USER MOD reduce.3.24.130724 H: found=0, std=0, add=565, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 557 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 484 HIS :FLIP no HD1:sc= -0.413 F(o=-3.5,f=-1.6) USER MOD Set 1.2: A 485 HIS :FLIP no HD1:sc= -1.22 F(o=-2.6!,f=-1.6) USER MOD Set 2.1: A 417 MET CE :methyl -161:sc=-0.000466 (180deg=0) USER MOD Set 2.2: A 433 GLN : amide:sc=-0.00317 K(o=-0.0036,f=-1.3) USER MOD Single : A 420 MET CE :methyl 140:sc= -0.146 (180deg=-3.47!) USER MOD Single : A 423 THR OG1 : rot 180:sc= 0.527 USER MOD Single : A 425 LYS NZ :NH3+ -164:sc= -0.0149 (180deg=-0.275) USER MOD Single : A 429 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 THR OG1 : rot 180:sc= 0 USER MOD Single : A 442 TYR OH : rot 180:sc= 0 USER MOD Single : A 443 SER OG : rot -45:sc= 0.738 USER MOD Single : A 445 HIS : no HD1:sc= -0.235 X(o=-0.24,f=-0.33) USER MOD Single : A 446 SER OG : rot 180:sc= 0 USER MOD Single : A 451 HIS : no HE2:sc= 1.26 K(o=1.3,f=-4.8!) USER MOD Single : A 452 CYS SG : rot 51:sc= -0.445! USER MOD Single : A 456 LYS NZ :NH3+ 158:sc= -0.121 (180deg=-0.647) USER MOD Single : A 458 ASN :FLIP amide:sc= -0.233! F(o=-1.5,f=-0.23!) USER MOD Single : A 459 HIS : no HD1:sc= 0 X(o=0,f=-0.0085) USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot -45:sc= 0.0951 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 469 ASN :FLIP amide:sc=-0.00346 F(o=-1.8,f=-0.0035) USER MOD Single : A 470 SER OG : rot 180:sc= 0 USER MOD Single : A 473 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 478 SER OG : rot 53:sc= 0.476 USER MOD Single : A 479 SER OG : rot 6:sc= 0.758! USER MOD Single : A 480 LYS NZ :NH3+ -164:sc= -0.0101 (180deg=-0.275) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 486 HIS :FLIP no HD1:sc= -3.71! C(o=-4.3!,f=-3.7!) USER MOD Single : A 487 HIS : no HD1:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 488 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 489 HIS : no HD1:sc=-0.00299 X(o=-0.003,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 417 11.462 -6.021 11.669 1.00 0.00 N ATOM 2 CA MET A 417 11.077 -7.053 10.669 1.00 0.00 C ATOM 3 C MET A 417 9.821 -6.597 9.933 1.00 0.00 C ATOM 4 O MET A 417 9.514 -7.066 8.855 1.00 0.00 O ATOM 5 CB MET A 417 10.805 -8.380 11.383 1.00 0.00 C ATOM 6 CG MET A 417 10.473 -9.455 10.347 1.00 0.00 C ATOM 7 SD MET A 417 10.296 -11.059 11.169 1.00 0.00 S ATOM 8 CE MET A 417 9.928 -12.035 9.690 1.00 0.00 C ATOM 0 HA MET A 417 11.887 -7.191 9.953 1.00 0.00 H new ATOM 0 HB2 MET A 417 11.677 -8.678 11.966 1.00 0.00 H new ATOM 0 HB3 MET A 417 9.977 -8.266 12.083 1.00 0.00 H new ATOM 0 HG2 MET A 417 9.551 -9.199 9.825 1.00 0.00 H new ATOM 0 HG3 MET A 417 11.261 -9.505 9.595 1.00 0.00 H new ATOM 0 HE1 MET A 417 9.457 -12.974 9.981 1.00 0.00 H new ATOM 0 HE2 MET A 417 9.252 -11.475 9.043 1.00 0.00 H new ATOM 0 HE3 MET A 417 10.853 -12.245 9.153 1.00 0.00 H new ATOM 18 N GLU A 418 9.100 -5.683 10.513 1.00 0.00 N ATOM 19 CA GLU A 418 7.849 -5.173 9.870 1.00 0.00 C ATOM 20 C GLU A 418 8.167 -3.975 8.984 1.00 0.00 C ATOM 21 O GLU A 418 9.203 -3.354 9.102 1.00 0.00 O ATOM 22 CB GLU A 418 6.844 -4.749 10.949 1.00 0.00 C ATOM 23 CG GLU A 418 6.368 -5.986 11.717 1.00 0.00 C ATOM 24 CD GLU A 418 5.402 -5.574 12.832 1.00 0.00 C ATOM 25 OE1 GLU A 418 5.667 -4.576 13.483 1.00 0.00 O ATOM 26 OE2 GLU A 418 4.415 -6.267 13.018 1.00 0.00 O ATOM 0 H GLU A 418 9.322 -5.260 11.414 1.00 0.00 H new ATOM 0 HA GLU A 418 7.419 -5.969 9.262 1.00 0.00 H new ATOM 0 HB2 GLU A 418 7.307 -4.039 11.634 1.00 0.00 H new ATOM 0 HB3 GLU A 418 5.994 -4.243 10.491 1.00 0.00 H new ATOM 0 HG2 GLU A 418 5.875 -6.679 11.036 1.00 0.00 H new ATOM 0 HG3 GLU A 418 7.223 -6.511 12.142 1.00 0.00 H new ATOM 33 N VAL A 419 7.265 -3.652 8.092 1.00 0.00 N ATOM 34 CA VAL A 419 7.471 -2.495 7.167 1.00 0.00 C ATOM 35 C VAL A 419 6.420 -1.424 7.439 1.00 0.00 C ATOM 36 O VAL A 419 5.238 -1.692 7.519 1.00 0.00 O ATOM 37 CB VAL A 419 7.364 -2.976 5.717 1.00 0.00 C ATOM 38 CG1 VAL A 419 8.575 -3.852 5.393 1.00 0.00 C ATOM 39 CG2 VAL A 419 6.081 -3.790 5.516 1.00 0.00 C ATOM 0 H VAL A 419 6.383 -4.147 7.963 1.00 0.00 H new ATOM 0 HA VAL A 419 8.461 -2.070 7.333 1.00 0.00 H new ATOM 0 HB VAL A 419 7.337 -2.110 5.055 1.00 0.00 H new ATOM 0 HG11 VAL A 419 8.507 -4.199 4.362 1.00 0.00 H new ATOM 0 HG12 VAL A 419 9.489 -3.272 5.521 1.00 0.00 H new ATOM 0 HG13 VAL A 419 8.593 -4.710 6.065 1.00 0.00 H new ATOM 0 HG21 VAL A 419 6.021 -4.124 4.480 1.00 0.00 H new ATOM 0 HG22 VAL A 419 6.093 -4.657 6.177 1.00 0.00 H new ATOM 0 HG23 VAL A 419 5.216 -3.169 5.748 1.00 0.00 H new ATOM 49 N MET A 420 6.863 -0.207 7.590 1.00 0.00 N ATOM 50 CA MET A 420 5.935 0.926 7.875 1.00 0.00 C ATOM 51 C MET A 420 5.653 1.706 6.594 1.00 0.00 C ATOM 52 O MET A 420 6.537 1.996 5.816 1.00 0.00 O ATOM 53 CB MET A 420 6.580 1.856 8.904 1.00 0.00 C ATOM 54 CG MET A 420 5.614 2.991 9.238 1.00 0.00 C ATOM 55 SD MET A 420 6.305 3.998 10.573 1.00 0.00 S ATOM 56 CE MET A 420 7.733 4.640 9.663 1.00 0.00 C ATOM 0 H MET A 420 7.847 0.056 7.527 1.00 0.00 H new ATOM 0 HA MET A 420 4.996 0.533 8.266 1.00 0.00 H new ATOM 0 HB2 MET A 420 6.830 1.299 9.807 1.00 0.00 H new ATOM 0 HB3 MET A 420 7.512 2.261 8.510 1.00 0.00 H new ATOM 0 HG2 MET A 420 5.441 3.607 8.356 1.00 0.00 H new ATOM 0 HG3 MET A 420 4.648 2.584 9.537 1.00 0.00 H new ATOM 0 HE1 MET A 420 7.883 5.690 9.915 1.00 0.00 H new ATOM 0 HE2 MET A 420 8.623 4.072 9.934 1.00 0.00 H new ATOM 0 HE3 MET A 420 7.554 4.545 8.592 1.00 0.00 H new ATOM 66 N VAL A 421 4.410 2.050 6.385 1.00 0.00 N ATOM 67 CA VAL A 421 4.013 2.819 5.166 1.00 0.00 C ATOM 68 C VAL A 421 3.152 4.012 5.570 1.00 0.00 C ATOM 69 O VAL A 421 2.652 4.086 6.679 1.00 0.00 O ATOM 70 CB VAL A 421 3.227 1.916 4.215 1.00 0.00 C ATOM 71 CG1 VAL A 421 4.140 0.791 3.724 1.00 0.00 C ATOM 72 CG2 VAL A 421 2.016 1.312 4.934 1.00 0.00 C ATOM 0 H VAL A 421 3.640 1.828 7.016 1.00 0.00 H new ATOM 0 HA VAL A 421 4.910 3.176 4.660 1.00 0.00 H new ATOM 0 HB VAL A 421 2.875 2.507 3.370 1.00 0.00 H new ATOM 0 HG11 VAL A 421 3.586 0.143 3.045 1.00 0.00 H new ATOM 0 HG12 VAL A 421 4.995 1.219 3.200 1.00 0.00 H new ATOM 0 HG13 VAL A 421 4.491 0.209 4.576 1.00 0.00 H new ATOM 0 HG21 VAL A 421 1.466 0.671 4.245 1.00 0.00 H new ATOM 0 HG22 VAL A 421 2.355 0.722 5.785 1.00 0.00 H new ATOM 0 HG23 VAL A 421 1.364 2.112 5.284 1.00 0.00 H new ATOM 82 N PHE A 422 2.992 4.952 4.674 1.00 0.00 N ATOM 83 CA PHE A 422 2.182 6.175 4.977 1.00 0.00 C ATOM 84 C PHE A 422 1.043 6.314 3.975 1.00 0.00 C ATOM 85 O PHE A 422 1.199 6.107 2.789 1.00 0.00 O ATOM 86 CB PHE A 422 3.075 7.412 4.878 1.00 0.00 C ATOM 87 CG PHE A 422 4.209 7.304 5.869 1.00 0.00 C ATOM 88 CD1 PHE A 422 5.404 6.676 5.499 1.00 0.00 C ATOM 89 CD2 PHE A 422 4.066 7.835 7.156 1.00 0.00 C ATOM 90 CE1 PHE A 422 6.456 6.579 6.416 1.00 0.00 C ATOM 91 CE2 PHE A 422 5.119 7.738 8.073 1.00 0.00 C ATOM 92 CZ PHE A 422 6.314 7.110 7.703 1.00 0.00 C ATOM 0 H PHE A 422 3.391 4.926 3.736 1.00 0.00 H new ATOM 0 HA PHE A 422 1.772 6.084 5.983 1.00 0.00 H new ATOM 0 HB2 PHE A 422 3.471 7.506 3.867 1.00 0.00 H new ATOM 0 HB3 PHE A 422 2.491 8.311 5.076 1.00 0.00 H new ATOM 0 HD1 PHE A 422 5.514 6.266 4.506 1.00 0.00 H new ATOM 0 HD2 PHE A 422 3.144 8.319 7.441 1.00 0.00 H new ATOM 0 HE1 PHE A 422 7.378 6.094 6.131 1.00 0.00 H new ATOM 0 HE2 PHE A 422 5.009 8.148 9.066 1.00 0.00 H new ATOM 0 HZ PHE A 422 7.126 7.035 8.411 1.00 0.00 H new ATOM 102 N THR A 423 -0.102 6.681 4.466 1.00 0.00 N ATOM 103 CA THR A 423 -1.300 6.868 3.595 1.00 0.00 C ATOM 104 C THR A 423 -1.453 8.364 3.301 1.00 0.00 C ATOM 105 O THR A 423 -0.857 9.197 3.957 1.00 0.00 O ATOM 106 CB THR A 423 -2.566 6.344 4.326 1.00 0.00 C ATOM 107 OG1 THR A 423 -3.544 7.375 4.392 1.00 0.00 O ATOM 108 CG2 THR A 423 -2.218 5.891 5.748 1.00 0.00 C ATOM 0 H THR A 423 -0.266 6.864 5.456 1.00 0.00 H new ATOM 0 HA THR A 423 -1.178 6.314 2.664 1.00 0.00 H new ATOM 0 HB THR A 423 -2.959 5.494 3.768 1.00 0.00 H new ATOM 0 HG1 THR A 423 -4.342 7.040 4.852 1.00 0.00 H new ATOM 0 HG21 THR A 423 -3.118 5.527 6.244 1.00 0.00 H new ATOM 0 HG22 THR A 423 -1.479 5.091 5.704 1.00 0.00 H new ATOM 0 HG23 THR A 423 -1.810 6.732 6.308 1.00 0.00 H new ATOM 116 N PRO A 424 -2.251 8.701 2.323 1.00 0.00 N ATOM 117 CA PRO A 424 -2.498 10.125 1.943 1.00 0.00 C ATOM 118 C PRO A 424 -3.225 10.889 3.054 1.00 0.00 C ATOM 119 O PRO A 424 -3.306 12.102 3.038 1.00 0.00 O ATOM 120 CB PRO A 424 -3.376 10.023 0.679 1.00 0.00 C ATOM 121 CG PRO A 424 -4.017 8.672 0.760 1.00 0.00 C ATOM 122 CD PRO A 424 -3.015 7.767 1.474 1.00 0.00 C ATOM 0 HA PRO A 424 -1.571 10.674 1.774 1.00 0.00 H new ATOM 0 HB2 PRO A 424 -4.125 10.814 0.654 1.00 0.00 H new ATOM 0 HB3 PRO A 424 -2.777 10.122 -0.226 1.00 0.00 H new ATOM 0 HG2 PRO A 424 -4.958 8.720 1.308 1.00 0.00 H new ATOM 0 HG3 PRO A 424 -4.247 8.290 -0.235 1.00 0.00 H new ATOM 0 HD2 PRO A 424 -3.517 7.003 2.068 1.00 0.00 H new ATOM 0 HD3 PRO A 424 -2.369 7.247 0.767 1.00 0.00 H new ATOM 130 N LYS A 425 -3.759 10.179 4.012 1.00 0.00 N ATOM 131 CA LYS A 425 -4.495 10.837 5.131 1.00 0.00 C ATOM 132 C LYS A 425 -3.498 11.271 6.209 1.00 0.00 C ATOM 133 O LYS A 425 -3.856 11.924 7.172 1.00 0.00 O ATOM 134 CB LYS A 425 -5.501 9.844 5.728 1.00 0.00 C ATOM 135 CG LYS A 425 -6.559 9.493 4.677 1.00 0.00 C ATOM 136 CD LYS A 425 -7.551 8.483 5.261 1.00 0.00 C ATOM 137 CE LYS A 425 -8.541 8.053 4.176 1.00 0.00 C ATOM 138 NZ LYS A 425 -9.381 9.218 3.778 1.00 0.00 N ATOM 0 H LYS A 425 -3.716 9.161 4.067 1.00 0.00 H new ATOM 0 HA LYS A 425 -5.027 11.712 4.758 1.00 0.00 H new ATOM 0 HB2 LYS A 425 -4.986 8.941 6.056 1.00 0.00 H new ATOM 0 HB3 LYS A 425 -5.977 10.277 6.608 1.00 0.00 H new ATOM 0 HG2 LYS A 425 -7.085 10.394 4.362 1.00 0.00 H new ATOM 0 HG3 LYS A 425 -6.081 9.077 3.790 1.00 0.00 H new ATOM 0 HD2 LYS A 425 -7.017 7.614 5.646 1.00 0.00 H new ATOM 0 HD3 LYS A 425 -8.086 8.927 6.101 1.00 0.00 H new ATOM 0 HE2 LYS A 425 -8.003 7.667 3.310 1.00 0.00 H new ATOM 0 HE3 LYS A 425 -9.173 7.245 4.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 425 -10.216 8.882 3.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 425 -9.688 9.731 4.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 425 -8.826 9.855 3.171 1.00 0.00 H new ATOM 152 N GLY A 426 -2.251 10.917 6.049 1.00 0.00 N ATOM 153 CA GLY A 426 -1.212 11.308 7.049 1.00 0.00 C ATOM 154 C GLY A 426 -1.202 10.303 8.200 1.00 0.00 C ATOM 155 O GLY A 426 -0.544 10.498 9.204 1.00 0.00 O ATOM 0 H GLY A 426 -1.904 10.369 5.262 1.00 0.00 H new ATOM 0 HA2 GLY A 426 -0.231 11.342 6.575 1.00 0.00 H new ATOM 0 HA3 GLY A 426 -1.417 12.309 7.429 1.00 0.00 H new ATOM 159 N GLU A 427 -1.933 9.233 8.059 1.00 0.00 N ATOM 160 CA GLU A 427 -1.994 8.206 9.138 1.00 0.00 C ATOM 161 C GLU A 427 -0.828 7.231 9.016 1.00 0.00 C ATOM 162 O GLU A 427 -0.219 7.088 7.976 1.00 0.00 O ATOM 163 CB GLU A 427 -3.315 7.441 9.036 1.00 0.00 C ATOM 164 CG GLU A 427 -3.451 6.504 10.236 1.00 0.00 C ATOM 165 CD GLU A 427 -4.852 5.895 10.266 1.00 0.00 C ATOM 166 OE1 GLU A 427 -5.553 6.019 9.277 1.00 0.00 O ATOM 167 OE2 GLU A 427 -5.200 5.313 11.282 1.00 0.00 O ATOM 0 H GLU A 427 -2.496 9.023 7.235 1.00 0.00 H new ATOM 0 HA GLU A 427 -1.930 8.706 10.104 1.00 0.00 H new ATOM 0 HB2 GLU A 427 -4.152 8.139 9.009 1.00 0.00 H new ATOM 0 HB3 GLU A 427 -3.347 6.869 8.108 1.00 0.00 H new ATOM 0 HG2 GLU A 427 -2.703 5.713 10.177 1.00 0.00 H new ATOM 0 HG3 GLU A 427 -3.264 7.052 11.159 1.00 0.00 H new ATOM 174 N ILE A 428 -0.520 6.559 10.091 1.00 0.00 N ATOM 175 CA ILE A 428 0.608 5.581 10.094 1.00 0.00 C ATOM 176 C ILE A 428 0.051 4.162 10.083 1.00 0.00 C ATOM 177 O ILE A 428 -0.789 3.799 10.882 1.00 0.00 O ATOM 178 CB ILE A 428 1.451 5.801 11.354 1.00 0.00 C ATOM 179 CG1 ILE A 428 1.845 7.283 11.450 1.00 0.00 C ATOM 180 CG2 ILE A 428 2.716 4.944 11.281 1.00 0.00 C ATOM 181 CD1 ILE A 428 2.493 7.746 10.139 1.00 0.00 C ATOM 0 H ILE A 428 -1.009 6.647 10.982 1.00 0.00 H new ATOM 0 HA ILE A 428 1.229 5.725 9.210 1.00 0.00 H new ATOM 0 HB ILE A 428 0.871 5.518 12.232 1.00 0.00 H new ATOM 0 HG12 ILE A 428 0.963 7.888 11.662 1.00 0.00 H new ATOM 0 HG13 ILE A 428 2.538 7.429 12.278 1.00 0.00 H new ATOM 0 HG21 ILE A 428 3.315 5.102 12.178 1.00 0.00 H new ATOM 0 HG22 ILE A 428 2.439 3.892 11.210 1.00 0.00 H new ATOM 0 HG23 ILE A 428 3.297 5.227 10.403 1.00 0.00 H new ATOM 0 HD11 ILE A 428 2.767 8.798 10.220 1.00 0.00 H new ATOM 0 HD12 ILE A 428 3.386 7.152 9.945 1.00 0.00 H new ATOM 0 HD13 ILE A 428 1.787 7.618 9.319 1.00 0.00 H new ATOM 193 N LYS A 429 0.522 3.363 9.164 1.00 0.00 N ATOM 194 CA LYS A 429 0.051 1.949 9.050 1.00 0.00 C ATOM 195 C LYS A 429 1.246 1.013 9.034 1.00 0.00 C ATOM 196 O LYS A 429 2.290 1.327 8.504 1.00 0.00 O ATOM 197 CB LYS A 429 -0.742 1.788 7.752 1.00 0.00 C ATOM 198 CG LYS A 429 -2.022 2.637 7.809 1.00 0.00 C ATOM 199 CD LYS A 429 -3.101 1.900 8.615 1.00 0.00 C ATOM 200 CE LYS A 429 -4.388 2.718 8.615 1.00 0.00 C ATOM 201 NZ LYS A 429 -5.417 2.020 9.436 1.00 0.00 N ATOM 0 H LYS A 429 1.225 3.633 8.476 1.00 0.00 H new ATOM 0 HA LYS A 429 -0.584 1.705 9.902 1.00 0.00 H new ATOM 0 HB2 LYS A 429 -0.131 2.093 6.903 1.00 0.00 H new ATOM 0 HB3 LYS A 429 -0.998 0.739 7.600 1.00 0.00 H new ATOM 0 HG2 LYS A 429 -1.809 3.602 8.268 1.00 0.00 H new ATOM 0 HG3 LYS A 429 -2.382 2.836 6.800 1.00 0.00 H new ATOM 0 HD2 LYS A 429 -3.284 0.916 8.183 1.00 0.00 H new ATOM 0 HD3 LYS A 429 -2.760 1.740 9.638 1.00 0.00 H new ATOM 0 HE2 LYS A 429 -4.199 3.713 9.017 1.00 0.00 H new ATOM 0 HE3 LYS A 429 -4.748 2.850 7.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 -6.296 2.576 9.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 -5.603 1.079 9.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 -5.071 1.916 10.411 1.00 0.00 H new ATOM 215 N ARG A 430 1.089 -0.140 9.624 1.00 0.00 N ATOM 216 CA ARG A 430 2.202 -1.136 9.678 1.00 0.00 C ATOM 217 C ARG A 430 1.743 -2.463 9.097 1.00 0.00 C ATOM 218 O ARG A 430 0.661 -2.941 9.379 1.00 0.00 O ATOM 219 CB ARG A 430 2.629 -1.335 11.128 1.00 0.00 C ATOM 220 CG ARG A 430 3.323 -0.068 11.624 1.00 0.00 C ATOM 221 CD ARG A 430 3.752 -0.263 13.079 1.00 0.00 C ATOM 222 NE ARG A 430 4.410 0.981 13.577 1.00 0.00 N ATOM 223 CZ ARG A 430 5.689 1.181 13.381 1.00 0.00 C ATOM 224 NH1 ARG A 430 6.409 0.296 12.747 1.00 0.00 N ATOM 225 NH2 ARG A 430 6.248 2.270 13.833 1.00 0.00 N ATOM 0 H ARG A 430 0.226 -0.440 10.078 1.00 0.00 H new ATOM 0 HA ARG A 430 3.044 -0.766 9.093 1.00 0.00 H new ATOM 0 HB2 ARG A 430 1.761 -1.555 11.749 1.00 0.00 H new ATOM 0 HB3 ARG A 430 3.303 -2.188 11.208 1.00 0.00 H new ATOM 0 HG2 ARG A 430 4.192 0.151 11.003 1.00 0.00 H new ATOM 0 HG3 ARG A 430 2.649 0.785 11.543 1.00 0.00 H new ATOM 0 HD2 ARG A 430 2.885 -0.500 13.696 1.00 0.00 H new ATOM 0 HD3 ARG A 430 4.439 -1.106 13.157 1.00 0.00 H new ATOM 0 HE ARG A 430 3.859 1.681 14.074 1.00 0.00 H new ATOM 0 HH11 ARG A 430 5.976 -0.560 12.400 1.00 0.00 H new ATOM 0 HH12 ARG A 430 7.405 0.460 12.599 1.00 0.00 H new ATOM 0 HH21 ARG A 430 5.689 2.959 14.336 1.00 0.00 H new ATOM 0 HH22 ARG A 430 7.244 2.432 13.684 1.00 0.00 H new ATOM 239 N LEU A 431 2.576 -3.060 8.289 1.00 0.00 N ATOM 240 CA LEU A 431 2.238 -4.372 7.661 1.00 0.00 C ATOM 241 C LEU A 431 3.375 -5.365 7.929 1.00 0.00 C ATOM 242 O LEU A 431 4.527 -4.985 8.010 1.00 0.00 O ATOM 243 CB LEU A 431 2.075 -4.194 6.146 1.00 0.00 C ATOM 244 CG LEU A 431 1.092 -3.055 5.858 1.00 0.00 C ATOM 245 CD1 LEU A 431 1.108 -2.738 4.361 1.00 0.00 C ATOM 246 CD2 LEU A 431 -0.325 -3.476 6.274 1.00 0.00 C ATOM 0 H LEU A 431 3.491 -2.689 8.033 1.00 0.00 H new ATOM 0 HA LEU A 431 1.307 -4.747 8.085 1.00 0.00 H new ATOM 0 HB2 LEU A 431 3.041 -3.976 5.691 1.00 0.00 H new ATOM 0 HB3 LEU A 431 1.713 -5.120 5.699 1.00 0.00 H new ATOM 0 HG LEU A 431 1.387 -2.171 6.424 1.00 0.00 H new ATOM 0 HD11 LEU A 431 0.409 -1.928 4.153 1.00 0.00 H new ATOM 0 HD12 LEU A 431 2.112 -2.436 4.064 1.00 0.00 H new ATOM 0 HD13 LEU A 431 0.814 -3.624 3.798 1.00 0.00 H new ATOM 0 HD21 LEU A 431 -1.021 -2.663 6.068 1.00 0.00 H new ATOM 0 HD22 LEU A 431 -0.622 -4.360 5.710 1.00 0.00 H new ATOM 0 HD23 LEU A 431 -0.339 -3.704 7.340 1.00 0.00 H new ATOM 258 N PRO A 432 3.058 -6.632 8.061 1.00 0.00 N ATOM 259 CA PRO A 432 4.079 -7.690 8.315 1.00 0.00 C ATOM 260 C PRO A 432 4.995 -7.926 7.109 1.00 0.00 C ATOM 261 O PRO A 432 4.662 -7.607 5.985 1.00 0.00 O ATOM 262 CB PRO A 432 3.245 -8.939 8.636 1.00 0.00 C ATOM 263 CG PRO A 432 1.921 -8.708 7.976 1.00 0.00 C ATOM 264 CD