USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=16 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 -153:sc= 0.127 USER MOD Set 1.2: A 163 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 104 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 101 MET CE :methyl -168:sc= -0.124 (180deg=-0.173) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 CYS SG : rot -170:sc= -0.0449 USER MOD Single : A 113 SER OG : rot 180:sc= -0.0608 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 129 ASN : amide:sc=-0.00527 K(o=-0.0053,f=-1.1) USER MOD Single : A 134 CYS SG : rot 180:sc= -1.08 USER MOD Single : A 138 SER OG : rot -29:sc= 0.181 USER MOD Single : A 145 SER OG : rot -34:sc= 1.01 USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 ASN : amide:sc= 0 K(o=0,f=-2.4!) USER MOD Single : A 158 HIS : no HE2:sc= 0.4 K(o=0.4,f=-1.4) USER MOD Single : A 164 TYR OH : rot -177:sc= 1.16 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0.196 K(o=0.2,f=-8.9!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 62.447 9.116 -11.818 1.00 25.00 N ATOM 307 CA HIS A 100 62.693 10.327 -11.049 1.00 25.00 C ATOM 308 C HIS A 100 63.706 9.923 -9.991 1.00 25.00 C ATOM 309 O HIS A 100 63.967 8.733 -9.815 1.00 25.00 O ATOM 310 CB HIS A 100 61.393 10.810 -10.406 1.00 25.00 C ATOM 311 CG HIS A 100 60.613 9.715 -9.735 1.00 25.00 C ATOM 312 ND1 HIS A 100 60.870 9.230 -8.479 1.00 25.00 N ATOM 313 CD2 HIS A 100 59.554 8.986 -10.182 1.00 25.00 C ATOM 314 CE1 HIS A 100 59.998 8.262 -8.220 1.00 25.00 C ATOM 315 NE2 HIS A 100 59.168 8.069 -9.231 1.00 25.00 N ATOM 0 HA HIS A 100 63.063 11.146 -11.666 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.625 11.582 -9.672 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.769 11.274 -11.170 1.00 25.00 H new ATOM 0 HD2 HIS A 100 59.083 9.110 -11.146 1.00 25.00 H new ATOM 0 HE1 HIS A 100 59.970 7.702 -7.297 1.00 25.00 H new ATOM 0 HE2 HIS A 100 58.409 7.390 -9.293 1.00 25.00 H new ATOM 323 N MET A 101 64.284 10.895 -9.304 1.00 25.00 N ATOM 324 CA MET A 101 65.311 10.650 -8.292 1.00 25.00 C ATOM 325 C MET A 101 65.147 11.658 -7.156 1.00 25.00 C ATOM 326 O MET A 101 64.437 12.650 -7.300 1.00 25.00 O ATOM 327 CB MET A 101 66.698 10.764 -8.931 1.00 25.00 C ATOM 328 CG MET A 101 66.989 12.129 -9.528 1.00 25.00 C ATOM 329 SD MET A 101 68.525 12.128 -10.445 1.00 25.00 S ATOM 330 CE MET A 101 68.690 13.867 -10.797 1.00 25.00 C ATOM 0 H MET A 101 64.057 11.881 -9.430 1.00 25.00 H new ATOM 0 HA MET A 101 65.204 9.645 -7.885 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.454 10.539 -8.179 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.791 10.009 -9.712 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.171 12.421 -10.186 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.039 12.872 -8.732 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.475 14.015 -11.538 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.747 14.251 -11.186 1.00 25.00 H new ATOM 0 HE3 MET A 101 68.949 14.400 -9.882 1.00 25.00 H new ATOM 340 N LEU A 102 65.781 11.387 -6.025 1.00 25.00 N ATOM 341 CA LEU A 102 65.683 12.254 -4.851 1.00 25.00 C ATOM 342 C LEU A 102 67.054 12.847 -4.562 1.00 25.00 C ATOM 343 O LEU A 102 68.034 12.112 -4.489 1.00 25.00 O ATOM 344 CB LEU A 102 65.210 11.434 -3.640 1.00 25.00 C ATOM 345 CG LEU A 102 64.959 12.223 -2.339 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.623 12.956 -2.389 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.970 11.275 -1.147 1.00 25.00 C ATOM 0 H LEU A 102 66.374 10.568 -5.891 1.00 25.00 H new ATOM 0 HA LEU A 102 64.966 13.053 -5.041 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.288 10.921 -3.913 1.00 25.00 H new ATOM 0 HB3 LEU A 102 65.954 10.664 -3.436 1.00 25.00 H new ATOM 0 HG LEU A 102 65.755 12.960 -2.233 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.473 13.503 -1.458 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.623 13.655 -3.225 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.817 12.234 -2.519 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.792 11.839 -0.232 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.187 10.527 -1.270 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.939 10.779 -1.085 1.00 25.00 H new ATOM 359 N LEU A 103 67.120 14.159 -4.388 1.00 25.00 N ATOM 360 CA LEU A 103 68.373 14.841 -4.061 1.00 25.00 C ATOM 361 C LEU A 103 68.192 15.591 -2.765 1.00 25.00 C ATOM 362 O LEU A 103 67.079 15.988 -2.438 1.00 25.00 O ATOM 363 CB LEU A 103 68.747 15.844 -5.154 1.00 25.00 C ATOM 364 CG LEU A 103 69.026 15.271 -6.550 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.341 16.431 -7.487 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.183 14.299 -6.531 1.00 25.00 C ATOM 0 H LEU A 103 66.315 14.781 -4.468 1.00 25.00 H new ATOM 0 HA LEU A 103 69.165 14.097 -3.976 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.939 16.571 -5.240 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.632 16.389 -4.827 1.00 25.00 H new ATOM 0 HG LEU A 103 68.147 14.725 -6.892 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.543 16.047 -8.487 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.489 17.110 -7.525 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.216 16.967 -7.121 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.351 13.914 -7.537 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.081 14.809 -6.183 1.00 25.00 H new ATOM 0 HD23 LEU A 103 69.952 13.472 -5.860 1.00 25.00 H new ATOM 378 N THR A 104 69.277 15.809 -2.046 1.00 25.00 N ATOM 379 CA THR A 104 69.230 16.546 -0.788 1.00 25.00 C ATOM 380 C THR A 104 69.800 17.941 -1.016 1.00 25.00 C ATOM 381 O THR A 104 70.746 18.120 -1.771 1.00 25.00 O ATOM 382 CB THR A 104 70.010 15.786 0.304 1.00 25.00 C ATOM 383 OG1 THR A 104 69.543 14.432 0.357 1.00 25.00 O ATOM 384 CG2 THR A 104 69.812 16.404 1.686 1.00 25.00 C ATOM 0 H THR A 104 70.208 15.486 -2.310 1.00 25.00 H new ATOM 0 HA THR A 104 68.200 16.639 -0.445 1.00 25.00 H new ATOM 0 HB THR A 104 71.068 15.838 0.046 1.00 25.00 H new ATOM 0 HG1 THR A 104 70.036 13.943 1.048 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.380 15.836 2.423 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.161 17.437 1.676 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.754 16.381 1.947 1.00 25.00 H new ATOM 392 N VAL A 105 69.200 18.936 -0.396 1.00 25.00 N ATOM 393 CA VAL A 105 69.653 20.315 -0.521 1.00 25.00 C ATOM 394 C VAL A 105 69.899 20.871 0.874 1.00 25.00 C ATOM 395 O VAL A 105 69.005 20.853 1.720 1.00 25.00 O ATOM 396 CB VAL A 105 68.588 21.182 -1.220 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.065 22.632 -1.367 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.218 20.599 -2.603 1.00 25.00 C ATOM 0 H VAL A 105 68.387 18.817 0.208 1.00 25.00 H new ATOM 0 HA VAL A 105 70.565 20.335 -1.117 1.00 25.00 H new ATOM 0 HB VAL A 105 67.697 21.175 -0.593 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.293 23.220 -1.864 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.263 23.052 -0.381 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.978 22.656 -1.961 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.465 21.230 -3.074 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.107 20.564 -3.233 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.821 19.592 -2.479 1.00 25.00 H new ATOM 408 N TYR A 106 71.098 21.375 1.111 1.00 25.00 N ATOM 409 CA TYR A 106 71.431 21.992 2.385 1.00 25.00 C ATOM 410 C TYR A 106 71.573 23.495 2.193 1.00 25.00 C ATOM 411 O TYR A 106 72.518 23.962 1.574 1.00 25.00 O ATOM 412 CB TYR A 106 72.728 21.399 2.942 1.00 25.00 C ATOM 413 CG TYR A 106 73.136 21.975 4.289 1.00 25.00 C ATOM 414 CD1 TYR A 106 72.166 22.369 5.239 1.00 25.00 C ATOM 415 CD2 TYR A 106 74.499 22.120 4.627 1.00 25.00 C ATOM 416 CE1 TYR A 106 72.547 22.893 6.496 1.00 25.00 C ATOM 417 CE2 TYR A 106 74.879 22.640 5.895 1.00 25.00 C ATOM 418 CZ TYR A 106 73.891 23.025 6.809 1.00 25.00 C ATOM 419 OH TYR A 106 74.230 23.542 8.027 1.00 25.00 O ATOM 0 H TYR A 106 71.861 21.369 0.434 1.00 25.00 H new ATOM 0 HA TYR A 106 70.633 21.795 3.101 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.611 20.320 3.039 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.532 21.569 2.226 1.00 25.00 H new ATOM 0 HD1 TYR A 106 71.117 22.268 5.001 1.00 25.00 H new ATOM 0 HD2 TYR A 106 75.260 21.833 3.916 1.00 25.00 H new ATOM 0 HE1 TYR A 106 71.793 23.190 7.210 1.00 25.00 H new ATOM 0 HE2 TYR A 106 75.924 22.737 6.151 1.00 25.00 H new ATOM 0 HH TYR A 106 75.206 23.575 8.108 1.00 25.00 H new ATOM 429 N CYS A 107 70.623 24.250 2.714 1.00 25.00 N ATOM 430 CA CYS A 107 70.637 25.699 2.599 1.00 25.00 C ATOM 431 C CYS A 107 71.307 26.264 3.837 1.00 25.00 C ATOM 432 O CYS A 107 71.030 25.826 4.940 1.00 25.00 O ATOM 433 CB CYS A 107 69.207 26.230 2.503 1.00 25.00 C ATOM 434 SG CYS A 107 69.118 28.029 2.467 1.00 25.00 S ATOM 0 H CYS A 107 69.823 23.879 3.227 1.00 25.00 H new ATOM 0 HA CYS A 107 71.180 25.997 1.702 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.738 25.832 1.603 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.632 25.861 3.352 1.00 25.00 H new ATOM 0 HG CYS A 107 67.880 28.405 2.596 1.00 25.00 H new ATOM 440 N VAL A 108 72.212 27.216 3.640 1.00 25.00 N ATOM 441 CA VAL A 108 72.998 27.784 4.733 1.00 25.00 C ATOM 442 C VAL A 108 72.919 29.306 4.761 1.00 25.00 C ATOM 443 O VAL A 108 73.158 29.979 3.748 1.00 25.00 O ATOM 444 CB VAL A 108 74.496 27.359 4.609 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.310 27.825 5.831 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.607 25.837 4.471 1.00 25.00 C ATOM 0 H VAL A 108 72.422 27.615 2.725 1.00 25.00 H new ATOM 0 HA VAL A 108 72.575 27.397 5.660 1.00 25.00 H new ATOM 0 HB VAL A 108 74.904 27.836 3.718 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.349 27.515 5.716 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.262 28.911 5.907 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.896 27.379 6.735 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.656 25.555 4.385 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.173 25.359 5.350 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.070 25.512 3.580 1.00 25.00 H new ATOM 456 N ARG A 109 72.647 29.852 5.944 1.00 25.00 N ATOM 457 CA ARG A 109 72.714 31.289 6.182 1.00 25.00 C ATOM 458 C ARG A 109 73.598 31.518 7.384 1.00 25.00 C ATOM 459 O ARG A 109 73.623 30.707 8.296 1.00 25.00 O ATOM 460 CB ARG A 109 71.333 31.857 6.455 1.00 25.00 C ATOM 461 CG ARG A 109 70.937 32.897 5.453 1.00 25.00 C ATOM 462 CD ARG A 109 70.006 33.926 6.062 1.00 25.00 C ATOM 463 NE ARG A 109 69.693 34.996 5.100 1.00 25.00 N ATOM 464 CZ ARG A 109 69.161 36.174 5.399 1.00 25.00 C ATOM 465 NH1 ARG A 109 68.878 36.526 6.634 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 68.918 37.014 4.430 1.00 25.00 N ATOM 0 H ARG A 109 72.374 29.309 6.764 1.00 25.00 H new ATOM 0 HA ARG A 109 73.116 31.788 5.300 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.602 31.049 6.444 1.00 25.00 H new ATOM 0 HB3 ARG A 109 71.313 32.292 7.454 1.00 25.00 H new ATOM 0 HG2 ARG A 109 71.829 33.393 5.069 1.00 25.00 H new ATOM 0 HG3 ARG A 109 70.448 32.419 4.604 1.00 25.00 H new ATOM 0 HD2 ARG A 109 69.084 33.441 6.383 1.00 25.00 H new ATOM 0 HD3 ARG A 109 70.467 34.356 6.951 1.00 25.00 H new ATOM 0 HE ARG A 109 69.904 34.816 4.118 1.00 25.00 H new ATOM 0 HH11 ARG A 109 69.067 35.884 7.403 1.00 25.00 H new ATOM 0 HH12 ARG A 109 68.469 37.441 6.822 1.00 25.00 H new ATOM 0 HH21 ARG A 109 69.137 36.759 3.467 1.00 25.00 H new ATOM 0 HH22 ARG A 109 68.509 37.926 4.636 1.00 25.00 H new ATOM 480 N ARG A 110 74.321 32.630 7.391 1.00 25.00 N ATOM 481 CA ARG A 110 75.243 32.927 8.494 1.00 25.00 C ATOM 482 C ARG A 110 74.500 33.167 9.810 1.00 25.00 C ATOM 483 O ARG A 110 75.039 32.926 10.877 1.00 25.00 O ATOM 484 CB ARG A 110 76.106 34.152 8.143 1.00 25.00 C ATOM 485 CG ARG A 110 77.254 34.425 9.124 1.00 25.00 C ATOM 486 CD ARG A 110 78.236 33.252 9.177 1.00 25.00 C ATOM 487 NE ARG A 110 79.372 33.523 10.069 1.00 25.00 N ATOM 488 CZ ARG A 110 80.297 32.630 10.415 1.00 25.00 C ATOM 489 NH1 ARG A 110 80.266 31.389 9.990 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 81.270 32.995 11.202 1.00 25.00 N ATOM 0 H ARG A 110 74.293 33.338 6.657 1.00 25.00 H new ATOM 0 HA ARG A 110 75.884 32.057 8.633 1.00 25.00 H new ATOM 0 HB2 ARG A 110 76.523 34.013 7.146 1.00 25.00 H new ATOM 0 HB3 ARG A 110 75.464 35.032 8.100 1.00 25.00 H new ATOM 0 HG2 ARG A 110 77.782 35.330 8.825 1.00 25.00 H new ATOM 0 HG3 ARG A 110 76.848 34.607 10.119 1.00 25.00 H new ATOM 0 HD2 ARG A 110 77.714 32.358 9.517 1.00 25.00 H new ATOM 0 HD3 ARG A 110 78.606 33.043 8.173 1.00 25.00 H new ATOM 0 HE ARG A 110 79.458 34.465 10.451 1.00 25.00 H new ATOM 0 HH11 ARG A 110 79.515 31.080 9.373 1.00 25.00 H new ATOM 0 HH12 ARG A 110 80.993 30.733 10.277 1.00 25.00 H new ATOM 0 HH21 ARG A 110 81.316 33.955 11.545 1.00 25.00 H new ATOM 0 HH22 ARG A 110 81.985 32.321 11.475 1.00 25.00 H new ATOM 504 N ASP A 111 73.253 33.599 9.705 1.00 25.00 N ATOM 505 CA ASP A 111 72.404 33.871 10.866 1.00 25.00 C ATOM 506 C ASP A 111 71.766 32.592 11.443 1.00 25.00 C ATOM 507 O ASP A 111 70.719 32.644 12.084 1.00 25.00 O ATOM 508 CB ASP A 111 71.303 34.847 10.451 1.00 25.00 C ATOM 509 CG ASP A 111 71.835 35.992 9.619 1.00 25.00 C ATOM 510 OD1 ASP A 111 72.673 36.774 10.111 1.00 25.00 O ATOM 511 OD2 ASP A 111 71.507 36.022 8.410 1.00 25.00 O1- ATOM 0 H ASP A 111 72.795 33.773 8.811 1.00 25.00 H new ATOM 0 HA ASP A 111 73.032 34.298 11.648 1.00 25.00 H new ATOM 0 HB2 ASP A 111 70.541 34.312 9.884 1.00 25.00 H new ATOM 0 HB3 ASP A 111 70.817 35.244 11.342 1.00 25.00 H new ATOM 516 N LEU A 112 72.399 31.454 11.171 1.00 25.00 N ATOM 517 CA LEU A 112 71.959 30.120 11.632 1.00 25.00 C ATOM 518 C LEU A 112 70.533 29.791 11.171 1.00 25.00 C ATOM 519 O LEU A 112 69.813 29.029 11.799 1.00 25.00 O ATOM 520 CB LEU A 112 72.078 29.984 13.160 1.00 25.00 C ATOM 521 CG LEU A 112 73.489 30.198 13.737 1.00 25.00 C ATOM 522 CD1 LEU A 112 73.417 30.138 15.265 1.00 25.00 C ATOM 523 CD2 LEU A 112 74.484 29.141 13.233 1.00 25.00 C ATOM 0 H LEU A 112 73.252 31.422 10.612 1.00 25.00 H new ATOM 0 HA LEU A 112 72.630 29.395 11.171 1.00 25.00 H new ATOM 0 HB2 LEU A 112 71.402 30.702 13.625 1.00 25.00 H new ATOM 0 HB3 LEU A 112 