813 -11.016 -3.858 1.00 0.00 H new ATOM 1922 N TYR A 485 14.243 -10.149 0.192 1.00 0.00 N ATOM 1923 CA TYR A 485 13.664 -8.846 0.602 1.00 0.00 C ATOM 1924 C TYR A 485 14.697 -8.006 1.373 1.00 0.00 C ATOM 1925 O TYR A 485 14.755 -6.801 1.235 1.00 0.00 O ATOM 1926 CB TYR A 485 12.425 -9.113 1.473 1.00 0.00 C ATOM 1927 CG TYR A 485 12.824 -9.429 2.908 1.00 0.00 C ATOM 1928 CD1 TYR A 485 13.756 -10.441 3.186 1.00 0.00 C ATOM 1929 CD2 TYR A 485 12.254 -8.707 3.959 1.00 0.00 C ATOM 1930 CE1 TYR A 485 14.113 -10.722 4.510 1.00 0.00 C ATOM 1931 CE2 TYR A 485 12.610 -8.987 5.284 1.00 0.00 C ATOM 1932 CZ TYR A 485 13.540 -9.995 5.559 1.00 0.00 C ATOM 1933 OH TYR A 485 13.892 -10.273 6.865 1.00 0.00 O ATOM 0 H TYR A 485 13.644 -10.958 0.356 1.00 0.00 H new ATOM 0 HA TYR A 485 13.377 -8.279 -0.284 1.00 0.00 H new ATOM 0 HB2 TYR A 485 11.771 -8.241 1.457 1.00 0.00 H new ATOM 0 HB3 TYR A 485 11.857 -9.946 1.058 1.00 0.00 H new ATOM 0 HD1 TYR A 485 14.198 -11.004 2.377 1.00 0.00 H new ATOM 0 HD2 TYR A 485 11.535 -7.929 3.749 1.00 0.00 H new ATOM 0 HE1 TYR A 485 14.831 -11.500 4.722 1.00 0.00 H new ATOM 0 HE2 TYR A 485 12.167 -8.425 6.093 1.00 0.00 H new ATOM 0 HH TYR A 485 14.818 -9.993 7.021 1.00 0.00 H new ATOM 1943 N ASN A 486 15.497 -8.629 2.193 1.00 0.00 N ATOM 1944 CA ASN A 486 16.507 -7.867 2.990 1.00 0.00 C ATOM 1945 C ASN A 486 17.223 -6.823 2.123 1.00 0.00 C ATOM 1946 O ASN A 486 17.381 -5.686 2.518 1.00 0.00 O ATOM 1947 CB ASN A 486 17.540 -8.838 3.568 1.00 0.00 C ATOM 1948 CG ASN A 486 16.914 -9.624 4.723 1.00 0.00 C ATOM 1949 OD1 ASN A 486 16.085 -9.106 5.445 1.00 0.00 O ATOM 1950 ND2 ASN A 486 17.279 -10.859 4.931 1.00 0.00 N ATOM 0 H ASN A 486 15.497 -9.637 2.348 1.00 0.00 H new ATOM 0 HA ASN A 486 15.986 -7.349 3.795 1.00 0.00 H new ATOM 0 HB2 ASN A 486 17.884 -9.523 2.793 1.00 0.00 H new ATOM 0 HB3 ASN A 486 18.414 -8.289 3.919 1.00 0.00 H new ATOM 0 HD21 ASN A 486 16.869 -11.390 5.699 1.00 0.00 H new ATOM 0 HD22 ASN A 486 17.975 -11.294 4.325 1.00 0.00 H new ATOM 1957 N LEU A 487 17.678 -7.196 0.960 1.00 0.00 N ATOM 1958 CA LEU A 487 18.401 -6.215 0.095 1.00 0.00 C ATOM 1959 C LEU A 487 17.384 -5.319 -0.629 1.00 0.00 C ATOM 1960 O LEU A 487 17.711 -4.240 -1.077 1.00 0.00 O ATOM 1961 CB LEU A 487 