PRO A 432 1.697 -7.198 7.985 1.00 0.00 C ATOM 0 HA PRO A 432 4.758 -7.412 9.121 1.00 0.00 H new ATOM 0 HB2 PRO A 432 3.723 -9.841 8.254 1.00 0.00 H new ATOM 0 HB3 PRO A 432 3.131 -9.070 9.712 1.00 0.00 H new ATOM 0 HG2 PRO A 432 1.921 -9.095 6.957 1.00 0.00 H new ATOM 0 HG3 PRO A 432 1.124 -9.223 8.512 1.00 0.00 H new ATOM 0 HD2 PRO A 432 1.177 -6.867 7.086 1.00 0.00 H new ATOM 0 HD3 PRO A 432 1.089 -6.890 8.836 1.00 0.00 H new ATOM 272 N GLN A 433 6.150 -8.479 7.354 1.00 0.00 N ATOM 273 CA GLN A 433 7.127 -8.743 6.258 1.00 0.00 C ATOM 274 C GLN A 433 6.472 -9.543 5.133 1.00 0.00 C ATOM 275 O GLN A 433 5.682 -10.438 5.356 1.00 0.00 O ATOM 276 CB GLN A 433 8.319 -9.533 6.818 1.00 0.00 C ATOM 277 CG GLN A 433 9.374 -9.710 5.719 1.00 0.00 C ATOM 278 CD GLN A 433 10.582 -10.478 6.266 1.00 0.00 C ATOM 279 OE1 GLN A 433 10.458 -11.613 6.683 1.00 0.00 O ATOM 280 NE2 GLN A 433 11.756 -9.908 6.274 1.00 0.00 N ATOM 0 H GLN A 433 6.464 -8.764 8.282 1.00 0.00 H new ATOM 0 HA GLN A 433 7.468 -7.789 5.856 1.00 0.00 H new ATOM 0 HB2 GLN A 433 8.750 -9.007 7.670 1.00 0.00 H new ATOM 0 HB3 GLN A 433 7.987 -10.506 7.179 1.00 0.00 H new ATOM 0 HG2 GLN A 433 8.944 -10.248 4.874 1.00 0.00 H new ATOM 0 HG3 GLN A 433 9.691 -8.735 5.348 1.00 0.00 H new ATOM 0 HE21 GLN A 433 11.863 -8.956 5.925 1.00 0.00 H new ATOM 0 HE22 GLN A 433 12.567 -10.415 6.630 1.00 0.00 H new ATOM 289 N GLY A 434 6.817 -9.213 3.918 1.00 0.00 N ATOM 290 CA GLY A 434 6.253 -9.924 2.736 1.00 0.00 C ATOM 291 C GLY A 434 4.889 -9.328 2.390 1.00 0.00 C ATOM 292 O GLY A 434 4.162 -9.853 1.572 1.00 0.00 O ATOM 0 H GLY A 434 7.477 -8.469 3.692 1.00 0.00 H new ATOM 0 HA2 GLY A 434 6.929 -9.832 1.886 1.00 0.00 H new ATOM 0 HA3 GLY A 434 6.154 -10.988 2.951 1.00 0.00 H new ATOM 296 N ALA A 435 4.543 -8.234 3.013 1.00 0.00 N ATOM 297 CA ALA A 435 3.223 -7.592 2.741 1.00 0.00 C ATOM 298 C ALA A 435 3.212 -6.977 1.346 1.00 0.00 C ATOM 299 O ALA A 435 4.228 -6.565 0.826 1.00 0.00 O ATOM 300 CB ALA A 435 2.957 -6.500 3.778 1.00 0.00 C ATOM 0 H ALA A 435 5.121 -7.754 3.703 1.00 0.00 H new ATOM 0 HA ALA A 435 2.445 -8.353 2.802 1.00 0.00 H new ATOM 0 HB1 ALA A 435 1.993 -6.034 3.576 1.00 0.00 H new ATOM 0 HB2 ALA A 435 2.946 -6.940 4.775 1.00 0.00 H new ATOM 0 HB3 ALA A 435 3.743 -5.747 3.723 1.00 0.00 H new ATOM 306 N THR A 436 2.054 -6.918 0.745 1.00 0.00 N ATOM 307 CA THR A 436 1.921 -6.339 -0.628 1.00 0.00 C ATOM 308 C THR A 436 0.839 -5.261 -0.644 1.00 0.00 C ATOM 309 O THR A 436 0.137 -5.040 0.324 1.00 0.00 O ATOM 310 CB THR A 436 1.542 -7.443 -1.615 1.00 0.00 C ATOM 311 OG1 THR A 436 0.230 -7.907 -1.329 1.00 0.00 O ATOM 312 CG2 THR A 436 2.532 -8.603 -1.498 1.00 0.00 C ATOM 0 H THR A 436 1.180 -7.251 1.152 1.00 0.00 H new ATOM 0 HA THR A 436 2.874 -5.896 -0.916 1.00 0.00 H new ATOM 0 HB THR A 436 1.573 -7.045 -2.629 1.00 0.00 H new ATOM 0 HG1 THR A 436 -0.013 -8.613 -1.963 1.00 0.00 H new ATOM 0 HG21 THR A 436 2.258 -9.388 -2.203 1.00 0.00 H new ATOM 0 HG22 THR A 436 3.537 -8.247 -1.723 1.00 0.00 H new ATOM 0 HG23 THR A 436 2.507 -9.002 -0.484 1.00 0.00 H new ATOM 320 N ALA A 437 0.718 -4.588 -1.754 1.00 0.00 N ATOM 321 CA ALA A 437 -0.293 -3.503 -1.895 1.00 0.00 C ATOM 322 C ALA A 437 -1.685 -4.063 -1.614 1.00 0.00 C ATOM 323 O ALA A 437 -2.580 -3.350 -1.196 1.00 0.00 O ATOM 324 CB ALA A 437 -0.242 -2.955 -3.328 1.00 0.00 C ATOM 0 H ALA A 437 1.288 -4.747 -2.585 1.00 0.00 H new ATOM 0 HA ALA A 437 -0.076 -2.704 -1.186 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -0.979 -2.160 -3.440 1.00 0.00 H new ATOM 0 HB2 ALA A 437 0.753 -2.558 -3.531 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -0.463 -3.757 -4.032 1.00 0.00 H new ATOM 330 N LEU A 438 -1.877 -5.328 -1.855 1.00 0.00 N ATOM 331 CA LEU A 438 -3.209 -5.947 -1.618 1.00 0.00 C ATOM 332 C LEU A 438 -3.552 -5.860 -0.125 1.00 0.00 C ATOM 333 O LEU A 438 -4.652 -5.507 0.254 1.00 0.00 O ATOM 334 CB LEU A 438 -3.147 -7.428 -2.050 1.00 0.00 C ATOM 335 CG LEU A 438 -4.537 -7.919 -2.493 1.00 0.00 C ATOM 336 CD1 LEU A 438 -5.571 -7.645 -1.392 1.00 0.00 C ATOM 337 CD2 LEU A 438 -4.959 -7.199 -3.797 1.00 0.00 C ATOM 0 H LEU A 438 -1.163 -5.965 -2.209 1.00 0.00 H new ATOM 0 HA LEU A 438 -3.974 -5.424 -2.192 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -2.436 -7.545 -2.868 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -2.785 -8.039 -1.223 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.489 -8.993 -2.675 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -6.550 -7.997 -1.717 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -5.281 -8.170 -0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -5.617 -6.574 -1.195 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -5.944 -7.551 -4.105 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -4.996 -6.124 -3.623 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -4.235 -7.415 -4.582 1.00 0.00 H new ATOM 349 N ASP A 439 -2.612 -6.193 0.715 1.00 0.00 N ATOM 350 CA ASP A 439 -2.856 -6.148 2.188 1.00 0.00 C ATOM 351 C ASP A 439 -3.104 -4.700 2.613 1.00 0.00 C ATOM 352 O ASP A 439 -3.942 -4.418 3.449 1.00 0.00 O ATOM 353 CB ASP A 439 -1.619 -6.691 2.929 1.00 0.00 C ATOM 354 CG ASP A 439 -1.633 -8.225 2.944 1.00 0.00 C ATOM 355 OD1 ASP A 439 -2.679 -8.799 2.690 1.00 0.00 O ATOM 356 OD2 ASP A 439 -0.592 -8.801 3.215 1.00 0.00 O ATOM 0 H ASP A 439 -1.677 -6.497 0.444 1.00 0.00 H new ATOM 0 HA ASP A 439 -3.725 -6.758 2.434 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -0.711 -6.334 2.443 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.604 -6.311 3.951 1.00 0.00 H new ATOM 361 N PHE A 440 -2.368 -3.787 2.044 1.00 0.00 N ATOM 362 CA PHE A 440 -2.522 -2.346 2.391 1.00 0.00 C ATOM 363 C PHE A 440 -3.941 -1.883 2.062 1.00 0.00 C ATOM 364 O PHE A 440 -4.575 -1.191 2.838 1.00 0.00 O ATOM 365 CB PHE A 440 -1.508 -1.533 1.578 1.00 0.00 C ATOM 366 CG PHE A 440 -1.717 -0.057 1.821 1.00 0.00 C ATOM 367 CD1 PHE A 440 -1.304 0.521 3.028 1.00 0.00 C ATOM 368 CD2 PHE A 440 -2.321 0.736 0.837 1.00 0.00 C ATOM 369 CE1 PHE A 440 -1.494 1.890 3.250 1.00 0.00 C ATOM 370 CE2 PHE A 440 -2.511 2.104 1.059 1.00 0.00 C ATOM 371 CZ PHE A 440 -2.098 2.681 2.265 1.00 0.00 C ATOM 0 H PHE A 440 -1.654 -3.981 1.342 1.00 0.00 H new ATOM 0 HA PHE A 440 -2.344 -2.200 3.456 1.00 0.00 H new ATOM 0 HB2 PHE A 440 -0.494 -1.816 1.859 1.00 0.00 H new ATOM 0 HB3 PHE A 440 -1.619 -1.755 0.517 1.00 0.00 H new ATOM 0 HD1 PHE A 440 -0.839 -0.090 3.788 1.00 0.00 H new ATOM 0 HD2 PHE A 440 -2.640 0.291 -0.094 1.00 0.00 H new ATOM 0 HE1 PHE A 440 -1.175 2.336 4.180 1.00 0.00 H new ATOM 0 HE2 PHE A 440 -2.976 2.715 0.300 1.00 0.00 H new ATOM 0 HZ PHE A 440 -2.245 3.737 2.436 1.00 0.00 H new ATOM 381 N ALA A 441 -4.443 -2.257 0.919 1.00 0.00 N ATOM 382 CA ALA A 441 -5.821 -1.843 0.526 1.00 0.00 C ATOM 383 C ALA A 441 -6.820 -2.402 1.539 1.00 0.00 C ATOM 384 O ALA A 441 -7.778 -1.750 1.910 1.00 0.00 O ATOM 385 CB ALA A 441 -6.142 -2.405 -0.865 1.00 0.00 C ATOM 0 H ALA A 441 -3.956 -2.836 0.235 1.00 0.00 H new ATOM 0 HA ALA A 441 -5.887 -0.755 0.505 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -7.149 -2.104 -1.155 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -5.425 -2.018 -1.588 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -6.081 -3.493 -0.841 1.00 0.00 H new ATOM 391 N TYR A 442 -6.602 -3.607 1.982 1.00 0.00 N ATOM 392 CA TYR A 442 -7.524 -4.233 2.974 1.00 0.00 C ATOM 393 C TYR A 442 -7.402 -3.507 4.314 1.00 0.00 C ATOM 394 O TYR A 442 -8.369 -3.342 5.033 1.00 0.00 O ATOM 395 CB TYR A 442 -7.138 -5.714 3.157 1.00 0.00 C ATOM 396 CG TYR A 442 -7.808 -6.558 2.094 1.00 0.00 C ATOM 397 CD1 TYR A 442 -7.673 -6.223 0.739 1.00 0.00 C ATOM 398 CD2 TYR A 442 -8.573 -7.672 2.465 1.00 0.00 C ATOM 399 CE1 TYR A 442 -8.301 -7.002 -0.239 1.00 0.00 C ATOM 400 CE2 TYR A 442 -9.199 -8.450 1.486 1.00 0.00 C ATOM 401 CZ TYR A 442 -9.064 -8.114 0.133 1.00 0.00 C ATOM 402 OH TYR A 442 -9.681 -8.881 -0.832 1.00 0.00 O ATOM 0 H TYR A 442 -5.817 -4.193 1.697 1.00 0.00 H new ATOM 0 HA TYR A 442 -8.551 -4.161 2.616 1.00 0.00 H new ATOM 0 HB2 TYR A 442 -6.056 -5.827 3.094 1.00 0.00 H new ATOM 0 HB3 TYR A 442 -7.437 -6.057 4.147 1.00 0.00 H new ATOM 0 HD1 TYR A 442 -7.085 -5.364 0.451 1.00 0.00 H new