USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 603 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 160 SER OG : rot 180:sc= 1.08 USER MOD Set 1.2: A 163 SER OG : rot 86:sc= 1.2 USER MOD Set 2.1: A 145 SER OG : rot 84:sc= 0.931 USER MOD Set 2.2: A 176 GLN :FLIP amide:sc= 0 F(o=0.4,f=0.93) USER MOD Set 3.1: A 128 HIS :FLIP no HD1:sc= -0.624 F(o=-1.4,f=-0.78) USER MOD Set 3.2: A 157 ASN : amide:sc= -0.157 K(o=-0.78,f=-1.4) USER MOD Set 4.1: A 104 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HE2:sc= 0.202 K(o=0.2,f=-0.73) USER MOD Single : A 101 MET CE :methyl -168:sc= -0.0106 (180deg=-0.0551) USER MOD Single : A 106 TYR OH : rot 0:sc= 1.28 USER MOD Single : A 107 CYS SG : rot -130:sc= -0.199 USER MOD Single : A 113 SER OG : rot 180:sc= -0.0664 USER MOD Single : A 116 THR OG1 : rot 30:sc= 1.03 USER MOD Single : A 120 GLN : amide:sc=-0.00438 X(o=-0.0044,f=-0.00019) USER MOD Single : A 129 ASN : amide:sc= -0.409 K(o=-0.41,f=-1.6!) USER MOD Single : A 134 CYS SG : rot 69:sc= 0.647 USER MOD Single : A 138 SER OG : rot -82:sc= 1.19 USER MOD Single : A 146 GLN : amide:sc= -0.131 K(o=-0.13,f=-0.86) USER MOD Single : A 149 TYR OH : rot 44:sc= 0.613 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 HIS : no HD1:sc=-0.00742 X(o=-0.0074,f=-0.0074) USER MOD Single : A 164 TYR OH : rot 30:sc= 0.476 USER MOD Single : A 167 LYS NZ :NH3+ -165:sc= -0.0398 (180deg=-0.368) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 62.746 8.250 -11.551 1.00 25.00 N ATOM 307 CA HIS A 100 63.033 9.574 -11.012 1.00 25.00 C ATOM 308 C HIS A 100 64.030 9.376 -9.883 1.00 25.00 C ATOM 309 O HIS A 100 64.237 8.243 -9.447 1.00 25.00 O ATOM 310 CB HIS A 100 61.752 10.244 -10.512 1.00 25.00 C ATOM 311 CG HIS A 100 60.623 10.172 -11.497 1.00 25.00 C ATOM 312 ND1 HIS A 100 60.659 10.691 -12.772 1.00 25.00 N ATOM 313 CD2 HIS A 100 59.397 9.590 -11.392 1.00 25.00 C ATOM 314 CE1 HIS A 100 59.502 10.425 -13.361 1.00 25.00 C ATOM 315 NE2 HIS A 100 58.694 9.751 -12.569 1.00 25.00 N ATOM 0 HA HIS A 100 63.446 10.230 -11.778 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.443 9.771 -9.580 1.00 25.00 H new ATOM 0 HB3 HIS A 100 61.961 11.289 -10.285 1.00 25.00 H new ATOM 0 HD1 HIS A 100 61.441 11.194 -13.191 1.00 25.00 H new ATOM 0 HD2 HIS A 100 59.028 9.077 -10.516 1.00 25.00 H new ATOM 0 HE1 HIS A 100 59.252 10.725 -14.368 1.00 25.00 H new ATOM 323 N MET A 101 64.657 10.448 -9.430 1.00 25.00 N ATOM 324 CA MET A 101 65.692 10.367 -8.403 1.00 25.00 C ATOM 325 C MET A 101 65.423 11.400 -7.316 1.00 25.00 C ATOM 326 O MET A 101 64.610 12.303 -7.495 1.00 25.00 O ATOM 327 CB MET A 101 67.076 10.581 -9.040 1.00 25.00 C ATOM 328 CG MET A 101 67.282 11.948 -9.673 1.00 25.00 C ATOM 329 SD MET A 101 68.846 12.012 -10.546 1.00 25.00 S ATOM 330 CE MET A 101 69.013 13.758 -10.848 1.00 25.00 C ATOM 0 H MET A 101 64.468 11.395 -9.758 1.00 25.00 H new ATOM 0 HA MET A 101 65.676 9.378 -7.945 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.839 10.431 -8.276 1.00 25.00 H new ATOM 0 HB3 MET A 101 67.232 9.816 -9.801 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.466 12.162 -10.363 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.258 12.719 -8.902 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.820 13.928 -11.561 1.00 25.00 H new ATOM 0 HE2 MET A 101 68.080 14.148 -11.256 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.241 14.269 -9.913 1.00 25.00 H new ATOM 340 N LEU A 102 66.088 11.242 -6.182 1.00 25.00 N ATOM 341 CA LEU A 102 65.892 12.123 -5.034 1.00 25.00 C ATOM 342 C LEU A 102 67.227 12.751 -4.665 1.00 25.00 C ATOM 343 O LEU A 102 68.229 12.049 -4.587 1.00 25.00 O ATOM 344 CB LEU A 102 65.357 11.305 -3.850 1.00 25.00 C ATOM 345 CG LEU A 102 64.926 12.116 -2.614 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.530 12.713 -2.818 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.924 11.223 -1.379 1.00 25.00 C ATOM 0 H LEU A 102 66.776 10.505 -6.029 1.00 25.00 H new ATOM 0 HA LEU A 102 65.174 12.905 -5.280 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.503 10.721 -4.193 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.127 10.596 -3.545 1.00 25.00 H new ATOM 0 HG LEU A 102 65.638 12.929 -2.473 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.245 13.282 -1.933 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.540 13.372 -3.686 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.811 11.910 -2.980 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.618 11.805 -0.510 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.227 10.398 -1.527 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.926 10.826 -1.215 1.00 25.00 H new ATOM 359 N LEU A 103 67.236 14.054 -4.439 1.00 25.00 N ATOM 360 CA LEU A 103 68.453 14.778 -4.056 1.00 25.00 C ATOM 361 C LEU A 103 68.185 15.498 -2.758 1.00 25.00 C ATOM 362 O LEU A 103 67.041 15.837 -2.470 1.00 25.00 O ATOM 363 CB LEU A 103 68.826 15.811 -5.125 1.00 25.00 C ATOM 364 CG LEU A 103 69.135 15.261 -6.522 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.462 16.428 -7.448 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.292 14.284 -6.512 1.00 25.00 C ATOM 0 H LEU A 103 66.408 14.644 -4.513 1.00 25.00 H new ATOM 0 HA LEU A 103 69.275 14.070 -3.951 1.00 25.00 H new ATOM 0 HB2 LEU A 103 68.007 16.525 -5.212 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.697 16.366 -4.775 1.00 25.00 H new ATOM 0 HG LEU A 103 68.257 14.720 -6.873 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.684 16.050 -8.446 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.608 17.103 -7.498 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.328 16.966 -7.063 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.472 13.923 -7.525 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.187 14.784 -6.141 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.051 13.442 -5.864 1.00 25.00 H new ATOM 378 N THR A 104 69.226 15.762 -1.992 1.00 25.00 N ATOM 379 CA THR A 104 69.089 16.482 -0.729 1.00 25.00 C ATOM 380 C THR A 104 69.723 17.857 -0.896 1.00 25.00 C ATOM 381 O THR A 104 70.768 17.979 -1.513 1.00 25.00 O ATOM 382 CB THR A 104 69.773 15.712 0.417 1.00 25.00 C ATOM 383 OG1 THR A 104 69.276 14.372 0.441 1.00 25.00 O ATOM 384 CG2 THR A 104 69.481 16.346 1.773 1.00 25.00 C ATOM 0 H THR A 104 70.182 15.490 -2.219 1.00 25.00 H new ATOM 0 HA THR A 104 68.034 16.582 -0.474 1.00 25.00 H new ATOM 0 HB THR A 104 70.848 15.736 0.240 1.00 25.00 H new ATOM 0 HG1 THR A 104 69.708 13.876 1.167 1.00 25.00 H new ATOM 0 HG21 THR A 104 69.980 15.776 2.556 1.00 25.00 H new ATOM 0 HG22 THR A 104 69.848 17.372 1.781 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.406 16.344 1.952 1.00 25.00 H new ATOM 392 N VAL A 105 69.083 18.890 -0.376 1.00 25.00 N ATOM 393 CA VAL A 105 69.580 20.257 -0.503 1.00 25.00 C ATOM 394 C VAL A 105 69.709 20.845 0.895 1.00 25.00 C ATOM 395 O VAL A 105 68.786 20.745 1.698 1.00 25.00 O ATOM 396 CB VAL A 105 68.610 21.117 -1.354 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.146 22.555 -1.518 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.404 20.483 -2.736 1.00 25.00 C ATOM 0 H VAL A 105 68.209 18.810 0.144 1.00 25.00 H new ATOM 0 HA VAL A 105 70.548 20.252 -1.005 1.00 25.00 H new ATOM 0 HB VAL A 105 67.654 21.158 -0.832 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.447 23.137 -2.119 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.254 23.017 -0.537 1.00 25.00 H new ATOM 0 HG13 VAL A 105 70.116 22.527 -2.015 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.721 21.099 -3.321 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.362 20.415 -3.251 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.983 19.485 -2.619 1.00 25.00 H new ATOM 408 N TYR A 106 70.855 21.443 1.187 1.00 25.00 N ATOM 409 CA TYR A 106 71.107 22.086 2.472 1.00 25.00 C ATOM 410 C TYR A 106 71.331 23.574 2.211 1.00 25.00 C ATOM 411 O TYR A 106 72.304 23.949 1.559 1.00 25.00 O ATOM 412 CB TYR A 106 72.339 21.454 3.133 1.00 25.00 C ATOM 413 CG TYR A 106 72.512 21.806 4.597 1.00 25.00 C ATOM 414 CD1 TYR A 106 72.867 23.111 4.998 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.330 20.827 5.596 1.00 25.00 C ATOM 416 CE1 TYR A 106 73.034 23.429 6.377 1.00 25.00 C ATOM 417 CE2 TYR A 106 72.495 21.146 6.970 1.00 25.00 C ATOM 418 CZ TYR A 106 72.851 22.444 7.346 1.00 25.00 C ATOM 419 OH TYR A 106 73.026 22.753 8.671 1.00 25.00 O ATOM 0 H TYR A 106 71.640 21.497 0.538 1.00 25.00 H new ATOM 0 HA TYR A 106 70.262 21.954 3.148 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.272 20.370 3.038 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.230 21.767 2.588 1.00 25.00 H new ATOM 0 HD1 TYR A 106 73.014 23.878 4.252 1.00 25.00 H new ATOM 0 HD2 TYR A 106 72.061 19.820 5.312 1.00 25.00 H new ATOM 0 HE1 TYR A 106 73.302 24.433 6.671 1.00 25.00 H new ATOM 0 HE2 TYR A 106 72.346 20.387 7.723 1.00 25.00 H new ATOM 0 HH TYR A 106 73.276 23.697 8.757 1.00 25.00 H new ATOM 429 N CYS A 107 70.427 24.415 2.682 1.00 25.00 N ATOM 430 CA CYS A 107 70.519 25.858 2.475 1.00 25.00 C ATOM 431 C CYS A 107 71.101 26.530 3.708 1.00 25.00 C ATOM 432 O CYS A 107 70.726 26.201 4.820 1.00 25.00 O ATOM 433 CB CYS A 107 69.139 26.433 2.170 1.00 25.00 C ATOM 434 SG CYS A 107 68.404 25.736 0.680 1.00 25.00 S ATOM 0 H CYS A 107 69.609 24.123 3.217 1.00 25.00 H new ATOM 0 HA CYS A 107 71.177 26.048 1.627 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.478 26.247 3.017 1.00 25.00 H new ATOM 0 HB3 CYS A 107 69.218 27.514 2.059 1.00 25.00 