19.273 -6.991 -0.930 1.00 0.00 C ATOM 1962 CG LEU A 487 20.771 -6.776 -0.654 1.00 0.00 C ATOM 1963 CD1 LEU A 487 21.173 -7.510 0.628 1.00 0.00 C ATOM 1964 CD2 LEU A 487 21.588 -7.325 -1.826 1.00 0.00 C ATOM 0 H LEU A 487 17.583 -8.133 0.570 1.00 0.00 H new ATOM 0 HA LEU A 487 19.046 -5.582 0.705 1.00 0.00 H new ATOM 0 HB2 LEU A 487 19.039 -8.054 -0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 487 19.034 -6.659 -1.941 1.00 0.00 H new ATOM 0 HG LEU A 487 20.964 -5.710 -0.536 1.00 0.00 H new ATOM 0 HD11 LEU A 487 22.235 -7.354 0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 487 20.593 -7.123 1.466 1.00 0.00 H new ATOM 0 HD13 LEU A 487 20.977 -8.576 0.513 1.00 0.00 H new ATOM 0 HD21 LEU A 487 22.650 -7.173 -1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 487 21.389 -8.390 -1.941 1.00 0.00 H new ATOM 0 HD23 LEU A 487 21.308 -6.803 -2.741 1.00 0.00 H new ATOM 1976 N GLU A 488 16.163 -5.758 -0.757 1.00 0.00 N ATOM 1977 CA GLU A 488 15.148 -4.926 -1.465 1.00 0.00 C ATOM 1978 C GLU A 488 14.786 -3.698 -0.620 1.00 0.00 C ATOM 1979 O GLU A 488 14.588 -2.619 -1.141 1.00 0.00 O ATOM 1980 CB GLU A 488 13.896 -5.764 -1.730 1.00 0.00 C ATOM 1981 CG GLU A 488 14.294 -7.023 -2.505 1.00 0.00 C ATOM 1982 CD GLU A 488 13.042 -7.811 -2.895 1.00 0.00 C ATOM 1983 OE1 GLU A 488 11.972 -7.227 -2.889 1.00 0.00 O ATOM 1984 OE2 GLU A 488 13.176 -8.985 -3.196 1.00 0.00 O ATOM 0 H GLU A 488 15.824 -6.653 -0.404 1.00 0.00 H new ATOM 0 HA GLU A 488 15.564 -4.586 -2.414 1.00 0.00 H new ATOM 0 HB2 GLU A 488 13.419 -6.036 -0.789 1.00 0.00 H new ATOM 0 HB3 GLU A 488 13.169 -5.185 -2.300 1.00 0.00 H new ATOM 0 HG2 GLU A 488 14.855 -6.749 -3.399 1.00 0.00 H new ATOM 0 HG3 GLU A 488 14.950 -7.644 -1.895 1.00 0.00 H new ATOM 1991 N VAL A 489 14.703 -3.840 0.676 1.00 0.00 N ATOM 1992 CA VAL A 489 14.360 -2.658 1.522 1.00 0.00 C ATOM 1993 C VAL A 489 15.594 -1.766 1.633 1.00 0.00 C ATOM 1994 O VAL A 489 15.520 -0.558 1.527 1.00 0.00 O ATOM 1995 CB VAL A 489 13.906 -3.118 2.919 1.00 0.00 C ATOM 1996 CG1 VAL A 489 12.987 -4.325 2.773 1.00 0.00 C ATOM 1997 CG2 VAL A 489 15.115 -3.515 3.779 1.00 0.00 C ATOM 0 H VAL A 489 14.856 -4.712 1.182 1.00 0.00 H new ATOM 0 HA VAL A 489 13.542 -2.101 1.066 1.00 0.00 H new ATOM 0 HB