ATOM 0 HD2 TYR A 442 -8.679 -7.930 3.508 1.00 0.00 H new ATOM 0 HE1 TYR A 442 -8.197 -6.744 -1.283 1.00 0.00 H new ATOM 0 HE2 TYR A 442 -9.786 -9.310 1.773 1.00 0.00 H new ATOM 0 HH TYR A 442 -10.169 -9.615 -0.404 1.00 0.00 H new ATOM 412 N SER A 443 -6.214 -3.093 4.657 1.00 0.00 N ATOM 413 CA SER A 443 -6.001 -2.395 5.957 1.00 0.00 C ATOM 414 C SER A 443 -6.847 -1.123 5.997 1.00 0.00 C ATOM 415 O SER A 443 -7.403 -0.769 7.019 1.00 0.00 O ATOM 416 CB SER A 443 -4.519 -2.023 6.094 1.00 0.00 C ATOM 417 OG SER A 443 -4.204 -0.975 5.184 1.00 0.00 O ATOM 0 H SER A 443 -5.375 -3.209 4.089 1.00 0.00 H new ATOM 0 HA SER A 443 -6.293 -3.052 6.776 1.00 0.00 H new ATOM 0 HB2 SER A 443 -4.306 -1.708 7.115 1.00 0.00 H new ATOM 0 HB3 SER A 443 -3.895 -2.894 5.892 1.00 0.00 H new ATOM 0 HG SER A 443 -4.598 -1.173 4.309 1.00 0.00 H new ATOM 423 N LEU A 444 -6.949 -0.441 4.891 1.00 0.00 N ATOM 424 CA LEU A 444 -7.759 0.812 4.844 1.00 0.00 C ATOM 425 C LEU A 444 -9.243 0.462 4.914 1.00 0.00 C ATOM 426 O LEU A 444 -9.886 0.644 5.929 1.00 0.00 O ATOM 427 CB LEU A 444 -7.482 1.552 3.531 1.00 0.00 C ATOM 428 CG LEU A 444 -5.984 1.856 3.405 1.00 0.00 C ATOM 429 CD1 LEU A 444 -5.716 2.551 2.065 1.00 0.00 C ATOM 430 CD2 LEU A 444 -5.539 2.774 4.558 1.00 0.00 C ATOM 0 H LEU A 444 -6.503 -0.698 4.010 1.00 0.00 H new ATOM 0 HA LEU A 444 -7.489 1.447 5.688 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -7.811 0.946 2.686 1.00 0.00 H new ATOM 0 HB3 LEU A 444 -8.053 2.480 3.499 1.00 0.00 H new ATOM 0 HG LEU A 444 -5.422 0.923 3.452 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -4.652 2.768 1.974 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -6.025 1.898 1.248 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -6.281 3.482 2.019 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -4.474 2.987 4.464 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -6.100 3.707 4.517 1.00 0.00 H new ATOM 0 HD23 LEU A 444 -5.727 2.279 5.511 1.00 0.00 H new ATOM 442 N HIS A 445 -9.796 -0.027 3.834 1.00 0.00 N ATOM 443 CA HIS A 445 -11.250 -0.385 3.816 1.00 0.00 C ATOM 444 C HIS A 445 -11.458 -1.681 3.032 1.00 0.00 C ATOM 445 O HIS A 445 -10.524 -2.288 2.549 1.00 0.00 O ATOM 446 CB HIS A 445 -12.045 0.746 3.163 1.00 0.00 C ATOM 447 CG HIS A 445 -11.890 2.001 3.979 1.00 0.00 C ATOM 448 ND1 HIS A 445 -12.424 2.121 5.252 1.00 0.00 N ATOM 449 CD2 HIS A 445 -11.262 3.194 3.722 1.00 0.00 C ATOM 450 CE1 HIS A 445 -12.110 3.346 5.710 1.00 0.00 C ATOM 451 NE2 HIS A 445 -11.402 4.041 4.816 1.00 0.00 N ATOM 0 H HIS A 445 -9.302 -0.195 2.958 1.00 0.00 H new ATOM 0 HA HIS A 445 -11.597 -0.530 4.839 1.00 0.00 H new ATOM 0 HB2 HIS A 445 -11.691 0.914 2.146 1.00 0.00 H new ATOM 0 HB3 HIS A 445 -13.098 0.472 3.093 1.00 0.00 H new ATOM 0 HD2 HIS A 445 -10.739 3.438 2.809 1.00 0.00 H new ATOM 0 HE1 HIS A 445 -12.395 3.722 6.682 1.00 0.00 H new ATOM 0 HE2 HIS A 445 -11.041 4.990 4.915 1.00 0.00 H new ATOM 459 N SER A 446 -12.685 -2.115 2.919 1.00 0.00 N ATOM 460 CA SER A 446 -12.990 -3.387 2.190 1.00 0.00 C ATOM 461 C SER A 446 -13.544 -3.080 0.794 1.00 0.00 C ATOM 462 O SER A 446 -12.992 -3.503 -0.205 1.00 0.00 O ATOM 463 CB SER A 446 -14.036 -4.177 2.982 1.00 0.00 C ATOM 464 OG SER A 446 -13.627 -4.265 4.342 1.00 0.00 O ATOM 0 H SER A 446 -13.500 -1.639 3.304 1.00 0.00 H new ATOM 0 HA SER A 446 -12.074 -3.969 2.088 1.00 0.00 H new ATOM 0 HB2 SER A 446 -15.007 -3.687 2.913 1.00 0.00 H new ATOM 0 HB3 SER A 446 -14.152 -5.175 2.560 1.00 0.00 H new ATOM 0 HG SER A 446 -14.295 -4.769 4.853 1.00 0.00 H new ATOM 470 N ASP A 447 -14.636 -2.365 0.715 1.00 0.00 N ATOM 471 CA ASP A 447 -15.233 -2.052 -0.615 1.00 0.00 C ATOM 472 C ASP A 447 -14.265 -1.205 -1.436 1.00 0.00 C ATOM 473 O ASP A 447 -14.068 -1.437 -2.615 1.00 0.00 O ATOM 474 CB ASP A 447 -16.551 -1.280 -0.423 1.00 0.00 C ATOM 475 CG ASP A 447 -16.313 -0.011 0.407 1.00 0.00 C ATOM 476 OD1 ASP A 447 -15.244 0.115 0.979 1.00 0.00 O ATOM 477 OD2 ASP A 447 -17.215 0.811 0.459 1.00 0.00 O ATOM 0 H ASP A 447 -15.140 -1.984 1.516 1.00 0.00 H new ATOM 0 HA ASP A 447 -15.430 -2.985 -1.143 1.00 0.00 H new ATOM 0 HB2 ASP A 447 -16.968 -1.014 -1.394 1.00 0.00 H new ATOM 0 HB3 ASP A 447 -17.283 -1.916 0.075 1.00 0.00 H new ATOM 482 N LEU A 448 -13.667 -0.223 -0.827 1.00 0.00 N ATOM 483 CA LEU A 448 -12.719 0.648 -1.570 1.00 0.00 C ATOM 484 C LEU A 448 -11.524 -0.191 -2.029 1.00 0.00 C ATOM 485 O LEU A 448 -11.074 -0.098 -3.154 1.00 0.00 O ATOM 486 CB LEU A 448 -12.234 1.777 -0.634 1.00 0.00 C ATOM 487 CG LEU A 448 -11.880 3.032 -1.452 1.00 0.00 C ATOM 488 CD1 LEU A 448 -10.882 2.667 -2.562 1.00 0.00 C ATOM 489 CD2 LEU A 448 -13.164 3.630 -2.078 1.00 0.00 C ATOM 0 H LEU A 448 -13.794 0.015 0.157 1.00 0.00 H new ATOM 0 HA LEU A 448 -13.212 1.083 -2.439 1.00 0.00 H new ATOM 0 HB2 LEU A 448 -13.011 2.015 0.093 1.00 0.00 H new ATOM 0 HB3 LEU A 448 -11.362 1.443 -0.071 1.00 0.00 H new ATOM 0 HG LEU A 448 -11.426 3.771 -0.792 1.00 0.00 H new ATOM 0 HD11 LEU A 448 -10.635 3.559 -3.137 1.00 0.00 H new ATOM 0 HD12 LEU A 448 -9.974 2.261 -2.116 1.00 0.00 H new ATOM 0 HD13 LEU A 448 -11.327 1.922 -3.221 1.00 0.00 H new ATOM 0 HD21 LEU A 448 -12.908 4.518 -2.656 1.00 0.00 H new ATOM 0 HD22 LEU A 448 -13.627 2.892 -2.733 1.00 0.00 H new ATOM 0 HD23 LEU A 448 -13.862 3.901 -1.286 1.00 0.00 H new ATOM 501 N GLY A 449 -11.011 -1.000 -1.150 1.00 0.00 N ATOM 502 CA GLY A 449 -9.843 -1.853 -1.498 1.00 0.00 C ATOM 503 C GLY A 449 -10.254 -2.889 -2.542 1.00 0.00 C ATOM 504 O GLY A 449 -9.498 -3.222 -3.434 1.00 0.00 O ATOM 0 H GLY A 449 -11.354 -1.109 -0.195 1.00 0.00 H new ATOM 0 HA2 GLY A 449 -9.032 -1.236 -1.884 1.00 0.00 H new ATOM 0 HA3 GLY A 449 -9.466 -2.352 -0.605 1.00 0.00 H new ATOM 508 N ASP A 450 -11.449 -3.401 -2.428 1.00 0.00 N ATOM 509 CA ASP A 450 -11.936 -4.425 -3.398 1.00 0.00 C ATOM 510 C ASP A 450 -12.029 -3.807 -4.789 1.00 0.00 C ATOM 511 O ASP A 450 -11.777 -4.452 -5.788 1.00 0.00 O ATOM 512 CB ASP A 450 -13.331 -4.905 -2.977 1.00 0.00 C ATOM 513 CG ASP A 450 -13.840 -5.944 -3.978 1.00 0.00 C ATOM 514 OD1 ASP A 450 -13.215 -6.986 -4.090 1.00 0.00 O ATOM 515 OD2 ASP A 450 -14.847 -5.684 -4.617 1.00 0.00 O ATOM 0 H ASP A 450 -12.116 -3.152 -1.697 1.00 0.00 H new ATOM 0 HA ASP A 450 -11.241 -5.265 -3.411 1.00 0.00 H new ATOM 0 HB2 ASP A 450 -13.291 -5.337 -1.977 1.00 0.00 H new ATOM 0 HB3 ASP A 450 -14.019 -4.061 -2.932 1.00 0.00 H new ATOM 520 N HIS A 451 -12.407 -2.564 -4.853 1.00 0.00 N ATOM 521 CA HIS A 451 -12.546 -1.879 -6.169 1.00 0.00 C ATOM 522 C HIS A 451 -11.181 -1.366 -6.629 1.00 0.00 C ATOM 523 O HIS A 451 -11.087 -0.483 -7.458 1.00 0.00 O ATOM 524 CB HIS A 451 -13.519 -0.701 -6.008 1.00 0.00 C ATOM 525 CG HIS A 451 -14.934 -1.219 -5.964 1.00 0.00 C ATOM 526 ND1 HIS A 451 -15.483 -1.796 -4.828 1.00 0.00 N ATOM 527 CD2 HIS A 451 -15.923 -1.247 -6.913 1.00 0.00 C ATOM 528 CE1 HIS A 451 -16.750 -2.143 -5.122 1.00 0.00 C ATOM 529 NE2 HIS A 451 -17.069 -1.830 -6.381 1.00 0.00 N ATOM 0 H HIS A 451 -12.628 -1.986 -4.043 1.00 0.00 H new ATOM 0 HA HIS A 451 -12.929 -2.576 -6.914 1.00 0.00 H new ATOM 0 HB2 HIS A 451 -13.293 -0.152 -5.094 1.00 0.00 H new ATOM 0 HB3 HIS A 451 -13.402 -0.003 -6.837 1.00 0.00 H new ATOM 0 HD1 HIS A 451 -15.012 -1.932 -3.933 1.00 0.00 H new ATOM 0 HD2 HIS A 451 -15.827 -0.873 -7.922 1.00 0.00 H new ATOM 0 HE1 HIS A 451 -17.426 -2.616 -4.425 1.00 0.00 H new ATOM 537 N CYS A 452 -10.123 -1.918 -6.102 1.00 0.00 N ATOM 538 CA CYS A 452 -8.761 -1.467 -6.509 1.00 0.00 C ATOM 539 C CYS A 452 -8.413 -2.071 -7.866 1.00 0.00 C ATOM 540 O CYS A 452 -8.375 -3.272 -8.040 1.00 0.00 O ATOM 541 CB CYS A 452 -7.734 -1.917 -5.464 1.00 0.00 C ATOM 542 SG CYS A 452 -6.063 -1.687 -6.120 1.00 0.00 S ATOM 0 H CYS A 452 -10.142 -2.663 -5.406 1.00 0.00 H new ATOM 0 HA CYS A 452 -8.744 -0.379 -6.580 1.00 0.00 H new ATOM 0 HB2 CYS A 452 -7.858 -1.342 -4.546 1.00 0.00 H new ATOM 0 HB3 CYS A 452 -7.895 -2.964 -5.208 1.00 0.00 H new ATOM 0 HG CYS A 452 -5.940 -0.477 -6.580 1.00 0.00 H new ATOM 548 N ILE A 453 -8.152 -1.230 -8.828 1.00 0.00 N ATOM 549 CA ILE A 453 -7.794 -1.706 -10.197 1.00 0.00 C ATOM 550 C ILE A 453 -6.283 -1.586 -10.385 1.00 0.00 C ATOM 551 O ILE A 453 -5.738 -1.996 -11.390 1.00 0.00 O ATOM 552 CB ILE A 453 -8.518 -0.842 -11.239 1.00 0.00 C ATOM 553 CG1 ILE A 453 -8.189 0.644 -11.024 1.00 0.00 C ATOM 554 CG2 ILE A 453 -10.030 -1.048 -11.102 1.00 0.00 C ATOM 555 CD1 ILE A 453 -8.710 1.459 -12.211 1.00 0.00 C ATOM 0 H ILE A 453 -8.172 -0.216 -8.723 1.00 0.00 H new ATOM 0 HA ILE A 453 -8.095 -2.746 -10.322 1.00 0.00 H new ATOM 0 HB ILE A 453 -8.188 -1.137 -12.235 1.00 0.00 H new ATOM 0 HG12 ILE A 453 -8.644 0.998 -10.099 1.00 0.00 H new ATOM 0 HG13 ILE A 453 -7.112 0.778 -10.922 1.00 0.00 H new ATOM 0 HG21 ILE A 453 -10.549 -0.436 -11.840 1.00 0.00 H new ATOM 0 HG22 ILE A 453 -10.271 -2.098 -11.267 1.00 0.00 H new ATOM 0 HG23 ILE A 453 -10.348 -0.756 -10.101 1.00 0.00 H new ATOM 0 HD11 ILE A 453 -8.477 2.513 -12.059 1.00 0.00 H new ATOM 0 HD12 ILE A 453 -8.235 1.111 -13.128 1.00 0.00 H new ATOM 0 HD13 ILE A 453 -9.790 1.334 -12.292 1.00 0.00 H new ATOM 567 N GLY A 454 -5.608 -1.025 -9.420 1.00 0.00 N ATOM 568 CA GLY A 454 -4.130 -0.870 -9.530 1.00 0.00 C ATOM 569 C GLY A 454 -3.578 -0.245 -8.249 1.00 0.00 C ATOM 570 O GLY A 454 -4.310 0.082 -7.333 1.00 0.00 O ATOM 0 H GLY A 454 -6.018 -0.666 -8.557 1.00 0.00 H new ATOM 0 HA2 GLY A 454 -3.665 -1.841 -9.701 1.00 0.00 H new ATOM 0 HA3 GLY A 454 -3.884 -0.243 -10.387 1.00 0.00 H new ATOM 574 N ALA A 455 -2.287 -0.078 -8.183 1.00 0.00 N ATOM 575 CA ALA A 455 -1.655 0.523 -6.969 1.00 0.00 C ATOM 576 C ALA A 455 -0.513 1.443 -7.379 1.00 0.00 C ATOM 577 O ALA A 455 0.154 1.227 -8.373 1.00 0.00 O ATOM 578 CB ALA A 455 -1.113 -0.589 -6.072 1.00 0.00 C ATOM 0 H ALA A 455 -1.634 -0.334 -8.924 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.404 1.100 -6.426 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -0.652 -0.150 -5.187 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.931 -1.243 -5.769 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -0.369 -1.168 -6.619 1.00 0.00 H new ATOM 584 N LYS A 456 -0.292 2.477 -6.610 1.00 0.00 N ATOM 585 CA LYS A 456 0.800 3.445 -6.923 1.00 0.00 C ATOM 586 C LYS A 456 1.662 3.665 -5.685 1.00 0.00 C ATOM 587 O LYS A 456 1.193 4.091 -4.650 1.00 0.00 O ATOM 588 CB LYS A 456 0.179 4.781 -7.371 1.00 0.00 C ATOM 589 CG LYS A 456 1.153 5.510 -8.296 1.00 0.00 C ATOM 590 CD LYS A 456 0.481 6.752 -8.874 1.00 0.00 C ATOM 591 CE LYS A 456 1.440 7.434 -9.849 1.00 0.00 C ATOM 592 NZ LYS A 456 1.706 6.526 -11.002 1.00 0.00 N ATOM 0 H LYS A 456 -0.828 2.694 -5.769 1.00 0.00 H new ATOM 0 HA LYS A 456 1.424 3.047 -7.723 1.00 0.00 H new ATOM 0 HB2 LYS A 456 -0.764 4.601 -7.887 1.00 0.00 H new ATOM 0 HB3 LYS A 456 -0.046 5.399 -6.502 1.00 0.00 H new ATOM 0 HG2 LYS A 456 2.050 5.793 -7.745 1.00 0.00 H new ATOM 0 HG3 LYS A 456 1.469 4.848 -9.102 1.00 0.00 H new ATOM 0 HD2 LYS A 456 -0.441 6.476 -9.385 1.00 0.00 H new ATOM 0 HD3 LYS A 456 0.208 7.439 -8.073 1.00 0.00 H new ATOM 0 HE2 LYS A 456 1.011 8.372 -10.202 1.00 0.00 H new ATOM 0 HE3 LYS A 456 2.374 7.681 -9.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 456 2.030 7.085 -11.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 456 2.441 5.838 -10.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 456 0.833 6.020 -11.254 1.00 0.00 H new ATOM 606 N VAL A 457 2.930 3.381 -5.806 1.00 0.00 N ATOM 607 CA VAL A 457 3.879 3.561 -4.666 1.00 0.00 C ATOM 608 C VAL A 457 4.987 4.534 -5.072 1.00 0.00 C ATOM 609 O VAL A 457 5.581 4.424 -6.128 1.00 0.00 O ATOM 610 CB VAL A 457 4.488 2.205 -4.298 1.00 0.00 C ATOM 611 CG1 VAL A 457 5.629 2.410 -3.299 1.00 0.00 C ATOM 612 CG2 VAL A 457 3.408 1.323 -3.663 1.00 0.00 C ATOM 0 H VAL A 457 3.357 3.025 -6.661 1.00 0.00 H new ATOM 0 HA VAL A 457 3.347 3.965 -3.805 1.00 0.00 H new ATOM 0 HB VAL A 457 4.876 1.723 -5.196 1.00 0.00 H new ATOM 0 HG11 VAL A 457 6.062 1.444 -3.038 1.00 0.00 H new ATOM 0 HG12 VAL A 457 6.396 3.042 -3.747 1.00 0.00 H new ATOM 0 HG13 VAL A 457 5.243 2.890 -2.400 1.00 0.00 H new ATOM 0 HG21 VAL A 457 3.837 0.356 -3.399 1.00 0.00 H new ATOM 0 HG22 VAL A 457 3.024 1.807 -2.765 1.00 0.00 H new ATOM 0 HG23 VAL A 457 2.594 1.177 -4.373 1.00 0.00 H new ATOM 622 N ASN A 458 5.260 5.484 -4.221 1.00 0.00 N ATOM 623 CA ASN A 458 6.322 6.494 -4.497 1.00 0.00 C ATOM 624 C ASN A 458 6.052 7.173 -5.839 1.00 0.00 C ATOM 625 O ASN A 458 6.945 7.376 -6.643 1.00 0.00 O ATOM 626 CB ASN A 458 7.697 5.813 -4.493 1.00 0.00 C ATOM 627 CG ASN A 458 8.797 6.876 -4.407 1.00 0.00 C ATOM 628 OD1 ASN A 458 9.698 6.796 -3.465 1.00 0.00 O flip ATOM 629 ND2 ASN A 458 8.836 7.794 -5.205 1.00 0.00 N flip ATOM 0 H ASN A 458 4.782 5.606 -3.328 1.00 0.00 H new ATOM 0 HA ASN A 458 6.314 7.257 -3.718 1.00 0.00 H new ATOM 0 HB2 ASN A 458 7.772 5.128 -3.648 1.00 0.00 H new ATOM 0 HB3 ASN A 458 7.822 5.218 -5.398 1.00 0.00 H new ATOM 0 HD21 ASN A 458 8.134 7.859 -5.942 1.00 0.00 H new ATOM 0 HD22 ASN A 458 9.571 8.498 -5.137 1.00 0.00 H new ATOM 636 N HIS A 459 4.814 7.527 -6.074 1.00 0.00 N ATOM 637 CA HIS A 459 4.427 8.204 -7.344 1.00 0.00 C ATOM 638 C HIS A 459 4.828 7.339 -8.533 1.00 0.00 C ATOM 639 O HIS A 459 4.853 7.792 -9.660 1.00 0.00 O ATOM 640 CB HIS A 459 5.108 9.573 -7.432 1.00 0.00 C ATOM 641 CG HIS A 459 4.599 10.451 -6.320 1.00 0.00 C ATOM 642 ND1 HIS A 459 3.318 10.985 -6.326 1.00 0.00 N ATOM 643 CD2 HIS A 459 5.187 10.901 -5.165 1.00 0.00 C ATOM 644 CE1 HIS A 459 3.180 11.719 -5.206 1.00 0.00 C ATOM 645 NE2 HIS A 459 4.290 11.700 -4.463 1.00 0.00 N ATOM 0 H HIS A 459 4.042 7.371 -5.425 1.00 0.00 H new ATOM 0 HA HIS A 459 3.347 8.347 -7.360 1.00 0.00 H new ATOM 0 HB2 HIS A 459 6.190 9.460 -7.356 1.00 0.00 H new ATOM 0 HB3 HIS A 459 4.902 10.033 -8.398 1.00 0.00 H new ATOM 0 HD2 HIS A 459 6.193 10.670 -4.849 1.00 0.00 H new ATOM 0 HE1 HIS A 459 2.282 12.257 -4.941 1.00 0.00 H new ATOM 0 HE2 HIS A 459 4.446 12.171 -3.572 1.00 0.00 H new ATOM 653 N LYS A 460 5.132 6.090 -8.285 1.00 0.00 N ATOM 654 CA LYS A 460 5.527 5.162 -9.391 1.00 0.00 C ATOM 655 C LYS A 460 4.528 4.012 -9.483 1.00 0.00 C ATOM 656 O LYS A 460 4.135 3.423 -8.494 1.00 0.00 O ATOM 657 CB LYS A 460 6.927 4.609 -9.121 1.00 0.00 C ATOM 658 CG LYS A 460 7.484 3.989 -10.406 1.00 0.00 C ATOM 659 CD LYS A 460 8.950 3.595 -10.204 1.00 0.00 C ATOM 660 CE LYS A 460 9.047 2.408 -9.239 1.00 0.00 C ATOM 661 NZ LYS A 460 10.390 1.778 -9.357 1.00 0.00 N ATOM 0 H LYS A 460 5.124 5.669 -7.356 1.00 0.00 H new ATOM 0 HA LYS A 460 5.530 5.708 -10.334 1.00 0.00 H new ATOM 0 HB2 LYS A 460 7.584 5.406 -8.774 1.00 0.00 H new ATOM 0 HB3 LYS A 460 6.888 3.860 -8.330 1.00 0.00 H new ATOM 0 HG2 LYS A 460 6.898 3.112 -10.680 1.00 0.00 H new ATOM 0 HG3 LYS A 460 7.400 4.699 -11.229 1.00 0.00 H new ATOM 0 HD2 LYS A 460 9.400 3.333 -11.162 1.00 0.00 H new ATOM 0 HD3 LYS A 460 9.511 4.442 -9.809 1.00 0.00 H new ATOM 0 HE2 LYS A 460 8.880 2.744 -8.215 1.00 0.00 H new ATOM 0 HE3 LYS A 460 8.270 1.678 -9.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 10.455 0.973 -8.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 10.532 1.444 -10.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 11.123 2.477 -9.120 1.00 0.00 H new ATOM 675 N LEU A 461 4.115 3.702 -10.678 1.00 0.00 N ATOM 676 CA LEU A 461 3.132 2.606 -10.885 1.00 0.00 C ATOM 677 C LEU A 461 3.769 1.264 -10.554 1.00 0.00 C ATOM 678 O LEU A 461 4.875 0.964 -10.962 1.00 0.00 O ATOM 679 CB LEU A 461 2.655 2.611 -12.347 1.00 0.00 C ATOM 680 CG LEU A 461 1.696 1.434 -12.594 1.00 0.00 C ATOM 681 CD1 LEU A 461 0.518 1.500 -11.609 1.00 0.00 C ATOM 682 CD2 LEU A 461 1.167 1.497 -14.032 1.00 0.00 C ATOM 0 H LEU A 461 4.421 4.168 -11.532 1.00 0.00 H new ATOM 0 HA LEU A 461 2.278 2.763 -10.226 1.00 0.00 H new ATOM 0 HB2 LEU A 461 2.153 3.552 -12.571 1.00 0.00 H new ATOM 0 HB3 LEU A 461 3.511 2.539 -13.017 1.00 0.00 H new ATOM 0 HG LEU A 461 2.234 0.498 -12.444 1.00 0.00 H new ATOM 0 HD11 LEU A 461 -0.156 0.663 -11.791 1.00 0.00 H new ATOM 0 HD12 LEU A 461 0.894 1.447 -10.587 1.00 0.00 H new ATOM 0 HD13 LEU A 461 -0.021 2.437 -11.749 1.00 0.00 H new ATOM 0 HD21 LEU A 461 0.488 0.663 -14.207 1.00 0.00 H new ATOM 0 HD22 LEU A 461 0.635 2.436 -14.183 1.00 0.00 H new ATOM 0 HD23 LEU A 461 2.002 1.437 -14.730 1.00 0.00 H new ATOM 694 N VAL A 462 3.063 0.447 -9.821 1.00 0.00 N ATOM 695 CA VAL A 462 3.596 -0.895 -9.454 1.00 0.00 C ATOM 696 C VAL A 462 2.447 -1.909 -9.385 1.00 0.00 C ATOM 