H new ATOM 0 HG CYS A 107 67.983 26.698 -0.087 1.00 25.00 H new ATOM 440 N VAL A 108 72.028 27.455 3.504 1.00 25.00 N ATOM 441 CA VAL A 108 72.738 28.126 4.598 1.00 25.00 C ATOM 442 C VAL A 108 72.515 29.641 4.580 1.00 25.00 C ATOM 443 O VAL A 108 72.700 30.293 3.544 1.00 25.00 O ATOM 444 CB VAL A 108 74.277 27.857 4.503 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.014 28.421 5.736 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.558 26.358 4.379 1.00 25.00 C ATOM 0 H VAL A 108 72.314 27.766 2.576 1.00 25.00 H new ATOM 0 HA VAL A 108 72.337 27.718 5.526 1.00 25.00 H new ATOM 0 HB VAL A 108 74.646 28.364 3.611 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.082 28.221 5.645 1.00 25.00 H new ATOM 0 HG12 VAL A 108 74.851 29.497 5.797 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.631 27.944 6.638 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.634 26.194 4.314 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.164 25.840 5.253 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.077 25.971 3.481 1.00 25.00 H new ATOM 456 N ARG A 109 72.182 30.193 5.741 1.00 25.00 N ATOM 457 CA ARG A 109 72.041 31.641 5.937 1.00 25.00 C ATOM 458 C ARG A 109 72.970 32.002 7.080 1.00 25.00 C ATOM 459 O ARG A 109 73.153 31.205 7.986 1.00 25.00 O ATOM 460 CB ARG A 109 70.601 31.993 6.339 1.00 25.00 C ATOM 461 CG ARG A 109 69.639 32.205 5.164 1.00 25.00 C ATOM 462 CD ARG A 109 69.442 33.697 4.827 1.00 25.00 C ATOM 463 NE ARG A 109 68.948 34.469 5.982 1.00 25.00 N ATOM 464 CZ ARG A 109 67.687 34.557 6.391 1.00 25.00 C ATOM 465 NH1 ARG A 109 66.694 33.950 5.779 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 67.429 35.269 7.452 1.00 25.00 N ATOM 0 H ARG A 109 72.000 29.648 6.584 1.00 25.00 H new ATOM 0 HA ARG A 109 72.279 32.181 5.020 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.210 31.196 6.971 1.00 25.00 H new ATOM 0 HB3 ARG A 109 70.619 32.900 6.944 1.00 25.00 H new ATOM 0 HG2 ARG A 109 70.022 31.685 4.286 1.00 25.00 H new ATOM 0 HG3 ARG A 109 68.674 31.759 5.403 1.00 25.00 H new ATOM 0 HD2 ARG A 109 70.388 34.119 4.488 1.00 25.00 H new ATOM 0 HD3 ARG A 109 68.737 33.791 4.001 1.00 25.00 H new ATOM 0 HE ARG A 109 69.643 34.987 6.520 1.00 25.00 H new ATOM 0 HH11 ARG A 109 66.876 33.381 4.952 1.00 25.00 H new ATOM 0 HH12 ARG A 109 65.742 34.048 6.131 1.00 25.00 H new ATOM 0 HH21 ARG A 109 68.186 35.741 7.946 1.00 25.00 H new ATOM 0 HH22 ARG A 109 66.470 35.354 7.788 1.00 25.00 H new ATOM 480 N ARG A 110 73.530 33.206 7.064 1.00 25.00 N ATOM 481 CA ARG A 110 74.438 33.637 8.141 1.00 25.00 C ATOM 482 C ARG A 110 73.723 33.776 9.479 1.00 25.00 C ATOM 483 O ARG A 110 74.350 33.727 10.523 1.00 25.00 O ATOM 484 CB ARG A 110 75.077 34.987 7.812 1.00 25.00 C ATOM 485 CG ARG A 110 76.104 34.938 6.698 1.00 25.00 C ATOM 486 CD ARG A 110 76.883 36.245 6.657 1.00 25.00 C ATOM 487 NE ARG A 110 77.973 36.209 5.666 1.00 25.00 N ATOM 488 CZ ARG A 110 78.929 37.123 5.549 1.00 25.00 C ATOM 489 NH1 ARG A 110 78.991 38.176 6.330 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 79.850 36.973 4.638 1.00 25.00 N ATOM 0 H ARG A 110 73.379 33.899 6.331 1.00 25.00 H new ATOM 0 HA ARG A 110 75.199 32.861 8.218 1.00 25.00 H new ATOM 0 HB2 ARG A 110 74.291 35.689 7.535 1.00 25.00 H new ATOM 0 HB3 ARG A 110 75.552 35.379 8.711 1.00 25.00 H new ATOM 0 HG2 ARG A 110 76.786 34.102 6.856 1.00 25.00 H new ATOM 0 HG3 ARG A 110 75.609 34.769 5.742 1.00 25.00 H new ATOM 0 HD2 ARG A 110 76.204 37.064 6.419 1.00 25.00 H new ATOM 0 HD3 ARG A 110 77.297 36.451 7.644 1.00 25.00 H new ATOM 0 HE ARG A 110 77.995 35.420 5.019 1.00 25.00 H new ATOM 0 HH11 ARG A 110 78.289 38.313 7.057 1.00 25.00 H new ATOM 0 HH12 ARG A 110 79.741 38.857 6.210 1.00 25.00 H new ATOM 0 HH21 ARG A 110 79.832 36.159 4.023 1.00 25.00 H new ATOM 0 HH22 ARG A 110 80.589 37.670 4.540 1.00 25.00 H new ATOM 504 N ASP A 111 72.416 33.955 9.425 1.00 25.00 N ATOM 505 CA ASP A 111 71.598 34.168 10.617 1.00 25.00 C ATOM 506 C ASP A 111 71.177 32.841 11.256 1.00 25.00 C ATOM 507 O ASP A 111 70.202 32.789 11.998 1.00 25.00 O ATOM 508 CB ASP A 111 70.362 34.976 10.221 1.00 25.00 C ATOM 509 CG ASP A 111 70.685 36.065 9.218 1.00 25.00 C ATOM 510 OD1 ASP A 111 71.405 37.022 9.554 1.00 25.00 O ATOM 511 OD2 ASP A 111 70.301 35.885 8.036 1.00 25.00 O1- ATOM 0 H ASP A 111 71.885 33.958 8.554 1.00 25.00 H new ATOM 0 HA ASP A 111 72.186 34.712 11.356 1.00 25.00 H new ATOM 0 HB2 ASP A 111 69.613 34.306 9.799 1.00 25.00 H new ATOM 0 HB3 ASP A 111 69.923 35.424 11.112 1.00 25.00 H new ATOM 516 N LEU A 112 71.894 31.772 10.903 1.00 25.00 N ATOM 517 CA LEU A 112 71.626 30.403 11.380 1.00 25.00 C ATOM 518 C LEU A 112 70.201 29.964 11.048 1.00 25.00 C ATOM 519 O LEU A 112 69.610 29.125 11.715 1.00 25.00 O ATOM 520 CB LEU A 112 71.901 30.266 12.884 1.00 25.00 C ATOM 521 CG LEU A 112 73.309 30.667 13.361 1.00 25.00 C ATOM 522 CD1 LEU A 112 73.380 30.540 14.888 1.00 25.00 C ATOM 523 CD2 LEU A 112 74.405 29.804 12.721 1.00 25.00 C ATOM 0 H LEU A 112 72.690 31.828 10.268 1.00 25.00 H new ATOM 0 HA LEU A 112 72.313 29.740 10.853 1.00 25.00 H new ATOM 0 HB2 LEU A 112 71.172 30.873 13.421 1.00 25.00 H new ATOM 0 HB3 LEU A 112 71.725 29.229 13.171 1.00 25.00 H new ATOM 0 HG LEU A 112 73.484 31.698 13.055 1.00 25.00 H new ATOM 0 HD11 LEU A 112 74.375 30.823 15.231 1.00 25.00 H new ATOM 0 HD12 LEU A 112 72.639 31.198 15.343 1.00 25.00 H new ATOM 0 HD13 LEU A 112 73.176 29.509 15.177 1.00 25.00 H new ATOM 0 HD21 LEU A 112 75.380 30.124 13.088 1.00 25.00 H new ATOM 0 HD22 LEU A 112 74.244 28.758 12.983 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.370 29.916 11.637 1.00 25.00 H new ATOM 535 N SER A 113 69.675 30.518 9.965 1.00 25.00 N ATOM 536 CA SER A 113 68.346 30.177 9.452 1.00 25.00 C ATOM 537 C SER A 113 68.470 29.031 8.456 1.00 25.00 C ATOM 538 O SER A 113 67.725 28.953 7.484 1.00 25.00 O ATOM 539 CB SER A 113 67.717 31.389 8.779 1.00 25.00 C ATOM 540 OG SER A 113 67.875 32.543 9.587 1.00 25.00 O ATOM 0 H SER A 113 70.159 31.223 9.409 1.00 25.00 H new ATOM 0 HA SER A 113 67.707 29.870 10.280 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.180 31.553 7.806 1.00 25.00 H new ATOM 0 HB3 SER A 113 66.658 31.205 8.601 1.00 25.00 H new ATOM 0 HG SER A 113 67.467 33.314 9.140 1.00 25.00 H new ATOM 546 N GLU A 114 69.515 28.245 8.630 1.00 25.00 N ATOM 547 CA GLU A 114 69.839 27.155 7.719 1.00 25.00 C ATOM 548 C GLU A 114 68.849 25.995 7.882 1.00 25.00 C ATOM 549 O GLU A 114 68.283 25.787 8.956 1.00 25.00 O ATOM 550 CB GLU A 114 71.284 26.696 7.964 1.00 25.00 C ATOM 551 CG GLU A 114 71.607 26.281 9.395 1.00 25.00 C ATOM 552 CD GLU A 114 73.104 26.206 9.618 1.00 25.00 C ATOM 553 OE1 GLU A 114 73.763 25.333 9.013 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 73.641 27.089 10.320 1.00 25.00 O1- ATOM 0 H GLU A 114 70.167 28.342 9.408 1.00 25.00 H new ATOM 0 HA GLU A 114 69.755 27.509 6.692 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.497 25.855 7.304 1.00 25.00 H new ATOM 0 HB3 GLU A 114 71.957 27.504 7.678 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.168 26.995 10.092 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.156 25.311 9.606 1.00 25.00 H new ATOM 561 N VAL A 115 68.594 25.296 6.785 1.00 25.00 N ATOM 562 CA VAL A 115 67.566 24.257 6.734 1.00 25.00 C ATOM 563 C VAL A 115 67.984 23.254 5.668 1.00 25.00 C ATOM 564 O VAL A 115 68.750 23.595 4.770 1.00 25.00 O ATOM 565 CB VAL A 115 66.153 24.895 6.388 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.124 25.471 4.954 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.008 23.887 6.584 1.00 25.00 C ATOM 0 H VAL A 115 69.091 25.430 5.905 1.00 25.00 H new ATOM 0 HA VAL A 115 67.470 23.761 7.700 1.00 25.00 H new ATOM 0 HB VAL A 115 66.001 25.717 7.088 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.142 25.899 4.753 1.00 25.00 H new ATOM 0 HG12 VAL A 115 66.884 26.246 4.858 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.326 24.675 4.238 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.059 24.362 6.337 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.164 23.028 5.932 1.00 25.00 H new ATOM 0 HG23 VAL A 115 64.989 23.556 7.622 1.00 25.00 H new ATOM 577 N THR A 116 67.484 22.031 5.742 1.00 25.00 N ATOM 578 CA THR A 116 67.755 21.041 4.710 1.00 25.00 C ATOM 579 C THR A 116 66.452 20.324 4.392 1.00 25.00 C ATOM 580 O THR A 116 65.563 20.229 5.245 1.00 25.00 O ATOM 581 CB THR A 116 68.880 20.053 5.131 1.00 25.00 C ATOM 582 OG1 THR A 116 69.244 19.226 4.022 1.00 25.00 O ATOM 583 CG2 THR A 116 68.460 19.153 6.281 1.00 25.00 C ATOM 0 H THR A 116 66.890 21.700 6.503 1.00 25.00 H new ATOM 0 HA THR A 116 68.127 21.537 3.814 1.00 25.00 H new ATOM 0 HB THR A 116 69.724 20.659 5.459 1.00 25.00 H new ATOM 0 HG1 THR A 116 69.098 19.717 3.186 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.280 18.482 6.537 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.207 19.764 7.148 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.591 18.566 5.985 1.00 25.00 H new ATOM 591 N PHE A 117 66.323 19.883 3.152 1.00 25.00 N ATOM 592 CA PHE A 117 65.112 19.238 2.660 1.00 25.00 C ATOM 593 C PHE A 117 65.540 18.386 1.474 1.00 25.00 C ATOM 594 O PHE A 117 66.690 18.467 1.049 1.00 25.00 O ATOM 595 CB PHE A 117 64.070 20.293 2.245 1.00 25.00 C ATOM 596 CG PHE A 117 64.614 21.364 1.337 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.645 21.178 -0.056 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.078 22.584 1.875 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.144 