VAL A 489 13.381 -2.295 3.405 1.00 0.00 H new ATOM 0 HG11 VAL A 489 12.662 -4.656 3.759 1.00 0.00 H new ATOM 0 HG12 VAL A 489 12.117 -4.050 2.177 1.00 0.00 H new ATOM 0 HG13 VAL A 489 13.524 -5.134 2.278 1.00 0.00 H new ATOM 0 HG21 VAL A 489 14.772 -3.837 4.762 1.00 0.00 H new ATOM 0 HG22 VAL A 489 15.652 -4.332 3.297 1.00 0.00 H new ATOM 0 HG23 VAL A 489 15.780 -2.658 3.889 1.00 0.00 H new ATOM 2007 N GLN A 490 16.730 -2.368 1.834 1.00 0.00 N ATOM 2008 CA GLN A 490 17.987 -1.583 1.943 1.00 0.00 C ATOM 2009 C GLN A 490 18.200 -0.804 0.648 1.00 0.00 C ATOM 2010 O GLN A 490 18.961 0.141 0.596 1.00 0.00 O ATOM 2011 CB GLN A 490 19.160 -2.542 2.152 1.00 0.00 C ATOM 2012 CG GLN A 490 19.047 -3.197 3.529 1.00 0.00 C ATOM 2013 CD GLN A 490 19.316 -2.153 4.614 1.00 0.00 C ATOM 2014 OE1 GLN A 490 19.777 -1.066 4.327 1.00 0.00 O ATOM 2015 NE2 GLN A 490 19.046 -2.439 5.858 1.00 0.00 N ATOM 0 H GLN A 490 16.842 -3.377 1.928 1.00 0.00 H new ATOM 0 HA GLN A 490 17.922 -0.892 2.784 1.00 0.00 H new ATOM 0 HB2 GLN A 490 19.162 -3.305 1.374 1.00 0.00 H new ATOM 0 HB3 GLN A 490 20.103 -2.002 2.071 1.00 0.00 H new ATOM 0 HG2 GLN A 490 18.053 -3.625 3.660 1.00 0.00 H new ATOM 0 HG3 GLN A 490 19.760 -4.017 3.613 1.00 0.00 H new ATOM 0 HE21 GLN A 490 18.659 -3.351 6.099 1.00 0.00 H new ATOM 0 HE22 GLN A 490 19.222 -1.750 6.589 1.00 0.00 H new ATOM 2024 N ASN A 491 17.541 -1.204 -0.405 1.00 0.00 N ATOM 2025 CA ASN A 491 17.718 -0.495 -1.703 1.00 0.00 C ATOM 2026 C ASN A 491 16.965 0.841 -1.683 1.00 0.00 C ATOM 2027 O ASN A 491 17.543 1.885 -1.904 1.00 0.00 O ATOM 2028 CB ASN A 491 17.185 -1.370 -2.837 1.00 0.00 C ATOM 2029 CG ASN A 491 18.116 -2.567 -3.035 1.00 0.00 C ATOM 2030 OD1 ASN A 491 19.220 -2.582 -2.529 1.00 0.00 O ATOM 2031 ND2 ASN A 491 17.714 -3.581 -3.752 1.00 0.00 N ATOM 0 H ASN A 491 16.890 -1.989 -0.422 1.00 0.00 H new ATOM 0 HA ASN A 491 18.779 -0.299 -1.861 1.00 0.00 H new ATOM 0 HB2 ASN A 491 16.177 -1.714 -2.603 1.00 0.00 H new ATOM 0 HB3 ASN A 491 17.119 -0.791 -3.758 1.00 0.00 H new ATOM 0 HD21 ASN A 491 18.327 -4.385 -3.887 1.00 0.00 H new ATOM 0 HD22 ASN A 491 16.787 -3.569 -4.177 1.00 0.00 H new ATOM 2038 N ILE A 492 15.682 0.819 -1.427 1.00 0.00 N ATOM 2039 CA ILE A 492 14.900 2.095 -1.404 1.00 