697 O VAL A 462 1.323 -1.561 -9.075 1.00 0.00 O ATOM 698 CB VAL A 462 4.290 -0.822 -8.090 1.00 0.00 C ATOM 699 CG1 VAL A 462 5.661 -0.170 -8.263 1.00 0.00 C ATOM 700 CG2 VAL A 462 3.451 0.009 -7.113 1.00 0.00 C ATOM 0 H VAL A 462 2.132 0.654 -9.458 1.00 0.00 H new ATOM 0 HA VAL A 462 4.314 -1.211 -10.211 1.00 0.00 H new ATOM 0 HB VAL A 462 4.403 -1.830 -7.690 1.00 0.00 H new ATOM 0 HG11 VAL A 462 6.162 -0.114 -7.297 1.00 0.00 H new ATOM 0 HG12 VAL A 462 6.263 -0.765 -8.950 1.00 0.00 H new ATOM 0 HG13 VAL A 462 5.538 0.835 -8.666 1.00 0.00 H new ATOM 0 HG21 VAL A 462 3.955 0.053 -6.147 1.00 0.00 H new ATOM 0 HG22 VAL A 462 3.329 1.019 -7.506 1.00 0.00 H new ATOM 0 HG23 VAL A 462 2.471 -0.453 -6.990 1.00 0.00 H new ATOM 710 N PRO A 463 2.730 -3.160 -9.668 1.00 0.00 N ATOM 711 CA PRO A 463 1.707 -4.245 -9.625 1.00 0.00 C ATOM 712 C PRO A 463 1.194 -4.522 -8.209 1.00 0.00 C ATOM 713 O PRO A 463 1.790 -4.129 -7.226 1.00 0.00 O ATOM 714 CB PRO A 463 2.435 -5.473 -10.202 1.00 0.00 C ATOM 715 CG PRO A 463 3.896 -5.194 -10.021 1.00 0.00 C ATOM 716 CD PRO A 463 4.056 -3.676 -10.062 1.00 0.00 C ATOM 0 HA PRO A 463 0.815 -3.973 -10.189 1.00 0.00 H new ATOM 0 HB2 PRO A 463 2.142 -6.384 -9.680 1.00 0.00 H new ATOM 0 HB3 PRO A 463 2.190 -5.616 -11.255 1.00 0.00 H new ATOM 0 HG2 PRO A 463 4.253 -5.596 -9.073 1.00 0.00 H new ATOM 0 HG3 PRO A 463 4.482 -5.667 -10.809 1.00 0.00 H new ATOM 0 HD2 PRO A 463 4.834 -3.339 -9.377 1.00 0.00 H new ATOM 0 HD3 PRO A 463 4.337 -3.332 -11.057 1.00 0.00 H new ATOM 724 N LEU A 464 0.082 -5.194 -8.117 1.00 0.00 N ATOM 725 CA LEU A 464 -0.515 -5.516 -6.790 1.00 0.00 C ATOM 726 C LEU A 464 0.442 -6.411 -5.997 1.00 0.00 C ATOM 727 O LEU A 464 0.595 -6.263 -4.800 1.00 0.00 O ATOM 728 CB LEU A 464 -1.844 -6.261 -7.004 1.00 0.00 C ATOM 729 CG LEU A 464 -2.954 -5.259 -7.335 1.00 0.00 C ATOM 730 CD1 LEU A 464 -2.641 -4.559 -8.661 1.00 0.00 C ATOM 731 CD2 LEU A 464 -4.291 -5.999 -7.451 1.00 0.00 C ATOM 0 H LEU A 464 -0.448 -5.540 -8.917 1.00 0.00 H new ATOM 0 HA LEU A 464 -0.690 -4.594 -6.236 1.00 0.00 H new ATOM 0 HB2 LEU A 464 -1.740 -6.983 -7.814 1.00 0.00 H new ATOM 0 HB3 LEU A 464 -2.105 -6.823 -6.107 1.00 0.00 H new ATOM 0 HG LEU A 464 -3.016 -4.515 -6.541 1.00 0.00 H new ATOM 0 HD11 LEU A 464 -3.433 -3.847 -8.893 1.00 0.00 H new ATOM 0 HD12 LEU A 464 -1.691 -4.031 -8.578 1.00 0.00 H new ATOM 0 HD13 LEU A 464 -2.575 -5.300 -9.457 1.00 0.00 H new ATOM 0 HD21 LEU A 464 -5.082 -5.287 -7.687 1.00 0.00 H new ATOM 0 HD22 LEU A 464 -4.227 -6.745 -8.243 1.00 0.00 H new ATOM 0 HD23 LEU A 464 -4.517 -6.492 -6.506 1.00 0.00 H new ATOM 743 N SER A 465 1.064 -7.348 -6.655 1.00 0.00 N ATOM 744 CA SER A 465 1.998 -8.274 -5.953 1.00 0.00 C ATOM 745 C SER A 465 3.310 -7.549 -5.649 1.00 0.00 C ATOM 746 O SER A 465 4.274 -8.144 -5.207 1.00 0.00 O ATOM 747 CB SER A 465 2.265 -9.487 -6.852 1.00 0.00 C ATOM 748 OG SER A 465 2.775 -10.551 -6.065 1.00 0.00 O ATOM 0 H SER A 465 0.965 -7.514 -7.657 1.00 0.00 H new ATOM 0 HA SER A 465 1.555 -8.606 -5.014 1.00 0.00 H new ATOM 0 HB2 SER A 465 1.345 -9.795 -7.349 1.00 0.00 H new ATOM 0 HB3 SER A 465 2.977 -9.224 -7.634 1.00 0.00 H new ATOM 0 HG SER A 465 3.459 -10.207 -5.454 1.00 0.00 H new ATOM 754 N TYR A 466 3.346 -6.267 -5.879 1.00 0.00 N ATOM 755 CA TYR A 466 4.585 -5.480 -5.610 1.00 0.00 C ATOM 756 C TYR A 466 4.838 -5.417 -4.103 1.00 0.00 C ATOM 757 O TYR A 466 3.945 -5.173 -3.316 1.00 0.00 O ATOM 758 CB TYR A 466 4.414 -4.065 -6.171 1.00 0.00 C ATOM 759 CG TYR A 466 5.669 -3.263 -5.921 1.00 0.00 C ATOM 760 CD1 TYR A 466 6.787 -3.433 -6.750 1.00 0.00 C ATOM 761 CD2 TYR A 466 5.717 -2.350 -4.863 1.00 0.00 C ATOM 762 CE1 TYR A 466 7.950 -2.689 -6.516 1.00 0.00 C ATOM 763 CE2 TYR A 466 6.879 -1.605 -4.631 1.00 0.00 C ATOM 764 CZ TYR A 466 7.996 -1.775 -5.457 1.00 0.00 C ATOM 765 OH TYR A 466 9.141 -1.040 -5.227 1.00 0.00 O ATOM 0 H TYR A 466 2.564 -5.724 -6.245 1.00 0.00 H new ATOM 0 HA TYR A 466 5.437 -5.960 -6.091 1.00 0.00 H new ATOM 0 HB2 TYR A 466 4.207 -4.110 -7.240 1.00 0.00 H new ATOM 0 HB3 TYR A 466 3.560 -3.578 -5.701 1.00 0.00 H new ATOM 0 HD1 TYR A 466 6.751 -4.137 -7.568 1.00 0.00 H new ATOM 0 HD2 TYR A 466 4.856 -2.219 -4.224 1.00 0.00 H new ATOM 0 HE1 TYR A 466 8.812 -2.821 -7.153 1.00 0.00 H new ATOM 0 HE2 TYR A 466 6.914 -0.899 -3.815 1.00 0.00 H new ATOM 0 HH TYR A 466 9.003 -0.453 -4.455 1.00 0.00 H new ATOM 775 N VAL A 467 6.059 -5.646 -3.705 1.00 0.00 N ATOM 776 CA VAL A 467 6.408 -5.621 -2.255 1.00 0.00 C ATOM 777 C VAL A 467 6.561 -4.176 -1.781 1.00 0.00 C ATOM 778 O VAL A 467 7.246 -3.374 -2.384 1.00 0.00 O ATOM 779 CB VAL A 467 7.715 -6.386 -2.029 1.00 0.00 C ATOM 780 CG1 VAL A 467 8.133 -6.254 -0.566 1.00 0.00 C ATOM 781 CG2 VAL A 467 7.502 -7.866 -2.364 1.00 0.00 C ATOM 0 H VAL A 467 6.839 -5.852 -4.329 1.00 0.00 H new ATOM 0 HA VAL A 467 5.610 -6.097 -1.685 1.00 0.00 H new ATOM 0 HB VAL A 467 8.494 -5.974 -2.670 1.00 0.00 H new ATOM 0 HG11 VAL A 467 9.063 -6.798 -0.403 1.00 0.00 H new ATOM 0 HG12 VAL A 467 8.281 -5.202 -0.323 1.00 0.00 H new ATOM 0 HG13 VAL A 467 7.354 -6.668 0.074 1.00 0.00 H new ATOM 0 HG21 VAL A 467 8.431 -8.413 -2.204 1.00 0.00 H new ATOM 0 HG22 VAL A 467 6.724 -8.276 -1.720 1.00 0.00 H new ATOM 0 HG23 VAL A 467 7.199 -7.963 -3.407 1.00 0.00 H new ATOM 791 N LEU A 468 5.912 -3.852 -0.699 1.00 0.00 N ATOM 792 CA LEU A 468 5.974 -2.467 -0.148 1.00 0.00 C ATOM 793 C LEU A 468 7.307 -2.238 0.554 1.00 0.00 C ATOM 794 O LEU A 468 7.855 -3.121 1.180 1.00 0.00 O ATOM 795 CB LEU A 468 4.833 -2.267 0.855 1.00 0.00 C ATOM 796 CG LEU A 468 3.487 -2.552 0.176 1.00 0.00 C ATOM 797 CD1 LEU A 468 2.359 -2.400 1.203 1.00 0.00 C ATOM 798 CD2 LEU A 468 3.265 -1.565 -0.982 1.00 0.00 C ATOM 0 H LEU A 468 5.332 -4.497 -0.163 1.00 0.00 H new ATOM 0 HA LEU A 468 5.877 -1.755 -0.968 1.00 0.00 H new ATOM 0 HB2 LEU A 468 4.967 -2.931 1.709 1.00 0.00 H new ATOM 0 HB3 LEU A 468 4.848 -1.247 1.238 1.00 0.00 H new ATOM 0 HG LEU A 468 3.490 -3.568 -0.218 1.00 0.00 H new ATOM 0 HD11 LEU A 468 1.401 -2.602 0.724 1.00 0.00 H new ATOM 0 HD12 LEU A 468 2.512 -3.106 2.019 1.00 0.00 H new ATOM 0 HD13 LEU A 468 2.360 -1.384 1.597 1.00 0.00 H new ATOM 0 HD21 LEU A 468 2.307 -1.773 -1.459 1.00 0.00 H new ATOM 0 HD22 LEU A 468 3.264 -0.546 -0.596 1.00 0.00 H new ATOM 0 HD23 LEU A 468 4.066 -1.675 -1.713 1.00 0.00 H new ATOM 810 N ASN A 469 7.825 -1.041 0.448 1.00 0.00 N ATOM 811 CA ASN A 469 9.132 -0.702 1.096 1.00 0.00 C ATOM 812 C ASN A 469 8.923 0.353 2.179 1.00 0.00 C ATOM 813 O ASN A 469 8.087 1.228 2.070 1.00 0.00 O ATOM 814 CB ASN A 469 10.095 -0.160 0.041 1.00 0.00 C ATOM 815 CG ASN A 469 10.437 -1.268 -0.959 1.00 0.00 C ATOM 816 OD1 ASN A 469 10.134 -2.504 -0.677 1.00 0.00 O flip ATOM 817 ND2 ASN A 469 10.984 -1.003 -2.013 1.00 0.00 N flip ATOM 0 H ASN A 469 7.394 -0.273 -0.066 1.00 0.00 H new ATOM 0 HA ASN A 469 9.548 -1.601 1.550 1.00 0.00 H new ATOM 0 HB2 ASN A 469 9.644 0.686 -0.478 1.00 0.00 H new ATOM 0 HB3 ASN A 469 11.004 0.207 0.518 1.00 0.00 H new ATOM 0 HD21 ASN A 469 11.222 -0.036 -2.235 1.00 0.00 H new ATOM 0 HD22 ASN A 469 11.205 -1.748 -2.674 1.00 0.00 H new ATOM 824 N SER A 470 9.691 0.260 3.226 1.00 0.00 N ATOM 825 CA SER A 470 9.577 1.227 4.353 1.00 0.00 C ATOM 826 C SER A 470 9.988 2.625 3.900 1.00 0.00 C ATOM 827 O SER A 470 10.939 2.807 3.167 1.00 0.00 O ATOM 828 CB SER A 470 10.486 0.782 5.502 1.00 0.00 C ATOM 829 OG SER A 470 10.436 1.752 6.540 1.00 0.00 O ATOM 0 H SER A 470 10.405 -0.457 3.351 1.00 0.00 H new ATOM 0 HA SER A 470 8.540 1.253 4.688 1.00 0.00 H new ATOM 0 HB2 SER A 470 10.166 -0.189 5.880 1.00 0.00 H new ATOM 0 HB3 SER A 470 11.510 0.664 5.147 1.00 0.00 H new ATOM 0 HG SER A 470 11.015 1.471 7.279 1.00 0.00 H new ATOM 835 N GLY A 471 9.270 3.614 4.354 1.00 0.00 N ATOM 836 CA GLY A 471 9.584 5.026 3.992 1.00 0.00 C ATOM 837 C GLY A 471 8.780 5.428 2.756 1.00 0.00 C ATOM 838 O GLY A 471 8.397 6.569 2.598 1.00 0.00 O ATOM 0 H GLY A 471 8.465 3.502 4.971 1.00 0.00 H new ATOM 0 HA2 GLY A 471 9.345 5.687 4.825 1.00 0.00 H new ATOM 0 HA3 GLY A 471 10.651 5.133 3.795 1.00 0.00 H new ATOM 842 N ASP A 472 8.535 4.494 1.876 1.00 0.00 N ATOM 843 CA ASP A 472 7.772 4.804 0.630 1.00 0.00 C ATOM 844 C ASP A 472 6.286 4.975 0.930 1.00 0.00 