USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=17 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 128 HIS : no HE2:sc= 0.615 K(o=0.75,f=-4.6!) USER MOD Set 1.2: A 157 ASN : amide:sc= 0.137 K(o=0.75,f=-1.6) USER MOD Single : A 100 HIS : no HE2:sc= 1.15 K(o=1.2,f=-3.7!) USER MOD Single : A 101 MET CE :methyl -147:sc= -0.202 (180deg=-1.57) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 CYS SG : rot -160:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc=-0.00627 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 129 ASN : amide:sc=-0.00881 K(o=-0.0088,f=-0.73) USER MOD Single : A 134 CYS SG : rot -13:sc= -0.828 USER MOD Single : A 138 SER OG : rot 83:sc= 1.07 USER MOD Single : A 145 SER OG : rot -85:sc= 0.0529 USER MOD Single : A 146 GLN : amide:sc= -0.0345 X(o=-0.034,f=0) USER MOD Single : A 149 TYR OH : rot 4:sc= 0.0777 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0.00352 USER MOD Single : A 158 HIS : no HD1:sc=-0.000452 X(o=-0.00045,f=-0.052) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 160:sc= 0.349 USER MOD Single : A 164 TYR OH : rot 30:sc= -0.166 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0.469 K(o=0.47,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 63.265 8.770 -12.056 1.00 25.00 N ATOM 307 CA HIS A 100 63.223 10.023 -11.327 1.00 25.00 C ATOM 308 C HIS A 100 64.194 9.829 -10.182 1.00 25.00 C ATOM 309 O HIS A 100 64.569 8.699 -9.898 1.00 25.00 O ATOM 310 CB HIS A 100 61.802 10.291 -10.840 1.00 25.00 C ATOM 311 CG HIS A 100 60.760 10.068 -11.898 1.00 25.00 C ATOM 312 ND1 HIS A 100 60.820 10.629 -13.179 1.00 25.00 N ATOM 313 CD2 HIS A 100 59.621 9.321 -11.903 1.00 25.00 C ATOM 314 CE1 HIS A 100 59.760 10.228 -13.872 1.00 25.00 C ATOM 315 NE2 HIS A 100 59.027 9.444 -13.122 1.00 25.00 N ATOM 0 HA HIS A 100 63.499 10.886 -11.933 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.589 9.645 -9.988 1.00 25.00 H new ATOM 0 HB3 HIS A 100 61.735 11.319 -10.485 1.00 25.00 H new ATOM 0 HD1 HIS A 100 61.557 11.245 -13.524 1.00 25.00 H new ATOM 0 HD2 HIS A 100 59.251 8.730 -11.078 1.00 25.00 H new ATOM 0 HE1 HIS A 100 59.538 10.505 -14.892 1.00 25.00 H new ATOM 323 N MET A 101 64.629 10.906 -9.556 1.00 25.00 N ATOM 324 CA MET A 101 65.628 10.818 -8.502 1.00 25.00 C ATOM 325 C MET A 101 65.198 11.619 -7.282 1.00 25.00 C ATOM 326 O MET A 101 64.259 12.415 -7.350 1.00 25.00 O ATOM 327 CB MET A 101 66.967 11.386 -8.994 1.00 25.00 C ATOM 328 CG MET A 101 67.466 10.808 -10.308 1.00 25.00 C ATOM 329 SD MET A 101 69.170 11.309 -10.661 1.00 25.00 S ATOM 330 CE MET A 101 69.051 13.141 -10.659 1.00 25.00 C ATOM 0 H MET A 101 64.308 11.853 -9.757 1.00 25.00 H new ATOM 0 HA MET A 101 65.735 9.767 -8.235 1.00 25.00 H new ATOM 0 HB2 MET A 101 66.868 12.466 -9.104 1.00 25.00 H new ATOM 0 HB3 MET A 101 67.722 11.211 -8.228 1.00 25.00 H new ATOM 0 HG2 MET A 101 67.407 9.720 -10.272 1.00 25.00 H new ATOM 0 HG3 MET A 101 66.816 11.135 -11.119 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.758 13.552 -11.379 1.00 25.00 H new ATOM 0 HE2 MET A 101 68.039 13.440 -10.933 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.285 13.520 -9.664 1.00 25.00 H new ATOM 340 N LEU A 102 65.935 11.467 -6.193 1.00 25.00 N ATOM 341 CA LEU A 102 65.733 12.267 -4.989 1.00 25.00 C ATOM 342 C LEU A 102 67.101 12.836 -4.611 1.00 25.00 C ATOM 343 O LEU A 102 68.087 12.104 -4.615 1.00 25.00 O ATOM 344 CB LEU A 102 65.195 11.390 -3.856 1.00 25.00 C ATOM 345 CG LEU A 102 64.800 12.117 -2.560 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.441 12.805 -2.699 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.747 11.125 -1.403 1.00 25.00 C ATOM 0 H LEU A 102 66.691 10.786 -6.116 1.00 25.00 H new ATOM 0 HA LEU A 102 65.009 13.063 -5.162 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.323 10.851 -4.225 1.00 25.00 H new ATOM 0 HB3 LEU A 102 65.951 10.644 -3.613 1.00 25.00 H new ATOM 0 HG LEU A 102 65.554 12.879 -2.362 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.191 13.309 -1.766 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.484 13.536 -3.506 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.678 12.060 -2.924 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.467 11.647 -0.488 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.010 10.352 -1.620 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.727 10.666 -1.273 1.00 25.00 H new ATOM 359 N LEU A 103 67.167 14.122 -4.314 1.00 25.00 N ATOM 360 CA LEU A 103 68.421 14.773 -3.917 1.00 25.00 C ATOM 361 C LEU A 103 68.188 15.509 -2.620 1.00 25.00 C ATOM 362 O LEU A 103 67.072 15.947 -2.359 1.00 25.00 O ATOM 363 CB LEU A 103 68.879 15.779 -4.978 1.00 25.00 C ATOM 364 CG LEU A 103 69.308 15.220 -6.343 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.651 16.386 -7.259 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.500 14.289 -6.219 1.00 25.00 C ATOM 0 H LEU A 103 66.363 14.749 -4.338 1.00 25.00 H new ATOM 0 HA LEU A 103 69.193 14.011 -3.804 1.00 25.00 H new ATOM 0 HB2 LEU A 103 68.067 16.487 -5.144 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.716 16.344 -4.567 1.00 25.00 H new ATOM 0 HG LEU A 103 68.485 14.639 -6.758 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.958 16.005 -8.233 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.776 17.025 -7.378 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.465 16.964 -6.823 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.773 13.914 -7.205 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.343 14.832 -5.791 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.241 13.451 -5.572 1.00 25.00 H new ATOM 378 N THR A 104 69.234 15.677 -1.830 1.00 25.00 N ATOM 379 CA THR A 104 69.140 16.417 -0.582 1.00 25.00 C ATOM 380 C THR A 104 69.709 17.814 -0.814 1.00 25.00 C ATOM 381 O THR A 104 70.726 17.957 -1.479 1.00 25.00 O ATOM 382 CB THR A 104 69.938 15.714 0.529 1.00 25.00 C ATOM 383 OG1 THR A 104 69.589 14.326 0.561 1.00 25.00 O ATOM 384 CG2 THR A 104 69.634 16.310 1.899 1.00 25.00 C ATOM 0 H THR A 104 70.164 15.309 -2.032 1.00 25.00 H new ATOM 0 HA THR A 104 68.098 16.472 -0.268 1.00 25.00 H new ATOM 0 HB THR A 104 70.997 15.848 0.310 1.00 25.00 H new ATOM 0 HG1 THR A 104 70.098 13.877 1.268 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.215 15.789 2.660 1.00 25.00 H new ATOM 0 HG22 THR A 104 69.897 17.368 1.902 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.571 16.200 2.116 1.00 25.00 H new ATOM 392 N VAL A 105 69.061 18.840 -0.292 1.00 25.00 N ATOM 393 CA VAL A 105 69.538 20.217 -0.432 1.00 25.00 C ATOM 394 C VAL A 105 69.670 20.843 0.949 1.00 25.00 C ATOM 395 O VAL A 105 68.715 20.885 1.719 1.00 25.00 O ATOM 396 CB VAL A 105 68.575 21.072 -1.303 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.132 22.507 -1.480 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.386 20.416 -2.675 1.00 25.00 C ATOM 0 H VAL A 105 68.194 18.751 0.239 1.00 25.00 H new ATOM 0 HA VAL A 105 70.507 20.194 -0.931 1.00 25.00 H new ATOM 0 HB VAL A 105 67.611 21.130 -0.797 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.445 23.091 -2.092 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.238 22.979 -0.503 1.00 25.00 H new ATOM 0 HG13 VAL A 105 70.105 22.462 -1.969 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.710 21.022 -3.278 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.350 20.339 -3.177 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.963 19.420 -2.547 1.00 25.00 H new ATOM 408 N TYR A 106 70.868 21.309 1.256 1.00 25.00 N ATOM 409 CA TYR A 106 71.165 21.944 2.536 1.00 25.00 C ATOM 410 C TYR A 106 71.312 23.450 2.312 1.00 25.00 C ATOM 411 O TYR A 106 72.221 23.875 1.613 1.00 25.00 O ATOM 412 CB TYR A 106 72.465 21.352 3.095 1.00 25.00 C ATOM 413 CG TYR A 106 72.722 21.658 4.554 1.00 25.00 C ATOM 414 CD1 TYR A 106 72.980 22.974 4.994 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.728 20.623 5.511 1.00 25.00 C ATOM 416 CE1 TYR A 106 73.236 23.249 6.363 1.00 25.00 C ATOM 417 CE2 TYR A 106 72.984 20.897 6.880 1.00 25.00 C ATOM 418 CZ TYR A 106 73.241 22.210 7.291 1.00 25.00 C ATOM 419 OH TYR A 106 73.495 22.488 8.602 1.00 25.00 O ATOM 0 H TYR A 106 71.668 21.259 0.625 1.00 25.00 H new ATOM 0 HA TYR A 106 70.362 21.767 3.251 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.442 20.270 2.963 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.302 21.727 2.506 1.00 25.00 H new ATOM 0 HD1 TYR A 106 72.983 23.783 4.279 1.00 25.00 H new ATOM 0 HD2 TYR A 106 72.535 19.607 5.198 1.00 25.00 H new ATOM 0 HE1 TYR A 106 73.427 24.262 6.685 1.00 25.00 H new ATOM 0 HE2 TYR A 106 72.980 20.094 7.603 1.00 25.00 H new ATOM 0 HH TYR A 106 73.462 21.659 9.124 1.00 25.00 H new ATOM 429 N CYS A 107 70.425 24.250 2.875 1.00 25.00 N ATOM 430 CA CYS A 107 70.476 25.709 2.712 1.00 25.00 C ATOM 431 C CYS A 107 71.162 26.339 3.925 1.00 25.00 C ATOM 432 O CYS A 107 70.829 26.016 5.056 1.00 25.00 O ATOM 433 CB CYS A 107 69.064 26.271 2.547 1.00 25.00 C ATOM 434 SG CYS A 107 69.051 28.035 2.140 1.00 25.00 S ATOM 0 H CYS A 107 69.653 23.921 3.454 1.00 25.00 H new ATOM 0 HA CYS A 107 71.049 25.949 1.817 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.548 25.718 1.762 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.505 26.112 3.469 1.00 25.00 H new ATOM 0 HG CYS A 107 67.886 28.537 2.423 1.00 25.00 H new ATOM 440 N VAL A 108 72.128 27.217 3.685 1.00 25.00 N ATOM 441 CA VAL A 108 72.936 27.809 4.760 1.00 25.00 C ATOM 442 C VAL A 108 72.738 29.322 4.898 1.00 25.00 