71.734 28.990 13.447 1.00 25.00 H new ATOM 0 HG LEU A 112 73.845 31.173 13.405 1.00 25.00 H new ATOM 0 HD11 LEU A 112 74.413 30.289 15.682 1.00 25.00 H new ATOM 0 HD12 LEU A 112 72.749 30.919 15.629 1.00 25.00 H new ATOM 0 HD13 LEU A 112 73.038 29.164 15.573 1.00 25.00 H new ATOM 0 HD21 LEU A 112 75.466 29.331 13.665 1.00 25.00 H new ATOM 0 HD22 LEU A 112 74.142 28.149 13.529 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.550 29.192 12.146 1.00 25.00 H new ATOM 535 N SER A 113 70.163 30.347 10.028 1.00 25.00 N ATOM 536 CA SER A 113 68.862 30.079 9.403 1.00 25.00 C ATOM 537 C SER A 113 69.002 28.897 8.448 1.00 25.00 C ATOM 538 O SER A 113 68.263 28.767 7.481 1.00 25.00 O ATOM 539 CB SER A 113 68.402 31.314 8.640 1.00 25.00 C ATOM 540 OG SER A 113 69.049 32.466 9.160 1.00 25.00 O ATOM 0 H SER A 113 70.749 30.996 9.503 1.00 25.00 H new ATOM 0 HA SER A 113 68.124 29.840 10.169 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.630 31.204 7.580 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.321 31.423 8.724 1.00 25.00 H new ATOM 0 HG SER A 113 68.752 33.259 8.666 1.00 25.00 H new ATOM 546 N GLU A 114 70.037 28.107 8.679 1.00 25.00 N ATOM 547 CA GLU A 114 70.359 26.975 7.825 1.00 25.00 C ATOM 548 C GLU A 114 69.358 25.832 8.023 1.00 25.00 C ATOM 549 O GLU A 114 68.815 25.638 9.111 1.00 25.00 O ATOM 550 CB GLU A 114 71.808 26.527 8.096 1.00 25.00 C ATOM 551 CG GLU A 114 72.131 26.159 9.549 1.00 25.00 C ATOM 552 CD GLU A 114 73.642 26.114 9.820 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.365 26.988 9.286 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.103 25.237 10.589 1.00 25.00 O1- ATOM 0 H GLU A 114 70.678 28.232 9.463 1.00 25.00 H new ATOM 0 HA GLU A 114 70.282 27.277 6.781 1.00 25.00 H new ATOM 0 HB2 GLU A 114 72.026 25.665 7.465 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.480 27.327 7.785 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.666 26.885 10.217 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.694 25.188 9.781 1.00 25.00 H new ATOM 561 N VAL A 115 69.083 25.117 6.947 1.00 25.00 N ATOM 562 CA VAL A 115 68.062 24.070 6.944 1.00 25.00 C ATOM 563 C VAL A 115 68.415 23.079 5.839 1.00 25.00 C ATOM 564 O VAL A 115 68.993 23.463 4.824 1.00 25.00 O ATOM 565 CB VAL A 115 66.626 24.693 6.704 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.518 25.389 5.331 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.518 23.633 6.851 1.00 25.00 C ATOM 0 H VAL A 115 69.555 25.240 6.051 1.00 25.00 H new ATOM 0 HA VAL A 115 68.037 23.563 7.908 1.00 25.00 H new ATOM 0 HB VAL A 115 66.485 25.450 7.476 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.516 25.801 5.210 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.251 26.193 5.272 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.710 24.664 4.540 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.546 24.096 6.680 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.675 22.839 6.121 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.547 23.213 7.856 1.00 25.00 H new ATOM 577 N THR A 116 68.092 21.812 6.020 1.00 25.00 N ATOM 578 CA THR A 116 68.349 20.801 4.997 1.00 25.00 C ATOM 579 C THR A 116 67.037 20.088 4.712 1.00 25.00 C ATOM 580 O THR A 116 66.211 19.913 5.608 1.00 25.00 O ATOM 581 CB THR A 116 69.469 19.808 5.429 1.00 25.00 C ATOM 582 OG1 THR A 116 69.597 18.769 4.459 1.00 25.00 O ATOM 583 CG2 THR A 116 69.179 19.175 6.781 1.00 25.00 C ATOM 0 H THR A 116 67.650 21.452 6.866 1.00 25.00 H new ATOM 0 HA THR A 116 68.717 21.278 4.088 1.00 25.00 H new ATOM 0 HB THR A 116 70.394 20.380 5.506 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.304 18.149 4.735 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.986 18.490 7.043 1.00 25.00 H new ATOM 0 HG22 THR A 116 69.105 19.954 7.539 1.00 25.00 H new ATOM 0 HG23 THR A 116 68.239 18.626 6.732 1.00 25.00 H new ATOM 591 N PHE A 117 66.821 19.745 3.453 1.00 25.00 N ATOM 592 CA PHE A 117 65.576 19.125 3.008 1.00 25.00 C ATOM 593 C PHE A 117 65.901 18.346 1.741 1.00 25.00 C ATOM 594 O PHE A 117 67.026 18.417 1.255 1.00 25.00 O ATOM 595 CB PHE A 117 64.504 20.195 2.729 1.00 25.00 C ATOM 596 CG PHE A 117 64.941 21.260 1.756 1.00 25.00 C ATOM 597 CD1 PHE A 117 65.590 22.425 2.219 1.00 25.00 C ATOM 598 CD2 PHE A 117 64.692 21.118 0.381 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.981 23.441 1.312 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.072 22.132 -0.534 1.00 25.00 C ATOM 601 CZ PHE A 117 65.716 23.294 -0.066 1.00 25.00 C ATOM 0 H PHE A 117 67.502 19.887 2.707 1.00 25.00 H new ATOM 0 HA PHE A 117 65.174 18.465 3.777 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.610 19.707 2.341 1.00 25.00 H new ATOM 0 HB3 PHE A 117 64.225 20.669 3.670 1.00 25.00 H new ATOM 0 HD1 PHE A 117 65.790 22.543 3.274 1.00 25.00 H new ATOM 0 HD2 PHE A 117 64.205 20.226 0.016 1.00 25.00 H new ATOM 0 HE1 PHE A 117 66.481 24.327 1.675 1.00 25.00 H new ATOM 0 HE2 PHE A 117 64.868 22.014 -1.588 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.006 24.070 -0.759 1.00 25.00 H new ATOM 611 N SER A 118 64.943 17.600 1.208 1.00 25.00 N ATOM 612 CA SER A 118 65.174 16.815 -0.003 1.00 25.00 C ATOM 613 C SER A 118 64.069 17.080 -1.003 1.00 25.00 C ATOM 614 O SER A 118 62.947 17.381 -0.622 1.00 25.00 O ATOM 615 CB SER A 118 65.239 15.323 0.334 1.00 25.00 C ATOM 616 OG SER A 118 66.280 15.056 1.266 1.00 25.00 O ATOM 0 H SER A 118 64.001 17.520 1.591 1.00 25.00 H new ATOM 0 HA SER A 118 66.127 17.111 -0.441 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.284 14.998 0.747 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.405 14.748 -0.577 1.00 25.00 H new ATOM 0 HG SER A 118 66.301 14.097 1.467 1.00 25.00 H new ATOM 622 N LEU A 119 64.404 16.982 -2.280 1.00 25.00 N ATOM 623 CA LEU A 119 63.465 17.261 -3.364 1.00 25.00 C ATOM 624 C LEU A 119 63.465 16.133 -4.379 1.00 25.00 C ATOM 625 O LEU A 119 64.501 15.508 -4.624 1.00 25.00 O ATOM 626 CB LEU A 119 63.858 18.554 -4.078 1.00 25.00 C ATOM 627 CG LEU A 119 63.422 19.866 -3.412 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.070 21.040 -4.140 1.00 25.00 C ATOM 629 CD2 LEU A 119 61.906 20.002 -3.463 1.00 25.00 C ATOM 0 H LEU A 119 65.333 16.707 -2.598 1.00 25.00 H new ATOM 0 HA LEU A 119 62.471 17.359 -2.928 1.00 25.00 H new ATOM 0 HB2 LEU A 119 64.943 18.569 -4.183 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.441 18.528 -5.085 1.00 25.00 H new ATOM 0 HG LEU A 119 63.739 19.862 -2.369 1.00 25.00 H new ATOM 0 HD11 LEU A 119 63.763 21.974 -3.670 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.155 20.947 -4.087 1.00 25.00 H new ATOM 0 HD13 LEU A 119 63.756 21.039 -5.184 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.608 20.937 -2.988 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.575 20.002 -4.502 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.448 19.165 -2.936 1.00 25.00 H new ATOM 641 N GLN A 120 62.316 15.901 -4.991 1.00 25.00 N ATOM 642 CA GLN A 120 62.180 14.890 -6.033 1.00 25.00 C ATOM 643 C GLN A 120 62.290 15.611 -7.361 1.00 25.00 C ATOM 644 O GLN A 120 61.606 16.607 -7.579 1.00 25.00 O ATOM 645 CB GLN A 120 60.821 14.182 -5.932 1.00 