C ATOM 845 O ASP A 472 5.724 4.312 1.779 1.00 0.00 O ATOM 846 CB ASP A 472 7.956 3.670 -0.383 1.00 0.00 C ATOM 847 CG ASP A 472 9.376 3.711 -0.954 1.00 0.00 C ATOM 848 OD1 ASP A 472 10.046 4.711 -0.754 1.00 0.00 O ATOM 849 OD2 ASP A 472 9.765 2.745 -1.587 1.00 0.00 O ATOM 0 H ASP A 472 8.833 3.523 1.967 1.00 0.00 H new ATOM 0 HA ASP A 472 8.155 5.737 0.217 1.00 0.00 H new ATOM 0 HB2 ASP A 472 7.775 2.708 0.097 1.00 0.00 H new ATOM 0 HB3 ASP A 472 7.227 3.767 -1.188 1.00 0.00 H new ATOM 854 N GLN A 473 5.652 5.862 0.216 1.00 0.00 N ATOM 855 CA GLN A 473 4.198 6.111 0.415 1.00 0.00 C ATOM 856 C GLN A 473 3.399 5.134 -0.439 1.00 0.00 C ATOM 857 O GLN A 473 3.795 4.772 -1.527 1.00 0.00 O ATOM 858 CB GLN A 473 3.864 7.549 0.005 1.00 0.00 C ATOM 859 CG GLN A 473 2.394 7.838 0.313 1.00 0.00 C ATOM 860 CD GLN A 473 2.046 9.266 -0.105 1.00 0.00 C ATOM 861 OE1 GLN A 473 2.427 9.711 -1.171 1.00 0.00 O ATOM 862 NE2 GLN A 473 1.330 10.009 0.692 1.00 0.00 N ATOM 0 H GLN A 473 6.087 6.434 -0.508 1.00 0.00 H new ATOM 0 HA GLN A 473 3.942 5.969 1.465 1.00 0.00 H new ATOM 0 HB2 GLN A 473 4.504 8.250 0.542 1.00 0.00 H new ATOM 0 HB3 GLN A 473 4.059 7.690 -1.058 1.00 0.00 H new ATOM 0 HG2 GLN A 473 1.757 7.129 -0.216 1.00 0.00 H new ATOM 0 HG3 GLN A 473 2.204 7.705 1.378 1.00 0.00 H new ATOM 0 HE21 GLN A 473 1.010 9.637 1.586 1.00 0.00 H new ATOM 0 HE22 GLN A 473 1.090 10.963 0.421 1.00 0.00 H new ATOM 871 N VAL A 474 2.275 4.702 0.066 1.00 0.00 N ATOM 872 CA VAL A 474 1.420 3.729 -0.680 1.00 0.00 C ATOM 873 C VAL A 474 0.058 4.343 -0.969 1.00 0.00 C ATOM 874 O VAL A 474 -0.588 4.907 -0.109 1.00 0.00 O ATOM 875 CB VAL A 474 1.243 2.464 0.156 1.00 0.00 C ATOM 876 CG1 VAL A 474 0.407 1.457 -0.631 1.00 0.00 C ATOM 877 CG2 VAL A 474 2.619 1.863 0.458 1.00 0.00 C ATOM 0 H VAL A 474 1.907 4.984 0.974 1.00 0.00 H new ATOM 0 HA VAL A 474 1.904 3.480 -1.624 1.00 0.00 H new ATOM 0 HB VAL A 474 0.738 2.705 1.092 1.00 0.00 H new ATOM 0 HG11 VAL A 474 0.277 0.551 -0.039 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -0.569 1.889 -0.853 1.00 0.00 H new ATOM 0 HG13 VAL A 474 0.916 1.212 -1.563 1.00 0.00 H new ATOM 0 HG21 VAL A 474 2.498 0.959 1.055 1.00 0.00 H new ATOM 0 HG22 VAL A 474 3.121 1.616 -0.477 1.00 0.00 H new ATOM 0 HG23 VAL A 474 3.218 2.586 1.011 1.00 0.00 H new ATOM 887 N GLU A 475 -0.378 4.219 -2.190 1.00 0.00 N ATOM 888 CA GLU A 475 -1.702 4.770 -2.594 1.00 0.00 C ATOM 889 C GLU A 475 -2.439 3.739 -3.448 1.00 0.00 C ATOM 890 O GLU A 475 -1.852 3.052 -4.259 1.00 0.00 O ATOM 891 CB GLU A 475 -1.496 6.055 -3.396 1.00 0.00 C ATOM 892 CG GLU A 475 -2.861 6.646 -3.751 1.00 0.00 C ATOM 893 CD GLU A 475 -2.683 7.978 -4.481 1.00 0.00 C ATOM 894 OE1 GLU A 475 -1.569 8.270 -4.882 1.00 0.00 O ATOM 895 OE2 GLU A 475 -3.668 8.683 -4.630 1.00 0.00 O ATOM 0 H GLU A 475 0.135 3.752 -2.938 1.00 0.00 H new ATOM 0 HA GLU A 475 -2.294 4.993 -1.706 1.00 0.00 H new ATOM 0 HB2 GLU A 475 -0.915 6.772 -2.816 1.00 0.00 H new ATOM 0 HB3 GLU A 475 -0.929 5.846 -4.303 1.00 0.00 H new ATOM 0 HG2 GLU A 475 -3.415 5.949 -4.380 1.00 0.00 H new ATOM 0 HG3 GLU A 475 -3.448 6.795 -2.845 1.00 0.00 H new ATOM 902 N VAL A 476 -3.729 3.636 -3.260 1.00 0.00 N ATOM 903 CA VAL A 476 -4.550 2.655 -4.039 1.00 0.00 C ATOM 904 C VAL A 476 -5.449 3.393 -5.023 1.00 0.00 C ATOM 905 O VAL A 476 -6.125 4.343 -4.685 1.00 0.00 O ATOM 906 CB VAL A 476 -5.408 1.824 -3.080 1.00 0.00 C ATOM 907 CG1 VAL A 476 -4.502 0.883 -2.283 1.00 0.00 C ATOM 908 CG2 VAL A 476 -6.164 2.740 -2.110 1.00 0.00 C ATOM 0 H VAL A 476 -4.257 4.196 -2.591 1.00 0.00 H new ATOM 0 HA VAL A 476 -3.883 1.994 -4.593 1.00 0.00 H new ATOM 0 HB VAL A 476 -6.131 1.248 -3.658 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.107 0.289 -1.598 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -3.973 0.221 -2.968 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -3.780 1.469 -1.714 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -6.769 2.135 -1.435 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -5.450 3.325 -1.531 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -6.811 3.412 -2.674 1.00 0.00 H new ATOM 918 N LEU A 477 -5.450 2.949 -6.251 1.00 0.00 N ATOM 919 CA LEU A 477 -6.287 3.596 -7.305 1.00 0.00 C ATOM 920 C LEU A 477 -7.569 2.797 -7.504 1.00 0.00 C ATOM 921 O LEU A 477 -7.548 1.593 -7.657 1.00 0.00 O ATOM 922 CB LEU A 477 -5.509 3.633 -8.623 1.00 0.00 C ATOM 923 CG LEU A 477 -4.172 4.352 -8.415 1.00 0.00 C ATOM 924 CD1 LEU A 477 -3.388 4.359 -9.731 1.00 0.00 C ATOM 925 CD2 LEU A 477 -4.426 5.798 -7.959 1.00 0.00 C ATOM 0 H LEU A 477 -4.899 2.154 -6.574 1.00 0.00 H new ATOM 0 HA LEU A 477 -6.534 4.611 -6.994 1.00 0.00 H new ATOM 0 HB2 LEU A 477 -5.335 2.619 -8.982 1.00 0.00 H new ATOM 0 HB3 LEU A 477 -6.093 4.146 -9.387 1.00 0.00 H new ATOM 0 HG LEU A 477 -3.596 3.831 -7.650 1.00 0.00 H new ATOM 0 HD11 LEU A 477 -2.436 4.870 -9.585 1.00 0.00 H new ATOM 0 HD12 LEU A 477 -3.204 3.333 -10.050 1.00 0.00 H new ATOM 0 HD13 LEU A 477 -3.965 4.879 -10.496 1.00 0.00 H new ATOM 0 HD21 LEU A 477 -3.473 6.306 -7.812 1.00 0.00 H new ATOM 0 HD22 LEU A 477 -5.004 6.323 -8.720 1.00 0.00 H new ATOM 0 HD23 LEU A 477 -4.982 5.792 -7.021 1.00 0.00 H new ATOM 937 N SER A 478 -8.685 3.473 -7.507 1.00 0.00 N ATOM 938 CA SER A 478 -9.997 2.785 -7.703 1.00 0.00 C ATOM 939 C SER A 478 -10.828 3.554 -8.728 1.00 0.00 C ATOM 940 O SER A 478 -10.975 4.758 -8.655 1.00 0.00 O ATOM 941 CB SER A 478 -10.741 2.725 -6.372 1.00 0.00 C ATOM 942 OG SER A 478 -11.995 2.089 -6.571 1.00 0.00 O ATOM 0 H SER A 478 -8.746 4.483 -7.381 1.00 0.00 H new ATOM 0 HA SER A 478 -9.829 1.772 -8.067 1.00 0.00 H new ATOM 0 HB2 SER A 478 -10.153 2.176 -5.637 1.00 0.00 H new ATOM 0 HB3 SER A 478 -10.887 3.730 -5.977 1.00 0.00 H new ATOM 0 HG SER A 478 -11.858 1.229 -7.020 1.00 0.00 H new ATOM 948 N SER A 479 -11.373 2.851 -9.680 1.00 0.00 N ATOM 949 CA SER A 479 -12.209 3.499 -10.733 1.00 0.00 C ATOM 950 C SER A 479 -13.680 3.424 -10.320 1.00 0.00 C ATOM 951 O SER A 479 -14.556 3.891 -11.024 1.00 0.00 O ATOM 952 CB SER A 479 -12.001 2.768 -12.060 1.00 0.00 C ATOM 953 OG SER A 479 -13.069 3.085 -12.940 1.00 0.00 O ATOM 0 H SER A 479 -11.274 1.840 -9.776 1.00 0.00 H new ATOM 0 HA SER A 479 -11.921 4.544 -10.850 1.00 0.00 H new ATOM 0 HB2 SER A 479 -11.049 3.059 -12.504 1.00 0.00 H new ATOM 0 HB3 SER A 479 -11.959 1.692 -11.893 1.00 0.00 H new ATOM 0 HG SER A 479 -13.634 3.775 -12.533 1.00 0.00 H new ATOM 959 N LYS A 480 -13.947 2.834 -9.184 1.00 0.00 N ATOM 960 CA LYS A 480 -15.351 2.711 -8.692 1.00 0.00 C ATOM 961 C LYS A 480 -16.205 2.004 -9.745 1.00 0.00 C ATOM 962 O LYS A 480 -17.314 2.407 -10.041 1.00 0.00 O ATOM 963 CB LYS A 480 -15.919 4.102 -8.388 1.00 0.00 C ATOM 964 CG LYS A 480 -15.191 4.693 -7.173 1.00 0.00 C ATOM 965 CD LYS A 480 -15.740 6.093 -6.877 1.00 0.00 C ATOM 966 CE LYS A 480 -14.965 6.715 -5.711 1.00 0.00 C ATOM 967 NZ LYS A 480 -15.241 5.947 -4.463 1.00 0.00 N ATOM 0 H LYS A 480 -13.243 2.427 -8.569 1.00 0.00 H new ATOM 0 HA LYS A 480 -15.364 2.121 -7.775 1.00 0.00 H new ATOM 0 HB2 LYS A 480 -15.796 4.754 -9.253 1.00 0.00 H new ATOM 0 HB3 LYS A 480 -16.988 4.035 -8.188 1.00 0.00 H new ATOM 0 HG2 LYS A 480 -15.326 4.047 -6.305 1.00 0.00 H new ATOM 0 HG3 LYS A 480 -14.120 4.745 -7.368 1.00 0.00 H new ATOM 0 HD2 LYS A 480 -15.652 6.723 -7.762 1.00 0.00 H new ATOM 0 HD3 LYS A 480 -16.800 6.034 -6.631 1.00 0.00 H new ATOM 0 HE2 LYS A 480 -13.896 6.708 -5.926 1.00 0.00 H new ATOM 0 HE3 LYS A 480 -15.257 7.757 -5.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 480 -14.947 6.508 -3.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 480 -16.259 5.743 -4.