C ATOM 443 O VAL A 108 72.891 30.086 3.927 1.00 25.00 O ATOM 444 CB VAL A 108 74.463 27.548 4.500 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.314 28.005 5.699 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.728 26.065 4.237 1.00 25.00 C ATOM 0 H VAL A 108 72.377 27.541 2.750 1.00 25.00 H new ATOM 0 HA VAL A 108 72.602 27.331 5.681 1.00 25.00 H new ATOM 0 HB VAL A 108 74.744 28.126 3.619 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.367 27.813 5.492 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.166 29.072 5.865 1.00 25.00 H new ATOM 0 HG13 VAL A 108 75.013 27.454 6.590 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.793 25.911 4.060 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.416 25.481 5.103 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.165 25.745 3.361 1.00 25.00 H new ATOM 456 N ARG A 109 72.521 29.756 6.135 1.00 25.00 N ATOM 457 CA ARG A 109 72.530 31.176 6.505 1.00 25.00 C ATOM 458 C ARG A 109 73.537 31.333 7.629 1.00 25.00 C ATOM 459 O ARG A 109 73.702 30.435 8.442 1.00 25.00 O ATOM 460 CB ARG A 109 71.151 31.652 6.971 1.00 25.00 C ATOM 461 CG ARG A 109 70.272 32.177 5.834 1.00 25.00 C ATOM 462 CD ARG A 109 69.053 32.939 6.373 1.00 25.00 C ATOM 463 NE ARG A 109 69.447 34.150 7.122 1.00 25.00 N ATOM 464 CZ ARG A 109 69.479 35.386 6.635 1.00 25.00 C ATOM 465 NH1 ARG A 109 69.130 35.672 5.405 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 69.878 36.359 7.401 1.00 25.00 N ATOM 0 H ARG A 109 72.332 29.131 6.919 1.00 25.00 H new ATOM 0 HA ARG A 109 72.796 31.781 5.638 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.638 30.827 7.465 1.00 25.00 H new ATOM 0 HB3 ARG A 109 71.279 32.439 7.714 1.00 25.00 H new ATOM 0 HG2 ARG A 109 70.859 32.834 5.192 1.00 25.00 H new ATOM 0 HG3 ARG A 109 69.938 31.344 5.216 1.00 25.00 H new ATOM 0 HD2 ARG A 109 68.405 33.220 5.543 1.00 25.00 H new ATOM 0 HD3 ARG A 109 68.473 32.283 7.022 1.00 25.00 H new ATOM 0 HE ARG A 109 69.718 34.027 8.098 1.00 25.00 H new ATOM 0 HH11 ARG A 109 68.818 34.931 4.778 1.00 25.00 H new ATOM 0 HH12 ARG A 109 69.171 36.636 5.074 1.00 25.00 H new ATOM 0 HH21 ARG A 109 70.161 36.168 8.362 1.00 25.00 H new ATOM 0 HH22 ARG A 109 69.908 37.313 7.040 1.00 25.00 H new ATOM 480 N ARG A 110 74.223 32.469 7.660 1.00 25.00 N ATOM 481 CA ARG A 110 75.278 32.714 8.656 1.00 25.00 C ATOM 482 C ARG A 110 74.750 32.712 10.087 1.00 25.00 C ATOM 483 O ARG A 110 75.455 32.332 11.012 1.00 25.00 O ATOM 484 CB ARG A 110 75.964 34.056 8.366 1.00 25.00 C ATOM 485 CG ARG A 110 77.214 34.283 9.218 1.00 25.00 C ATOM 486 CD ARG A 110 77.958 35.549 8.821 1.00 25.00 C ATOM 487 NE ARG A 110 79.185 35.695 9.630 1.00 25.00 N ATOM 488 CZ ARG A 110 80.098 36.647 9.484 1.00 25.00 C ATOM 489 NH1 ARG A 110 80.001 37.580 8.567 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 81.140 36.647 10.271 1.00 25.00 N ATOM 0 H ARG A 110 74.073 33.240 7.010 1.00 25.00 H new ATOM 0 HA ARG A 110 75.992 31.895 8.572 1.00 25.00 H new ATOM 0 HB2 ARG A 110 76.237 34.098 7.312 1.00 25.00 H new ATOM 0 HB3 ARG A 110 75.257 34.866 8.545 1.00 25.00 H new ATOM 0 HG2 ARG A 110 76.929 34.345 10.268 1.00 25.00 H new ATOM 0 HG3 ARG A 110 77.880 33.426 9.118 1.00 25.00 H new ATOM 0 HD2 ARG A 110 78.214 35.512 7.762 1.00 25.00 H new ATOM 0 HD3 ARG A 110 77.315 36.417 8.963 1.00 25.00 H new ATOM 0 HE ARG A 110 79.344 35.005 10.364 1.00 25.00 H new ATOM 0 HH11 ARG A 110 79.202 37.591 7.933 1.00 25.00 H new ATOM 0 HH12 ARG A 110 80.725 38.294 8.488 1.00 25.00 H new ATOM 0 HH21 ARG A 110 81.242 35.923 10.983 1.00 25.00 H new ATOM 0 HH22 ARG A 110 81.852 37.371 10.174 1.00 25.00 H new ATOM 504 N ASP A 111 73.502 33.122 10.249 1.00 25.00 N ATOM 505 CA ASP A 111 72.872 33.221 11.567 1.00 25.00 C ATOM 506 C ASP A 111 72.300 31.880 12.040 1.00 25.00 C ATOM 507 O ASP A 111 71.381 31.845 12.850 1.00 25.00 O ATOM 508 CB ASP A 111 71.765 34.269 11.513 1.00 25.00 C ATOM 509 CG ASP A 111 72.128 35.439 10.620 1.00 25.00 C ATOM 510 OD1 ASP A 111 73.018 36.234 10.974 1.00 25.00 O ATOM 511 OD2 ASP A 111 71.595 35.478 9.481 1.00 25.00 O1- ATOM 0 H ASP A 111 72.894 33.396 9.477 1.00 25.00 H new ATOM 0 HA ASP A 111 73.638 33.514 12.285 1.00 25.00 H new ATOM 0 HB2 ASP A 111 70.847 33.807 11.149 1.00 25.00 H new ATOM 0 HB3 ASP A 111 71.561 34.632 12.520 1.00 25.00 H new ATOM 516 N LEU A 112 72.838 30.790 11.495 1.00 25.00 N ATOM 517 CA LEU A 112 72.429 29.404 11.814 1.00 25.00 C ATOM 518 C LEU A 112 70.934 29.167 11.588 1.00 25.00 C ATOM 519 O LEU A 112 70.316 28.320 12.215 1.00 25.00 O ATOM 520 CB LEU A 112 72.825 29.017 13.249 1.00 25.00 C ATOM 521 CG LEU A 112 74.327 29.112 13.574 1.00 25.00 C ATOM 522 CD1 LEU A 112 74.541 28.805 15.057 1.00 25.00 C ATOM 523 CD2 LEU A 112 75.160 28.141 12.726 1.00 25.00 C ATOM 0 H LEU A 112 73.587 30.836 10.804 1.00 25.00 H new ATOM 0 HA LEU A 112 72.968 28.759 11.120 1.00 25.00 H new ATOM 0 HB2 LEU A 112 72.280 29.658 13.942 1.00 25.00 H new ATOM 0 HB3 LEU A 112 72.496 27.995 13.434 1.00 25.00 H new ATOM 0 HG LEU A 112 74.658 30.124 13.341 1.00 25.00 H new ATOM 0 HD11 LEU A 112 75.603 28.871 15.293 1.00 25.00 H new ATOM 0 HD12 LEU A 112 73.990 29.526 15.661 1.00 25.00 H new ATOM 0 HD13 LEU A 112 74.183 27.799 15.276 1.00 25.00 H new ATOM 0 HD21 LEU A 112 76.213 28.241 12.988 1.00 25.00 H new ATOM 0 HD22 LEU A 112 74.834 27.119 12.918 1.00 25.00 H new ATOM 0 HD23 LEU A 112 75.025 28.373 11.670 1.00 25.00 H new ATOM 535 N SER A 113 70.389 29.889 10.621 1.00 25.00 N ATOM 536 CA SER A 113 68.999 29.731 10.180 1.00 25.00 C ATOM 537 C SER A 113 68.959 28.669 9.081 1.00 25.00 C ATOM 538 O SER A 113 68.134 28.709 8.176 1.00 25.00 O ATOM 539 CB SER A 113 68.464 31.054 9.656 1.00 25.00 C ATOM 540 OG SER A 113 69.152 32.137 10.267 1.00 25.00 O ATOM 0 H SER A 113 70.899 30.610 10.111 1.00 25.00 H new ATOM 0 HA SER A 113 68.374 29.420 11.017 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.585 31.101 8.574 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.396 31.130 9.861 1.00 25.00 H new ATOM 0 HG SER A 113 68.801 32.984 9.921 1.00 25.00 H new ATOM 546 N GLU A 114 69.958 27.804 9.117 1.00 25.00 N ATOM 547 CA GLU A 114 70.170 26.784 8.109 1.00 25.00 C ATOM 548 C GLU A 114 69.122 25.682 8.239 1.00 25.00 C ATOM 549 O GLU A 114 68.557 25.464 9.309 1.00 25.00 O ATOM 550 CB GLU A 114 71.598 26.227 8.259 1.00 25.00 C ATOM 551 CG GLU A 114 71.902 25.574 9.626 1.00 25.00 C ATOM 552 CD GLU A 114 73.402 25.373 9.862 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.213 25.890 9.059 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 73.767 24.755 10.890 1.00 25.00 O1- ATOM 0 H GLU A 114 70.656 27.792 9.861 1.00 25.00 H new ATOM 0 HA GLU A 114 70.063 27.215 7.114 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.769 25.490 7.475 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.308 27.038 8.094 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.493 26.197 10.421 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.396 24.610 9.685 1.00 25.00 H new ATOM 561 N VAL A 115 68.836 25.028 7.123 1.00 25.00 N ATOM 562 CA VAL A 115 67.801 23.998 7.062 1.00 25.00 C ATOM 563 C VAL A 115 68.231 23.019 5.975 1.00 25.00 C ATOM 564 O VAL A 115 68.952 23.397 5.054 1.00 25.00 O ATOM 565 CB VAL A 115 66.386 24.645 6.754 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.360 25.307 5.359 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.247 23.613 6.869 1.00 25.00 C ATOM 0 H VAL A 115 69.311 25.193 6.235 1.00 25.00 H new ATOM 0 HA VAL A 115 67.693 23.480 8.015 1.00 25.00 H new ATOM 0 HB VAL A 115 66.224 25.416 7.508 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.376 25.740 5.180 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.116 26.091 5.314 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.570 24.557 4.596 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.295 24.096 6.651 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.415 22.805 6.158 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.224 23.207 7.880 1.00 25.00 H new ATOM 577 N THR A 116 67.792 21.777 6.060 1.00 25.00 N ATOM 578 CA THR A 116 68.081 20.800 5.021 1.00 25.00 C ATOM 579 C THR A 116 66.773 20.109 4.697 1.00 25.00 C ATOM 580 O THR A 116 65.927 19.926 5.579 1.00 25.00 O ATOM 581 CB THR A 116 69.204 19.809 5.449 1.00 25.00 C ATOM 582 OG1 THR A 116 69.510 18.917 4.375 1.00 25.00 O ATOM 583 CG2 THR A 116 68.814 18.978 6.663 1.00 25.00 C ATOM 0 H THR A 116 67.235 21.419 6.836 1.00 25.00 H new ATOM 0 HA THR A 116 68.475 21.285 4.128 1.00 25.00 H new ATOM 0 HB THR A 116 70.071 20.416 5.709 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.218 18.300 4.654 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.631 18.304 6.920 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.610 19.639 7.506 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.922 18.396 6.434 1.00 25.00 H new ATOM 591 N PHE A 117 66.573 19.806 3.427 1.00 25.00 N ATOM 592 CA PHE A 117 65.333 19.221 2.934 1.00 25.00 C ATOM 593 C PHE A 117 65.705 18.374 1.732 1.00 25.00 C ATOM 594 O PHE A 117 66.860 18.354 1.339 1.00 25.00 O ATOM 595 CB PHE A 117 64.326 20.320 2.553 1.00 25.00 C ATOM 596 CG PHE A 117 64.879 21.374 1.621 1.00 25.00 C ATOM 597 CD1 PHE A 117 65.480 22.538 2.144 1.00 25.00 C ATOM 598 CD2 PHE A 117 64.762 21.237 0.224 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.964 23.558 1.288 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.242 22.251 -0.645 1.00 25.00 C ATOM 601 CZ PHE A 117 65.842 23.416 -0.108 1.00 25.00 C ATOM 0 H PHE A 117 67.272 19.959 2.700 1.00 25.00 H new ATOM 0 HA PHE A 117 64.851 18.613 3.700 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.459 19.855 2.083 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.974 20.805 3.463 1.00 25.00 H new ATOM 0 HD1 PHE A 117 65.573 22.654 3.214 1.00 25.00 H new ATOM 0 HD2 PHE A 117 64.302 20.352 -0.190 1.00 25.00 H new ATOM 0 HE1 PHE A 117 66.425 24.441 1.705 1.00 25.00 H new ATOM 0 HE2 PHE A 117 65.150 22.134 -1.715 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.204 24.192 -0.766 1.00 25.00 H new ATOM 611 N SER A 118 64.751 17.669 1.147 1.00 25.00 N ATOM 612 CA SER A 118 65.028 16.848 -0.025 1.00 25.00 C ATOM 613 C SER A 118 64.029 17.181 -1.113 1.00 25.00 C ATOM 614 O SER A 118 62.932 17.643 -0.825 1.00 25.00 O ATOM 615 CB SER A 118 64.974 15.355 0.319 1.00 25.00 C ATOM 616 OG SER A 118 63.678 14.969 0.749 1.00 25.00 O ATOM 0 H SER A 118 63.781 17.647 1.461 1.00 25.00 H new ATOM 0 HA SER A 118 66.036 17.065 -0.378 1.00 25.00 H new ATOM 0 HB2 SER A 118 65.259 14.768 -0.554 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.700 15.134 1.102 1.00 25.00 H new ATOM 0 HG SER A 118 63.675 14.012 0.959 1.00 25.00 H new ATOM 622 N LEU A 119 64.433 16.987 -2.358 1.00 25.00 N ATOM 623 CA LEU A 119 63.605 17.307 -3.507 1.00 25.00 C ATOM 624 C LEU A 119 63.523 16.129 -4.437 1.00 25.00 C ATOM 625 O LEU A 119 64.518 15.447 -4.694 1.00 25.00 O ATOM 626 CB LEU A 119 64.211 18.472 -4.286 1.00 25.00 C ATOM 627 CG LEU A 119 63.911 19.881 -3.776 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.728 20.846 -4.598 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.426 20.226 -3.900 1.00 25.00 C ATOM 0 H LEU A 119 65.346 16.602 -2.600 1.00 25.00 H new ATOM 0 HA LEU A 119 62.613 17.569 -3.140 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.293 18.341 -4.303 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.866 18.405 -5.318 1.00 25.00 H new ATOM 0 HG LEU A 119 64.168 19.943 -2.718 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.537 21.864 -4.259 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.787 20.617 -4.481 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.451 20.755 -5.648 1.00 25.00 H new ATOM 0 HD21 LEU A 119 62.255 21.236 -3.527 1.00 25.00 H new ATOM 0 HD22 LEU A 119 62.126 20.170 -4.946 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.838 19.518 -3.315 1.00 25.00 H new ATOM 641 N GLN A 120 62.341 15.933 -4.993 1.00 25.00 N ATOM 642 CA GLN A 120 62.120 14.917 -6.010 1.00 25.00 C ATOM 643 C GLN A 120 62.350 15.615 -7.349 1.00 25.00 C ATOM 644 O GLN A 120 61.833 16.708 -7.586 1.00 25.00 O ATOM 645 CB GLN A 120 60.712 14.311 -5.898 1.00 25.00 C ATOM 646 CG GLN A 120 59.549 15.318 -5.991 1.00 25.00 C ATOM 647 CD GLN A 120 58.198 14.679 -5.745 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.015 13.484 -5.921 1.00 25.00 O ATOM 649 NE2 GLN A 120 57.240 15.476 -5.344 1.00 25.00 N ATOM 0 H GLN A 120 61.508 16.471 -4.754 1.00 25.00 H new ATOM 0 HA GLN A 120 62.800 14.073 -5.894 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.591 13.568 -6.687 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.637 13.782 -4.948 1.00 25.00 H new ATOM 0 HG2 GLN A 120 59.706 16.116 -5.265 1.00 25.00 H new ATOM 0 HG3 GLN A 120 59.553 15.780 -6.978 1.00 25.00 H new ATOM 0 HE21 GLN A 120 57.427 16.469 -5.207 1.00 25.00 H new ATOM 0 HE22 GLN A 120 56.307 15.104 -5.169 1.00 25.00 H new ATOM 658 N VAL A 121 63.200 15.030 -8.174 1.00 25.00 N ATOM 659 CA VAL A 121 63.614 15.628 -9.441 1.00 25.00 C ATOM 660 C VAL A 121 63.676 14.520 -10.480 1.00 25.00 C ATOM 661 O VAL A 121 63.448 13.361 -10.159 1.00 25.00 O ATOM 662 CB VAL A 121 65.022 16.301 -9.321 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.989 17.447 -8.311 1.00 25.00 C ATOM 664 CG2 VAL A 121 66.092 15.283 -8.894 1.00 25.00 C ATOM 0 H VAL A 121 63.627 14.123 -7.988 1.00 25.00 H new ATOM 0 HA VAL A 121 62.898 16.400 -9.725 1.00 25.00 H new ATOM 0 HB VAL A 121 65.279 16.692 -10.306 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.978 17.901 -8.243 1.00 25.00 H new ATOM 0 HG12 VAL A 121 64.267 18.197 -8.635 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.699 17.062 -7.333 1.00 25.00 H new ATOM 0 HG21 VAL A 121 67.059 15.781 -8.819 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.826 14.860 -7.925 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.151 14.485 -9.634 1.00 25.00 H new ATOM 674 N ASP A 122 64.041 14.854 -11.703 1.00 25.00 N ATOM 675 CA ASP A 122 64.258 13.851 -12.742 1.00 25.00 C ATOM 676 C ASP A 122 65.755 13.758 -13.031 1.00 25.00 C ATOM 677 O ASP A 122 66.517 14.633 -12.625 1.00 25.00 O ATOM 678 CB ASP A 122 63.506 14.235 -14.008 1.00 25.00 C ATOM 679 CG ASP A 122 63.357 13.071 -14.947 1.00 25.00 C ATOM 680 OD1 ASP A 122 62.466 12.237 -14.693 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 64.212 12.909 -15.840 1.00 25.00 O1- ATOM 0 H ASP A 122 64.195 15.815 -12.008 1.00 25.00 H new ATOM 0 HA ASP A 122 63.887 12.884 -12.401 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.520 14.616 -13.743 1.00 25.00 H new ATOM 0 HB3 ASP A 122 64.035 15.043 -14.513 1.00 25.00 H new ATOM 686 N ALA A 123 66.187 12.733 -13.745 1.00 25.00 N ATOM 687 CA ALA A 123 67.585 12.631 -14.126 1.00 25.00 C ATOM 688 C ALA A 123 67.934 13.771 -15.095 1.00 25.00 C ATOM 689 O ALA A 123 68.998 14.387 -14.990 1.00 25.00 O ATOM 690 CB ALA A 123 67.845 11.274 -14.787 1.00 25.00 C ATOM 0 H ALA A 123 65.597 11.967 -14.070 1.00 25.00 H new ATOM 0 HA ALA A 123 68.212 12.713 -13.238 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.895 11.203 -15.071 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.604 10.475 -14.085 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.222 11.177 -15.676 1.00 25.00 H new ATOM 696 N ASP A 124 67.029 14.053 -16.022 1.00 25.00 N ATOM 697 CA ASP A 124 67.284 15.063 -17.058 1.00 25.00 C ATOM 698 C ASP A 124 66.769 16.445 -16.648 1.00 25.00 C ATOM 699 O ASP A 124 66.628 17.346 -17.463 1.00 25.00 O ATOM 700 CB ASP A 124 66.636 14.623 -18.373 1.00 25.00 C ATOM 701 CG ASP A 124 67.393 15.133 -19.599 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.604 15.447 -19.472 1.00 25.00 O ATOM 703 OD2 ASP A 124 66.804 15.125 -20.702 1.00 25.00 O1- ATOM 0 H ASP A 124 66.115 13.604 -16.084 1.00 25.00 H new ATOM 0 HA ASP A 124 68.363 15.146 -17.190 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.590 13.534 -18.405 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.609 14.986 -18.407 1.00 25.00 H new ATOM 708 N PHE A 125 66.486 16.601 -15.364 1.00 25.00 N ATOM 709 CA PHE A 125 65.968 17.864 -14.839 1.00 25.00 C ATOM 710 C PHE A 125 67.005 18.972 -14.992 1.00 25.00 C ATOM 711 O PHE A 125 68.157 18.807 -14.582 1.00 25.00 O ATOM 712 CB PHE A 125 65.621 17.680 -13.368 1.00 25.00 C ATOM 713 CG PHE A 125 64.467 18.499 -12.903 1.00 25.00 C ATOM 714 CD1 PHE A 125 63.156 18.132 -13.252 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.669 19.614 -12.075 1.00 25.00 C ATOM 716 CE1 PHE A 125 62.050 18.870 -12.777 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.571 20.351 -11.584 1.00 25.00 C ATOM 718 CZ PHE A 125 62.261 19.980 -11.934 1.00 25.00 C ATOM 0 H PHE A 125 66.605 15.870 -14.662 1.00 25.00 H new ATOM 0 HA PHE A 125 65.077 18.149 -15.399 1.00 25.00 H new ATOM 0 HB2 PHE A 125 65.401 16.628 -13.188 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.495 17.930 -12.767 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.993 17.276 -13.890 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.674 19.910 -11.812 1.00 25.00 H new ATOM 0 HE1 PHE A 125 61.047 18.585 -13.058 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.737 21.201 -10.939 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.419 20.543 -11.558 1.00 25.00 H new ATOM 728 N GLU A 126 66.610 20.083 -15.594 1.00 25.00 N ATOM 729 CA GLU A 126 67.530 21.196 -15.831 1.00 25.00 C ATOM 730 C GLU A 126 67.897 21.877 -14.522 1.00 25.00 C ATOM 731 O GLU A 126 67.071 21.991 -13.618 1.00 25.00 O ATOM 732 CB GLU A 126 66.888 22.247 -16.733 1.00 25.00 C ATOM 733 CG GLU A 126 66.596 21.779 -18.147 1.00 25.00 C ATOM 734 CD GLU A 126 66.033 22.904 -19.003 1.00 25.00 C ATOM 735 OE1 GLU A 126 65.279 23.735 -18.444 1.00 25.00 O ATOM 736 OE2 GLU A 126 66.349 22.979 -20.206 1.00 25.00 O1- ATOM 0 H GLU A 126 65.660 20.243 -15.929 1.00 25.00 H new ATOM 0 HA GLU A 126 68.419 20.782 -16.307 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.956 22.578 -16.275 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.546 23.115 -16.781 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.511 21.398 -18.601 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.886 20.952 -18.118 1.00 25.00 H new ATOM 743 N LEU A 127 69.108 22.414 -14.443 1.00 25.00 N ATOM 744 CA LEU A 127 69.532 23.157 -13.264 1.00 25.00 C ATOM 745 C LEU A 127 68.704 24.424 -13.075 1.00 25.00 C ATOM 746 O LEU A 127 68.537 24.897 -11.952 1.00 25.00 O ATOM 747 CB LEU A 127 70.991 23.573 -13.383 1.00 25.00 C ATOM 748 CG LEU A 127 72.033 22.719 -12.662 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.381 23.304 -12.958 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.812 22.698 -11.143 1.00 25.00 C ATOM 0 H LEU A 127 69.811 22.349 -15.179 1.00 25.00 H new ATOM 0 HA LEU A 127 69.393 22.493 -12.411 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.249 23.594 -14.442 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.080 24.594 -13.013 1.00 25.00 H new