22.191 -0.914 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.569 23.607 1.031 1.00 25.00 C ATOM 601 CZ PHE A 117 65.607 23.410 -0.367 1.00 25.00 C ATOM 0 H PHE A 117 67.060 19.962 2.451 1.00 25.00 H new ATOM 0 HA PHE A 117 64.642 18.625 3.429 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.241 19.793 1.745 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.665 20.762 3.142 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.284 20.252 -0.478 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.058 22.738 2.944 1.00 25.00 H new ATOM 0 HE1 PHE A 117 65.170 22.032 -1.982 1.00 25.00 H new ATOM 0 HE2 PHE A 117 65.915 24.538 1.455 1.00 25.00 H new ATOM 0 HZ PHE A 117 65.988 24.186 -1.015 1.00 25.00 H new ATOM 611 N SER A 118 64.635 17.587 0.935 1.00 25.00 N ATOM 612 CA SER A 118 64.944 16.753 -0.219 1.00 25.00 C ATOM 613 C SER A 118 63.947 17.044 -1.322 1.00 25.00 C ATOM 614 O SER A 118 62.812 17.424 -1.053 1.00 25.00 O ATOM 615 CB SER A 118 64.904 15.271 0.157 1.00 25.00 C ATOM 616 OG SER A 118 65.848 14.979 1.175 1.00 25.00 O ATOM 0 H SER A 118 63.678 17.497 1.277 1.00 25.00 H new ATOM 0 HA SER A 118 65.951 16.983 -0.567 1.00 25.00 H new ATOM 0 HB2 SER A 118 63.903 15.005 0.497 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.113 14.663 -0.723 1.00 25.00 H new ATOM 0 HG SER A 118 65.803 14.026 1.400 1.00 25.00 H new ATOM 622 N LEU A 119 64.392 16.887 -2.556 1.00 25.00 N ATOM 623 CA LEU A 119 63.578 17.169 -3.730 1.00 25.00 C ATOM 624 C LEU A 119 63.600 15.970 -4.650 1.00 25.00 C ATOM 625 O LEU A 119 64.634 15.318 -4.803 1.00 25.00 O ATOM 626 CB LEU A 119 64.150 18.362 -4.491 1.00 25.00 C ATOM 627 CG LEU A 119 64.103 19.730 -3.803 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.844 20.701 -4.701 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.673 20.208 -3.587 1.00 25.00 C ATOM 0 H LEU A 119 65.333 16.559 -2.775 1.00 25.00 H new ATOM 0 HA LEU A 119 62.561 17.389 -3.407 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.190 18.141 -4.729 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.617 18.444 -5.438 1.00 25.00 H new ATOM 0 HG LEU A 119 64.563 19.663 -2.817 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.836 21.693 -4.249 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.874 20.367 -4.826 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.355 20.742 -5.674 1.00 25.00 H new ATOM 0 HD21 LEU A 119 62.685 21.181 -3.097 1.00 25.00 H new ATOM 0 HD22 LEU A 119 62.168 20.293 -4.549 1.00 25.00 H new ATOM 0 HD23 LEU A 119 62.141 19.492 -2.960 1.00 25.00 H new ATOM 641 N GLN A 120 62.473 15.705 -5.288 1.00 25.00 N ATOM 642 CA GLN A 120 62.366 14.609 -6.249 1.00 25.00 C ATOM 643 C GLN A 120 62.421 15.236 -7.626 1.00 25.00 C ATOM 644 O GLN A 120 61.683 16.179 -7.910 1.00 25.00 O ATOM 645 CB GLN A 120 61.063 13.828 -6.060 1.00 25.00 C ATOM 646 CG GLN A 120 60.979 12.573 -6.940 1.00 25.00 C ATOM 647 CD GLN A 120 59.654 11.853 -6.805 1.00 25.00 C ATOM 648 OE1 GLN A 120 59.207 11.550 -5.713 1.00 25.00 O ATOM 649 NE2 GLN A 120 59.024 11.579 -7.920 1.00 25.00 N ATOM 0 H GLN A 120 61.611 16.235 -5.160 1.00 25.00 H new ATOM 0 HA GLN A 120 63.177 13.894 -6.108 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.969 13.537 -5.014 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.220 14.480 -6.287 1.00 25.00 H new ATOM 0 HG2 GLN A 120 61.131 12.854 -7.982 1.00 25.00 H new ATOM 0 HG3 GLN A 120 61.787 11.892 -6.673 1.00 25.00 H new ATOM 0 HE21 GLN A 120 59.431 11.849 -8.815 1.00 25.00 H new ATOM 0 HE22 GLN A 120 58.126 11.095 -7.893 1.00 25.00 H new ATOM 658 N VAL A 121 63.336 14.757 -8.449 1.00 25.00 N ATOM 659 CA VAL A 121 63.584 15.336 -9.765 1.00 25.00 C ATOM 660 C VAL A 121 63.815 14.212 -10.762 1.00 25.00 C ATOM 661 O VAL A 121 64.034 13.065 -10.378 1.00 25.00 O ATOM 662 CB VAL A 121 64.842 16.261 -9.739 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.590 17.490 -8.858 1.00 25.00 C ATOM 664 CG2 VAL A 121 66.072 15.505 -9.214 1.00 25.00 C ATOM 0 H VAL A 121 63.929 13.957 -8.228 1.00 25.00 H new ATOM 0 HA VAL A 121 62.719 15.933 -10.054 1.00 25.00 H new ATOM 0 HB VAL A 121 65.035 16.583 -10.763 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.478 18.122 -8.853 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.745 18.054 -9.253 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.367 17.169 -7.841 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.934 16.173 -9.206 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.877 15.152 -8.201 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.279 14.653 -9.861 1.00 25.00 H new ATOM 674 N ASP A 122 63.783 14.539 -12.039 1.00 25.00 N ATOM 675 CA ASP A 122 64.106 13.570 -13.080 1.00 25.00 C ATOM 676 C ASP A 122 65.609 13.667 -13.351 1.00 25.00 C ATOM 677 O ASP A 122 66.253 14.629 -12.944 1.00 25.00 O ATOM 678 CB ASP A 122 63.312 13.868 -14.351 1.00 25.00 C ATOM 679 CG ASP A 122 63.202 12.656 -15.249 1.00 25.00 C ATOM 680 OD1 ASP A 122 62.235 11.890 -15.065 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 64.141 12.395 -16.039 1.00 25.00 O1- ATOM 0 H ASP A 122 63.537 15.466 -12.385 1.00 25.00 H new ATOM 0 HA ASP A 122 63.843 12.563 -12.758 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.313 14.211 -14.082 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.792 14.680 -14.896 1.00 25.00 H new ATOM 686 N ALA A 123 66.165 12.704 -14.065 1.00 25.00 N ATOM 687 CA ALA A 123 67.572 12.760 -14.444 1.00 25.00 C ATOM 688 C ALA A 123 67.771 13.898 -15.458 1.00 25.00 C ATOM 689 O ALA A 123 68.811 14.567 -15.487 1.00 25.00 O ATOM 690 CB ALA A 123 67.994 11.417 -15.051 1.00 25.00 C ATOM 0 H ALA A 123 65.669 11.876 -14.394 1.00 25.00 H new ATOM 0 HA ALA A 123 68.190 12.952 -13.567 1.00 25.00 H new ATOM 0 HB1 ALA A 123 69.046 11.460 -15.334 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.848 10.624 -14.317 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.389 11.211 -15.934 1.00 25.00 H new ATOM 696 N ASP A 124 66.751 14.111 -16.282 1.00 25.00 N ATOM 697 CA ASP A 124 66.789 15.128 -17.332 1.00 25.00 C ATOM 698 C ASP A 124 66.475 16.527 -16.797 1.00 25.00 C ATOM 699 O ASP A 124 66.543 17.511 -17.521 1.00 25.00 O ATOM 700 CB ASP A 124 65.760 14.762 -18.409 1.00 25.00 C ATOM 701 CG ASP A 124 66.119 15.322 -19.780 1.00 25.00 C ATOM 702 OD1 ASP A 124 67.332 15.398 -20.101 1.00 25.00 O ATOM 703 OD2 ASP A 124 65.189 15.573 -20.578 1.00 25.00 O1- ATOM 0 H ASP A 124 65.877 13.587 -16.243 1.00 25.00 H new ATOM 0 HA ASP A 124 67.799 15.150 -17.741 1.00 25.00 H new ATOM 0 HB2 ASP A 124 65.679 13.677 -18.474 1.00 25.00 H new ATOM 0 HB3 ASP A 124 64.781 15.138 -18.113 1.00 25.00 H new ATOM 708 N PHE A 125 66.117 16.604 -15.521 1.00 25.00 N ATOM 709 CA PHE A 125 65.694 17.865 -14.906 1.00 25.00 C ATOM 710 C PHE A 125 66.822 18.885 -14.930 1.00 25.00 C ATOM 711 O PHE A 125 67.956 18.598 -14.529 1.00 25.00 O ATOM 712 CB PHE A 125 65.250 17.605 -13.475 1.00 25.00 C ATOM 713 CG PHE A 125 64.242 18.585 -12.954 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.912 18.541 -13.414 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.596 19.538 -11.979 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.942 19.426 -12.905 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.626 20.428 -11.458 1.00 25.00 C ATOM 718 CZ PHE A 125 62.295 20.366 -11.921 1.00 25.00 C ATOM 0 H PHE A 125 66.110 15.806 -14.886 1.00 25.00 H new ATOM 0 HA PHE A 125 64.860 18.273 -15.477 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.829 16.602 -13.414 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.126 17.623 -12.826 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.632 17.819 -14.167 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.615 19.590 -11.626 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.927 19.383 -13.271 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.905 21.153 -10.708 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.550 21.038 -11.521 1.00 25.00 H new ATOM 728 N GLU A 126 66.521 20.062 -15.445 1.00 25.00 N ATOM 729 CA GLU A 126 67.521 21.097 -15.644 1.00 25.00 C ATOM 730 C GLU A 126 67.863 21.853 -14.367 1.00 25.00 C ATOM 731 O GLU A 126 67.029 22.025 -13.473 1.00 25.00 O ATOM 732 CB GLU A 126 67.071 22.077 -16.741 1.00 25.00 C ATOM 733 CG GLU A 126 65.791 22.839 -16.477 1.00 25.00 C ATOM 734 CD GLU A 126 64.549 22.097 -16.948 1.00 25.00 C ATOM 735 OE1 GLU A 126 64.094 21.169 -16.239 1.00 25.00 O ATOM 736 OE2 GLU A 126 63.976 22.507 -17.978 1.00 25.00 O1- ATOM 0 H GLU A 126 65.581 20.328 -15.737 1.00 25.00 H new ATOM 0 HA GLU A 126 68.432 20.590 -15.960 1.00 25.00 H new ATOM 0 HB2 GLU A 126 67.871 22.799 -16.904 1.00 25.00 H new ATOM 0 HB3 GLU A 126 66.951 21.519 -17.670 1.00 25.00 H new ATOM 0 HG2 GLU A 126 65.706 23.036 -15.408 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.841 23.806 -16.977 1.00 25.00 H new ATOM 743 N LEU A 127 69.093 22.340 -14.300 1.00 25.00 N ATOM 744 CA LEU A 127 69.562 23.103 -13.147 1.00 25.00 C ATOM 745 C LEU A 127 68.718 24.369 -12.989 1.00 25.00 C ATOM 746 O LEU A 127 68.464 24.822 -11.872 1.00 25.00 O ATOM 747 CB LEU A 127 71.057 23.428 -13.330 1.00 25.00 C ATOM 748 CG LEU A 127 71.881 24.059 -12.184 1.00 25.00 C ATOM 749 CD1 LEU A 127 71.805 25.587 -12.193 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.466 23.531 -10.811 1.00 25.00 C ATOM 0 H LEU A 127 69.790 22.221 -15.035 1.00 25.00 H new ATOM 0 HA LEU A 127 69.452 22.518 -12.234 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.554 