25.00 C ATOM 646 CG GLN A 120 60.641 13.379 -4.652 1.00 25.00 C ATOM 647 CD GLN A 120 59.301 12.681 -4.596 1.00 25.00 C ATOM 648 OE1 GLN A 120 59.026 11.779 -5.370 1.00 25.00 O ATOM 649 NE2 GLN A 120 58.472 13.076 -3.663 1.00 25.00 N ATOM 0 H GLN A 120 61.453 16.404 -4.783 1.00 25.00 H new ATOM 0 HA GLN A 120 62.953 14.129 -5.930 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.028 14.927 -5.997 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.704 13.516 -6.787 1.00 25.00 H new ATOM 0 HG2 GLN A 120 61.437 12.639 -4.575 1.00 25.00 H new ATOM 0 HG3 GLN A 120 60.739 14.042 -3.793 1.00 25.00 H new ATOM 0 HE21 GLN A 120 58.736 13.834 -3.033 1.00 25.00 H new ATOM 0 HE22 GLN A 120 57.562 12.626 -3.566 1.00 25.00 H new ATOM 658 N VAL A 121 63.171 15.126 -8.221 1.00 25.00 N ATOM 659 CA VAL A 121 63.415 15.747 -9.522 1.00 25.00 C ATOM 660 C VAL A 121 63.601 14.660 -10.561 1.00 25.00 C ATOM 661 O VAL A 121 63.869 13.510 -10.216 1.00 25.00 O ATOM 662 CB VAL A 121 64.702 16.634 -9.508 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.522 17.847 -8.593 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.927 15.823 -9.047 1.00 25.00 C ATOM 0 H VAL A 121 63.736 14.296 -8.043 1.00 25.00 H new ATOM 0 HA VAL A 121 62.558 16.379 -9.756 1.00 25.00 H new ATOM 0 HB VAL A 121 64.869 16.980 -10.528 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.432 18.447 -8.601 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.686 18.450 -8.948 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.320 17.509 -7.577 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.809 16.464 -9.046 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.754 15.443 -8.040 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.087 14.987 -9.728 1.00 25.00 H new ATOM 674 N ASP A 122 63.490 15.019 -11.826 1.00 25.00 N ATOM 675 CA ASP A 122 63.733 14.076 -12.908 1.00 25.00 C ATOM 676 C ASP A 122 65.227 14.016 -13.175 1.00 25.00 C ATOM 677 O ASP A 122 65.963 14.934 -12.823 1.00 25.00 O ATOM 678 CB ASP A 122 62.998 14.522 -14.168 1.00 25.00 C ATOM 679 CG ASP A 122 61.497 14.475 -14.003 1.00 25.00 C ATOM 680 OD1 ASP A 122 60.981 13.428 -13.560 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 60.838 15.490 -14.294 1.00 25.00 O1- ATOM 0 H ASP A 122 63.233 15.957 -12.133 1.00 25.00 H new ATOM 0 HA ASP A 122 63.366 13.089 -12.625 1.00 25.00 H new ATOM 0 HB2 ASP A 122 63.302 15.537 -14.423 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.290 13.883 -15.002 1.00 25.00 H new ATOM 686 N ALA A 123 65.687 12.971 -13.843 1.00 25.00 N ATOM 687 CA ALA A 123 67.100 12.874 -14.197 1.00 25.00 C ATOM 688 C ALA A 123 67.475 14.006 -15.168 1.00 25.00 C ATOM 689 O ALA A 123 68.606 14.507 -15.173 1.00 25.00 O ATOM 690 CB ALA A 123 67.381 11.511 -14.830 1.00 25.00 C ATOM 0 H ALA A 123 65.114 12.185 -14.150 1.00 25.00 H new ATOM 0 HA ALA A 123 67.706 12.974 -13.296 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.437 11.443 -15.093 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.132 10.722 -14.120 1.00 25.00 H new ATOM 0 HB3 ALA A 123 66.775 11.395 -15.729 1.00 25.00 H new ATOM 696 N ASP A 124 66.510 14.394 -15.989 1.00 25.00 N ATOM 697 CA ASP A 124 66.710 15.412 -17.020 1.00 25.00 C ATOM 698 C ASP A 124 66.367 16.820 -16.531 1.00 25.00 C ATOM 699 O ASP A 124 66.288 17.762 -17.315 1.00 25.00 O ATOM 700 CB ASP A 124 65.841 15.067 -18.235 1.00 25.00 C ATOM 701 CG ASP A 124 66.375 15.673 -19.528 1.00 25.00 C ATOM 702 OD1 ASP A 124 67.604 15.922 -19.614 1.00 25.00 O ATOM 703 OD2 ASP A 124 65.584 15.814 -20.489 1.00 25.00 O1- ATOM 0 H ASP A 124 65.564 14.014 -15.962 1.00 25.00 H new ATOM 0 HA ASP A 124 67.767 15.413 -17.285 1.00 25.00 H new ATOM 0 HB2 ASP A 124 65.785 13.984 -18.342 1.00 25.00 H new ATOM 0 HB3 ASP A 124 64.825 15.423 -18.063 1.00 25.00 H new ATOM 708 N PHE A 125 66.121 16.961 -15.238 1.00 25.00 N ATOM 709 CA PHE A 125 65.726 18.253 -14.688 1.00 25.00 C ATOM 710 C PHE A 125 66.857 19.262 -14.863 1.00 25.00 C ATOM 711 O PHE A 125 68.006 19.006 -14.494 1.00 25.00 O ATOM 712 CB PHE A 125 65.368 18.095 -13.209 1.00 25.00 C ATOM 713 CG PHE A 125 64.322 19.054 -12.716 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.993 18.938 -13.159 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.644 20.046 -11.767 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.985 19.807 -12.661 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.640 20.914 -11.255 1.00 25.00 C ATOM 718 CZ PHE A 125 62.311 20.792 -11.704 1.00 25.00 C ATOM 0 H PHE A 125 66.186 16.207 -14.554 1.00 25.00 H new ATOM 0 HA PHE A 125 64.851 18.622 -15.222 1.00 25.00 H new ATOM 0 HB2 PHE A 125 65.018 17.077 -13.040 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.272 18.225 -12.613 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.736 18.181 -13.885 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.663 20.148 -11.425 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.969 19.714 -13.015 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.897 21.665 -10.523 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.545 21.449 -11.318 1.00 25.00 H new ATOM 728 N GLU A 126 66.528 20.398 -15.457 1.00 25.00 N ATOM 729 CA GLU A 126 67.510 21.439 -15.740 1.00 25.00 C ATOM 730 C GLU A 126 67.971 22.100 -14.458 1.00 25.00 C ATOM 731 O GLU A 126 67.195 22.251 -13.507 1.00 25.00 O ATOM 732 CB GLU A 126 66.909 22.525 -16.629 1.00 25.00 C ATOM 733 CG GLU A 126 66.578 22.064 -18.037 1.00 25.00 C ATOM 734 CD GLU A 126 66.075 23.212 -18.894 1.00 25.00 C ATOM 735 OE1 GLU A 126 66.830 24.196 -19.069 1.00 25.00 O ATOM 736 OE2 GLU A 126 64.910 23.164 -19.331 1.00 25.00 O1- ATOM 0 H GLU A 126 65.580 20.626 -15.756 1.00 25.00 H new ATOM 0 HA GLU A 126 68.349 20.961 -16.245 1.00 25.00 H new ATOM 0 HB2 GLU A 126 66.001 22.902 -16.159 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.608 23.360 -16.687 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.465 21.627 -18.496 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.822 21.280 -17.996 1.00 25.00 H new ATOM 743 N LEU A 127 69.213 22.567 -14.445 1.00 25.00 N ATOM 744 CA LEU A 127 69.750 23.260 -13.274 1.00 25.00 C ATOM 745 C LEU A 127 68.961 24.527 -12.972 1.00 25.00 C ATOM 746 O LEU A 127 68.757 24.875 -11.818 1.00 25.00 O ATOM 747 CB LEU A 127 71.199 23.652 -13.523 1.00 25.00 C ATOM 748 CG LEU A 127 72.223 23.188 -12.483 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.594 23.656 -12.943 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.935 23.744 -11.081 1.00 25.00 C ATOM 0 H LEU A 127 69.866 22.481 -15.224 1.00 25.00 H new ATOM 0 HA LEU A 127 69.676 22.578 -12.427 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.497 23.257 -14.494 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.251 24.739 -13.591 1.00 25.00 H new ATOM 0 HG LEU A 127 72.172 22.102 -12.406 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.347 23.340 -12.221 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.819 23.221 -13.917 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.600 24.743 -13.021 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.691 23.383 -10.384 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.958 