ATOM 0 HG LEU A 127 71.952 21.691 -13.014 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.151 22.717 -12.457 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.556 23.289 -14.034 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.418 24.332 -12.599 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.576 22.079 -10.673 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.876 23.713 -10.752 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.827 22.287 -10.924 1.00 25.00 H new ATOM 762 N HIS A 128 68.195 24.977 -14.165 1.00 25.00 N ATOM 763 CA HIS A 128 67.338 26.153 -14.107 1.00 25.00 C ATOM 764 C HIS A 128 66.068 25.815 -13.334 1.00 25.00 C ATOM 765 O HIS A 128 65.626 26.559 -12.467 1.00 25.00 O ATOM 766 CB HIS A 128 66.974 26.607 -15.526 1.00 25.00 C ATOM 767 CG HIS A 128 66.313 27.947 -15.585 1.00 25.00 C ATOM 768 ND1 HIS A 128 66.911 29.075 -16.087 1.00 25.00 N ATOM 769 CD2 HIS A 128 65.065 28.349 -15.208 1.00 25.00 C ATOM 770 CE1 HIS A 128 66.051 30.080 -15.995 1.00 25.00 C ATOM 771 NE2 HIS A 128 64.911 29.698 -15.462 1.00 25.00 N ATOM 0 H HIS A 128 68.362 24.627 -15.108 1.00 25.00 H new ATOM 0 HA HIS A 128 67.869 26.960 -13.603 1.00 25.00 H new ATOM 0 HB2 HIS A 128 67.880 26.633 -16.132 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.312 25.867 -15.975 1.00 25.00 H new ATOM 0 HD1 HIS A 128 67.856 29.131 -16.466 1.00 25.00 H new ATOM 0 HD2 HIS A 128 64.311 27.708 -14.776 1.00 25.00 H new ATOM 0 HE1 HIS A 128 66.261 31.089 -16.318 1.00 25.00 H new ATOM 779 N ASN A 129 65.505 24.660 -13.640 1.00 25.00 N ATOM 780 CA ASN A 129 64.286 24.210 -12.986 1.00 25.00 C ATOM 781 C ASN A 129 64.597 23.805 -11.544 1.00 25.00 C ATOM 782 O ASN A 129 63.859 24.121 -10.610 1.00 25.00 O ATOM 783 CB ASN A 129 63.712 23.030 -13.777 1.00 25.00 C ATOM 784 CG ASN A 129 62.212 22.933 -13.669 1.00 25.00 C ATOM 785 OD1 ASN A 129 61.649 23.091 -12.607 1.00 25.00 O ATOM 786 ND2 ASN A 129 61.561 22.691 -14.770 1.00 25.00 N ATOM 0 H ASN A 129 65.872 24.014 -14.339 1.00 25.00 H new ATOM 0 HA ASN A 129 63.549 25.012 -12.960 1.00 25.00 H new ATOM 0 HB2 ASN A 129 63.991 23.131 -14.826 1.00 25.00 H new ATOM 0 HB3 ASN A 129 64.159 22.104 -13.416 1.00 25.00 H new ATOM 0 HD21 ASN A 129 60.543 22.629 -14.757 1.00 25.00 H new ATOM 0 HD22 ASN A 129 62.069 22.564 -15.645 1.00 25.00 H new ATOM 793 N PHE A 130 65.731 23.143 -11.354 1.00 25.00 N ATOM 794 CA PHE A 130 66.144 22.689 -10.025 1.00 25.00 C ATOM 795 C PHE A 130 66.336 23.842 -9.046 1.00 25.00 C ATOM 796 O PHE A 130 65.917 23.756 -7.888 1.00 25.00 O ATOM 797 CB PHE A 130 67.446 21.898 -10.130 1.00 25.00 C ATOM 798 CG PHE A 130 67.906 21.324 -8.822 1.00 25.00 C ATOM 799 CD1 PHE A 130 67.091 20.421 -8.115 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.159 21.673 -8.288 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.524 19.858 -6.884 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.609 21.109 -7.067 1.00 25.00 C ATOM 803 CZ PHE A 130 68.784 20.197 -6.366 1.00 25.00 C ATOM 0 H PHE A 130 66.384 22.907 -12.101 1.00 25.00 H new ATOM 0 HA PHE A 130 65.343 22.058 -9.640 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.312 21.087 -10.846 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.226 22.548 -10.526 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.124 20.152 -8.513 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.786 22.378 -8.813 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.885 19.171 -6.348 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.579 21.375 -6.673 1.00 25.00 H new ATOM 0 HZ PHE A 130 69.123 19.764 -5.436 1.00 25.00 H new ATOM 813 N ARG A 131 66.959 24.926 -9.493 1.00 25.00 N ATOM 814 CA ARG A 131 67.181 26.051 -8.594 1.00 25.00 C ATOM 815 C ARG A 131 65.881 26.746 -8.251 1.00 25.00 C ATOM 816 O ARG A 131 65.748 27.244 -7.157 1.00 25.00 O ATOM 817 CB ARG A 131 68.215 27.047 -9.135 1.00 25.00 C ATOM 818 CG ARG A 131 67.786 27.856 -10.359 1.00 25.00 C ATOM 819 CD ARG A 131 68.868 28.835 -10.749 1.00 25.00 C ATOM 820 NE ARG A 131 70.085 28.113 -11.141 1.00 25.00 N ATOM 821 CZ ARG A 131 71.328 28.502 -10.891 1.00 25.00 C ATOM 822 NH1 ARG A 131 71.610 29.620 -10.262 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 72.309 27.734 -11.284 1.00 25.00 N ATOM 0 H ARG A 131 67.310 25.049 -10.443 1.00 25.00 H new ATOM 0 HA ARG A 131 67.598 25.636 -7.676 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.474 27.742 -8.336 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.123 26.498 -9.386 1.00 25.00 H new ATOM 0 HG2 ARG A 131 67.577 27.184 -11.192 1.00 25.00 H new ATOM 0 HG3 ARG A 131 66.862 28.392 -10.143 1.00 25.00 H new ATOM 0 HD2 ARG A 131 68.524 29.459 -11.574 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.084 29.501 -9.914 1.00 25.00 H new ATOM 0 HE ARG A 131 69.964 27.237 -11.649 1.00 25.00 H new ATOM 0 HH11 ARG A 131 70.857 30.230 -9.944 1.00 25.00 H new ATOM 0 HH12 ARG A 131 72.582 29.878 -10.092 1.00 25.00 H new ATOM 0 HH21 ARG A 131 72.109 26.860 -11.770 1.00 25.00 H new ATOM 0 HH22 ARG A 131 73.275 28.009 -11.105 1.00 25.00 H new ATOM 837 N ALA A 132 64.907 26.721 -9.148 1.00 25.00 N ATOM 838 CA ALA A 132 63.602 27.306 -8.859 1.00 25.00 C ATOM 839 C ALA A 132 62.910 26.449 -7.790 1.00 25.00 C ATOM 840 O ALA A 132 62.305 26.966 -6.859 1.00 25.00 O ATOM 841 CB ALA A 132 62.758 27.373 -10.131 1.00 25.00 C ATOM 0 H ALA A 132 64.992 26.306 -10.076 1.00 25.00 H new ATOM 0 HA ALA A 132 63.723 28.324 -8.488 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.787 27.811 -9.901 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.267 27.988 -10.873 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.617 26.368 -10.528 1.00 25.00 H new ATOM 847 N LEU A 133 63.041 25.135 -7.918 1.00 25.00 N ATOM 848 CA LEU A 133 62.447 24.217 -6.943 1.00 25.00 C ATOM 849 C LEU A 133 63.052 24.403 -5.552 1.00 25.00 C ATOM 850 O LEU A 133 62.331 24.421 -4.564 1.00 25.00 O ATOM 851 CB LEU A 133 62.657 22.764 -7.382 1.00 25.00 C ATOM 852 CG LEU A 133 61.427 22.039 -7.950 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.937 22.680 -9.243 1.00 25.00 C ATOM 854 CD2 LEU A 133 61.784 20.564 -8.197 1.00 25.00 C ATOM 0 H LEU A 133 63.547 24.680 -8.678 1.00 25.00 H new ATOM 0 HA LEU A 133 61.382 24.444 -6.896 1.00 25.00 H new ATOM 0 HB2 LEU A 133 63.444 22.745 -8.136 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.023 22.197 -6.526 1.00 25.00 H new ATOM 0 HG LEU A 133 60.618 22.115 -7.223 1.00 25.00 H new ATOM 0 HD11 LEU A 133 60.066 22.137 -9.611 1.00 25.00 H new ATOM 0 HD12 LEU A 133 60.664 23.718 -9.054 1.00 25.00 H new ATOM 0 HD13 LEU A 133 61.730 22.644 -9.990 1.00 25.00 H new ATOM 0 HD21 LEU A 133 60.916 20.042 -8.600 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.607 20.503 -8.909 1.00 25.00 H new ATOM 0 HD23 LEU A 133 62.082 20.100 -7.257 1.00 25.00 H new ATOM 866 N CYS A 134 64.371 24.547 -5.457 1.00 25.00 N ATOM 867 CA CYS A 134 64.988 24.728 -4.141 1.00 25.00 C ATOM 868 C CYS A 134 64.796 26.149 -3.608 1.00 25.00 C ATOM 869 O CYS A 134 64.791 26.353 -2.396 1.00 25.00 O ATOM 870 CB CYS A 134 66.468 24.327 -4.145 1.00 25.00 C ATOM 871 SG CYS A 134 67.566 25.411 -5.076 1.00 25.00 S ATOM 0 H CYS A 134 65.018 24.543 -6.246 1.00 25.00 H new ATOM 0 HA CYS A 134 64.470 24.055 -3.457 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.817 24.285 -3.113 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.552 23.319 -4.551 1.00 25.00 H new ATOM 0 HG CYS A 134 66.859 26.209 -5.821 1.00 25.00 H new ATOM 877 N GLU A 135 64.606 27.120 -4.493 1.00 25.00 N ATOM 878 CA GLU A 135 64.310 28.499 -4.080 1.00 25.00 C ATOM 879 C GLU A 135 62.965 28.512 -3.367 1.00 25.00 C ATOM 880 O GLU A 135 62.804 29.152 -2.327 1.00 25.00 O ATOM 881 CB GLU A 135 64.258 29.428 -5.307 1.00 25.00 C ATOM 882 CG GLU A 135 64.090 30.905 -4.979 1.00 25.00 C ATOM 883 CD GLU A 135 64.045 31.802 -6.220 1.00 25.00 C ATOM 884 OE1 GLU A 135 64.037 31.274 -7.352 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 64.123 33.052 -6.055 1.00 25.00 O1- ATOM 0 H GLU A 135 64.650 26.985 -5.503 1.00 25.00 H new ATOM 0 HA GLU A 135 65.094 28.857 -3.412 1.00 25.00 H new ATOM 0 HB2 GLU A 135 65.175 29.299 -5.882 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.433 29.116 -5.948 1.00 25.00 H new ATOM 0 HG2 GLU A 135 63.171 31.041 -4.408 1.00 25.00 H new ATOM 0 HG3 GLU A 135 64.913 31.223 -4.339 1.00 25.00 H new ATOM 892 N LEU A 136 62.009 27.765 -3.905 1.00 25.00 N ATOM 893 CA LEU A 136 60.666 27.689 -3.339 1.00 25.00 C ATOM 894 C LEU A 136 60.674 27.080 -1.935 1.00 25.00 C ATOM 895 O LEU A 136 60.034 27.601 -1.026 1.00 25.00 O ATOM 896 CB LEU A 136 59.769 26.845 -4.261 1.00 25.00 C ATOM 897 CG LEU A 136 58.290 26.709 -3.859 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.573 28.059 -3.875 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.601 25.743 -4.819 1.00 25.00 C ATOM 0 H LEU A 136 62.141 27.197 -4.742 1.00 25.00 H new ATOM 0 HA LEU A 136 60.277 28.704 -3.260 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.810 27.276 -5.262 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.196 25.844 -4.327 1.00 25.00 H new ATOM 0 HG LEU A 136 58.244 26.326 -2.840 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.531 27.921 -3.586 1.00 25.00 H new ATOM 0 HD12 LEU A 136 58.058 28.737 -3.173 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.618 28.483 -4.878 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.552 25.641 -4.541 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.671 