22.498 -13.606 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.136 24.098 -14.186 1.00 25.00 H new ATOM 0 HG LEU A 127 72.914 23.763 -12.367 1.00 25.00 H new ATOM 0 HD11 LEU A 127 72.399 25.986 -11.370 1.00 25.00 H new ATOM 0 HD12 LEU A 127 72.194 25.965 -13.138 1.00 25.00 H new ATOM 0 HD13 LEU A 127 70.768 25.900 -12.077 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.074 24.005 -10.040 1.00 25.00 H new ATOM 0 HD22 LEU A 127 70.415 23.760 -10.636 1.00 25.00 H new ATOM 0 HD23 LEU A 127 71.613 22.451 -10.777 1.00 25.00 H new ATOM 762 N HIS A 128 68.230 24.907 -14.100 1.00 25.00 N ATOM 763 CA HIS A 128 67.374 26.093 -14.058 1.00 25.00 C ATOM 764 C HIS A 128 66.118 25.864 -13.223 1.00 25.00 C ATOM 765 O HIS A 128 65.729 26.711 -12.421 1.00 25.00 O ATOM 766 CB HIS A 128 66.944 26.495 -15.469 1.00 25.00 C ATOM 767 CG HIS A 128 66.419 27.892 -15.551 1.00 25.00 C ATOM 768 ND1 HIS A 128 67.003 29.075 -15.228 1.00 25.00 N flip ATOM 769 CD2 HIS A 128 65.163 28.227 -15.984 1.00 25.00 C flip ATOM 770 CE1 HIS A 128 66.134 30.119 -15.465 1.00 25.00 C flip ATOM 771 NE2 HIS A 128 65.035 29.549 -15.917 1.00 25.00 N flip ATOM 0 H HIS A 128 68.409 24.546 -15.037 1.00 25.00 H new ATOM 0 HA HIS A 128 67.964 26.886 -13.599 1.00 25.00 H new ATOM 0 HB2 HIS A 128 67.794 26.394 -16.143 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.176 25.805 -15.818 1.00 25.00 H new ATOM 0 HD2 HIS A 128 64.406 27.535 -16.322 1.00 25.00 H new ATOM 0 HE1 HIS A 128 66.314 31.173 -15.313 1.00 25.00 H new ATOM 0 HE2 HIS A 128 64.192 30.058 -16.182 1.00 25.00 H new ATOM 779 N ASN A 129 65.484 24.722 -13.425 1.00 25.00 N ATOM 780 CA ASN A 129 64.257 24.396 -12.710 1.00 25.00 C ATOM 781 C ASN A 129 64.589 23.877 -11.315 1.00 25.00 C ATOM 782 O ASN A 129 63.845 24.096 -10.367 1.00 25.00 O ATOM 783 CB ASN A 129 63.441 23.381 -13.513 1.00 25.00 C ATOM 784 CG ASN A 129 62.702 24.020 -14.672 1.00 25.00 C ATOM 785 OD1 ASN A 129 62.694 25.240 -14.824 1.00 25.00 O ATOM 786 ND2 ASN A 129 62.089 23.219 -15.488 1.00 25.00 N ATOM 0 H ASN A 129 65.797 24.003 -14.078 1.00 25.00 H new ATOM 0 HA ASN A 129 63.651 25.294 -12.594 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.105 22.604 -13.893 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.724 22.892 -12.853 1.00 25.00 H new ATOM 0 HD21 ASN A 129 61.579 23.597 -16.287 1.00 25.00 H new ATOM 0 HD22 ASN A 129 62.117 22.212 -15.331 1.00 25.00 H new ATOM 793 N PHE A 130 65.738 23.232 -11.171 1.00 25.00 N ATOM 794 CA PHE A 130 66.170 22.734 -9.866 1.00 25.00 C ATOM 795 C PHE A 130 66.368 23.860 -8.862 1.00 25.00 C ATOM 796 O PHE A 130 65.894 23.776 -7.731 1.00 25.00 O ATOM 797 CB PHE A 130 67.469 21.949 -9.996 1.00 25.00 C ATOM 798 CG PHE A 130 67.908 21.287 -8.711 1.00 25.00 C ATOM 799 CD1 PHE A 130 67.107 20.298 -8.114 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.124 21.644 -8.099 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.516 19.653 -6.927 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.545 21.006 -6.907 1.00 25.00 C ATOM 803 CZ PHE A 130 68.742 20.004 -6.326 1.00 25.00 C ATOM 0 H PHE A 130 66.387 23.040 -11.934 1.00 25.00 H new ATOM 0 HA PHE A 130 65.377 22.082 -9.499 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.347 21.186 -10.765 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.257 22.621 -10.336 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.166 20.028 -8.570 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.741 22.411 -8.542 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.892 18.893 -6.481 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.480 21.287 -6.444 1.00 25.00 H new ATOM 0 HZ PHE A 130 69.065 19.507 -5.423 1.00 25.00 H new ATOM 813 N ARG A 131 67.031 24.935 -9.274 1.00 25.00 N ATOM 814 CA ARG A 131 67.231 26.068 -8.364 1.00 25.00 C ATOM 815 C ARG A 131 65.896 26.732 -8.019 1.00 25.00 C ATOM 816 O ARG A 131 65.754 27.261 -6.935 1.00 25.00 O ATOM 817 CB ARG A 131 68.227 27.097 -8.929 1.00 25.00 C ATOM 818 CG ARG A 131 67.741 27.847 -10.160 1.00 25.00 C ATOM 819 CD ARG A 131 68.709 28.927 -10.579 1.00 25.00 C ATOM 820 NE ARG A 131 68.136 29.741 -11.665 1.00 25.00 N ATOM 821 CZ ARG A 131 68.694 30.831 -12.180 1.00 25.00 C ATOM 822 NH1 ARG A 131 69.848 31.291 -11.766 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 68.071 31.473 -13.130 1.00 25.00 N ATOM 0 H ARG A 131 67.431 25.050 -10.205 1.00 25.00 H new ATOM 0 HA ARG A 131 67.666 25.671 -7.447 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.461 27.821 -8.149 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.156 26.584 -9.177 1.00 25.00 H new ATOM 0 HG2 ARG A 131 67.602 27.145 -10.982 1.00 25.00 H new ATOM 0 HG3 ARG A 131 66.768 28.292 -9.953 1.00 25.00 H new ATOM 0 HD2 ARG A 131 68.945 29.563 -9.726 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.645 28.476 -10.909 1.00 25.00 H new ATOM 0 HE ARG A 131 67.240 29.444 -12.052 1.00 25.00 H new ATOM 0 HH11 ARG A 131 70.352 30.809 -11.022 1.00 25.00 H new ATOM 0 HH12 ARG A 131 70.243 32.132 -12.188 1.00 25.00 H new ATOM 0 HH21 ARG A 131 67.169 31.136 -13.467 1.00 25.00 H new ATOM 0 HH22 ARG A 131 68.486 32.312 -13.536 1.00 25.00 H new ATOM 837 N ALA A 132 64.917 26.659 -8.911 1.00 25.00 N ATOM 838 CA ALA A 132 63.594 27.227 -8.642 1.00 25.00 C ATOM 839 C ALA A 132 62.863 26.370 -7.596 1.00 25.00 C ATOM 840 O ALA A 132 62.210 26.892 -6.705 1.00 25.00 O ATOM 841 CB ALA A 132 62.778 27.310 -9.942 1.00 25.00 C ATOM 0 H ALA A 132 65.009 26.215 -9.825 1.00 25.00 H new ATOM 0 HA ALA A 132 63.711 28.236 -8.247 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.797 27.734 -9.729 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.299 27.944 -10.659 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.659 26.311 -10.361 1.00 25.00 H new ATOM 847 N LEU A 133 63.014 25.055 -7.684 1.00 25.00 N ATOM 848 CA LEU A 133 62.438 24.160 -6.676 1.00 25.00 C ATOM 849 C LEU A 133 63.110 24.406 -5.325 1.00 25.00 C ATOM 850 O LEU A 133 62.461 24.398 -4.290 1.00 25.00 O ATOM 851 CB LEU A 133 62.625 22.695 -7.079 1.00 25.00 C ATOM 852 CG LEU A 133 61.419 21.998 -7.729 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.998 22.645 -9.051 1.00 25.00 C ATOM 854 CD2 LEU A 133 61.765 20.525 -7.969 1.00 25.00 C ATOM 0 H LEU A 133 63.523 24.584 -8.432 1.00 25.00 H new ATOM 0 HA LEU A 133 61.371 24.367 -6.601 1.00 25.00 H new ATOM 0 HB2 LEU A 133 63.465 22.637 -7.771 1.00 25.00 H new ATOM 0 HB3 LEU A 133 62.905 22.131 -6.190 1.00 25.00 H new ATOM 0 HG LEU A 133 60.576 22.096 -7.045 1.00 25.00 H new ATOM 0 HD11 LEU A 133 60.142 22.109 -9.462 1.00 25.00 H new ATOM 0 HD12 LEU A 133 60.725 23.686 -8.876 1.00 25.00 H new ATOM 0 HD13 LEU A 133 61.827 22.601 -9.758 1.00 25.00 H new ATOM 0 HD21 LEU A 133 60.915 20.022 -8.430 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.629 20.457 -8.630 1.00 25.00 H new ATOM 0 HD23 LEU A 133 61.998 20.046 -7.018 1.00 25.00 H new ATOM 866 N CYS A 134 64.411 24.664 -5.335 1.00 25.00 N ATOM 867 CA CYS A 134 65.133 24.977 -4.105 1.00 25.00 C ATOM 868 C CYS A 134 64.634 26.298 -3.511 1.00 25.00 C ATOM 869 O CYS A 134 64.483 26.428 -2.304 1.00 25.00 O ATOM 870 CB CYS A 134 66.635 25.094 -4.375 1.00 25.00 C ATOM 871 SG CYS A 134 67.407 23.565 -4.975 1.00 25.00 S ATOM 0 H CYS A 134 64.988 24.663 -6.176 1.00 25.00 H new ATOM 0 HA CYS A 134 64.953 24.166 -3.399 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.800 25.883 -5.109 1.00 25.00 H new ATOM 0 HB3 CYS A 134 67.134 25.403 -3.457 1.00 25.00 H new ATOM 0 HG CYS A 134 66.986 23.310 -6.178 1.00 25.00 H new ATOM 877 N GLU A 135 64.387 27.275 -4.370 1.00 25.00 N ATOM 878 CA GLU A 135 63.908 28.597 -3.961 1.00 25.00 C ATOM 879 C GLU A 135 62.539 28.492 -3.290 1.00 25.00 C ATOM 880 O GLU A 135 62.285 29.135 -2.272 1.00 25.00 O ATOM 881 CB GLU A 135 63.839 29.490 -5.209 1.00 25.00 C ATOM 882 CG GLU A 135 63.510 30.955 -4.961 1.00 25.00 C ATOM 883 CD GLU A 135 63.788 31.822 -6.195 1.00 25.00 C ATOM 884 OE1 GLU A 135 63.637 31.329 -7.334 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 64.249 32.975 -6.023 1.00 25.00 O1- ATOM 0 H GLU A 135 64.512 27.178 -5.378 1.00 25.00 H new ATOM 0 HA GLU A 135 64.593 29.032 -3.233 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.798 29.435 -5.725 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.090 29.079 -5.885 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.461 31.049 -4.681 1.00 25.00 H new ATOM 0 HG3 GLU A 135 64.099 31.322 -4.120 1.00 25.00 H new ATOM 892 N LEU A 136 61.685 27.639 -3.841 1.00 25.00 N ATOM 893 CA LEU A 136 60.338 27.422 -3.307 1.00 25.00 C ATOM 894 C LEU A 136 60.366 26.919 -1.867 1.00 25.00 C ATOM 895 O LEU A 136 59.625 27.406 -1.020 1.00 25.00 O ATOM 896 CB LEU A 136 59.604 26.400 -4.184 1.00 25.00 C ATOM 897 CG LEU A 136 58.138 26.113 -3.841 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.246 27.326 -4.142 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.665 24.904 -4.653 1.00 25.00 C ATOM 0 H LEU A 136 61.900 27.079 -4.666 1.00 25.00 H new ATOM 0 HA LEU A 136 59.819 28.380 -3.316 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.649 26.746 -5.217 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.153 25.459 -4.139 1.00 25.00 H new ATOM 0 HG LEU A 136 58.063 25.902 -2.774 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.213 27.090 -3.888 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.579 28.179 -3.550 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.312 27.572 -5.202 