0.00 C ATOM 2040 C ILE A 492 15.668 3.162 -0.616 1.00 0.00 C ATOM 2041 O ILE A 492 15.577 4.341 -0.895 1.00 0.00 O ATOM 2042 CB ILE A 492 13.534 1.858 -0.740 1.00 0.00 C ATOM 2043 CG1 ILE A 492 12.939 0.529 -1.224 1.00 0.00 C ATOM 2044 CG2 ILE A 492 12.581 3.001 -1.104 1.00 0.00 C ATOM 2045 CD1 ILE A 492 12.972 0.468 -2.753 1.00 0.00 C ATOM 0 H ILE A 492 15.142 -0.024 -1.233 1.00 0.00 H new ATOM 0 HA ILE A 492 14.752 2.437 -2.428 1.00 0.00 H new ATOM 0 HB ILE A 492 13.667 1.821 0.341 1.00 0.00 H new ATOM 0 HG12 ILE A 492 13.503 -0.305 -0.806 1.00 0.00 H new ATOM 0 HG13 ILE A 492 11.913 0.430 -0.870 1.00 0.00 H new ATOM 0 HG21 ILE A 492 11.613 2.832 -0.633 1.00 0.00 H new ATOM 0 HG22 ILE A 492 12.995 3.946 -0.753 1.00 0.00 H new ATOM 0 HG23 ILE A 492 12.456 3.040 -2.186 1.00 0.00 H new ATOM 0 HD11 ILE A 492 12.548 -0.478 -3.089 1.00 0.00 H new ATOM 0 HD12 ILE A 492 12.389 1.293 -3.163 1.00 0.00 H new ATOM 0 HD13 ILE A 492 14.003 0.546 -3.098 1.00 0.00 H new ATOM 2057 N LEU A 493 16.416 2.756 0.371 1.00 0.00 N ATOM 2058 CA LEU A 493 17.182 3.740 1.186 1.00 0.00 C ATOM 2059 C LEU A 493 18.244 4.434 0.324 1.00 0.00 C ATOM 2060 O LEU A 493 18.484 5.618 0.455 1.00 0.00 O ATOM 2061 CB LEU A 493 17.878 3.000 2.339 1.00 0.00 C ATOM 2062 CG LEU A 493 18.300 4.009 3.449 1.00 0.00 C ATOM 2063 CD1 LEU A 493 17.375 3.880 4.668 1.00 0.00 C ATOM 2064 CD2 LEU A 493 19.748 3.736 3.887 1.00 0.00 C ATOM 0 H LEU A 493 16.530 1.781 0.650 1.00 0.00 H new ATOM 0 HA LEU A 493 16.495 4.491 1.577 1.00 0.00 H new ATOM 0 HB2 LEU A 493 17.207 2.249 2.756 1.00 0.00 H new ATOM 0 HB3 LEU A 493 18.755 2.472 1.965 1.00 0.00 H new ATOM 0 HG LEU A 493 18.224 5.017 3.043 1.00 0.00 H new ATOM 0 HD11 LEU A 493 17.682 4.591 5.435 1.00 0.00 H new ATOM 0 HD12 LEU A 493 16.348 4.090 4.369 1.00 0.00 H new ATOM 0 HD13 LEU A 493 17.437 2.867 5.066 1.00 0.00 H new ATOM 0 HD21 LEU A 493 20.033 4.446 4.663 1.00 0.00 H new ATOM 0 HD22 LEU A 493 19.825 2.721 4.278 1.00 0.00 H new ATOM 0 HD23 LEU A 493 20.414 3.846 3.031 1.00 0.00 H new ATOM 2076 N SER A 494 18.897 3.701 -0.536 1.00 0.00 N ATOM 2077 CA SER A 494 19.960 4.312 -1.386 1.00 0.00 C ATOM 2078 C SER A 494 19.348 5.318 -2.365 1.00 0.00 C ATOM 2079 O SER A 494 19.900 6.370 -2.615 1.00 0.00 O