26.129 -5.836 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.087 24.769 -4.766 1.00 25.00 H new ATOM 911 N GLU A 137 61.408 25.992 -1.761 1.00 25.00 N ATOM 912 CA GLU A 137 61.482 25.313 -0.465 1.00 25.00 C ATOM 913 C GLU A 137 62.235 26.162 0.562 1.00 25.00 C ATOM 914 O GLU A 137 61.919 26.156 1.749 1.00 25.00 O ATOM 915 CB GLU A 137 62.206 23.976 -0.607 1.00 25.00 C ATOM 916 CG GLU A 137 61.446 22.908 -1.402 1.00 25.00 C ATOM 917 CD GLU A 137 60.174 22.429 -0.706 1.00 25.00 C ATOM 918 OE1 GLU A 137 60.202 22.207 0.524 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 59.163 22.222 -1.410 1.00 25.00 O1- ATOM 0 H GLU A 137 61.963 25.556 -2.497 1.00 25.00 H new ATOM 0 HA GLU A 137 60.460 25.154 -0.123 1.00 25.00 H new ATOM 0 HB2 GLU A 137 63.168 24.150 -1.089 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.415 23.586 0.389 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.187 23.310 -2.382 1.00 25.00 H new ATOM 0 HG3 GLU A 137 62.103 22.055 -1.571 1.00 25.00 H new ATOM 926 N SER A 138 63.253 26.877 0.102 1.00 25.00 N ATOM 927 CA SER A 138 64.082 27.676 1.005 1.00 25.00 C ATOM 928 C SER A 138 63.447 29.013 1.376 1.00 25.00 C ATOM 929 O SER A 138 63.752 29.578 2.420 1.00 25.00 O ATOM 930 CB SER A 138 65.444 27.931 0.369 1.00 25.00 C ATOM 931 OG SER A 138 66.077 26.711 0.030 1.00 25.00 O ATOM 0 H SER A 138 63.526 26.923 -0.880 1.00 25.00 H new ATOM 0 HA SER A 138 64.186 27.098 1.924 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.324 28.544 -0.524 1.00 25.00 H new ATOM 0 HB3 SER A 138 66.073 28.493 1.059 1.00 25.00 H new ATOM 0 HG SER A 138 65.743 26.399 -0.837 1.00 25.00 H new ATOM 937 N GLY A 139 62.583 29.530 0.512 1.00 25.00 N ATOM 938 CA GLY A 139 61.890 30.782 0.788 1.00 25.00 C ATOM 939 C GLY A 139 62.785 32.011 0.788 1.00 25.00 C ATOM 940 O GLY A 139 62.524 32.972 1.504 1.00 25.00 O ATOM 0 H GLY A 139 62.346 29.103 -0.384 1.00 25.00 H new ATOM 0 HA2 GLY A 139 61.105 30.920 0.044 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.400 30.705 1.758 1.00 25.00 H new ATOM 944 N ILE A 140 63.846 31.985 -0.010 1.00 25.00 N ATOM 945 CA ILE A 140 64.805 33.101 -0.082 1.00 25.00 C ATOM 946 C ILE A 140 64.991 33.506 -1.542 1.00 25.00 C ATOM 947 O ILE A 140 64.815 32.683 -2.428 1.00 25.00 O ATOM 948 CB ILE A 140 66.194 32.702 0.527 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.796 31.491 -0.224 1.00 25.00 C ATOM 950 CG2 ILE A 140 66.046 32.406 2.045 1.00 25.00 C ATOM 951 CD1 ILE A 140 68.240 31.184 0.112 1.00 25.00 C ATOM 0 H ILE A 140 64.072 31.202 -0.623 1.00 25.00 H new ATOM 0 HA ILE A 140 64.407 33.934 0.497 1.00 25.00 H new ATOM 0 HB ILE A 140 66.883 33.538 0.407 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.192 30.610 -0.005 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.719 31.672 -1.296 1.00 25.00 H new ATOM 0 HG21 ILE A 140 67.016 32.130 2.458 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.674 33.295 2.555 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.344 31.585 2.189 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.572 30.320 -0.464 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.862 32.045 -0.134 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.327 30.966 1.176 1.00 25.00 H new ATOM 963 N PRO A 141 65.338 34.778 -1.811 1.00 25.00 N ATOM 964 CA PRO A 141 65.528 35.102 -3.229 1.00 25.00 C ATOM 965 C PRO A 141 66.763 34.428 -3.837 1.00 25.00 C ATOM 966 O PRO A 141 67.857 34.494 -3.267 1.00 25.00 O ATOM 967 CB PRO A 141 65.729 36.627 -3.209 1.00 25.00 C ATOM 968 CG PRO A 141 65.180 37.077 -1.888 1.00 25.00 C ATOM 969 CD PRO A 141 65.546 35.964 -0.963 1.00 25.00 C ATOM 0 HA PRO A 141 64.690 34.758 -3.835 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.783 36.887 -3.307 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.205 37.104 -4.037 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.619 38.023 -1.572 1.00 25.00 H new ATOM 0 HG3 PRO A 141 64.101 37.225 -1.931 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.577 36.043 -0.618 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.913 35.947 -0.076 1.00 25.00 H new ATOM 977 N ALA A 142 66.622 33.847 -5.023 1.00 25.00 N ATOM 978 CA ALA A 142 67.758 33.243 -5.722 1.00 25.00 C ATOM 979 C ALA A 142 68.794 34.307 -6.093 1.00 25.00 C ATOM 980 O ALA A 142 69.970 34.019 -6.224 1.00 25.00 O ATOM 981 CB ALA A 142 67.286 32.517 -6.986 1.00 25.00 C ATOM 0 H ALA A 142 65.735 33.780 -5.523 1.00 25.00 H new ATOM 0 HA ALA A 142 68.222 32.521 -5.050 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.143 32.074 -7.493 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.581 31.732 -6.713 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.798 33.228 -7.653 1.00 25.00 H new ATOM 987 N ALA A 143 68.346 35.548 -6.226 1.00 25.00 N ATOM 988 CA ALA A 143 69.235 36.659 -6.555 1.00 25.00 C ATOM 989 C ALA A 143 70.264 36.928 -5.445 1.00 25.00 C ATOM 990 O ALA A 143 71.303 37.535 -5.691 1.00 25.00 O ATOM 991 CB ALA A 143 68.402 37.919 -6.810 1.00 25.00 C ATOM 0 H ALA A 143 67.368 35.814 -6.111 1.00 25.00 H new ATOM 0 HA ALA A 143 69.790 36.387 -7.453 1.00 25.00 H new ATOM 0 HB1 ALA A 143 69.064 38.749 -7.056 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.719 37.742 -7.641 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.830 38.164 -5.915 1.00 25.00 H new ATOM 997 N GLU A 144 69.958 36.498 -4.228 1.00 25.00 N ATOM 998 CA GLU A 144 70.822 36.750 -3.073 1.00 25.00 C ATOM 999 C GLU A 144 71.618 35.512 -2.675 1.00 25.00 C ATOM 1000 O GLU A 144 72.227 35.473 -1.605 1.00 25.00 O ATOM 1001 CB GLU A 144 69.967 37.174 -1.877 1.00 25.00 C ATOM 1002 CG GLU A 144 69.200 38.467 -2.097 1.00 25.00 C ATOM 1003 CD GLU A 144 68.353 38.836 -0.886 1.00 25.00 C ATOM 1004 OE1 GLU A 144 68.338 38.063 0.101 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 67.685 39.888 -0.930 1.00 25.00 O1- ATOM 0 H GLU A 144 69.113 35.969 -4.010 1.00 25.00 H new ATOM 0 HA GLU A 144 71.520 37.538 -3.356 1.00 25.00 H new ATOM 0 HB2 GLU A 144 69.259 36.377 -1.648 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.611 37.289 -1.005 1.00 25.00 H new ATOM 0 HG2 GLU A 144 69.901 39.274 -2.309 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.558 38.364 -2.972 1.00 25.00 H new ATOM 1012 N SER A 145 71.568 34.470 -3.491 1.00 25.00 N ATOM 1013 CA SER A 145 72.179 33.204 -3.116 1.00 25.00 C ATOM 1014 C SER A 145 72.824 32.462 -4.280 1.00 25.00 C ATOM 1015 O SER A 145 72.630 32.796 -5.442 1.00 25.00 O ATOM 1016 CB SER A 145 71.113 32.329 -2.457 1.00 25.00 C ATOM 1017 OG SER A 145 70.028 32.094 -3.336 1.00 25.00 O ATOM 0 H SER A 145 71.117 34.474 -4.406 1.00 25.00 H new ATOM 0 HA SER A 145 72.992 33.426 -2.424 1.00 25.00 H new ATOM 0 HB2 SER A 145 71.554 31.378 -2.157 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.751 32.813 -1.550 1.00 25.00 H new ATOM 0 HG SER A 145 69.388 32.834 -3.271 1.00 25.00 H new ATOM 1023 N GLN A 146 73.610 31.450 -3.949 1.00 25.00 N ATOM 1024 CA GLN A 146 74.264 30.621 -4.958 1.00 25.00 C ATOM 1025 C GLN A 146 74.114 29.160 -4.558 1.00 25.00 C ATOM 1026 O GLN A 146 73.865 28.859 -3.396 1.00 25.00 O ATOM 1027 CB GLN A 146 75.747 30.991 -5.092 1.00 25.00 C ATOM 1028 CG GLN A 146 76.595 30.673 -3.851 1.00 25.00 C ATOM 1029 CD GLN A 146 78.063 30.967 -4.064 1.00 25.00 C ATOM 1030 OE1 GLN A 146 78.663 31.743 -3.342 1.00 25.00 O ATOM 1031 NE2 GLN A 146 78.654 30.328 -5.043 1.00 25.00 N ATOM 0 H GLN A 146 73.813 31.179 -2.987 1.00 25.00 H new ATOM 0 HA GLN A 146 73.794 30.790 -5.927 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.165 30.462 -5.948 1.00 25.00 H new ATOM 0 HB3 GLN A 146 75.825 32.057 -5.307 1.00 25.00 H new ATOM 0 HG2 GLN A 146 76.230 31.256 -3.006 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.472 29.622 -3.590 1.00 25.00 H new ATOM 0 HE21 GLN A 146 78.120 29.685 -5.628 1.00 25.00 H new ATOM 0 HE22 GLN A 146 79.648 30.473 -5.220 1.00 25.00 H new ATOM 1040 N ILE A 147 74.275 28.259 -5.508 1.00 25.00 N ATOM 1041 CA ILE A 147 74.105 26.825 -5.252 1.00 25.00 C ATOM 1042 C ILE A 147 75.381 26.076 -5.682 1.00 25.00 C ATOM 1043 O ILE A 147 76.010 26.411 -6.697 1.00 25.00 O ATOM 1044 CB ILE A 147 72.796 26.323 -5.948 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.446 24.911 -5.467 1.00 25.00 C ATOM 1046 CG2 ILE A 147 72.905 26.417 -7.491 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.171 24.325 -6.093 1.00 25.00 C ATOM 0 H ILE A 147 74.524 28.487 -6.470 1.00 25.00 H new ATOM 0 HA ILE A 147 73.977 26.623 -4.189 1.00 25.00 H new ATOM 0 HB ILE A 147 71.974 26.978 -5.661 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.282 24.248 -5.687 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.329 24.928 -4.383 1.00 25.00 H new ATOM 0 HG21 ILE A 147 71.980 26.061 -7.943 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.075 27.454 -7.781 1.00 25.00 H new ATOM 0 HG23 ILE A 147 73.737 25.803 -7.835 1.00 25.00 H new ATOM 0 HD11 ILE A 147 70.998 23.324 -5.697 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.321 24.963 -5.851 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.288 24.272 -7.175 1.00 25.00 H new ATOM 1059 N VAL A 148 75.821 25.169 -4.821 1.00 25.00 N ATOM 1060 CA VAL A 148 77.135 24.525 -4.901 1.00 25.00 C ATOM 1061 C VAL A 148 76.998 23.002 -4.764 1.00 25.00 C ATOM 1062 O VAL A 148 76.253 22.518 -3.922 1.00 25.00 O ATOM 1063 CB VAL A 148 78.039 25.062 -3.724 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.430 24.412 -3.716 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.191 