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.623 24.692 -4.416 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.758 25.121 -5.717 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.277 24.037 -4.405 1.00 25.00 H new ATOM 911 N GLU A 137 61.217 25.944 -1.597 1.00 25.00 N ATOM 912 CA GLU A 137 61.290 25.347 -0.259 1.00 25.00 C ATOM 913 C GLU A 137 62.089 26.205 0.728 1.00 25.00 C ATOM 914 O GLU A 137 61.795 26.237 1.919 1.00 25.00 O ATOM 915 CB GLU A 137 61.952 23.968 -0.342 1.00 25.00 C ATOM 916 CG GLU A 137 61.217 22.952 -1.217 1.00 25.00 C ATOM 917 CD GLU A 137 59.800 22.663 -0.737 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.621 22.310 0.450 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.866 22.756 -1.564 1.00 25.00 O1- ATOM 0 H GLU A 137 61.866 25.546 -2.276 1.00 25.00 H new ATOM 0 HA GLU A 137 60.266 25.271 0.106 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.965 24.090 -0.725 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.039 23.562 0.666 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.178 23.324 -2.241 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.784 22.021 -1.237 1.00 25.00 H new ATOM 926 N SER A 138 63.125 26.873 0.237 1.00 25.00 N ATOM 927 CA SER A 138 64.011 27.649 1.110 1.00 25.00 C ATOM 928 C SER A 138 63.455 29.031 1.451 1.00 25.00 C ATOM 929 O SER A 138 63.822 29.617 2.470 1.00 25.00 O ATOM 930 CB SER A 138 65.386 27.805 0.465 1.00 25.00 C ATOM 931 OG SER A 138 65.305 28.522 -0.752 1.00 25.00 O ATOM 0 H SER A 138 63.375 26.897 -0.752 1.00 25.00 H new ATOM 0 HA SER A 138 64.090 27.089 2.042 1.00 25.00 H new ATOM 0 HB2 SER A 138 66.055 28.324 1.151 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.818 26.821 0.282 1.00 25.00 H new ATOM 0 HG SER A 138 65.030 27.916 -1.471 1.00 25.00 H new ATOM 937 N GLY A 139 62.588 29.562 0.599 1.00 25.00 N ATOM 938 CA GLY A 139 61.979 30.858 0.861 1.00 25.00 C ATOM 939 C GLY A 139 62.936 32.037 0.829 1.00 25.00 C ATOM 940 O GLY A 139 62.630 33.097 1.379 1.00 25.00 O ATOM 0 H GLY A 139 62.293 29.120 -0.272 1.00 25.00 H new ATOM 0 HA2 GLY A 139 61.193 31.028 0.126 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.499 30.826 1.839 1.00 25.00 H new ATOM 944 N ILE A 140 64.088 31.878 0.186 1.00 25.00 N ATOM 945 CA ILE A 140 65.067 32.962 0.056 1.00 25.00 C ATOM 946 C ILE A 140 65.367 33.143 -1.433 1.00 25.00 C ATOM 947 O ILE A 140 65.328 32.173 -2.182 1.00 25.00 O ATOM 948 CB ILE A 140 66.389 32.677 0.852 1.00 25.00 C ATOM 949 CG1 ILE A 140 67.039 31.342 0.416 1.00 25.00 C ATOM 950 CG2 ILE A 140 66.106 32.663 2.365 1.00 25.00 C ATOM 951 CD1 ILE A 140 68.447 31.104 0.982 1.00 25.00 C ATOM 0 H ILE A 140 64.372 31.004 -0.257 1.00 25.00 H new ATOM 0 HA ILE A 140 64.646 33.872 0.484 1.00 25.00 H new ATOM 0 HB ILE A 140 67.093 33.478 0.627 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.393 30.520 0.725 1.00 25.00 H new ATOM 0 HG13 ILE A 140 67.090 31.316 -0.673 1.00 25.00 H new ATOM 0 HG21 ILE A 140 67.031 32.464 2.906 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.708 33.631 2.670 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.378 31.884 2.592 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.825 30.146 0.625 1.00 25.00 H new ATOM 0 HD12 ILE A 140 69.112 31.902 0.652 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.405 31.094 2.071 1.00 25.00 H new ATOM 963 N PRO A 141 65.619 34.387 -1.887 1.00 25.00 N ATOM 964 CA PRO A 141 65.830 34.524 -3.334 1.00 25.00 C ATOM 965 C PRO A 141 67.037 33.759 -3.864 1.00 25.00 C ATOM 966 O PRO A 141 68.167 33.917 -3.375 1.00 25.00 O ATOM 967 CB PRO A 141 66.038 36.035 -3.512 1.00 25.00 C ATOM 968 CG PRO A 141 65.373 36.644 -2.331 1.00 25.00 C ATOM 969 CD PRO A 141 65.679 35.698 -1.216 1.00 25.00 C ATOM 0 HA PRO A 141 64.991 34.108 -3.892 1.00 25.00 H new ATOM 0 HB2 PRO A 141 67.098 36.289 -3.545 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.596 36.390 -4.443 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.760 37.642 -2.125 1.00 25.00 H new ATOM 0 HG3 PRO A 141 64.299 36.745 -2.486 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.660 35.887 -0.781 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.952 35.774 -0.408 1.00 25.00 H new ATOM 977 N ALA A 142 66.816 32.958 -4.897 1.00 25.00 N ATOM 978 CA ALA A 142 67.883 32.204 -5.546 1.00 25.00 C ATOM 979 C ALA A 142 68.853 33.170 -6.226 1.00 25.00 C ATOM 980 O ALA A 142 70.024 32.868 -6.382 1.00 25.00 O ATOM 981 CB ALA A 142 67.293 31.221 -6.570 1.00 25.00 C ATOM 0 H ALA A 142 65.895 32.812 -5.309 1.00 25.00 H new ATOM 0 HA ALA A 142 68.425 31.630 -4.795 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.100 30.665 -7.047 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.623 30.526 -6.063 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.737 31.774 -7.327 1.00 25.00 H new ATOM 987 N ALA A 143 68.355 34.336 -6.616 1.00 25.00 N ATOM 988 CA ALA A 143 69.179 35.355 -7.268 1.00 25.00 C ATOM 989 C ALA A 143 70.262 35.924 -6.332 1.00 25.00 C ATOM 990 O ALA A 143 71.284 36.422 -6.787 1.00 25.00 O ATOM 991 CB ALA A 143 68.281 36.484 -7.781 1.00 25.00 C ATOM 0 H ALA A 143 67.379 34.604 -6.493 1.00 25.00 H new ATOM 0 HA ALA A 143 69.697 34.879 -8.101 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.893 37.244 -8.267 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.565 36.082 -8.498 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.745 36.931 -6.944 1.00 25.00 H new ATOM 997 N GLU A 144 70.020 35.850 -5.031 1.00 25.00 N ATOM 998 CA GLU A 144 70.962 36.352 -4.023 1.00 25.00 C ATOM 999 C GLU A 144 71.844 35.223 -3.501 1.00 25.00 C ATOM 1000 O GLU A 144 72.655 35.421 -2.598 1.00 25.00 O ATOM 1001 CB GLU A 144 70.186 36.908 -2.830 1.00 25.00 C ATOM 1002 CG GLU A 144 69.344 38.136 -3.118 1.00 25.00 C ATOM 1003 CD GLU A 144 68.540 38.568 -1.888 1.00 25.00 C ATOM 1004 OE1 GLU A 144 68.583 37.854 -0.850 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 67.852 39.605 -1.960 1.00 25.00 O1- ATOM 0 H GLU A 144 69.171 35.443 -4.639 1.00 25.00 H new ATOM 0 HA GLU A 144 71.574 37.123 -4.491 1.00 25.00 H new ATOM 0 HB2 GLU A 144 69.535 36.124 -2.444 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.895 37.152 -2.039 1.00 25.00 H new ATOM 0 HG2 GLU A 144 69.990 38.954 -3.437 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.663 37.926 -3.943 1.00 25.00 H new ATOM 1012 N SER A 145 71.621 34.019 -4.006 1.00 25.00 N ATOM 1013 CA SER A 145 72.251 32.828 -3.455 1.00 25.00 C ATOM 1014 C SER A 145 73.125 32.114 -4.474 1.00 25.00 C ATOM 1015 O SER A 145 72.966 32.288 -5.674 1.00 25.00 O ATOM 1016 CB SER A 145 71.168 31.874 -2.958 1.00 25.00 C ATOM 1017 OG SER A 145 70.282 32.535 -2.068 1.00 25.00 O ATOM 0 H SER A 145 71.006 33.840 -4.800 1.00 25.00 H new ATOM 0 HA SER A 145 72.895 33.142 -2.634 1.00 25.00 H new ATOM 0 HB2 SER A 145 70.610 31.478 -3.806 1.00 25.00 H new ATOM 0 HB3 SER A 145 71.629 31.024 -2.455 1.00 25.00 H new ATOM 0 HG SER A 145 69.591 33.003 -2.582 1.00 25.00 H new ATOM 1023 N GLN A 146 74.022 31.277 -3.984 1.00 25.00 N ATOM 1024 CA GLN A 146 74.875 30.459 -4.836 1.00 25.00 C ATOM 1025 C GLN A 146 74.640 29.008 -4.491 1.00 25.00 C ATOM 1026 O GLN A 146 74.367 28.678 -3.342 1.00 25.00 O ATOM 1027 CB GLN A 146 76.345 30.826 -4.638 1.00 25.00 C ATOM 1028 CG GLN A 146 76.752 32.096 -5.378 1.00 25.00 C ATOM 1029 CD GLN A 146 76.912 31.854 -6.865 1.00 25.00 C ATOM 1030 OE1 GLN A 146 75.955 31.799 -7.606 1.00 25.00 O ATOM 1031 NE2 GLN A 146 78.130 31.673 -7.294 1.00 25.00 N ATOM 0 H GLN A 146 74.182 31.143 -2.985 1.00 25.00 H new ATOM 0 HA GLN A 146 74.630 30.636 -5.883 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.540 30.955 -3.573 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.968 29.999 -4.979 1.00 25.00 H new ATOM 0 HG2 GLN A 146 76.001 32.869 -5.214 1.00 25.00 H new ATOM 0 HG3 GLN A 146 77.690 32.471 -4.968 1.00 25.00 H new ATOM 0 HE21 GLN A 146 78.913 31.726 -6.643 1.00 25.00 H new ATOM 0 HE22 GLN A 146 78.299 31.478 -8.281 1.00 25.00 H new ATOM 1040 N ILE A 147 74.731 28.147 -5.490 1.00 25.00 N ATOM 1041 CA ILE A 147 74.441 26.726 -5.333 1.00 25.00 C ATOM 1042 C ILE A 147 75.687 25.929 -5.731 1.00 25.00 C ATOM 1043 O ILE A 147 76.342 26.228 -6.731 1.00 25.00 O ATOM 1044 CB ILE A 147 73.175 26.345 -6.171 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.841 24.859 -5.974 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.361 26.733 -7.666 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.558 24.399 -6.679 1.00 25.00 C ATOM 0 H ILE A 147 75.008 28.411 -6.436 1.00 25.00 H new ATOM 0 HA ILE A 147 74.207 26.484 -4.296 1.00 25.00 H new ATOM 0 HB ILE A 147 72.319 26.917 -5.813 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.676 24.260 -6.338 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.746 24.659 -4.907 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.468 26.458 -8.227 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.523 27.808 -7.745 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.223 26.205 -8.074 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.398 23.338 -6.487 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.710 24.968 -6.299 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.654 24.563 -7.752 1.00 25.00 H new ATOM 1059 N VAL A 148 76.071 24.994 -4.872 1.00 25.00 N ATOM 1060 CA VAL A 148 77.340 24.267 -4.981 1.00 25.00 C ATOM 1061 C VAL A 148 77.142 22.767 -4.743 1.00 25.00 C ATOM 1062 O VAL A 148 76.509 22.362 -3.776 1.00 25.00 O ATOM 1063 CB VAL A 148 78.357 24.822 -3.911 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.710 24.105 -3.988 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.586 26.334 -4.105 1.00 25.00 C ATOM 0 H VAL A 148 75.508 24.712 -4.070 1.00 25.00 H new ATOM 0 HA VAL A 148 77.728 24.413 -5.989 1.00 25.00 H new ATOM 0 HB VAL A 148 77.915 24.637 -2.932 1.00 25.00 H new ATOM 0 HG11 VAL A 148 80.383 24.516 -3.235 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.568 23.040 -3.805 1.00 25.00 H new ATOM 0 HG13 VAL A 148 80.142 24.249 -4.978 1.00 25.00 H new ATOM 0 HG21 VAL A 148 79.291 26.694 -3.356 1.00 25.00 H new ATOM 0 HG22 VAL A 148 78.990 26.516 -5.101 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.639 26.862 -3.996 1.00 25.00 H new ATOM 1075 N TYR A 149 77.731 21.948 -5.600 1.00 25.00 N ATOM 1076 CA TYR A 149 77.715 20.491 -5.443 1.00 25.00 C ATOM 1077 C TYR A 149 79.128 20.011 -5.750 1.00 25.00 C ATOM 1078 O TYR A 149 79.779 20.563 -6.633 1.00 25.00 O ATOM 1079 CB TYR A 149 76.706 19.859 -6.407 1.00 25.00 C ATOM 1080 CG TYR A 149 77.005 18.411 -6.717 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.797 17.398 -5.753 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.522 18.040 -7.975 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.123 16.044 -6.049 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.833 16.689 -8.270 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.635 15.706 -7.301 1.00 25.00 C ATOM 1086 OH TYR A 149 77.960 14.404 -7.579 1.00 25.00 O ATOM 0 H TYR A 149 78.235 22.269 -6.426 1.00 25.00 H new ATOM 0 HA TYR A 149 77.414 20.205 -4.435 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.707 19.933 -5.977 1.00 25.00 H new ATOM 0 HB3 TYR A 149 76.696 20.428 -7.337 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.388 17.653 -4.786 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.684 18.798 -8.727 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.973 15.278 -5.303 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.222 16.422 -9.242 1.00 25.00 H new ATOM 0 HH TYR A 149 77.251 13.812 -7.250 1.00 25.00 H new ATOM 1096 N ALA A 150 79.619 19.042 -4.977 1.00 25.00 N ATOM 1097 CA ALA A 150 80.985 18.515 -5.123 1.00 25.00 C ATOM 1098 C ALA A 150 82.031 19.650 -5.130 1.00 25.00 C ATOM 1099 O ALA A 150 82.954 19.657 -5.941 1.00 25.00 O ATOM 1100 CB ALA A 150 81.091 17.649 -6.399 1.00 25.00 C ATOM 0 H ALA A 150 79.085 18.597 -4.231 1.00 25.00 H new ATOM 0 HA ALA A 150 81.200 17.885 -4.260 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.107 17.265 -6.495 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.393 16.815 -6.332 1.00 25.00 H new ATOM 0 HB3 ALA A 150 80.848 18.256 -7.272 1.00 25.00 H new ATOM 1106 N GLU A 151 81.820 20.621 -4.244 1.00 25.00 N ATOM 1107 CA GLU A 151 82.669 21.825 -4.103 1.00 25.00 C ATOM 1108 C GLU A 151 82.767 22.705 -5.363 1.00 25.00 C ATOM 1109 O GLU A 151 83.591 23.622 -5.425 1.00 25.00 O ATOM 1110 CB GLU A 151 84.081 21.463 -3.605 1.00 25.00 C ATOM 1111 CG GLU A 151 84.088 20.769 -2.251 1.00 25.00 C ATOM 1112 CD GLU A 151 85.497 20.628 -1.692 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.271 19.791 -2.206 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.841 21.387 -0.757 1.00 25.00 O1- ATOM 0 H GLU A 151 81.041 20.602 -3.586 1.00 25.00 H new ATOM 0 HA GLU A 151 82.154 22.429 -3.356 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.561 20.816 -4.339 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.679 22.372 -3.542 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.474 21.335 -1.550 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.635 19.782 -2.347 1.00 25.00 H new ATOM 1121 N ARG A 152 81.895 22.482 -6.340 1.00 25.00 N ATOM 1122 CA ARG A 152 81.874 23.299 -7.560 1.00 25.00 C ATOM 1123 C ARG A 152 80.528 24.000 -7.717 1.00 25.00 C ATOM 1124 O ARG A 152 79.481 23.403 -7.475 1.00 25.00 O ATOM 1125 CB ARG A 152 82.142 22.415 -8.786 1.00 25.00 C ATOM 1126 CG ARG A 152 83.492 21.682 -8.749 1.00 25.00 C ATOM 1127 CD ARG A 152 84.669 22.657 -8.746 1.00 25.00 C ATOM 1128 NE ARG A 152 85.955 21.950 -8.629 1.00 25.00 N ATOM 1129 CZ ARG A 152 87.145 22.538 -8.574 1.00 25.00 C ATOM 1130 NH1 ARG A 152 87.282 23.839 -8.640 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 88.213 21.800 -8.451 1.00 25.00 N ATOM 0 H ARG A 152 81.191 21.744 -6.316 1.00 25.00 H new ATOM 0 HA ARG A 152 82.654 24.056 -7.480 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.343 21.678 -8.871 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.101 23.034 -9.682 1.00 25.00 H new ATOM 0 HG2 ARG A 152 83.539 21.053 -7.860 1.00 25.00 H new ATOM 0 HG3 ARG A 152 83.570 21.021 -9.612 1.00 25.00 H new ATOM 0 HD2 ARG A 152 84.658 23.245 -9.664 1.00 25.00 H new ATOM 0 HD3 ARG A 152 84.561 23.357 -7.918 1.00 25.00 H new ATOM 0 HE ARG A 152 85.930 20.931 -8.587 1.00 25.00 H new ATOM 0 HH11 ARG A 152 86.459 24.434 -8.737 1.00 25.00 H new ATOM 0 HH12 ARG A 152 88.211 24.257 -8.595 1.00 25.00 H new ATOM 0 HH21 ARG A 152 88.128 20.785 -8.398 1.00 25.00 H new ATOM 0 HH22 ARG A 152 89.133 22.238 -8.408 1.00 25.00 H new ATOM 1145 N PRO A 153 80.531 25.290 -8.099 1.00 25.00 N ATOM 1146 CA PRO A 153 79.217 25.916 -8.255 1.00 25.00 C ATOM 1147 C PRO A 153 78.488 25.416 -9.499 1.00 25.00 C ATOM 1148 O PRO A 153 79.114 25.072 -10.510 1.00 25.00 O ATOM 1149 CB PRO A 153 79.557 27.401 -8.368 1.00 25.00 C ATOM 1150 CG PRO A 153 80.887 27.413 -9.014 1.00 25.00 C ATOM 1151 CD PRO A 153 81.618 26.237 -8.412 1.00 25.00 C ATOM 0 HA PRO A 153 78.541 25.688 -7.431 1.00 25.00 H new ATOM 0 HB2 PRO A 153 78.818 27.936 -8.965 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.584 27.880 -7.389 1.00 25.00 H new ATOM 0 HG2 PRO A 153 80.802 27.314 -10.096 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.413 28.348 -8.819 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.337 25.809 -9.111 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.173 26.522 -7.519 1.00 25.00 H new ATOM 1159 N LEU A 154 77.169 25.388 -9.431 1.00 25.00 N ATOM 1160 CA LEU A 154 76.342 24.933 -10.549 1.00 25.00 C ATOM 1161 C LEU A 154 75.826 26.173 -11.283 1.00 0.00 C ATOM 1162 O LEU A 154 74.809 26.745 -10.911 1.00 25.00 O ATOM 1163 CB LEU A 154 75.180 24.064 -10.044 1.00 25.00 C ATOM 1164 CG LEU A 154 75.543 22.843 -9.180 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.276 22.159 -8.683 1.00 25.00 C ATOM 1166 CD2 LEU A 154 76.369 21.856 -9.968 1.00 25.00 C ATOM 0 H LEU A 154 76.638 25.676 -8.609 1.00 25.00 H new ATOM 0 HA LEU A 154 76.929 24.316 -11.230 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.508 24.699 -9.467 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.620 23.711 -10.910 1.00 25.00 H new ATOM 0 HG LEU A 154 76.128 23.191 -8.329 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.544 21.296 -8.073 1.00 25.00 H new ATOM 0 HD12 LEU A 154 73.695 22.860 -8.085 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.682 21.830 -9.536 1.00 25.00 H new ATOM 0 HD21 LEU A 154 76.614 21.001 -9.337 1.00 25.00 H new ATOM 0 HD22 LEU A 154 75.802 21.517 -10.835 1.00 25.00 H new ATOM 0 HD23 LEU A 154 77.289 22.336 -10.302 1.00 25.00 H new ATOM 1178 N THR A 155 76.585 26.636 -12.269 1.00 25.00 N ATOM 1179 CA THR A 155 76.285 27.900 -12.945 1.00 25.00 C ATOM 1180 C THR A 155 75.565 27.757 -14.279 1.00 25.00 C ATOM 1181 O THR A 155 74.953 28.712 -14.755 1.00 25.00 O ATOM 1182 CB THR A 155 77.591 28.672 -13.224 1.00 25.00 C ATOM 1183 OG1 THR A 155 78.464 27.850 -14.008 1.00 25.00 O ATOM 1184 CG2 THR A 155 78.315 29.011 -11.921 1.00 25.00 C ATOM 0 H THR A 155 77.414 26.157 -12.621 1.00 25.00 H new ATOM 0 HA THR A 155 75.619 28.425 -12.260 1.00 25.00 H new ATOM 0 HB THR A 155 77.336 29.593 -13.749 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.295 28.336 -14.190 1.00 25.00 H new ATOM 0 HG21 THR A 155 79.232 29.555 -12.145 1.00 25.00 H new ATOM 0 HG22 THR A 155 77.670 29.629 -11.297 1.00 25.00 H new ATOM 0 HG23 THR A 155 78.559 28.091 -11.391 1.00 25.00 H new ATOM 1192 N ASP A 156 75.647 26.593 -14.905 1.00 25.00 N ATOM 1193 CA ASP A 156 75.042 26.414 -16.227 1.00 25.00 C ATOM 1194 C ASP A 156 73.622 25.913 -16.054 1.00 25.00 C ATOM 1195 O ASP A 156 73.377 24.728 -15.834 1.00 25.00 O ATOM 1196 CB ASP A 156 75.843 25.434 -17.082 1.00 25.00 C ATOM 1197 CG ASP A 156 77.249 25.915 -17.365 1.00 25.00 C ATOM 1198 OD1 ASP A 156 77.434 27.088 -17.723 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 78.183 25.083 -17.261 1.00 25.00 O1- ATOM 0 H ASP A 156 76.117 25.768 -14.532 1.00 25.00 H new ATOM 0 HA ASP A 156 75.041 27.374 -16.743 1.00 25.00 H new ATOM 0 HB2 ASP A 156 75.889 24.470 -16.575 1.00 25.00 H new ATOM 0 HB3 ASP A 156 75.322 25.273 -18.026 1.00 25.00 H new ATOM 1204 N ASN A 157 72.680 26.834 -16.155 1.00 25.00 N ATOM 1205 CA ASN A 157 71.267 26.527 -15.951 1.00 25.00 C ATOM 1206 C ASN A 157 70.711 25.579 -17.024 1.00 25.00 C ATOM 1207 O ASN A 157 69.684 24.944 -16.827 1.00 25.00 O ATOM 1208 CB ASN A 157 70.468 27.837 -15.950 1.00 25.00 C ATOM 1209 CG ASN A 157 70.307 28.420 -17.335 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.277 28.646 -18.040 1.00 25.00 O ATOM 1211 ND2 ASN A 157 69.092 28.662 -17.734 1.00 25.00 N ATOM 0 H ASN A 157 72.867 27.811 -16.379 1.00 25.00 H new ATOM 0 HA ASN A 157 71.170 26.016 -14.993 1.00 25.00 H new ATOM 0 HB2 ASN A 157 69.483 27.657 -15.519 1.00 25.00 H new ATOM 0 HB3 ASN A 157 70.969 28.563 -15.310 1.00 25.00 H new ATOM 0 HD21 ASN A 157 68.928 29.053 -18.662 1.00 25.00 H new ATOM 0 HD22 ASN A 157 