ATOM 2080 CB SER A 494 20.676 3.211 -2.170 1.00 0.00 C ATOM 2081 OG SER A 494 21.336 3.786 -3.289 1.00 0.00 O ATOM 0 H SER A 494 18.741 2.704 -0.687 1.00 0.00 H new ATOM 0 HA SER A 494 20.670 4.833 -0.744 1.00 0.00 H new ATOM 0 HB2 SER A 494 21.397 2.702 -1.530 1.00 0.00 H new ATOM 0 HB3 SER A 494 19.959 2.460 -2.502 1.00 0.00 H new ATOM 0 HG SER A 494 21.225 3.204 -4.069 1.00 0.00 H new ATOM 2087 N PHE A 495 18.220 4.998 -2.926 1.00 0.00 N ATOM 2088 CA PHE A 495 17.573 5.922 -3.897 1.00 0.00 C ATOM 2089 C PHE A 495 16.997 7.135 -3.164 1.00 0.00 C ATOM 2090 O PHE A 495 16.672 8.138 -3.766 1.00 0.00 O ATOM 2091 CB PHE A 495 16.444 5.179 -4.611 1.00 0.00 C ATOM 2092 CG PHE A 495 17.032 4.169 -5.568 1.00 0.00 C ATOM 2093 CD1 PHE A 495 17.694 3.043 -5.070 1.00 0.00 C ATOM 2094 CD2 PHE A 495 16.916 4.358 -6.952 1.00 0.00 C ATOM 2095 CE1 PHE A 495 18.240 2.103 -5.951 1.00 0.00 C ATOM 2096 CE2 PHE A 495 17.461 3.418 -7.833 1.00 0.00 C ATOM 2097 CZ PHE A 495 18.124 2.291 -7.333 1.00 0.00 C ATOM 0 H PHE A 495 17.713 4.130 -2.753 1.00 0.00 H new ATOM 0 HA PHE A 495 18.314 6.264 -4.620 1.00 0.00 H new ATOM 0 HB2 PHE A 495 15.807 4.678 -3.883 1.00 0.00 H new ATOM 0 HB3 PHE A 495 15.815 5.885 -5.152 1.00 0.00 H new ATOM 0 HD1 PHE A 495 17.784 2.898 -4.004 1.00 0.00 H new ATOM 0 HD2 PHE A 495 16.406 5.229 -7.338 1.00 0.00 H new ATOM 0 HE1 PHE A 495 18.751 1.233 -5.565 1.00 0.00 H new ATOM 0 HE2 PHE A 495 17.370 3.562 -8.900 1.00 0.00 H new ATOM 0 HZ PHE A 495 18.546 1.567 -8.014 1.00 0.00 H new ATOM 2107 N LEU A 496 16.832 7.036 -1.874 1.00 0.00 N ATOM 2108 CA LEU A 496 16.237 8.154 -1.099 1.00 0.00 C ATOM 2109 C LEU A 496 17.188 9.366 -1.062 1.00 0.00 C ATOM 2110 O LEU A 496 16.756 10.491 -1.220 1.00 0.00 O ATOM 2111 CB LEU A 496 15.886 7.613 0.319 1.00 0.00 C ATOM 2112 CG LEU A 496 16.732 8.255 1.446 1.00 0.00 C ATOM 2113 CD1 LEU A 496 16.371 9.758 1.602 1.00 0.00 C ATOM 2114 CD2 LEU A 496 16.493 7.498 2.787 1.00 0.00 C ATOM 0 H LEU A 496 17.088 6.218 -1.320 1.00 0.00 H new ATOM 0 HA LEU A 496 15.325 8.515 -1.574 1.00 0.00 H new ATOM 0 HB2 LEU A 496 14.830 7.795 0.518 1.00 0.00 H new ATOM 0 HB3 LEU A 496 16.032 6.533 0.335 1.00 0.00 H new ATOM 0 HG LEU A 496 17.787 8.179 1.182 1.00 0.00 H new ATOM 0 HD11 LEU A 