26.599 -3.822 1.00 25.00 C ATOM 0 H VAL A 148 75.265 24.850 -4.027 1.00 25.00 H new ATOM 0 HA VAL A 148 77.584 24.756 -5.867 1.00 25.00 H new ATOM 0 HB VAL A 148 77.539 24.796 -2.793 1.00 25.00 H new ATOM 0 HG11 VAL A 148 80.015 24.814 -2.888 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.327 23.333 -3.598 1.00 25.00 H new ATOM 0 HG13 VAL A 148 79.937 24.627 -4.656 1.00 25.00 H new ATOM 0 HG21 VAL A 148 78.817 26.956 -3.004 1.00 25.00 H new ATOM 0 HG22 VAL A 148 78.655 26.859 -4.774 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.209 27.067 -3.758 1.00 25.00 H new ATOM 1075 N TYR A 149 77.746 22.263 -5.574 1.00 25.00 N ATOM 1076 CA TYR A 149 77.802 20.798 -5.506 1.00 25.00 C ATOM 1077 C TYR A 149 79.237 20.382 -5.797 1.00 25.00 C ATOM 1078 O TYR A 149 79.904 21.032 -6.593 1.00 25.00 O ATOM 1079 CB TYR A 149 76.872 20.179 -6.548 1.00 25.00 C ATOM 1080 CG TYR A 149 77.127 18.711 -6.793 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.816 17.749 -5.812 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.698 18.276 -8.009 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.074 16.375 -6.040 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.940 16.891 -8.243 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.625 15.959 -7.257 1.00 25.00 C ATOM 1086 OH TYR A 149 77.844 14.631 -7.485 1.00 25.00 O ATOM 0 H TYR A 149 78.337 22.661 -6.304 1.00 25.00 H new ATOM 0 HA TYR A 149 77.485 20.456 -4.521 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.839 20.310 -6.224 1.00 25.00 H new ATOM 0 HB3 TYR A 149 76.983 20.720 -7.488 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.376 18.062 -4.877 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.954 19.000 -8.769 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.845 15.648 -5.274 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.366 16.566 -9.181 1.00 25.00 H new ATOM 0 HH TYR A 149 77.505 14.109 -6.728 1.00 25.00 H new ATOM 1096 N ALA A 150 79.716 19.336 -5.126 1.00 25.00 N ATOM 1097 CA ALA A 150 81.094 18.854 -5.281 1.00 25.00 C ATOM 1098 C ALA A 150 82.098 20.009 -5.117 1.00 25.00 C ATOM 1099 O ALA A 150 83.019 20.166 -5.918 1.00 25.00 O ATOM 1100 CB ALA A 150 81.269 18.153 -6.636 1.00 25.00 C ATOM 0 H ALA A 150 79.163 18.797 -4.459 1.00 25.00 H new ATOM 0 HA ALA A 150 81.296 18.125 -4.496 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.296 17.802 -6.734 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.588 17.304 -6.697 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.047 18.855 -7.440 1.00 25.00 H new ATOM 1106 N GLU A 151 81.860 20.823 -4.087 1.00 25.00 N ATOM 1107 CA GLU A 151 82.694 22.000 -3.738 1.00 25.00 C ATOM 1108 C GLU A 151 82.783 23.090 -4.827 1.00 25.00 C ATOM 1109 O GLU A 151 83.571 24.033 -4.706 1.00 25.00 O ATOM 1110 CB GLU A 151 84.112 21.560 -3.324 1.00 25.00 C ATOM 1111 CG GLU A 151 84.135 20.566 -2.169 1.00 25.00 C ATOM 1112 CD GLU A 151 85.560 20.199 -1.757 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.235 19.480 -2.519 1.00 25.00 O ATOM 1114 OE2 GLU A 151 86.006 20.655 -0.678 1.00 25.00 O1- ATOM 0 H GLU A 151 81.071 20.690 -3.454 1.00 25.00 H new ATOM 0 HA GLU A 151 82.175 22.464 -2.899 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.610 21.114 -4.185 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.689 22.442 -3.044 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.609 20.991 -1.314 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.597 19.663 -2.457 1.00 25.00 H new ATOM 1121 N ARG A 152 81.968 22.987 -5.876 1.00 25.00 N ATOM 1122 CA ARG A 152 82.011 23.962 -6.970 1.00 25.00 C ATOM 1123 C ARG A 152 80.632 24.538 -7.283 1.00 25.00 C ATOM 1124 O ARG A 152 79.618 23.850 -7.155 1.00 25.00 O ATOM 1125 CB ARG A 152 82.592 23.297 -8.215 1.00 25.00 C ATOM 1126 CG ARG A 152 84.045 22.901 -8.026 1.00 25.00 C ATOM 1127 CD ARG A 152 84.638 22.327 -9.294 1.00 25.00 C ATOM 1128 NE ARG A 152 86.059 22.002 -9.089 1.00 25.00 N ATOM 1129 CZ ARG A 152 86.890 21.563 -10.025 1.00 25.00 C ATOM 1130 NH1 ARG A 152 86.500 21.362 -11.259 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 88.136 21.326 -9.711 1.00 25.00 N ATOM 0 H ARG A 152 81.276 22.247 -5.993 1.00 25.00 H new ATOM 0 HA ARG A 152 82.644 24.792 -6.655 1.00 25.00 H new ATOM 0 HB2 ARG A 152 82.005 22.412 -8.460 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.510 23.979 -9.061 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.622 23.772 -7.716 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.121 22.167 -7.224 1.00 25.00 H new ATOM 0 HD2 ARG A 152 84.091 21.431 -9.587 1.00 25.00 H new ATOM 0 HD3 ARG A 152 84.535 23.043 -10.109 1.00 25.00 H new ATOM 0 HE ARG A 152 86.436 22.125 -8.149 1.00 25.00 H new ATOM 0 HH11 ARG A 152 85.532 21.544 -11.524 1.00 25.00 H new ATOM 0 HH12 ARG A 152 87.164 21.024 -11.955 1.00 25.00 H new ATOM 0 HH21 ARG A 152 88.459 21.479 -8.756 1.00 25.00 H new ATOM 0 HH22 ARG A 152 88.786 20.988 -10.421 1.00 25.00 H new ATOM 1145 N PRO A 153 80.568 25.823 -7.665 1.00 25.00 N ATOM 1146 CA PRO A 153 79.232 26.353 -7.945 1.00 25.00 C ATOM 1147 C PRO A 153 78.642 25.777 -9.226 1.00 25.00 C ATOM 1148 O PRO A 153 79.346 25.529 -10.209 1.00 25.00 O ATOM 1149 CB PRO A 153 79.482 27.855 -8.074 1.00 25.00 C ATOM 1150 CG PRO A 153 80.869 27.952 -8.573 1.00 25.00 C ATOM 1151 CD PRO A 153 81.605 26.855 -7.851 1.00 25.00 C ATOM 0 HA PRO A 153 78.507 26.097 -7.172 1.00 25.00 H new ATOM 0 HB2 PRO A 153 78.777 28.318 -8.765 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.368 28.361 -7.115 1.00 25.00 H new ATOM 0 HG2 PRO A 153 80.913 27.815 -9.654 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.301 28.929 -8.357 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.446 26.481 -8.435 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.007 27.199 -6.898 1.00 25.00 H new ATOM 1159 N LEU A 154 77.335 25.582 -9.215 1.00 25.00 N ATOM 1160 CA LEU A 154 76.611 25.061 -10.365 1.00 25.00 C ATOM 1161 C LEU A 154 76.202 26.243 -11.252 1.00 0.00 C ATOM 1162 O LEU A 154 75.101 26.781 -11.133 1.00 25.00 O ATOM 1163 CB LEU A 154 75.381 24.293 -9.891 1.00 25.00 C ATOM 1164 CG LEU A 154 75.652 22.998 -9.105 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.528 22.766 -8.111 1.00 25.00 C ATOM 1166 CD2 LEU A 154 75.764 21.808 -10.046 1.00 25.00 C ATOM 0 H LEU A 154 76.743 25.780 -8.408 1.00 25.00 H new ATOM 0 HA LEU A 154 77.240 24.378 -10.936 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.783 24.955 -9.265 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.775 24.045 -10.762 1.00 25.00 H new ATOM 0 HG LEU A 154 76.597 23.103 -8.573 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.719 21.849 -7.554 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.475 23.607 -7.419 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.582 22.676 -8.646 1.00 25.00 H new ATOM 0 HD21 LEU A 154 75.956 20.904 -9.468 1.00 25.00 H new ATOM 0 HD22 LEU A 154 74.833 21.694 -10.600 1.00 25.00 H new ATOM 0 HD23 LEU A 154 76.584 21.973 -10.745 1.00 25.00 H new ATOM 1178 N THR A 155 77.137 26.723 -12.054 1.00 25.00 N ATOM 1179 CA THR A 155 76.937 27.951 -12.821 1.00 25.00 C ATOM 1180 C THR A 155 76.130 27.791 -14.113 1.00 25.00 C ATOM 1181 O THR A 155 75.334 28.666 -14.461 1.00 25.00 O ATOM 1182 CB THR A 155 78.302 28.552 -13.217 1.00 25.00 C ATOM 1183 OG1 THR A 155 79.072 27.560 -13.899 1.00 25.00 O ATOM 1184 CG2 THR A 155 79.093 28.976 -11.981 1.00 25.00 C ATOM 0 H THR A 155 78.046 26.283 -12.194 1.00 25.00 H new ATOM 0 HA THR A 155 76.364 28.595 -12.154 1.00 25.00 H new ATOM 0 HB THR A 155 78.117 29.420 -13.850 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.940 27.938 -14.154 1.00 25.00 H new ATOM 0 HG21 THR A 155 80.051 29.396 -12.288 1.00 25.00 H new ATOM 0 HG22 THR A 155 78.528 29.726 -11.427 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.265 28.108 -11.344 1.00 25.00 H new ATOM 1192 N ASP A 156 76.344 26.705 -14.843 1.00 25.00 N ATOM 1193 CA ASP A 156 75.673 26.510 -16.132 1.00 25.00 C ATOM 1194 C ASP A 156 74.287 25.923 -15.924 1.00 25.00 C ATOM 1195 O ASP A 156 74.102 24.715 -15.868 1.00 25.00 O ATOM 1196 CB ASP A 156 76.491 25.614 -17.057 1.00 25.00 C ATOM 1197 CG ASP A 156 75.921 25.563 -18.461 1.00 25.00 C ATOM 1198 OD1 ASP A 156 74.806 26.089 -18.689 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 76.598 24.994 -19.336 1.00 25.00 O1- ATOM 0 H ASP A 156 76.971 25.948 -14.572 1.00 25.00 H new ATOM 0 HA ASP A 156 75.578 27.486 -16.608 1.00 25.00 H new ATOM 0 HB2 ASP A 156 77.518 25.978 -17.097 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.526 24.606 -16.645 1.00 25.00 H new ATOM 1204 N ASN A 157 73.324 26.812 -15.770 1.00 25.00 N ATOM 1205 CA ASN A 157 71.954 26.429 -15.448 1.00 25.00 C ATOM 1206 C ASN A 157 71.199 25.749 -16.597 1.00 25.00 C ATOM 1207 O ASN A 157 70.103 25.249 -16.389 1.00 25.00 O ATOM 1208 CB ASN A 157 71.167 27.656 -14.948 1.00 25.00 C ATOM 1209 CG ASN A 157 70.849 28.645 -16.051 1.00 25.00 C ATOM 1210 OD1 ASN A 157 69.744 28.693 -16.545 1.00 25.00 O ATOM 1211 ND2 ASN A 157 71.801 29.468 -16.400 1.00 25.00 N ATOM 0 H ASN A 157 73.464 27.818 -15.863 1.00 25.00 H new ATOM 0 HA ASN A 157 72.032 25.679 -14.661 1.00 25.00 H new ATOM 0 HB2 ASN A 157 70.237 27.322 -14.488 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.744 28.159 -14.172 1.00 25.00 H new ATOM 0 HD21 ASN A 157 71.625 30.180 -17.109 1.00 25.00 H new ATOM 0 HD22 ASN A 157 72.720 29.399 -15.963 1.00 25.00 H new