68.304 28.461 -17.119 1.00 25.00 H new ATOM 1218 N HIS A 158 71.398 25.508 -18.153 1.00 25.00 N ATOM 1219 CA HIS A 158 70.962 24.704 -19.289 1.00 25.00 C ATOM 1220 C HIS A 158 71.365 23.223 -19.179 1.00 25.00 C ATOM 1221 O HIS A 158 70.985 22.414 -20.012 1.00 25.00 O ATOM 1222 CB HIS A 158 71.558 25.316 -20.567 1.00 25.00 C ATOM 1223 CG HIS A 158 70.864 24.892 -21.827 1.00 25.00 C ATOM 1224 ND1 HIS A 158 69.638 25.359 -22.229 1.00 25.00 N ATOM 1225 CD2 HIS A 158 71.245 24.020 -22.801 1.00 25.00 C ATOM 1226 CE1 HIS A 158 69.334 24.782 -23.387 1.00 25.00 C ATOM 1227 NE2 HIS A 158 70.284 23.962 -23.789 1.00 25.00 N ATOM 0 H HIS A 158 72.274 26.006 -18.310 1.00 25.00 H new ATOM 0 HA HIS A 158 69.872 24.719 -19.311 1.00 25.00 H new ATOM 0 HB2 HIS A 158 71.518 26.403 -20.490 1.00 25.00 H new ATOM 0 HB3 HIS A 158 72.610 25.040 -20.633 1.00 25.00 H new ATOM 0 HD2 HIS A 158 72.166 23.456 -22.800 1.00 25.00 H new ATOM 0 HE1 HIS A 158 68.420 24.963 -23.932 1.00 25.00 H new ATOM 0 HE2 HIS A 158 70.304 23.406 -24.644 1.00 25.00 H new ATOM 1235 N ARG A 159 72.146 22.859 -18.168 1.00 25.00 N ATOM 1236 CA ARG A 159 72.543 21.455 -18.009 1.00 25.00 C ATOM 1237 C ARG A 159 71.546 20.734 -17.130 1.00 25.00 C ATOM 1238 O ARG A 159 71.008 21.317 -16.189 1.00 25.00 O ATOM 1239 CB ARG A 159 73.926 21.341 -17.373 1.00 25.00 C ATOM 1240 CG ARG A 159 75.034 21.890 -18.229 1.00 25.00 C ATOM 1241 CD ARG A 159 76.391 21.608 -17.596 1.00 25.00 C ATOM 1242 NE ARG A 159 77.420 22.522 -18.106 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.100 22.384 -19.234 1.00 25.00 C ATOM 1244 NH1 ARG A 159 77.942 21.366 -20.043 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.958 23.313 -19.546 1.00 25.00 N ATOM 0 H ARG A 159 72.512 23.495 -17.459 1.00 25.00 H new ATOM 0 HA ARG A 159 72.570 21.003 -19.001 1.00 25.00 H new ATOM 0 HB2 ARG A 159 73.922 21.868 -16.419 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.131 20.292 -17.157 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.990 21.442 -19.222 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.903 22.964 -18.358 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.317 21.709 -16.513 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.683 20.578 -17.801 1.00 25.00 H new ATOM 0 HE ARG A 159 77.632 23.342 -17.537 1.00 25.00 H new ATOM 0 HH11 ARG A 159 77.270 20.633 -19.815 1.00 25.00 H new ATOM 0 HH12 ARG A 159 78.491 21.306 -20.901 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.089 24.114 -18.929 1.00 25.00 H new ATOM 0 HH22 ARG A 159 79.499 23.239 -20.407 1.00 25.00 H new ATOM 1259 N SER A 160 71.357 19.452 -17.391 1.00 25.00 N ATOM 1260 CA SER A 160 70.539 18.624 -16.520 1.00 25.00 C ATOM 1261 C SER A 160 71.383 18.240 -15.319 1.00 25.00 C ATOM 1262 O SER A 160 72.613 18.289 -15.372 1.00 25.00 O ATOM 1263 CB SER A 160 70.033 17.378 -17.249 1.00 25.00 C ATOM 1264 OG SER A 160 71.107 16.540 -17.652 1.00 25.00 O ATOM 0 H SER A 160 71.755 18.964 -18.193 1.00 25.00 H new ATOM 0 HA SER A 160 69.658 19.181 -16.202 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.360 16.821 -16.597 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.455 17.676 -18.123 1.00 25.00 H new ATOM 0 HG SER A 160 70.752 15.752 -18.113 1.00 25.00 H new ATOM 1270 N LEU A 161 70.739 17.865 -14.231 1.00 25.00 N ATOM 1271 CA LEU A 161 71.450 17.498 -13.008 1.00 25.00 C ATOM 1272 C LEU A 161 72.284 16.237 -13.219 1.00 25.00 C ATOM 1273 O LEU A 161 73.390 16.098 -12.684 1.00 25.00 O ATOM 1274 CB LEU A 161 70.432 17.280 -11.890 1.00 25.00 C ATOM 1275 CG LEU A 161 69.653 18.541 -11.500 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.403 18.147 -10.753 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.524 19.476 -10.657 1.00 25.00 C ATOM 0 H LEU A 161 69.723 17.804 -14.163 1.00 25.00 H new ATOM 0 HA LEU A 161 72.131 18.304 -12.735 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.725 16.511 -12.201 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.950 16.899 -11.010 1.00 25.00 H new ATOM 0 HG LEU A 161 69.369 19.081 -12.403 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.848 19.043 -10.475 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.781 17.518 -11.390 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.675 17.595 -9.853 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.952 20.365 -10.391 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.837 18.961 -9.749 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.404 19.769 -11.230 1.00 25.00 H new ATOM 1289 N ALA A 162 71.790 15.337 -14.055 1.00 25.00 N ATOM 1290 CA ALA A 162 72.523 14.116 -14.363 1.00 25.00 C ATOM 1291 C ALA A 162 73.801 14.453 -15.133 1.00 25.00 C ATOM 1292 O ALA A 162 74.816 13.780 -14.985 1.00 25.00 O ATOM 1293 CB ALA A 162 71.651 13.147 -15.160 1.00 25.00 C ATOM 0 H ALA A 162 70.892 15.426 -14.530 1.00 25.00 H new ATOM 0 HA ALA A 162 72.797 13.628 -13.427 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.219 12.243 -15.379 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.767 12.889 -14.577 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.344 13.618 -16.094 1.00 25.00 H new ATOM 1299 N SER A 163 73.773 15.534 -15.905 1.00 25.00 N ATOM 1300 CA SER A 163 74.966 15.982 -16.628 1.00 25.00 C ATOM 1301 C SER A 163 76.003 16.552 -15.660 1.00 25.00 C ATOM 1302 O SER A 163 77.178 16.665 -15.998 1.00 25.00 O ATOM 1303 CB SER A 163 74.615 17.056 -17.660 1.00 25.00 C ATOM 1304 OG SER A 163 73.671 16.572 -18.607 1.00 25.00 O ATOM 0 H SER A 163 72.947 16.114 -16.048 1.00 25.00 H new ATOM 0 HA SER A 163 75.379 15.113 -17.139 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.209 17.932 -17.153 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.520 17.377 -18.176 1.00 25.00 H new ATOM 0 HG SER A 163 72.764 16.700 -18.259 1.00 25.00 H new ATOM 1310 N TYR A 164 75.576 16.882 -14.448 1.00 25.00 N ATOM 1311 CA TYR A 164 76.489 17.366 -13.417 1.00 25.00 C ATOM 1312 C TYR A 164 76.922 16.205 -12.520 1.00 25.00 C ATOM 1313 O TYR A 164 77.789 16.360 -11.665 1.00 25.00 O ATOM 1314 CB TYR A 164 75.810 18.437 -12.563 1.00 25.00 C ATOM 1315 CG TYR A 164 75.981 19.849 -13.063 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.257 20.446 -13.088 1.00 25.00 C ATOM 1317 CD2 TYR A 164 74.867 20.619 -13.466 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.430 21.786 -13.495 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.036 21.981 -13.868 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.319 22.545 -13.869 1.00 25.00 C ATOM 1321 OH TYR A 164 76.537 23.848 -14.227 1.00 25.00 O ATOM 0 H TYR A 164 74.601 16.824 -14.153 1.00 25.00 H new ATOM 0 HA TYR A 164 77.363 17.799 -13.904 1.00 25.00 H new ATOM 0 HB2 TYR A 164 74.745 18.214 -12.505 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.204 18.376 -11.548 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.119 19.867 -12.790 1.00 25.00 H new ATOM 0 HD2 TYR A 164 73.882 20.176 -13.470 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.417 22.223 -13.517 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.182 22.570 -14.168 1.00 25.00 H new ATOM 0 HH TYR A 164 77.431 23.935 -14.618 1.00 25.00 H new ATOM 1331 N GLY A 165 76.326 15.040 -12.727 1.00 25.00 N ATOM 1332 CA GLY A 165 76.652 13.870 -11.927 1.00 25.00 C ATOM 1333 C GLY A 165 75.869 13.763 -10.629 1.00 25.00 C ATOM 1334 O GLY A 165 76.285 13.044 -9.714 1.00 25.00 O ATOM 0 H GLY A 165 75.615 14.880 -13.441 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.470 12.975 -12.522 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.717 13.888 -11.695 1.00 25.00 H new ATOM 1338 N LEU A 166 74.739 14.457 -10.534 1.00 25.00 N ATOM 1339 CA LEU A 166 73.923 14.385 -9.319 1.00 25.00 C ATOM 1340 C LEU A 166 73.237 13.026 -9.200 1.00 25.00 C ATOM 1341 O LEU A 166 72.116 12.833 -9.659 1.00 25.00 O ATOM 1342 CB LEU A 166 72.857 15.493 -9.286 1.00 25.00 C ATOM 1343 CG LEU A 166 73.208 16.866 -8.692 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.644 16.740 -7.240 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.259 17.607 -9.481 1.00 25.00 C ATOM 0 H LEU A 166 74.370 15.065 -11.265 1.00 25.00 H new ATOM 0 HA LEU A 166 74.600 14.524 -8.476 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.525 15.656 -10.311 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.002 15.107 -8.731 1.00 25.00 H new ATOM 0 HG LEU A 166 72.292 17.455 -8.747 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.886 17.727 -6.846 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.835 16.304 -6.654 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.523 16.099 -7.179 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.460 18.568 -9.007 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.176 17.018 -9.509 1.00 25.00 H new ATOM 0 HD23 LEU A 166 73.902 17.771 -10.498 1.00 25.00 H new ATOM 1357 N LYS A 167 73.939 12.099 -8.575 1.00 25.00 N ATOM 1358 CA LYS A 167 73.388 10.781 -8.235 1.00 25.00 C ATOM 1359 C LYS A 167 72.262 10.917 -7.224 1.00 25.00 C ATOM 1360 O LYS A 167 72.250 11.838 -6.416 1.00 25.00 O ATOM 1361 CB LYS A 167 74.462 9.912 -7.582 1.00 25.00 C ATOM 1362 CG LYS A 167 75.670 9.671 -8.442 1.00 25.00 C ATOM 1363 CD LYS A 167 76.675 8.813 -7.691 1.00 25.00 C ATOM 1364 CE LYS A 167 77.940 8.634 -8.507 1.00 25.00 C ATOM 1365 NZ LYS A 167 77.625 7.958 -9.815 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.908 12.229 -8.285 1.00 25.00 H new ATOM 0 HA LYS A 167 73.026 10.332 -9.160 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.780 