24.833 -11.110 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.951 23.411 -10.753 1.00 25.00 H new ATOM 762 N HIS A 128 68.502 25.205 -14.017 1.00 25.00 N ATOM 763 CA HIS A 128 67.717 26.423 -13.844 1.00 25.00 C ATOM 764 C HIS A 128 66.445 26.117 -13.058 1.00 25.00 C ATOM 765 O HIS A 128 66.114 26.803 -12.088 1.00 25.00 O ATOM 766 CB HIS A 128 67.341 27.005 -15.212 1.00 25.00 C ATOM 767 CG HIS A 128 66.564 28.278 -15.126 1.00 25.00 C ATOM 768 ND1 HIS A 128 65.461 28.566 -15.891 1.00 25.00 N ATOM 769 CD2 HIS A 128 66.734 29.372 -14.333 1.00 25.00 C ATOM 770 CE1 HIS A 128 65.027 29.779 -15.554 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.770 30.317 -14.609 1.00 25.00 N ATOM 0 H HIS A 128 68.658 24.935 -14.988 1.00 25.00 H new ATOM 0 HA HIS A 128 68.316 27.149 -13.295 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.251 27.182 -15.785 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.756 26.268 -15.763 1.00 25.00 H new ATOM 0 HD2 HIS A 128 67.513 29.483 -13.593 1.00 25.00 H new ATOM 0 HE1 HIS A 128 64.171 30.262 -16.001 1.00 25.00 H new ATOM 0 HE2 HIS A 128 65.657 31.233 -14.176 1.00 25.00 H new ATOM 779 N ASN A 129 65.765 25.051 -13.455 1.00 25.00 N ATOM 780 CA ASN A 129 64.518 24.659 -12.808 1.00 25.00 C ATOM 781 C ASN A 129 64.809 24.157 -11.399 1.00 25.00 C ATOM 782 O ASN A 129 64.006 24.340 -10.495 1.00 25.00 O ATOM 783 CB ASN A 129 63.816 23.560 -13.619 1.00 25.00 C ATOM 784 CG ASN A 129 63.344 24.038 -14.977 1.00 25.00 C ATOM 785 OD1 ASN A 129 63.540 25.177 -15.354 1.00 25.00 O ATOM 786 ND2 ASN A 129 62.732 23.156 -15.715 1.00 25.00 N ATOM 0 H ASN A 129 66.054 24.442 -14.221 1.00 25.00 H new ATOM 0 HA ASN A 129 63.860 25.526 -12.755 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.499 22.721 -13.752 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.962 23.188 -13.053 1.00 25.00 H new ATOM 0 HD21 ASN A 129 62.399 23.412 -16.644 1.00 25.00 H new ATOM 0 HD22 ASN A 129 62.586 22.210 -15.363 1.00 25.00 H new ATOM 793 N PHE A 130 65.971 23.551 -11.199 1.00 25.00 N ATOM 794 CA PHE A 130 66.368 23.073 -9.869 1.00 25.00 C ATOM 795 C PHE A 130 66.516 24.226 -8.875 1.00 25.00 C ATOM 796 O PHE A 130 66.056 24.130 -7.741 1.00 25.00 O ATOM 797 CB PHE A 130 67.681 22.293 -9.959 1.00 25.00 C ATOM 798 CG PHE A 130 68.048 21.571 -8.689 1.00 25.00 C ATOM 799 CD1 PHE A 130 67.132 20.692 -8.074 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.324 21.735 -8.124 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.480 19.987 -6.896 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.693 21.026 -6.951 1.00 25.00 C ATOM 803 CZ PHE A 130 68.766 20.148 -6.335 1.00 25.00 C ATOM 0 H PHE A 130 66.657 23.376 -11.933 1.00 25.00 H new ATOM 0 HA PHE A 130 65.578 22.416 -9.506 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.607 21.568 -10.770 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.485 22.982 -10.220 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.152 20.555 -8.507 1.00 25.00 H new ATOM 0 HD2 PHE A 130 70.031 22.407 -8.587 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.764 19.328 -6.428 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.678 21.155 -6.528 1.00 25.00 H new ATOM 0 HZ PHE A 130 69.041 19.606 -5.443 1.00 25.00 H new ATOM 813 N ARG A 131 67.104 25.338 -9.309 1.00 25.00 N ATOM 814 CA ARG A 131 67.209 26.531 -8.447 1.00 25.00 C ATOM 815 C ARG A 131 65.827 27.017 -8.068 1.00 25.00 C ATOM 816 O ARG A 131 65.572 27.362 -6.927 1.00 25.00 O ATOM 817 CB ARG A 131 67.912 27.688 -9.160 1.00 25.00 C ATOM 818 CG ARG A 131 69.329 27.398 -9.562 1.00 25.00 C ATOM 819 CD ARG A 131 69.938 28.595 -10.304 1.00 25.00 C ATOM 820 NE ARG A 131 69.997 29.805 -9.454 1.00 25.00 N ATOM 821 CZ ARG A 131 71.040 30.201 -8.735 1.00 25.00 C ATOM 822 NH1 ARG A 131 72.179 29.560 -8.737 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 70.935 31.263 -7.994 1.00 25.00 N ATOM 0 H ARG A 131 67.512 25.446 -10.237 1.00 25.00 H new ATOM 0 HA ARG A 131 67.785 26.236 -7.570 1.00 25.00 H new ATOM 0 HB2 ARG A 131 67.341 27.951 -10.050 1.00 25.00 H new ATOM 0 HB3 ARG A 131 67.904 28.560 -8.507 1.00 25.00 H new ATOM 0 HG2 ARG A 131 69.924 27.171 -8.677 1.00 25.00 H new ATOM 0 HG3 ARG A 131 69.358 26.515 -10.201 1.00 25.00 H new ATOM 0 HD2 ARG A 131 70.943 28.339 -10.640 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.348 28.807 -11.195 1.00 25.00 H new ATOM 0 HE ARG A 131 69.160 30.387 -9.417 1.00 25.00 H new ATOM 0 HH11 ARG A 131 72.291 28.721 -9.306 1.00 25.00 H new ATOM 0 HH12 ARG A 131 72.956 29.899 -8.169 1.00 25.00 H new ATOM 0 HH21 ARG A 131 70.058 31.783 -7.969 1.00 25.00 H new ATOM 0 HH22 ARG A 131 71.730 31.577 -7.437 1.00 25.00 H new ATOM 837 N ALA A 132 64.955 27.063 -9.059 1.00 25.00 N ATOM 838 CA ALA A 132 63.581 27.537 -8.851 1.00 25.00 C ATOM 839 C ALA A 132 62.821 26.628 -7.873 1.00 25.00 C ATOM 840 O ALA A 132 62.128 27.103 -6.983 1.00 25.00 O ATOM 841 CB ALA A 132 62.851 27.613 -10.200 1.00 25.00 C ATOM 0 H ALA A 132 65.164 26.781 -10.017 1.00 25.00 H new ATOM 0 HA ALA A 132 63.620 28.533 -8.410 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.831 27.965 -10.043 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.376 28.304 -10.859 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.827 26.624 -10.657 1.00 25.00 H new ATOM 847 N LEU A 133 62.967 25.321 -8.038 1.00 25.00 N ATOM 848 CA LEU A 133 62.290 24.363 -7.161 1.00 25.00 C ATOM 849 C LEU A 133 62.834 24.463 -5.729 1.00 25.00 C ATOM 850 O LEU A 133 62.089 24.381 -4.757 1.00 25.00 O ATOM 851 CB LEU A 133 62.483 22.941 -7.700 1.00 25.00 C ATOM 852 CG LEU A 133 61.587 21.847 -7.089 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.110 22.072 -7.440 1.00 25.00 C ATOM 854 CD2 LEU A 133 62.030 20.485 -7.621 1.00 25.00 C ATOM 0 H LEU A 133 63.543 24.897 -8.765 1.00 25.00 H new ATOM 0 HA LEU A 133 61.226 24.598 -7.141 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.314 22.958 -8.777 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.524 22.656 -7.545 1.00 25.00 H new ATOM 0 HG LEU A 133 61.688 21.886 -6.004 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.506 21.283 -6.993 1.00 25.00 H new ATOM 0 HD12 LEU A 133 59.787 23.039 -7.053 1.00 25.00 H new ATOM 0 HD13 LEU A 133 59.987 22.055 -8.523 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.400 19.705 -7.193 1.00 25.00 H new ATOM 0 HD22 LEU A 133 61.937 20.471 -8.707 1.00 25.00 H new ATOM 0 HD23 LEU A 133 63.069 20.306 -7.343 1.00 25.00 H new ATOM 866 N CYS A 134 64.137 24.687 -5.621 1.00 25.00 N ATOM 867 CA CYS A 134 64.784 24.887 -4.326 1.00 25.00 C ATOM 868 C CYS A 134 64.237 26.136 -3.640 1.00 25.00 C ATOM 869 O CYS A 134 64.000 26.134 -2.444 1.00 25.00 O ATOM 870 CB CYS A 134 66.292 25.044 -4.534 1.00 25.00 C ATOM 871 SG CYS A 134 67.193 25.365 -3.011 1.00 25.00 S ATOM 0 H CYS A 134 64.772 24.735 -6.418 1.00 25.00 H new ATOM 0 HA CYS A 134 64.581 24.022 -3.694 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.684 24.138 -4.995 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.472 25.861 -5.233 1.00 25.00 H new ATOM 0 HG CYS A 134 68.461 25.483 -3.273 1.00 25.00 H new ATOM 877 N GLU A 135 