ATOM 1218 N HIS A 158 71.780 25.714 -17.787 1.00 25.00 N ATOM 1219 CA HIS A 158 71.120 25.093 -18.939 1.00 25.00 C ATOM 1220 C HIS A 158 71.337 23.573 -18.961 1.00 25.00 C ATOM 1221 O HIS A 158 70.650 22.848 -19.661 1.00 25.00 O ATOM 1222 CB HIS A 158 71.670 25.721 -20.226 1.00 25.00 C ATOM 1223 CG HIS A 158 70.904 25.346 -21.462 1.00 25.00 C ATOM 1224 ND1 HIS A 158 69.528 25.352 -21.558 1.00 25.00 N ATOM 1225 CD2 HIS A 158 71.343 24.955 -22.688 1.00 25.00 C ATOM 1226 CE1 HIS A 158 69.199 24.981 -22.785 1.00 25.00 C ATOM 1227 NE2 HIS A 158 70.266 24.737 -23.527 1.00 25.00 N ATOM 0 H HIS A 158 72.701 26.104 -17.986 1.00 25.00 H new ATOM 0 HA HIS A 158 70.047 25.270 -18.863 1.00 25.00 H new ATOM 0 HB2 HIS A 158 71.663 26.806 -20.121 1.00 25.00 H new ATOM 0 HB3 HIS A 158 72.710 25.420 -20.350 1.00 25.00 H new ATOM 0 HD2 HIS A 158 72.380 24.833 -22.965 1.00 25.00 H new ATOM 0 HE1 HIS A 158 68.182 24.889 -23.138 1.00 25.00 H new ATOM 0 HE2 HIS A 158 70.289 24.450 -24.506 1.00 25.00 H new ATOM 1235 N ARG A 159 72.301 23.089 -18.193 1.00 25.00 N ATOM 1236 CA ARG A 159 72.602 21.653 -18.163 1.00 25.00 C ATOM 1237 C ARG A 159 71.708 20.921 -17.175 1.00 25.00 C ATOM 1238 O ARG A 159 71.262 21.493 -16.182 1.00 25.00 O ATOM 1239 CB ARG A 159 74.059 21.434 -17.769 1.00 25.00 C ATOM 1240 CG ARG A 159 75.047 21.852 -18.840 1.00 25.00 C ATOM 1241 CD ARG A 159 76.463 21.853 -18.299 1.00 25.00 C ATOM 1242 NE ARG A 159 76.922 20.512 -17.896 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.078 20.254 -17.301 1.00 25.00 C ATOM 1244 NH1 ARG A 159 78.942 21.200 -17.029 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.375 19.031 -16.969 1.00 25.00 N ATOM 0 H ARG A 159 72.888 23.659 -17.584 1.00 25.00 H new ATOM 0 HA ARG A 159 72.420 21.256 -19.161 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.268 21.992 -16.856 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.210 20.379 -17.539 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.978 21.172 -19.689 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.793 22.846 -19.207 1.00 25.00 H new ATOM 0 HD2 ARG A 159 77.137 22.249 -19.059 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.519 22.524 -17.442 1.00 25.00 H new ATOM 0 HE ARG A 159 76.304 19.724 -18.089 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.734 22.167 -17.276 1.00 25.00 H new ATOM 0 HH12 ARG A 159 79.823 20.969 -16.570 1.00 25.00 H new ATOM 0 HH21 ARG A 159 77.719 18.275 -17.167 1.00 25.00 H new ATOM 0 HH22 ARG A 159 79.264 18.828 -16.511 1.00 25.00 H new ATOM 1259 N SER A 160 71.488 19.640 -17.435 1.00 25.00 N ATOM 1260 CA SER A 160 70.697 18.796 -16.544 1.00 25.00 C ATOM 1261 C SER A 160 71.550 18.303 -15.377 1.00 25.00 C ATOM 1262 O SER A 160 72.783 18.331 -15.434 1.00 25.00 O ATOM 1263 CB SER A 160 70.121 17.607 -17.312 1.00 25.00 C ATOM 1264 OG SER A 160 71.153 16.825 -17.896 1.00 25.00 O ATOM 0 H SER A 160 71.847 19.158 -18.259 1.00 25.00 H new ATOM 0 HA SER A 160 69.874 19.391 -16.147 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.529 16.988 -16.638 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.447 17.965 -18.091 1.00 25.00 H new ATOM 0 HG SER A 160 70.757 16.070 -18.380 1.00 25.00 H new ATOM 1270 N LEU A 161 70.891 17.857 -14.316 1.00 25.00 N ATOM 1271 CA LEU A 161 71.579 17.386 -13.109 1.00 25.00 C ATOM 1272 C LEU A 161 72.433 16.133 -13.367 1.00 25.00 C ATOM 1273 O LEU A 161 73.548 15.992 -12.826 1.00 25.00 O ATOM 1274 CB LEU A 161 70.529 17.090 -12.029 1.00 25.00 C ATOM 1275 CG LEU A 161 69.745 18.302 -11.499 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.559 17.831 -10.681 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.624 19.207 -10.644 1.00 25.00 C ATOM 0 H LEU A 161 69.874 17.809 -14.262 1.00 25.00 H new ATOM 0 HA LEU A 161 72.262 18.170 -12.781 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.817 16.370 -12.431 1.00 25.00 H new ATOM 0 HB3 LEU A 161 71.028 16.609 -11.188 1.00 25.00 H new ATOM 0 HG LEU A 161 69.399 18.876 -12.358 1.00 25.00 H new ATOM 0 HD11 LEU A 161 68.008 18.695 -10.309 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.904 17.224 -11.306 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.911 17.235 -9.839 1.00 25.00 H new ATOM 0 HD21 LEU A 161 70.037 20.053 -10.287 1.00 25.00 H new ATOM 0 HD22 LEU A 161 71.005 18.644 -9.792 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.460 19.572 -11.241 1.00 25.00 H new ATOM 1289 N ALA A 162 71.947 15.246 -14.228 1.00 25.00 N ATOM 1290 CA ALA A 162 72.702 14.048 -14.594 1.00 25.00 C ATOM 1291 C ALA A 162 74.014 14.428 -15.287 1.00 25.00 C ATOM 1292 O ALA A 162 75.011 13.718 -15.171 1.00 25.00 O ATOM 1293 CB ALA A 162 71.871 13.145 -15.512 1.00 25.00 C ATOM 0 H ALA A 162 71.039 15.331 -14.685 1.00 25.00 H new ATOM 0 HA ALA A 162 72.933 13.502 -13.679 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.450 12.259 -15.773 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.959 12.843 -14.997 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.612 13.689 -16.420 1.00 25.00 H new ATOM 1299 N SER A 163 74.028 15.558 -15.984 1.00 25.00 N ATOM 1300 CA SER A 163 75.234 16.028 -16.668 1.00 25.00 C ATOM 1301 C SER A 163 76.329 16.415 -15.663 1.00 25.00 C ATOM 1302 O SER A 163 77.505 16.460 -16.016 1.00 25.00 O ATOM 1303 CB SER A 163 74.903 17.230 -17.561 1.00 25.00 C ATOM 1304 OG SER A 163 76.013 17.611 -18.359 1.00 25.00 O ATOM 0 H SER A 163 73.218 16.169 -16.092 1.00 25.00 H new ATOM 0 HA SER A 163 75.608 15.211 -17.285 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.059 16.984 -18.205 1.00 25.00 H new ATOM 0 HB3 SER A 163 74.595 18.071 -16.940 1.00 25.00 H new ATOM 0 HG SER A 163 75.701 18.141 -19.122 1.00 25.00 H new ATOM 1310 N TYR A 164 75.951 16.671 -14.413 1.00 25.00 N ATOM 1311 CA TYR A 164 76.925 16.996 -13.369 1.00 25.00 C ATOM 1312 C TYR A 164 77.180 15.780 -12.498 1.00 25.00 C ATOM 1313 O TYR A 164 77.999 15.820 -11.582 1.00 25.00 O ATOM 1314 CB TYR A 164 76.400 18.122 -12.486 1.00 25.00 C ATOM 1315 CG TYR A 164 76.573 19.485 -13.080 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.775 20.196 -12.903 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.533 20.088 -13.808 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.934 21.494 -13.434 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.686 21.377 -14.342 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.887 22.080 -14.145 1.00 25.00 C ATOM 1321 OH TYR A 164 77.068 23.342 -14.634 1.00 25.00 O ATOM 0 H TYR A 164 74.981 16.660 -14.097 1.00 25.00 H new ATOM 0 HA TYR A 164 77.850 17.309 -13.853 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.341 17.953 -12.289 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.913 18.087 -11.525 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.586 19.742 -12.353 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.606 19.554 -13.958 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.861 22.030 -13.291 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.882 21.828 -14.904 1.00 25.00 H new ATOM 0 HH TYR A 164 78.017 23.483 -14.833 1.00 25.00 H new ATOM 1331 N GLY A 165 76.471 14.699 -12.774 1.00 25.00 N ATOM 1332 CA GLY A 165 76.613 13.496 -11.984 1.00 25.00 C ATOM 1333 C GLY A 165 75.862 13.567 -10.672 1.00 25.00 C ATOM 1334 O GLY A 165 76.275 12.919 -9.707 1.00 25.00 O ATOM 0 H GLY A 165 75.796 14.633 -13.536 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.251 12.644 -12.559 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.670 13.320 -11.784 1.00 25.00 H new ATOM 1338 N LEU A 166 74.768 14.327 -10.602 1.00 25.00 N ATOM 1339 CA LEU A 166 73.975 14.363 -9.368 1.00 25.00 C ATOM 1340 C LEU A 166 73.208 13.054 -9.219 1.00 25.00 C ATOM 1341 O LEU A 166 72.057 12.942 -9.615 1.00 25.00 O ATOM 1342 CB LEU A 166 72.984 15.528 -9.368 1.00 25.00 C ATOM 1343 CG LEU A 166 73.403 16.873 -8.765 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.757 16.720 -7.296 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.540 17.522 -9.507 1.00 25.00 C ATOM 0 H LEU A 166 74.416 14.911 -11.361 1.00 25.00 H new ATOM 0 HA LEU A 166 74.661 14.500 -8.532 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.693 15.710 -10.403 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.090 15.197 -8.839 1.00 25.00 H new ATOM 0 HG LEU A 166 72.541 17.533 -8.862 1.00 25.00 H new ATOM 0 HD11 LEU A 166 74.051 17.688 -6.890 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.891 16.346 -6.750 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.583 16.017 -7.192 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.790 18.471 -9.032 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.410 16.865 -9.487 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.245 17.701 -10.541 1.00 25.00 H new ATOM 1357 N LYS A 167 73.879 12.056 -8.674 1.00 25.00 N ATOM 1358 CA LYS A 167 73.275 10.752 -8.416 1.00 25.00 C ATOM 1359 C LYS A 167 72.230 10.864 -7.312 1.00 25.00 C ATOM 1360 O LYS A 167 72.329 11.712 -6.419 1.00 25.00 O ATOM 1361 CB LYS A 167 74.367 9.754 -8.010 1.00 25.00 C ATOM 1362 CG LYS A 167 75.160 10.193 -6.781 1.00 25.00 C ATOM 1363 CD LYS A 167 76.296 9.251 -6.474 1.00 25.00 C ATOM 1364 CE LYS A 167 77.070 9.786 -5.278 1.00 25.00 C ATOM 1365 NZ LYS A 167 78.226 8.936 -4.925 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.858 12.122 -8.396 1.00 25.00 H new ATOM 0 HA LYS A 167 72.784 10.399 -9.323 1.00 25.00 H new ATOM 0 HB2 LYS A 167 73.908 8.785 -7.811 1.00 25.00 H new ATOM 0 HB3 LYS A 167 75.053 