496 16.973 10.196 2.398 1.00 0.00 H new ATOM 0 HD12 LEU A 496 16.571 10.279 0.666 1.00 0.00 H new ATOM 0 HD13 LEU A 496 15.314 9.854 1.852 1.00 0.00 H new ATOM 0 HD21 LEU A 496 17.092 7.955 3.575 1.00 0.00 H new ATOM 0 HD22 LEU A 496 15.438 7.555 3.054 1.00 0.00 H new ATOM 0 HD23 LEU A 496 16.782 6.453 2.672 1.00 0.00 H new ATOM 2126 N LYS A 497 18.459 9.171 -0.836 1.00 0.00 N ATOM 2127 CA LYS A 497 19.375 10.346 -0.773 1.00 0.00 C ATOM 2128 C LYS A 497 19.690 10.833 -2.179 1.00 0.00 C ATOM 2129 O LYS A 497 19.807 12.017 -2.424 1.00 0.00 O ATOM 2130 CB LYS A 497 20.669 9.954 -0.052 1.00 0.00 C ATOM 2131 CG LYS A 497 21.460 8.926 -0.879 1.00 0.00 C ATOM 2132 CD LYS A 497 22.724 8.479 -0.109 1.00 0.00 C ATOM 2133 CE LYS A 497 22.434 7.228 0.731 1.00 0.00 C ATOM 2134 NZ LYS A 497 21.369 7.521 1.731 1.00 0.00 N ATOM 0 H LYS A 497 18.899 8.262 -0.694 1.00 0.00 H new ATOM 0 HA LYS A 497 18.889 11.151 -0.221 1.00 0.00 H new ATOM 0 HB2 LYS A 497 21.280 10.840 0.117 1.00 0.00 H new ATOM 0 HB3 LYS A 497 20.434 9.537 0.927 1.00 0.00 H new ATOM 0 HG2 LYS A 497 20.832 8.061 -1.095 1.00 0.00 H new ATOM 0 HG3 LYS A 497 21.744 9.361 -1.837 1.00 0.00 H new ATOM 0 HD2 LYS A 497 23.530 8.272 -0.813 1.00 0.00 H new ATOM 0 HD3 LYS A 497 23.066 9.286 0.538 1.00 0.00 H new ATOM 0 HE2 LYS A 497 22.121 6.409 0.083 1.00 0.00 H new ATOM 0 HE3 LYS A 497 23.342 6.903 1.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 21.398 6.809 2.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 21.525 8.465 2.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 20.439 7.494 1.266 1.00 0.00 H new ATOM 2148 N MET A 498 19.827 9.924 -3.104 1.00 0.00 N ATOM 2149 CA MET A 498 20.139 10.318 -4.518 1.00 0.00 C ATOM 2150 C MET A 498 18.898 10.117 -5.387 1.00 0.00 C ATOM 2151 O MET A 498 18.993 9.818 -6.560 1.00 0.00 O ATOM 2152 CB MET A 498 21.295 9.463 -5.056 1.00 0.00 C ATOM 2153 CG MET A 498 21.112 8.009 -4.628 1.00 0.00 C ATOM 2154 SD MET A 498 22.160 6.945 -5.652 1.00 0.00 S ATOM 2155 CE MET A 498 21.070 5.500 -5.682 1.00 0.00 C ATOM 0 H MET A 498 19.737 8.920 -2.947 1.00 0.00 H new ATOM 0 HA MET A 498 20.433 11.367 -4.544 1.00 0.00 H new ATOM 0 HB2 MET A 498 21.331 9.529 -6.143 1.00 0.00 H new ATOM 0 HB3 MET A 498 22.245 9.844 -4.682 