64.044 27.197 -4.409 1.00 25.00 N ATOM 878 CA GLU A 135 63.499 28.454 -3.894 1.00 25.00 C ATOM 879 C GLU A 135 62.079 28.237 -3.367 1.00 25.00 C ATOM 880 O GLU A 135 61.722 28.739 -2.296 1.00 25.00 O ATOM 881 CB GLU A 135 63.543 29.510 -5.019 1.00 25.00 C ATOM 882 CG GLU A 135 62.384 30.521 -5.081 1.00 25.00 C ATOM 883 CD GLU A 135 62.555 31.491 -6.246 1.00 25.00 C ATOM 884 OE1 GLU A 135 63.567 32.238 -6.261 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 61.706 31.494 -7.154 1.00 25.00 O1- ATOM 0 H GLU A 135 64.259 27.216 -5.406 1.00 25.00 H new ATOM 0 HA GLU A 135 64.098 28.814 -3.057 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.474 30.069 -4.921 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.585 28.985 -5.973 1.00 25.00 H new ATOM 0 HG2 GLU A 135 61.439 29.988 -5.185 1.00 25.00 H new ATOM 0 HG3 GLU A 135 62.334 31.078 -4.146 1.00 25.00 H new ATOM 892 N LEU A 136 61.296 27.461 -4.100 1.00 25.00 N ATOM 893 CA LEU A 136 59.908 27.187 -3.739 1.00 25.00 C ATOM 894 C LEU A 136 59.826 26.464 -2.394 1.00 25.00 C ATOM 895 O LEU A 136 59.061 26.863 -1.518 1.00 25.00 O ATOM 896 CB LEU A 136 59.250 26.369 -4.864 1.00 25.00 C ATOM 897 CG LEU A 136 57.712 26.311 -4.948 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.334 25.748 -6.320 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.063 25.454 -3.859 1.00 25.00 C ATOM 0 H LEU A 136 61.600 27.003 -4.959 1.00 25.00 H new ATOM 0 HA LEU A 136 59.368 28.127 -3.625 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.616 26.761 -5.813 1.00 25.00 H new ATOM 0 HB3 LEU A 136 59.613 25.345 -4.781 1.00 25.00 H new ATOM 0 HG LEU A 136 57.340 27.325 -4.800 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.249 25.696 -6.406 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.729 26.397 -7.101 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.755 24.749 -6.432 1.00 25.00 H new ATOM 0 HD21 LEU A 136 55.980 25.463 -3.986 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.429 24.430 -3.936 1.00 25.00 H new ATOM 0 HD23 LEU A 136 57.317 25.857 -2.879 1.00 25.00 H new ATOM 911 N GLU A 137 60.617 25.414 -2.229 1.00 25.00 N ATOM 912 CA GLU A 137 60.601 24.613 -1.000 1.00 25.00 C ATOM 913 C GLU A 137 61.222 25.362 0.175 1.00 25.00 C ATOM 914 O GLU A 137 60.714 25.333 1.291 1.00 25.00 O ATOM 915 CB GLU A 137 61.380 23.315 -1.243 1.00 25.00 C ATOM 916 CG GLU A 137 61.238 22.253 -0.147 1.00 25.00 C ATOM 917 CD GLU A 137 59.869 21.577 -0.152 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.505 20.984 -1.194 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 59.186 21.597 0.888 1.00 25.00 O1- ATOM 0 H GLU A 137 61.283 25.091 -2.931 1.00 25.00 H new ATOM 0 HA GLU A 137 59.563 24.400 -0.747 1.00 25.00 H new ATOM 0 HB2 GLU A 137 61.051 22.884 -2.189 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.436 23.560 -1.355 1.00 25.00 H new ATOM 0 HG2 GLU A 137 62.012 21.497 -0.278 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.406 22.716 0.825 1.00 25.00 H new ATOM 926 N SER A 138 62.343 26.029 -0.074 1.00 25.00 N ATOM 927 CA SER A 138 63.080 26.699 0.997 1.00 25.00 C ATOM 928 C SER A 138 62.477 28.051 1.380 1.00 25.00 C ATOM 929 O SER A 138 62.804 28.590 2.434 1.00 25.00 O ATOM 930 CB SER A 138 64.543 26.880 0.602 1.00 25.00 C ATOM 931 OG SER A 138 65.330 27.255 1.721 1.00 25.00 O ATOM 0 H SER A 138 62.761 26.122 -1.000 1.00 25.00 H new ATOM 0 HA SER A 138 63.009 26.055 1.873 1.00 25.00 H new ATOM 0 HB2 SER A 138 64.926 25.952 0.178 1.00 25.00 H new ATOM 0 HB3 SER A 138 64.622 27.641 -0.174 1.00 25.00 H new ATOM 0 HG SER A 138 64.777 27.754 2.358 1.00 25.00 H new ATOM 937 N GLY A 139 61.615 28.602 0.531 1.00 25.00 N ATOM 938 CA GLY A 139 60.927 29.847 0.850 1.00 25.00 C ATOM 939 C GLY A 139 61.816 31.073 0.790 1.00 25.00 C ATOM 940 O GLY A 139 61.557 32.076 1.457 1.00 25.00 O ATOM 0 H GLY A 139 61.377 28.208 -0.379 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.096 29.979 0.158 1.00 25.00 H new ATOM 0 HA3 GLY A 139 60.500 29.769 1.850 1.00 25.00 H new ATOM 944 N ILE A 140 62.880 30.992 0.008 1.00 25.00 N ATOM 945 CA ILE A 140 63.840 32.094 -0.125 1.00 25.00 C ATOM 946 C ILE A 140 64.161 32.317 -1.597 1.00 25.00 C ATOM 947 O ILE A 140 64.200 31.366 -2.369 1.00 25.00 O ATOM 948 CB ILE A 140 65.169 31.796 0.631 1.00 25.00 C ATOM 949 CG1 ILE A 140 65.685 30.384 0.290 1.00 25.00 C ATOM 950 CG2 ILE A 140 64.956 31.927 2.161 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.158 30.171 0.531 1.00 25.00 C ATOM 0 H ILE A 140 63.108 30.170 -0.552 1.00 25.00 H new ATOM 0 HA ILE A 140 63.383 32.982 0.311 1.00 25.00 H new ATOM 0 HB ILE A 140 65.915 32.524 0.312 1.00 25.00 H new ATOM 0 HG12 ILE A 140 65.126 29.657 0.879 1.00 25.00 H new ATOM 0 HG13 ILE A 140 65.470 30.178 -0.758 1.00 25.00 H new ATOM 0 HG21 ILE A 140 65.892 31.716 2.678 1.00 25.00 H new ATOM 0 HG22 ILE A 140 64.631 32.940 2.398 1.00 25.00 H new ATOM 0 HG23 ILE A 140 64.195 31.217 2.485 1.00 25.00 H new ATOM 0 HD11 ILE A 140 67.427 29.149 0.262 1.00 25.00 H new ATOM 0 HD12 ILE A 140 67.731 30.869 -0.079 1.00 25.00 H new ATOM 0 HD13 ILE A 140 67.383 30.340 1.584 1.00 25.00 H new ATOM 963 N PRO A 141 64.399 33.577 -2.010 1.00 25.00 N ATOM 964 CA PRO A 141 64.709 33.739 -3.436 1.00 25.00 C ATOM 965 C PRO A 141 66.021 33.077 -3.841 1.00 25.00 C ATOM 966 O PRO A 141 67.058 33.275 -3.194 1.00 25.00 O ATOM 967 CB PRO A 141 64.822 35.261 -3.597 1.00 25.00 C ATOM 968 CG PRO A 141 64.090 35.826 -2.427 1.00 25.00 C ATOM 969 CD PRO A 141 64.392 34.876 -1.315 1.00 25.00 C ATOM 0 HA PRO A 141 63.952 33.271 -4.065 1.00 25.00 H new ATOM 0 HB2 PRO A 141 65.864 35.581 -3.603 1.00 25.00 H new ATOM 0 HB3 PRO A 141 64.381 35.593 -4.537 1.00 25.00 H new ATOM 0 HG2 PRO A 141 64.430 36.835 -2.193 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.019 35.888 -2.619 1.00 25.00 H new ATOM 0 HD2 PRO A 141 65.351 35.091 -0.845 1.00 25.00 H new ATOM 0 HD3 PRO A 141 63.636 34.914 -0.530 1.00 25.00 H new ATOM 977 N ALA A 142 65.996 32.346 -4.943 1.00 25.00 N ATOM 978 CA ALA A 142 67.192 31.709 -5.481 1.00 25.00 C ATOM 979 C ALA A 142 68.181 32.781 -5.937 1.00 25.00 C ATOM 980 O ALA A 142 69.387 32.553 -5.963 1.00 25.00 O ATOM 981 CB ALA A 142 66.824 30.788 -6.651 1.00 25.00 C ATOM 0 H ALA A 142 65.152 32.176 -5.489 1.00 25.00 H new ATOM 0 HA ALA A 142 67.657 31.104 -4.702 1.00 25.00 H new ATOM 0 HB1 ALA A 142 67.727 30.319 -7.043 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.136 30.017 -6.305 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.348 31.372 -7.438 1.00 25.00 H new ATOM 987 N ALA A 143 67.668 33.946 -6.308 1.00 25.00 N ATOM 988 CA ALA A 143 68.504 35.049 -6.778 1.00 25.00 C ATOM 989 C ALA A 143 69.497 35.513 -5.698 1.00 25.00 C ATOM 990 O ALA A 143 70.604 35.926 -6.004 1.00 25.00 O ATOM 991 CB ALA A 143 67.611 36.218 -7.208 1.00 25.00 C ATOM 0 H ALA A 143 66.670 34.155 -6.293 1.00 25.00 H new ATOM 0 HA ALA A 143 69.087 34.695 -7.628 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.233 37.041 -7.559 1.00 25.00 H new ATOM 0 HB2 ALA A 143 66.950 35.894 -8.012 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.014 36.551 -6.359 1.00 25.00 H new ATOM 997 N