9.616 -8.846 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.555 11.196 -6.944 1.00 25.00 H new ATOM 0 HG3 LYS A 167 74.493 10.249 -5.921 1.00 25.00 H new ATOM 0 HD2 LYS A 167 75.911 8.254 -6.259 1.00 25.00 H new ATOM 0 HD3 LYS A 167 76.954 9.159 -7.338 1.00 25.00 H new ATOM 0 HE2 LYS A 167 77.419 10.795 -5.497 1.00 25.00 H new ATOM 0 HE3 LYS A 167 76.402 9.859 -4.420 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 78.719 9.344 -4.105 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 77.894 7.979 -4.689 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 78.880 8.886 -5.732 1.00 25.00 H new ATOM 1379 N ASP A 168 71.241 9.992 -7.364 1.00 25.00 N ATOM 1380 CA ASP A 168 70.202 9.978 -6.362 1.00 25.00 C ATOM 1381 C ASP A 168 70.839 9.738 -4.999 1.00 25.00 C ATOM 1382 O ASP A 168 71.714 8.890 -4.837 1.00 25.00 O ATOM 1383 CB ASP A 168 69.138 8.910 -6.675 1.00 25.00 C ATOM 1384 CG ASP A 168 69.733 7.526 -6.929 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.459 7.356 -7.941 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.392 6.587 -6.179 1.00 25.00 O1- ATOM 0 H ASP A 168 71.139 9.285 -8.092 1.00 25.00 H new ATOM 0 HA ASP A 168 69.691 10.941 -6.359 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.437 8.850 -5.843 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.568 9.220 -7.551 1.00 25.00 H new ATOM 1391 N GLY A 169 70.428 10.549 -4.033 1.00 25.00 N ATOM 1392 CA GLY A 169 70.962 10.467 -2.689 1.00 25.00 C ATOM 1393 C GLY A 169 72.077 11.454 -2.418 1.00 25.00 C ATOM 1394 O GLY A 169 72.463 11.616 -1.263 1.00 25.00 O ATOM 0 H GLY A 169 69.722 11.274 -4.161 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.156 10.638 -1.976 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.332 9.457 -2.515 1.00 25.00 H new ATOM 1398 N ASP A 170 72.608 12.119 -3.439 1.00 25.00 N ATOM 1399 CA ASP A 170 73.674 13.095 -3.202 1.00 25.00 C ATOM 1400 C ASP A 170 73.139 14.398 -2.589 1.00 25.00 C ATOM 1401 O ASP A 170 71.923 14.652 -2.567 1.00 25.00 O ATOM 1402 CB ASP A 170 74.453 13.379 -4.478 1.00 25.00 C ATOM 1403 CG ASP A 170 75.954 13.488 -4.225 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.357 14.106 -3.216 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.730 12.897 -5.002 1.00 25.00 O1- ATOM 0 H ASP A 170 72.330 12.008 -4.414 1.00 25.00 H new ATOM 0 HA ASP A 170 74.355 12.650 -2.476 1.00 25.00 H new ATOM 0 HB2 ASP A 170 74.265 12.585 -5.201 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.093 14.307 -4.923 1.00 25.00 H new ATOM 1410 N VAL A 171 74.051 15.205 -2.059 1.00 25.00 N ATOM 1411 CA VAL A 171 73.705 16.427 -1.331 1.00 25.00 C ATOM 1412 C VAL A 171 74.207 17.685 -2.052 1.00 25.00 C ATOM 1413 O VAL A 171 75.370 17.775 -2.457 1.00 25.00 O ATOM 1414 CB VAL A 171 74.309 16.399 0.114 1.00 25.00 C ATOM 1415 CG1 VAL A 171 73.804 17.601 0.947 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.946 15.085 0.835 1.00 25.00 C ATOM 0 H VAL A 171 75.054 15.033 -2.120 1.00 25.00 H new ATOM 0 HA VAL A 171 72.617 16.465 -1.280 1.00 25.00 H new ATOM 0 HB VAL A 171 75.393 16.465 0.019 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.237 17.559 1.946 1.00 25.00 H new ATOM 0 HG12 VAL A 171 74.101 18.531 0.461 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.717 17.561 1.021 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.376 15.089 1.836 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.862 14.997 0.906 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.343 14.240 0.273 1.00 25.00 H new ATOM 1426 N VAL A 172 73.324 18.664 -2.182 1.00 25.00 N ATOM 1427 CA VAL A 172 73.637 19.947 -2.802 1.00 25.00 C ATOM 1428 C VAL A 172 73.588 21.004 -1.703 1.00 25.00 C ATOM 1429 O VAL A 172 72.782 20.897 -0.787 1.00 25.00 O ATOM 1430 CB VAL A 172 72.594 20.292 -3.906 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.117 21.406 -4.804 1.00 25.00 C ATOM 1432 CG2 VAL A 172 72.280 19.048 -4.759 1.00 25.00 C ATOM 0 H VAL A 172 72.360 18.591 -1.857 1.00 25.00 H new ATOM 0 HA VAL A 172 74.620 19.909 -3.270 1.00 25.00 H new ATOM 0 HB VAL A 172 71.680 20.628 -3.416 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.376 21.634 -5.570 1.00 25.00 H new ATOM 0 HG12 VAL A 172 73.307 22.297 -4.205 1.00 25.00 H new ATOM 0 HG13 VAL A 172 74.043 21.085 -5.280 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.550 19.307 -5.525 1.00 25.00 H new ATOM 0 HG22 VAL A 172 73.194 18.693 -5.234 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.874 18.263 -4.121 1.00 25.00 H new ATOM 1442 N ILE A 173 74.447 22.009 -1.772 1.00 25.00 N ATOM 1443 CA ILE A 173 74.496 23.042 -0.737 1.00 25.00 C ATOM 1444 C ILE A 173 74.096 24.386 -1.340 1.00 25.00 C ATOM 1445 O ILE A 173 74.719 24.877 -2.278 1.00 25.00 O ATOM 1446 CB ILE A 173 75.913 23.151 -0.097 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.345 21.773 0.462 1.00 25.00 C ATOM 1448 CG2 ILE A 173 75.898 24.212 1.045 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.804 21.703 0.954 1.00 25.00 C ATOM 0 H ILE A 173 75.119 22.135 -2.529 1.00 25.00 H new ATOM 0 HA ILE A 173 73.797 22.763 0.051 1.00 25.00 H new ATOM 0 HB ILE A 173 76.627 23.463 -0.859 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.685 21.509 1.288 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.202 21.021 -0.314 1.00 25.00 H new ATOM 0 HG21 ILE A 173 76.891 24.283 1.488 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.612 25.182 0.637 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.180 23.914 1.809 1.00 25.00 H new ATOM 0 HD11 ILE A 173 78.014 20.701 1.327 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.478 21.932 0.128 1.00 25.00 H new ATOM 0 HD13 ILE A 173 77.953 22.427 1.755 1.00 25.00 H new ATOM 1461 N LEU A 174 73.046 24.975 -0.795 1.00 25.00 N ATOM 1462 CA LEU A 174 72.562 26.280 -1.216 1.00 25.00 C ATOM 1463 C LEU A 174 73.116 27.274 -0.190 1.00 25.00 C ATOM 1464 O LEU A 174 73.054 27.037 1.010 1.00 25.00 O ATOM 1465 CB LEU A 174 71.031 26.274 -1.213 1.00 25.00 C ATOM 1466 CG LEU A 174 70.287 27.200 -2.191 1.00 25.00 C ATOM 1467 CD1 LEU A 174 68.793 26.943 -2.056 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.567 28.670 -1.935 1.00 25.00 C ATOM 0 H LEU A 174 72.500 24.558 -0.041 1.00 25.00 H new ATOM 0 HA LEU A 174 72.882 26.545 -2.224 1.00 25.00 H new ATOM 0 HB2 LEU A 174 70.704 25.253 -1.411 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.701 26.525 -0.205 1.00 25.00 H new ATOM 0 HG LEU A 174 70.641 26.977 -3.198 1.00 25.00 H new ATOM 0 HD11 LEU A 174 68.249 27.591 -2.743 1.00 25.00 H new ATOM 0 HD12 LEU A 174 68.580 25.901 -2.295 1.00 25.00 H new ATOM 0 HD13 LEU A 174 68.479 27.152 -1.033 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.016 29.276 -2.654 1.00 25.00 H new ATOM 0 HD22 LEU A 174 70.252 28.930 -0.925 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.635 28.861 -2.042 1.00 25.00 H new ATOM 1480 N ARG A 175 73.721 28.358 -0.646 1.00 25.00 N ATOM 1481 CA ARG A 175 74.353 29.316 0.260 1.00 25.00 C ATOM 1482 C ARG A 175 73.828 30.723 0.079 1.00 25.00 C ATOM 1483 O ARG A 175 74.004 31.336 -0.967 1.00 25.00 O ATOM 1484 CB ARG A 175 75.863 29.341 0.036 1.00 25.00 C ATOM 1485 CG ARG A 175 76.569 28.043 0.417 1.00 25.00 C ATOM 1486 CD ARG A 175 78.083 28.217 0.359 1.00 25.00 C ATOM 1487 NE ARG A 175 78.558 29.185 1.369 1.00 25.00 N ATOM 1488 CZ ARG A 175 79.806 29.619 1.503 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.782 29.192 0.737 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.073 30.501 2.426 1.00 25.00 N ATOM 0 H ARG A 175 73.791 28.601 -1.634 1.00 25.00 H new ATOM 0 HA ARG A 175 74.114 28.984 1.270 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.061 29.555 -1.014 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.292 30.159 0.614 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.271 27.742 1.421 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.263 27.245 -0.259 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.567 27.254 0.521 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.373 28.556 -0.635 1.00 25.00 H new ATOM 0 HE ARG A 175 77.866 29.553 2.022 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.594 28.503 0.008 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.728 29.549 0.870 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.329 30.847 3.031 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.026 30.845 2.542 1.00 25.00 H new ATOM 1504 N GLN A 176 73.265 31.240 1.171 1.00 25.00 N ATOM 1505 CA GLN A 176 72.901 32.658 1.313 1.00 25.00 C ATOM 1506 C GLN A 176 73.791 33.318 2.377 1.00 25.00 C ATOM 1507 O GLN A 176 74.594 34.188 2.138 1.00 25.00 O ATOM 1508 CB GLN A 176 71.405 32.835 1.632 1.00 25.00 C ATOM 1509 CG GLN A 176 70.987 34.326 1.565 1.00 25.00 C ATOM 1510 CD GLN A 176 69.575 34.521 2.041 1.00 25.00 C ATOM 1511 OE1 GLN A 176 69.145 33.987 3.038 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.822 35.358 1.355 1.00 25.00 N ATOM 1513 OXT GLN A 176 73.695 32.842 3.474 1.00 25.00 O ATOM 0 H GLN A 176 73.044 30.682 1.996 1.00 25.00 H new ATOM 0 HA GLN A 176 73.073 33.156 0.359 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.810 32.256 0.926 1.00 25.00 H new ATOM 0 HB3 GLN A 176 71.194 32.440 2.626 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.664 34.923 2.176 1.00 25.00 H new ATOM 0 HG3 GLN A 176 71.080 34.686 0.540 1.00 25.00 H new ATOM 0 HE21 GLN A 176 69.191 35.805 0.515 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.871 35.559 1.664 1.00 25.00 H new