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 480 -14.709 5.053 -4.481 1.00 0.00 H new ATOM 981 N SER A 481 -15.686 0.947 -10.305 1.00 0.00 N ATOM 982 CA SER A 481 -16.434 0.185 -11.346 1.00 0.00 C ATOM 983 C SER A 481 -17.760 -0.323 -10.785 1.00 0.00 C ATOM 984 O SER A 481 -18.351 0.272 -9.904 1.00 0.00 O ATOM 985 CB SER A 481 -15.598 -1.017 -11.794 1.00 0.00 C ATOM 986 OG SER A 481 -14.282 -0.585 -12.114 1.00 0.00 O ATOM 0 H SER A 481 -14.763 0.573 -10.083 1.00 0.00 H new ATOM 0 HA SER A 481 -16.629 0.847 -12.189 1.00 0.00 H new ATOM 0 HB2 SER A 481 -15.564 -1.766 -11.002 1.00 0.00 H new ATOM 0 HB3 SER A 481 -16.058 -1.491 -12.661 1.00 0.00 H new ATOM 0 HG SER A 481 -13.746 -1.354 -12.399 1.00 0.00 H new ATOM 992 N LEU A 482 -18.229 -1.418 -11.310 1.00 0.00 N ATOM 993 CA LEU A 482 -19.521 -2.001 -10.855 1.00 0.00 C ATOM 994 C LEU A 482 -20.579 -0.904 -10.799 1.00 0.00 C ATOM 995 O LEU A 482 -20.842 -0.316 -9.768 1.00 0.00 O ATOM 996 CB LEU A 482 -19.349 -2.648 -9.475 1.00 0.00 C ATOM 997 CG LEU A 482 -18.720 -4.043 -9.625 1.00 0.00 C ATOM 998 CD1 LEU A 482 -17.229 -3.910 -9.942 1.00 0.00 C ATOM 999 CD2 LEU A 482 -18.902 -4.817 -8.323 1.00 0.00 C ATOM 0 H LEU A 482 -17.763 -1.944 -12.049 1.00 0.00 H new ATOM 0 HA LEU A 482 -19.840 -2.770 -11.559 1.00 0.00 H new ATOM 0 HB2 LEU A 482 -18.717 -2.021 -8.846 1.00 0.00 H new ATOM 0 HB3 LEU A 482 -20.316 -2.727 -8.978 1.00 0.00 H new ATOM 0 HG LEU A 482 -19.209 -4.577 -10.440 1.00 0.00 H new ATOM 0 HD11 LEU A 482 -16.789 -4.902 -10.047 1.00 0.00 H new ATOM 0 HD12 LEU A 482 -17.103 -3.357 -10.873 1.00 0.00 H new ATOM 0 HD13 LEU A 482 -16.731 -3.376 -9.132 1.00 0.00 H new ATOM 0 HD21 LEU A 482 -18.458 -5.807 -8.423 1.00 0.00 H new ATOM 0 HD22 LEU A 482 -18.413 -4.281 -7.510 1.00 0.00 H new ATOM 0 HD23 LEU A 482 -19.965 -4.917 -8.105 1.00 0.00 H new ATOM 1011 N GLU A 483 -21.180 -0.640 -11.916 1.00 0.00 N ATOM 1012 CA GLU A 483 -22.229 0.419 -11.998 1.00 0.00 C ATOM 1013 C GLU A 483 -23.575 -0.128 -11.528 1.00 0.00 C ATOM 1014 O GLU A 483 -23.966 -1.229 -11.854 1.00 0.00 O ATOM 1015 CB GLU A 483 -22.358 0.897 -13.449 1.00 0.00 C ATOM 1016 CG GLU A 483 -21.072 1.624 -13.876 1.00 0.00 C ATOM 1017 CD GLU A 483 -20.006 0.605 -14.293 1.00 0.00 C ATOM 1018 OE1 GLU A 483 -20.256 -0.581 -14.149 1.00 0.00 O ATOM 1019 OE2 GLU A 483 -18.958 1.030 -14.748 1.00 0.00 O ATOM 0 H GLU A 483 -20.990 -1.119 -12.796 1.00 0.00 H new ATOM 0 HA GLU A 483 -21.940 1.251 -11.356 1.00 0.00 H new ATOM 0 HB2 GLU A 483 -22.541 0.047 -14.106 1.00 0.00 H new ATOM 0 HB3 GLU A 483 -23.214 1.565 -13.546 1.00 0.00 H new ATOM 0 HG2 GLU A 483 -21.285 2.299 -14.705 1.00 0.00 H new ATOM 0 HG3 GLU A 483 -20.700 2.235 -13.054 1.00 0.00 H new ATOM 1026 N HIS A 484 -24.283 0.654 -10.759 1.00 0.00 N ATOM 1027 CA HIS A 484 -25.610 0.215 -10.238 1.00 0.00 C ATOM 1028 C HIS A 484 -26.714 0.581 -11.224 1.00 0.00 C ATOM 1029 O HIS A 484 -26.599 1.520 -11.986 1.00 0.00 O ATOM 1030 CB HIS A 484 -25.887 0.888 -8.884 1.00 0.00 C ATOM 1031 CG HIS A 484 -25.497 2.346 -8.929 1.00 0.00 C ATOM 1032 ND1 HIS A 484 -25.943 3.395 -9.697 1.00 0.00 N flip ATOM 1033 CD2 HIS A 484 -24.535 2.881 -8.083 1.00 0.00 C flip ATOM 1034 CE1 HIS A 484 -25.272 4.560 -9.335 1.00 0.00 C flip ATOM 1035 NE2 HIS A 484 -24.435 4.195 -8.360 1.00 0.00 N flip ATOM 0 H HIS A 484 -23.996 1.588 -10.466 1.00 0.00 H new ATOM 0 HA HIS A 484 -25.594 -0.867 -10.110 1.00 0.00 H new ATOM 0 HB2 HIS A 484 -26.944 0.796 -8.635 1.00 0.00 H new ATOM 0 HB3 HIS A 484 -25.329 0.380 -8.098 1.00 0.00 H new ATOM 0 HD2 HIS A 484 -23.969 2.341 -7.338 1.00 0.00 H new ATOM 0 HE1 HIS A 484 -25.401 5.547 -9.753 1.00 0.00 H new ATOM 0 HE2 HIS A 484 -23.798 4.834 -7.884 1.00 0.00 H new ATOM 1043 N HIS A 485 -27.780 -0.174 -11.196 1.00 0.00 N ATOM 1044 CA HIS A 485 -28.935 0.068 -12.107 1.00 0.00 C ATOM 1045 C HIS A 485 -28.529 -0.271 -13.540 1.00 0.00 C ATOM 1046 O HIS A 485 -29.228 -0.973 -14.245 1.00 0.00 O ATOM 1047 CB HIS A 485 -29.364 1.538 -12.022 1.00 0.00 C ATOM 1048 CG HIS A 485 -29.296 2.003 -10.592 1.00 0.00 C ATOM 1049 ND1 HIS A 485 -29.388 1.328 -9.398 1.00 0.00 N flip ATOM 1050 CD2 HIS A 485 -29.112 3.335 -10.258 1.00 0.00 C flip ATOM 1051 CE1 HIS A 485 -29.265 2.226 -8.341 1.00 0.00 C flip ATOM 1052 NE2 HIS A 485 -29.102 3.421 -8.915 1.00 0.00 N flip ATOM 0 H HIS A 485 -27.900 -0.966 -10.565 1.00 0.00 H new ATOM 0 HA HIS A 485 -29.772 -0.563 -11.808 1.00 0.00 H new ATOM 0 HB2 HIS A 485 -28.716 2.153 -12.646 1.00 0.00 H new ATOM 0 HB3 HIS A 485 -30.378 1.654 -12.405 1.00 0.00 H new ATOM 0 HD2 HIS A 485 -28.997 4.156 -10.950 1.00 0.00 H new ATOM 0 HE1 HIS A 485 -29.295 2.004 -7.284 1.00 0.00 H new ATOM 0 HE2 HIS A 485 -28.984 4.293 -8.398 1.00 0.00 H new ATOM 1060 N HIS A 486 -27.400 0.232 -13.966 1.00 0.00 N ATOM 1061 CA HIS A 486 -26.908 -0.028 -15.351 1.00 0.00 C ATOM 1062 C HIS A 486 -28.080 0.025 -16.335 1.00 0.00 C ATOM 1063 O HIS A 486 -28.176 -0.761 -17.257 1.00 0.00 O ATOM 1064 CB HIS A 486 -26.216 -1.393 -15.411 1.00 0.00 C ATOM 1065 CG HIS A 486 -27.075 -2.435 -14.748 1.00 0.00 C ATOM 1066 ND1 HIS A 486 -27.164 -2.856 -13.443 1.00 0.00 N flip ATOM 1067 CD2 HIS A 486 -27.986 -3.202 -15.456 1.00 0.00 C flip ATOM 1068 CE1 HIS A 486 -28.113 -3.869 -13.343 1.00 0.00 C flip ATOM 1069 NE2 HIS A 486 -28.578 -4.038 -14.584 1.00 0.00 N flip ATOM 0 H HIS A 486 -26.788 0.822 -13.402 1.00 0.00 H new ATOM 0 HA HIS A 486 -26.185 0.739 -15.628 1.00 0.00 H new ATOM 0 HB2 HIS A 486 -26.030 -1.670 -16.449 1.00 0.00 H new ATOM 0 HB3 HIS A 486 -25.246 -1.340 -14.916 1.00 0.00 H new ATOM 0 HD2 HIS A 486 -28.185 -3.140 -16.516 1.00 0.00 H new ATOM 0 HE1 HIS A 486 -28.410 -4.404 -12.453 1.00 0.00 H new ATOM 0 HE2 HIS A 486 -29.294 -4.718 -14.839 1.00 0.00 H new ATOM 1077 N HIS A 487 -28.964 0.965 -16.129 1.00 0.00 N ATOM 1078 CA HIS A 487 -30.148 1.127 -17.021 1.00 0.00 C ATOM 1079 C HIS A 487 -30.815 -0.221 -17.299 1.00 0.00 C ATOM 1080 O HIS A 487 -30.431 -1.242 -16.763 1.00 0.00 O ATOM 1081 CB HIS A 487 -29.704 1.779 -18.333 1.00 0.00 C ATOM 1082 CG HIS A 487 -29.222 3.181 -18.049 1.00 0.00 C ATOM 1083 ND1 HIS A 487 -27.895 3.466 -17.767 1.00 0.00 N ATOM 1084 CD2 HIS A 487 -29.882 4.386 -18.003 1.00 0.00 C ATOM 1085 CE1 HIS A 487 -27.798 4.793 -17.566 1.00 0.00 C ATOM 1086 NE2 HIS A 487 -28.980 5.402 -17.698 1.00 0.00 N ATOM 0 H HIS A 487 -28.914 1.640 -15.366 1.00 0.00 H new ATOM 0 HA HIS A 487 -30.879 1.764 -16.524 1.00 0.00 H new ATOM 0 HB2 HIS A 487 -28.908 1.194 -18.793 1.00 0.00 H new ATOM 0 HB3 HIS A 487 -30.533 1.802 -19.041 1.00 0.00 H new ATOM 0 HD2 HIS A 487 -30.939 4.524 -18.177 1.00 0.00 H new ATOM 0 HE1 HIS A 487 -26.877 5.304 -17.327 1.00 0.00 H new ATOM 0 HE2 HIS A 487 -29.179 6.397 -17.597 1.00 0.00 H new ATOM 1094 N HIS A 488 -31.832 -0.221 -18.122 1.00 0.00 N ATOM 1095 CA HIS A 488 -32.559 -1.487 -18.439 1.00 0.00 C ATOM 1096 C HIS A 488 -31.633 -2.418 -19.227 1.00 0.00 C ATOM 1097 O HIS A 488 -31.611 -3.615 -19.009 1.00 0.00 O ATOM 1098 CB HIS A 488 -33.808 -1.171 -19.277 1.00 0.00 C ATOM 1099 CG HIS A 488 -34.860 -0.525 -18.409 1.00 0.00 C ATOM 1100 ND1 HIS A 488 -34.864 0.833 -18.125 1.00 0.00 N ATOM 1101 CD2 HIS A 488 -35.958 -1.044 -17.766 1.00 0.00 C ATOM 1102 CE1 HIS A 488 -35.933 1.081 -17.343 1.00 0.00 C ATOM 1103 NE2 HIS A 488 -36.632 -0.029 -17.094 1.00 0.00 N ATOM 0 H HIS A 488 -32.193 0.609 -18.592 1.00 0.00 H new ATOM 0 HA HIS A 488 -32.864 -1.974 -17.512 1.00 0.00 H new ATOM 0 HB2 HIS A 488 -33.545 -0.507 -20.100 1.00 0.00 H new ATOM 0 HB3 HIS A 488 -34.201 -2.087 -19.719 1.00 0.00 H new ATOM 0 HD2 HIS A 488 -36.253 -2.083 -17.780 1.00 0.00 H new ATOM 0 HE1 HIS A 488 -36.193 2.058 -16.964 1.00 0.00 H new ATOM 0 HE2 HIS A 488 -37.479 -0.115 -16.532 1.00 0.00 H new ATOM 1111 N HIS A 489 -30.869 -1.873 -20.135 1.00 0.00 N ATOM 1112 CA HIS A 489 -29.930 -2.708 -20.943 1.00 0.00 C ATOM 1113 C HIS A 489 -28.865 -1.806 -21.579 1.00 0.00 C ATOM 1114 O HIS A 489 -29.092 -0.609 -21.649 1.00 0.00 O ATOM 1115 CB HIS A 489 -30.706 -3.452 -22.041 1.00 0.00 C ATOM 1116 CG HIS A 489 -31.225 -2.475 -23.064 1.00 0.00 C ATOM 1117 ND1 HIS A 489 -32.397 -1.758 -22.876 1.00 0.00 N ATOM 1118 CD2 HIS A 489 -30.754 -2.103 -24.301 1.00 0.00 C ATOM 1119 CE1 HIS A 489 -32.589 -0.999 -23.971 1.00 0.00 C ATOM 1120 NE2 HIS A 489 -31.618 -1.171 -24.870 1.00 0.00 N ATOM 1121 OXT HIS A 489 -27.839 -2.330 -21.985 1.00 0.00 O ATOM 0 H HIS A 489 -30.854 -0.877 -20.354 1.00 0.00 H new ATOM 0 HA HIS A 489 -29.446 -3.438 -20.295 1.00 0.00 H new ATOM 0 HB2 HIS A 489 -30.058 -4.184 -22.523 1.00 0.00 H new ATOM 0 HB3 HIS A 489 -31.536 -4.003 -21.600 1.00 0.00 H new ATOM 0 HD2 HIS A 489 -29.851 -2.477 -24.761 1.00 0.00 H new ATOM 0 HE1 HIS A 489 -33.427 -0.332 -24.106 1.00 0.00 H new ATOM 0 HE2 HIS A 489 -31.528 -0.717 -25.779 1.00 0.00 H new TER 1129 HIS A 489