1.00 0.00 H new ATOM 0 HG2 MET A 498 21.373 7.892 -3.576 1.00 0.00 H new ATOM 0 HG3 MET A 498 20.067 7.717 -4.731 1.00 0.00 H new ATOM 0 HE1 MET A 498 21.671 4.591 -5.663 1.00 0.00 H new ATOM 0 HE2 MET A 498 20.415 5.520 -4.811 1.00 0.00 H new ATOM 0 HE3 MET A 498 20.467 5.518 -6.590 1.00 0.00 H new ATOM 2165 N GLN A 499 17.731 10.289 -4.825 1.00 0.00 N ATOM 2166 CA GLN A 499 16.490 10.118 -5.630 1.00 0.00 C ATOM 2167 C GLN A 499 16.552 11.060 -6.833 1.00 0.00 C ATOM 2168 O GLN A 499 16.499 10.638 -7.971 1.00 0.00 O ATOM 2169 CB GLN A 499 15.263 10.461 -4.766 1.00 0.00 C ATOM 2170 CG GLN A 499 14.014 9.776 -5.333 1.00 0.00 C ATOM 2171 CD GLN A 499 13.832 10.164 -6.802 1.00 0.00 C ATOM 2172 OE1 GLN A 499 14.368 9.422 -7.733 1.00 0.00 O flip ATOM 2173 NE2 GLN A 499 13.193 11.151 -7.107 1.00 0.00 N flip ATOM 0 H GLN A 499 17.585 10.540 -3.847 1.00 0.00 H new ATOM 0 HA GLN A 499 16.407 9.086 -5.971 1.00 0.00 H new ATOM 0 HB2 GLN A 499 15.430 10.138 -3.738 1.00 0.00 H new ATOM 0 HB3 GLN A 499 15.116 11.541 -4.741 1.00 0.00 H new ATOM 0 HG2 GLN A 499 14.109 8.694 -5.242 1.00 0.00 H new ATOM 0 HG3 GLN A 499 13.135 10.068 -4.758 1.00 0.00 H new ATOM 0 HE21 GLN A 499 12.774 11.732 -6.381 1.00 0.00 H new ATOM 0 HE22 GLN A 499 13.076 11.399 -8.089 1.00 0.00 H new ATOM 2182 N HIS A 500 16.666 12.336 -6.584 1.00 0.00 N ATOM 2183 CA HIS A 500 16.732 13.315 -7.705 1.00 0.00 C ATOM 2184 C HIS A 500 18.147 13.330 -8.286 1.00 0.00 C ATOM 2185 O HIS A 500 18.273 13.187 -9.492 1.00 0.00 O ATOM 2186 CB HIS A 500 16.382 14.710 -7.186 1.00 0.00 C ATOM 2187 CG HIS A 500 17.355 15.099 -6.106 1.00 0.00 C ATOM 2188 ND1 HIS A 500 17.463 14.722 -4.790 1.00 0.00 N flip ATOM 2189 CD2 HIS A 500 18.396 15.990 -6.332 1.00 0.00 C flip ATOM 2190 CE1 HIS A 500 18.550 15.365 -4.211 1.00 0.00 C flip ATOM 2191 NE2 HIS A 500 19.078 16.117 -5.178 1.00 0.00 N flip ATOM 2192 OXT HIS A 500 19.080 13.487 -7.517 1.00 0.00 O ATOM 0 H HIS A 500 16.716 12.743 -5.650 1.00 0.00 H new ATOM 0 HA HIS A 500 16.022 13.026 -8.480 1.00 0.00 H new ATOM 0 HB2 HIS A 500 16.418 15.433 -8.001 1.00 0.00 H new ATOM 0 HB3 HIS A 500 15.364 14.720 -6.795 1.00 0.00 H new ATOM 0 HD2 HIS A 500 18.618 16.490 -7.263 1.00 0.00 H new ATOM 0 HE1 HIS A 500 18.895 15.275 -3.192 