GLU A 144 69.089 35.400 -4.443 1.00 25.00 N ATOM 998 CA GLU A 144 69.910 35.822 -3.307 1.00 25.00 C ATOM 999 C GLU A 144 70.915 34.733 -2.900 1.00 25.00 C ATOM 1000 O GLU A 144 71.528 34.814 -1.825 1.00 25.00 O ATOM 1001 CB GLU A 144 69.000 36.137 -2.109 1.00 25.00 C ATOM 1002 CG GLU A 144 68.046 37.301 -2.337 1.00 25.00 C ATOM 1003 CD GLU A 144 68.779 38.628 -2.488 1.00 25.00 C ATOM 1004 OE1 GLU A 144 69.450 39.049 -1.522 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 68.675 39.248 -3.567 1.00 25.00 O1- ATOM 0 H GLU A 144 68.182 35.015 -4.179 1.00 25.00 H new ATOM 0 HA GLU A 144 70.469 36.709 -3.607 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.418 35.248 -1.866 1.00 25.00 H new ATOM 0 HB3 GLU A 144 69.623 36.357 -1.242 1.00 25.00 H new ATOM 0 HG2 GLU A 144 67.453 37.112 -3.232 1.00 25.00 H new ATOM 0 HG3 GLU A 144 67.350 37.366 -1.501 1.00 25.00 H new ATOM 1012 N SER A 145 71.048 33.691 -3.708 1.00 25.00 N ATOM 1013 CA SER A 145 71.869 32.552 -3.326 1.00 25.00 C ATOM 1014 C SER A 145 72.771 31.970 -4.412 1.00 25.00 C ATOM 1015 O SER A 145 72.555 32.135 -5.618 1.00 25.00 O ATOM 1016 CB SER A 145 70.959 31.438 -2.813 1.00 25.00 C ATOM 1017 OG SER A 145 70.199 30.884 -3.870 1.00 25.00 O ATOM 0 H SER A 145 70.603 33.611 -4.622 1.00 25.00 H new ATOM 0 HA SER A 145 72.547 32.942 -2.567 1.00 25.00 H new ATOM 0 HB2 SER A 145 71.560 30.659 -2.344 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.292 31.831 -2.046 1.00 25.00 H new ATOM 0 HG SER A 145 69.975 31.587 -4.515 1.00 25.00 H new ATOM 1023 N GLN A 146 73.775 31.227 -3.961 1.00 25.00 N ATOM 1024 CA GLN A 146 74.672 30.494 -4.844 1.00 25.00 C ATOM 1025 C GLN A 146 74.567 29.023 -4.503 1.00 25.00 C ATOM 1026 O GLN A 146 74.263 28.675 -3.367 1.00 25.00 O ATOM 1027 CB GLN A 146 76.119 30.950 -4.668 1.00 25.00 C ATOM 1028 CG GLN A 146 76.360 32.379 -5.087 1.00 25.00 C ATOM 1029 CD GLN A 146 77.819 32.641 -5.353 1.00 25.00 C ATOM 1030 OE1 GLN A 146 78.599 32.879 -4.449 1.00 25.00 O ATOM 1031 NE2 GLN A 146 78.202 32.549 -6.602 1.00 25.00 N ATOM 0 H GLN A 146 73.990 31.116 -2.970 1.00 25.00 H new ATOM 0 HA GLN A 146 74.385 30.680 -5.879 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.402 30.835 -3.622 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.770 30.296 -5.248 1.00 25.00 H new ATOM 0 HG2 GLN A 146 75.781 32.598 -5.984 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.005 33.052 -4.307 1.00 25.00 H new ATOM 0 HE21 GLN A 146 77.518 32.348 -7.332 1.00 25.00 H new ATOM 0 HE22 GLN A 146 79.184 32.678 -6.845 1.00 25.00 H new ATOM 1040 N ILE A 147 74.837 28.174 -5.485 1.00 25.00 N ATOM 1041 CA ILE A 147 74.733 26.727 -5.320 1.00 25.00 C ATOM 1042 C ILE A 147 76.107 26.103 -5.621 1.00 25.00 C ATOM 1043 O ILE A 147 76.802 26.501 -6.560 1.00 25.00 O ATOM 1044 CB ILE A 147 73.603 26.152 -6.254 1.00 25.00 C ATOM 1045 CG1 ILE A 147 73.492 24.623 -6.111 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.834 26.596 -7.722 1.00 25.00 C ATOM 1047 CD1 ILE A 147 72.304 23.976 -6.870 1.00 25.00 C ATOM 0 H ILE A 147 75.134 28.466 -6.416 1.00 25.00 H new ATOM 0 HA ILE A 147 74.453 26.477 -4.297 1.00 25.00 H new ATOM 0 HB ILE A 147 72.644 26.564 -5.940 1.00 25.00 H new ATOM 0 HG12 ILE A 147 74.419 24.172 -6.466 1.00 25.00 H new ATOM 0 HG13 ILE A 147 73.403 24.378 -5.053 1.00 25.00 H new ATOM 0 HG21 ILE A 147 73.044 26.190 -8.354 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.821 27.684 -7.779 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.800 26.226 -8.066 1.00 25.00 H new ATOM 0 HD11 ILE A 147 72.312 22.898 -6.707 1.00 25.00 H new ATOM 0 HD12 ILE A 147 71.367 24.392 -6.501 1.00 25.00 H new ATOM 0 HD13 ILE A 147 72.398 24.183 -7.936 1.00 25.00 H new ATOM 1059 N VAL A 148 76.511 25.163 -4.781 1.00 25.00 N ATOM 1060 CA VAL A 148 77.806 24.505 -4.904 1.00 25.00 C ATOM 1061 C VAL A 148 77.613 23.004 -4.659 1.00 25.00 C ATOM 1062 O VAL A 148 76.843 22.597 -3.792 1.00 25.00 O ATOM 1063 CB VAL A 148 78.857 25.173 -3.926 1.00 25.00 C ATOM 1064 CG1 VAL A 148 78.452 25.033 -2.464 1.00 25.00 C ATOM 1065 CG2 VAL A 148 80.260 24.599 -4.127 1.00 25.00 C ATOM 0 H VAL A 148 75.952 24.833 -3.994 1.00 25.00 H new ATOM 0 HA VAL A 148 78.214 24.628 -5.907 1.00 25.00 H new ATOM 0 HB VAL A 148 78.871 26.234 -4.177 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.203 25.506 -1.831 1.00 25.00 H new ATOM 0 HG12 VAL A 148 77.488 25.516 -2.306 1.00 25.00 H new ATOM 0 HG13 VAL A 148 78.375 23.976 -2.207 1.00 25.00 H new ATOM 0 HG21 VAL A 148 80.953 25.082 -3.438 1.00 25.00 H new ATOM 0 HG22 VAL A 148 80.245 23.526 -3.934 1.00 25.00 H new ATOM 0 HG23 VAL A 148 80.583 24.779 -5.152 1.00 25.00 H new ATOM 1075 N TYR A 149 78.278 22.183 -5.458 1.00 25.00 N ATOM 1076 CA TYR A 149 78.170 20.728 -5.376 1.00 25.00 C ATOM 1077 C TYR A 149 79.557 20.134 -5.534 1.00 25.00 C ATOM 1078 O TYR A 149 80.292 20.547 -6.418 1.00 25.00 O ATOM 1079 CB TYR A 149 77.282 20.209 -6.499 1.00 25.00 C ATOM 1080 CG TYR A 149 77.312 18.703 -6.650 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.868 17.865 -5.615 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.791 18.105 -7.839 1.00 25.00 C ATOM 1083 CE1 TYR A 149 76.896 16.451 -5.758 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.805 16.686 -7.988 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.353 15.876 -6.945 1.00 25.00 C ATOM 1086 OH TYR A 149 77.361 14.515 -7.070 1.00 25.00 O ATOM 0 H TYR A 149 78.913 22.507 -6.188 1.00 25.00 H new ATOM 0 HA TYR A 149 77.737 20.446 -4.416 1.00 25.00 H new ATOM 0 HB2 TYR A 149 76.256 20.527 -6.315 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.594 20.666 -7.438 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.500 18.300 -4.698 1.00 25.00 H new ATOM 0 HD2 TYR A 149 78.150 18.730 -8.643 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.563 15.820 -4.947 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.164 16.241 -8.904 1.00 25.00 H new ATOM 0 HH TYR A 149 77.706 14.270 -7.954 1.00 25.00 H new ATOM 1096 N ALA A 150 79.927 19.220 -4.640 1.00 25.00 N ATOM 1097 CA ALA A 150 81.275 18.626 -4.621 1.00 25.00 C ATOM 1098 C ALA A 150 82.354 19.730 -4.645 1.00 25.00 C ATOM 1099 O ALA A 150 83.332 19.646 -5.382 1.00 25.00 O ATOM 1100 CB ALA A 150 81.445 17.646 -5.814 1.00 25.00 C ATOM 0 H ALA A 150 79.309 18.867 -3.909 1.00 25.00 H new ATOM 0 HA ALA A 150 81.399 18.061 -3.697 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.445 17.213 -5.790 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.703 16.851 -5.740 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.306 18.186 -6.751 1.00 25.00 H new ATOM 1106 N GLU A 151 82.096 20.779 -3.866 1.00 25.00 N ATOM 1107 CA GLU A 151 82.952 21.981 -3.756 1.00 25.00 C ATOM 1108 C GLU A 151 83.150 22.769 -5.068 1.00 25.00 C ATOM 1109 O GLU A 151 83.951 23.701 -5.126 1.00 25.00 O ATOM 1110 CB GLU A 151 84.305 21.632 -3.108 1.00 25.00 C ATOM 1111 CG GLU A 151 84.154 20.993 -1.726 1.00 25.00 C ATOM 1112 CD GLU A 151 85.482 20.830 -0.992 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.546 21.089 -1.594 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.450 20.464 0.202 1.00 25.00 O1- ATOM 0 