10.385 -6.653 1.00 25.00 H new ATOM 0 HB3 LYS A 167 74.023 8.951 -7.316 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.376 9.176 -9.368 1.00 25.00 H new ATOM 0 HG3 LYS A 167 76.125 10.622 -8.720 1.00 25.00 H new ATOM 0 HD2 LYS A 167 76.915 9.278 -6.735 1.00 25.00 H new ATOM 0 HD3 LYS A 167 76.237 7.839 -7.471 1.00 25.00 H new ATOM 0 HE2 LYS A 167 78.402 9.604 -8.693 1.00 25.00 H new ATOM 0 HE3 LYS A 167 78.662 8.039 -7.947 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 78.505 7.613 -10.248 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 76.985 7.156 -9.646 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 77.167 8.637 -10.455 1.00 25.00 H new ATOM 1379 N ASP A 168 71.374 9.941 -7.198 1.00 25.00 N ATOM 1380 CA ASP A 168 70.350 9.873 -6.172 1.00 25.00 C ATOM 1381 C ASP A 168 71.043 9.786 -4.811 1.00 25.00 C ATOM 1382 O ASP A 168 71.979 9.011 -4.616 1.00 25.00 O ATOM 1383 CB ASP A 168 69.425 8.660 -6.392 1.00 25.00 C ATOM 1384 CG ASP A 168 70.193 7.341 -6.544 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.980 7.210 -7.521 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.920 6.399 -5.768 1.00 25.00 O1- ATOM 0 H ASP A 168 71.341 9.182 -7.878 1.00 25.00 H new ATOM 0 HA ASP A 168 69.725 10.765 -6.217 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.736 8.578 -5.551 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.821 8.827 -7.284 1.00 25.00 H new ATOM 1391 N GLY A 169 70.607 10.634 -3.892 1.00 25.00 N ATOM 1392 CA GLY A 169 71.196 10.682 -2.562 1.00 25.00 C ATOM 1393 C GLY A 169 72.264 11.748 -2.396 1.00 25.00 C ATOM 1394 O GLY A 169 72.666 12.035 -1.267 1.00 25.00 O ATOM 0 H GLY A 169 69.848 11.298 -4.042 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.406 10.858 -1.832 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.630 9.709 -2.333 1.00 25.00 H new ATOM 1398 N ASP A 170 72.721 12.353 -3.487 1.00 25.00 N ATOM 1399 CA ASP A 170 73.747 13.402 -3.384 1.00 25.00 C ATOM 1400 C ASP A 170 73.207 14.628 -2.655 1.00 25.00 C ATOM 1401 O ASP A 170 72.008 14.948 -2.729 1.00 25.00 O ATOM 1402 CB ASP A 170 74.255 13.832 -4.766 1.00 25.00 C ATOM 1403 CG ASP A 170 75.367 12.927 -5.296 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.052 12.261 -4.490 1.00 25.00 O ATOM 1405 OD2 ASP A 170 75.629 12.972 -6.515 1.00 25.00 O1- ATOM 0 H ASP A 170 72.410 12.146 -4.436 1.00 25.00 H new ATOM 0 HA ASP A 170 74.575 12.976 -2.817 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.424 13.829 -5.471 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.622 14.857 -4.710 1.00 25.00 H new ATOM 1410 N VAL A 171 74.101 15.313 -1.954 1.00 25.00 N ATOM 1411 CA VAL A 171 73.741 16.490 -1.164 1.00 25.00 C ATOM 1412 C VAL A 171 74.287 17.749 -1.834 1.00 25.00 C ATOM 1413 O VAL A 171 75.476 17.836 -2.163 1.00 25.00 O ATOM 1414 CB VAL A 171 74.298 16.388 0.291 1.00 25.00 C ATOM 1415 CG1 VAL A 171 73.808 17.578 1.146 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.857 15.063 0.950 1.00 25.00 C ATOM 0 H VAL A 171 75.092 15.073 -1.915 1.00 25.00 H new ATOM 0 HA VAL A 171 72.654 16.542 -1.111 1.00 25.00 H new ATOM 0 HB VAL A 171 75.386 16.414 0.236 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.207 17.489 2.156 1.00 25.00 H new ATOM 0 HG12 VAL A 171 74.152 18.512 0.701 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.719 17.574 1.184 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.255 15.011 1.963 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.768 15.019 0.985 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.236 14.223 0.367 1.00 25.00 H new ATOM 1426 N VAL A 172 73.414 18.723 -2.033 1.00 25.00 N ATOM 1427 CA VAL A 172 73.766 19.995 -2.655 1.00 25.00 C ATOM 1428 C VAL A 172 73.770 21.068 -1.574 1.00 25.00 C ATOM 1429 O VAL A 172 72.865 21.123 -0.754 1.00 25.00 O ATOM 1430 CB VAL A 172 72.734 20.361 -3.752 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.185 21.602 -4.519 1.00 25.00 C ATOM 1432 CG2 VAL A 172 72.553 19.191 -4.719 1.00 25.00 C ATOM 0 H VAL A 172 72.432 18.655 -1.766 1.00 25.00 H new ATOM 0 HA VAL A 172 74.749 19.920 -3.120 1.00 25.00 H new ATOM 0 HB VAL A 172 71.781 20.575 -3.269 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.448 21.844 -5.285 1.00 25.00 H new ATOM 0 HG12 VAL A 172 73.281 22.441 -3.830 1.00 25.00 H new ATOM 0 HG13 VAL A 172 74.148 21.408 -4.991 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.826 19.461 -5.485 1.00 25.00 H new ATOM 0 HG22 VAL A 172 73.507 18.958 -5.191 1.00 25.00 H new ATOM 0 HG23 VAL A 172 72.197 18.318 -4.172 1.00 25.00 H new ATOM 1442 N ILE A 173 74.780 21.924 -1.574 1.00 25.00 N ATOM 1443 CA ILE A 173 74.892 22.979 -0.573 1.00 25.00 C ATOM 1444 C ILE A 173 74.573 24.314 -1.240 1.00 25.00 C ATOM 1445 O ILE A 173 75.228 24.715 -2.197 1.00 25.00 O ATOM 1446 CB ILE A 173 76.320 23.025 0.062 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.706 21.627 0.607 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.363 24.081 1.206 1.00 25.00 C ATOM 1449 CD1 ILE A 173 78.157 21.506 1.109 1.00 25.00 C ATOM 0 H ILE A 173 75.537 21.910 -2.257 1.00 25.00 H new ATOM 0 HA ILE A 173 74.187 22.776 0.233 1.00 25.00 H new ATOM 0 HB ILE A 173 77.039 23.311 -0.706 1.00 25.00 H new ATOM 0 HG12 ILE A 173 76.031 21.373 1.425 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.546 20.889 -0.179 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.362 24.105 1.642 1.00 25.00 H new ATOM 0 HG22 ILE A 173 76.119 25.064 0.803 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.638 23.814 1.975 1.00 25.00 H new ATOM 0 HD11 ILE A 173 78.334 20.493 1.471 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.844 21.724 0.292 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.322 22.215 1.920 1.00 25.00 H new ATOM 1461 N LEU A 174 73.555 24.991 -0.739 1.00 25.00 N ATOM 1462 CA LEU A 174 73.113 26.272 -1.277 1.00 25.00 C ATOM 1463 C LEU A 174 73.400 27.314 -0.205 1.00 25.00 C ATOM 1464 O LEU A 174 73.146 27.085 0.966 1.00 25.00 O ATOM 1465 CB LEU A 174 71.625 26.175 -1.628 1.00 25.00 C ATOM 1466 CG LEU A 174 70.991 27.340 -2.409 1.00 25.00 C ATOM 1467 CD1 LEU A 174 69.786 26.814 -3.175 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.546 28.486 -1.493 1.00 25.00 C ATOM 0 H LEU A 174 73.006 24.668 0.058 1.00 25.00 H new ATOM 0 HA LEU A 174 73.634 26.551 -2.193 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.477 25.264 -2.208 1.00 25.00 H new ATOM 0 HB3 LEU A 174 71.069 26.054 -0.698 1.00 25.00 H new ATOM 0 HG LEU A 174 71.746 27.740 -3.086 1.00 25.00 H new ATOM 0 HD11 LEU A 174 69.326 27.629 -3.734 1.00 25.00 H new ATOM 0 HD12 LEU A 174 70.106 26.035 -3.867 1.00 25.00 H new ATOM 0 HD13 LEU A 174 69.061 26.400 -2.474 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.106 29.282 -2.094 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.807 28.117 -0.782 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.408 28.875 -0.952 1.00 25.00 H new ATOM 1480 N ARG A 175 74.025 28.419 -0.577 1.00 25.00 N ATOM 1481 CA ARG A 175 74.499 29.401 0.404 1.00 25.00 C ATOM 1482 C ARG A 175 74.084 30.819 0.062 1.00 25.00 C ATOM 1483 O ARG A 175 74.317 31.294 -1.047 1.00 25.00 O ATOM 1484 CB ARG A 175 76.031 29.343 0.470 1.00 25.00 C ATOM 1485 CG ARG A 175 76.582 27.990 0.926 1.00 25.00 C ATOM 1486 CD ARG A 175 78.077 27.873 0.677 1.00 25.00 C ATOM 1487 NE ARG A 175 78.855 28.854 1.456 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.175 28.989 1.417 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.936 28.232 0.660 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.743 29.902 2.151 1.00 25.00 N ATOM 0 H ARG A 175 74.219 28.665 -1.548 1.00 25.00 H new ATOM 0 HA ARG A 175 74.047 29.145 1.362 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.436 29.576 -0.515 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.385 30.117 1.151 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.379 27.855 1.988 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.063 27.190 0.398 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.407 26.866 0.932 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.278 28.015 -0.385 1.00 25.00 H new ATOM 0 HE ARG A 175 78.337 29.479 2.074 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.516 27.510 0.075 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.947 28.366 0.657 1.00 25.00 H new ATOM 0 HH21 ARG A 175 80.175 30.504 2.747 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.756 30.016 2.130 1.00 25.00 H new ATOM 1504 N GLN A 176 73.550 31.517 1.063 1.00 25.00 N ATOM 1505 CA GLN A 176 73.273 32.964 0.993 1.00 25.00 C ATOM 1506 C GLN A 176 74.119 33.712 2.047 1.00 25.00 C ATOM 1507 O GLN A 176 75.086 34.341 1.664 1.00 25.00 O ATOM 1508 CB GLN A 176 71.759 33.271 1.115 1.00 25.00 C ATOM 1509 CG GLN A 176 71.484 34.738 0.756 1.00 25.00 C ATOM 1510 CD GLN A 176 70.018 35.068 0.799 1.00 25.00 C ATOM 1511 OE1 GLN A 176 69.211 34.782 -0.220 1.00 25.00 O flip ATOM 1512 NE2 GLN A 176 69.477 35.683 1.830 1.00 25.00 N flip ATOM 1513 OXT GLN A 176 73.863 33.571 3.211 1.00 25.00 O ATOM 0 H GLN A 176 73.293 31.097 1.956 1.00 25.00 H new ATOM 0 HA GLN A 176 73.567 33.328 0.008 1.00 25.00 H new ATOM 0 HB2 GLN A 176 71.193 32.615 0.453 1.00 25.00 H new ATOM 0 HB3 GLN A 176 71.420 33.068 2.131 1.00 25.00 H new ATOM 0 HG2 GLN A 176 72.021 35.386 1.448 1.00 25.00 H new ATOM 0 HG3 GLN A 176 71.872 34.945 -0.241 1.00 25.00 H new ATOM 0 HE21 GLN A 176 70.051 35.926 2.638 1.00 25.00 H new ATOM 0 HE22 GLN A 176 68.484 35.917 1.821 1.00 25.00 H new