1.00 0.00 H new ATOM 0 HE2 HIS A 500 19.896 16.714 -5.058 1.00 0.00 H new TER 2201 HIS A 500 HETATM 2202 C1 4IP A1228 -14.202 4.597 -0.761 1.00 20.00 C HETATM 2203 O1 4IP A1228 -15.395 5.377 -0.608 1.00 20.00 O HETATM 2204 C2 4IP A1228 -13.245 5.361 -1.676 1.00 20.00 C HETATM 2205 O2 4IP A1228 -13.913 5.654 -2.904 1.00 20.00 O HETATM 2206 C3 4IP A1228 -11.986 4.535 -1.947 1.00 20.00 C HETATM 2207 O3 4IP A1228 -11.109 5.279 -2.808 1.00 20.00 O HETATM 2208 C4 4IP A1228 -12.336 3.174 -2.565 1.00 20.00 C HETATM 2209 O4 4IP A1228 -12.993 3.344 -3.824 1.00 20.00 O HETATM 2210 C5 4IP A1228 -13.277 2.420 -1.622 1.00 20.00 C HETATM 2211 O5 4IP A1228 -13.627 1.158 -2.193 1.00 20.00 O HETATM 2212 C6 4IP A1228 -14.551 3.234 -1.373 1.00 20.00 C HETATM 2213 O6 4IP A1228 -15.402 2.512 -0.478 1.00 20.00 O HETATM 2214 P1 4IP A1228 -16.718 4.743 0.053 1.00 20.00 P HETATM 2215 O1P 4IP A1228 -17.487 3.909 -0.896 1.00 20.00 O HETATM 2216 O2P 4IP A1228 -17.569 5.987 0.617 1.00 20.00 O HETATM 2217 O3P 4IP A1228 -16.220 3.926 1.344 1.00 20.00 O HETATM 2218 P3 4IP A1228 -11.235 5.265 -4.417 1.00 20.00 P HETATM 2219 O4P 4IP A1228 -10.528 4.124 -5.039 1.00 20.00 O HETATM 2220 O5P 4IP A1228 -10.649 6.681 -4.902 1.00 20.00 O HETATM 2221 O6P 4IP A1228 -12.800 5.319 -4.778 1.00 20.00 O HETATM 2222 P4 4IP A1228 -13.007 2.154 -4.917 1.00 20.00 P HETATM 2223 O7P 4IP A1228 -12.888 0.808 -4.314 1.00 20.00 O HETATM 2224 O8P 4IP A1228 -11.814 2.474 -5.948 1.00 20.00 O HETATM 2225 O9P 4IP A1228 -14.370 2.340 -5.754 1.00 20.00 O HETATM 2226 P5 4IP A1228 -14.005 -0.079 -1.235 1.00 20.00 P HETATM 2227 OPF 4IP A1228 -15.443 -0.119 -0.889 1.00 20.00 O HETATM 2228 OPG 4IP A1228 -13.053 0.057 0.056 1.00 20.00 O HETATM 2229 OPH 4IP A1228 -13.509 -1.401 -2.009 1.00 20.00 O HETATM 0 HO6 4IP A1228 -15.314 2.880 0.426 1.00 20.00 H new HETATM 0 HO2 4IP A1228 -13.636 5.010 -3.589 1.00 20.00 H new HETATM 0 H6 4IP A1228 -15.062 3.397 -2.322 1.00 20.00 H new HETATM 0 H5 4IP A1228 -12.764 2.264 -0.673 1.00 20.00 H new HETATM 0 H4 4IP A1228 -11.413 2.614 -2.716 1.00 20.00 H new HETATM 0 H3 4IP A1228 -11.481 4.339 -1.001 1.00 20.00 H new HETATM 0 H2 4IP A1228 -12.944 6.288 -1.189 1.00 20.00 H new HETATM 0 H1 4IP A1228 -13.731 4.428 0.207 1.00 20.00 H new