H GLU A 151 81.266 20.827 -3.274 1.00 25.00 H new ATOM 0 HA GLU A 151 82.400 22.661 -3.107 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.850 20.950 -3.761 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.905 22.538 -3.021 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.484 21.604 -1.121 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.683 20.016 -1.834 1.00 25.00 H new ATOM 1121 N ARG A 152 82.372 22.453 -6.095 1.00 25.00 N ATOM 1122 CA ARG A 152 82.419 23.178 -7.372 1.00 25.00 C ATOM 1123 C ARG A 152 81.133 23.970 -7.551 1.00 25.00 C ATOM 1124 O ARG A 152 80.043 23.433 -7.342 1.00 25.00 O ATOM 1125 CB ARG A 152 82.548 22.189 -8.530 1.00 25.00 C ATOM 1126 CG ARG A 152 83.794 21.329 -8.452 1.00 25.00 C ATOM 1127 CD ARG A 152 83.754 20.234 -9.494 1.00 25.00 C ATOM 1128 NE ARG A 152 84.822 19.253 -9.256 1.00 25.00 N ATOM 1129 CZ ARG A 152 85.064 18.186 -10.005 1.00 25.00 C ATOM 1130 NH1 ARG A 152 84.352 17.904 -11.072 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 86.038 17.382 -9.674 1.00 25.00 N ATOM 0 H ARG A 152 81.692 21.693 -6.074 1.00 25.00 H new ATOM 0 HA ARG A 152 83.278 23.849 -7.365 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.670 21.543 -8.546 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.555 22.741 -9.470 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.679 21.948 -8.601 1.00 25.00 H new ATOM 0 HG3 ARG A 152 83.877 20.889 -7.458 1.00 25.00 H new ATOM 0 HD2 ARG A 152 82.784 19.737 -9.470 1.00 25.00 H new ATOM 0 HD3 ARG A 152 83.865 20.667 -10.488 1.00 25.00 H new ATOM 0 HE ARG A 152 85.426 19.405 -8.449 1.00 25.00 H new ATOM 0 HH11 ARG A 152 83.584 18.515 -11.348 1.00 25.00 H new ATOM 0 HH12 ARG A 152 84.568 17.074 -11.624 1.00 25.00 H new ATOM 0 HH21 ARG A 152 86.603 17.578 -8.847 1.00 25.00 H new ATOM 0 HH22 ARG A 152 86.234 16.558 -10.242 1.00 25.00 H new ATOM 1145 N PRO A 153 81.224 25.258 -7.922 1.00 25.00 N ATOM 1146 CA PRO A 153 79.943 25.953 -8.090 1.00 25.00 C ATOM 1147 C PRO A 153 79.199 25.457 -9.329 1.00 25.00 C ATOM 1148 O PRO A 153 79.811 25.089 -10.332 1.00 25.00 O ATOM 1149 CB PRO A 153 80.361 27.418 -8.234 1.00 25.00 C ATOM 1150 CG PRO A 153 81.716 27.347 -8.857 1.00 25.00 C ATOM 1151 CD PRO A 153 82.365 26.145 -8.210 1.00 25.00 C ATOM 0 HA PRO A 153 79.253 25.787 -7.263 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.662 27.973 -8.860 1.00 25.00 H new ATOM 0 HB3 PRO A 153 80.392 27.921 -7.268 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.650 27.229 -9.939 1.00 25.00 H new ATOM 0 HG3 PRO A 153 82.288 28.256 -8.670 1.00 25.00 H new ATOM 0 HD2 PRO A 153 83.086 25.670 -8.876 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.902 26.418 -7.301 1.00 25.00 H new ATOM 1159 N LEU A 154 77.880 25.446 -9.248 1.00 25.00 N ATOM 1160 CA LEU A 154 77.049 25.009 -10.368 1.00 25.00 C ATOM 1161 C LEU A 154 76.474 26.246 -11.055 1.00 0.00 C ATOM 1162 O LEU A 154 75.516 26.849 -10.572 1.00 25.00 O ATOM 1163 CB LEU A 154 75.920 24.091 -9.879 1.00 25.00 C ATOM 1164 CG LEU A 154 76.301 22.717 -9.304 1.00 25.00 C ATOM 1165 CD1 LEU A 154 75.027 21.980 -8.876 1.00 25.00 C ATOM 1166 CD2 LEU A 154 77.044 21.864 -10.319 1.00 25.00 C ATOM 0 H LEU A 154 77.357 25.734 -8.421 1.00 25.00 H new ATOM 0 HA LEU A 154 77.654 24.441 -11.075 1.00 25.00 H new ATOM 0 HB2 LEU A 154 75.361 24.629 -9.114 1.00 25.00 H new ATOM 0 HB3 LEU A 154 75.239 23.926 -10.714 1.00 25.00 H new ATOM 0 HG LEU A 154 76.960 22.883 -8.452 1.00 25.00 H new ATOM 0 HD11 LEU A 154 75.291 21.005 -8.467 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.507 22.563 -8.116 1.00 25.00 H new ATOM 0 HD13 LEU A 154 74.376 21.847 -9.740 1.00 25.00 H new ATOM 0 HD21 LEU A 154 77.294 20.902 -9.872 1.00 25.00 H new ATOM 0 HD22 LEU A 154 76.412 21.705 -11.193 1.00 25.00 H new ATOM 0 HD23 LEU A 154 77.959 22.373 -10.621 1.00 25.00 H new ATOM 1178 N THR A 155 77.105 26.655 -12.149 1.00 25.00 N ATOM 1179 CA THR A 155 76.714 27.884 -12.849 1.00 25.00 C ATOM 1180 C THR A 155 76.178 27.652 -14.257 1.00 25.00 C ATOM 1181 O THR A 155 75.465 28.498 -14.798 1.00 25.00 O ATOM 1182 CB THR A 155 77.923 28.833 -12.976 1.00 25.00 C ATOM 1183 OG1 THR A 155 78.976 28.163 -13.679 1.00 25.00 O ATOM 1184 CG2 THR A 155 78.456 29.230 -11.598 1.00 25.00 C ATOM 0 H THR A 155 77.888 26.159 -12.574 1.00 25.00 H new ATOM 0 HA THR A 155 75.915 28.312 -12.244 1.00 25.00 H new ATOM 0 HB THR A 155 77.598 29.726 -13.510 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.746 28.763 -13.764 1.00 25.00 H new ATOM 0 HG21 THR A 155 79.308 29.899 -11.716 1.00 25.00 H new ATOM 0 HG22 THR A 155 77.671 29.737 -11.037 1.00 25.00 H new ATOM 0 HG23 THR A 155 78.769 28.337 -11.058 1.00 25.00 H new ATOM 1192 N ASP A 156 76.532 26.533 -14.867 1.00 25.00 N ATOM 1193 CA ASP A 156 76.118 26.257 -16.242 1.00 25.00 C ATOM 1194 C ASP A 156 74.724 25.633 -16.254 1.00 25.00 C ATOM 1195 O ASP A 156 74.551 24.418 -16.178 1.00 25.00 O ATOM 1196 CB ASP A 156 77.145 25.365 -16.951 1.00 25.00 C ATOM 1197 CG ASP A 156 77.681 26.000 -18.212 1.00 25.00 C ATOM 1198 OD1 ASP A 156 76.866 26.508 -19.007 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 78.915 25.989 -18.406 1.00 25.00 O1- ATOM 0 H ASP A 156 77.101 25.802 -14.440 1.00 25.00 H new ATOM 0 HA ASP A 156 76.071 27.196 -16.793 1.00 25.00 H new ATOM 0 HB2 ASP A 156 77.972 25.156 -16.272 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.684 24.408 -17.196 1.00 25.00 H new ATOM 1204 N ASN A 157 73.713 26.494 -16.284 1.00 25.00 N ATOM 1205 CA ASN A 157 72.318 26.060 -16.170 1.00 25.00 C ATOM 1206 C ASN A 157 71.864 25.218 -17.359 1.00 25.00 C ATOM 1207 O ASN A 157 70.840 24.541 -17.289 1.00 25.00 O ATOM 1208 CB ASN A 157 71.389 27.275 -16.037 1.00 25.00 C ATOM 1209 CG ASN A 157 71.537 27.986 -14.715 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.570 27.367 -13.662 1.00 25.00 O ATOM 1211 ND2 ASN A 157 71.599 29.289 -14.760 1.00 25.00 N ATOM 0 H ASN A 157 73.830 27.502 -16.387 1.00 25.00 H new ATOM 0 HA ASN A 157 72.261 25.438 -15.276 1.00 25.00 H new ATOM 0 HB2 ASN A 157 71.597 27.975 -16.846 1.00 25.00 H new ATOM 0 HB3 ASN A 157 70.355 26.950 -16.155 1.00 25.00 H new ATOM 0 HD21 ASN A 157 71.678 29.826 -13.896 1.00 25.00 H new ATOM 0 HD22 ASN A 157 71.569 29.770 -15.659 1.00 25.00 H new ATOM 1218 N HIS A 158 72.634 25.254 -18.439 1.00 25.00 N ATOM 1219 CA HIS A 158 72.324 24.536 -19.677 1.00 25.00 C ATOM 1220 C HIS A 158 72.508 23.010 -19.575 1.00 25.00 C ATOM 1221 O HIS A 158 72.378 22.293 -20.571 1.00 25.00 O ATOM 1222 CB HIS A 158 73.237 25.073 -20.792 1.00 25.00 C ATOM 1223 CG HIS A 158 72.584 25.133 -22.141 1.00 25.00 C ATOM 1224 ND1 HIS A 158 71.902 24.099 -22.722 1.00 25.00 N ATOM 1225 CD2 HIS A 158 72.527 26.141 -23.049 1.00 25.00 C ATOM 1226 CE1 HIS A 158 71.469 24.496 -23.912 1.00 25.00 C ATOM 1227 NE2 HIS A 158 71.820 25.736 -24.167 1.00 25.00 N ATOM 0 H HIS A 158 73.502 25.788 -18.484 1.00 25.00 H new ATOM 0 HA HIS A 158 71.269 24.708 -19.890 1.00 25.00 H new ATOM 0 HB2 HIS A 158 73.576 26.072 -20.519 1.00 25.00 H new ATOM 0 HB3 HIS A 158 74.123 24.442 -20.857 1.00 25.00 H new ATOM 0 HD1 HIS A 158 71.752 23.178 -22.310 1.00 25.00 H new ATOM 0 HD2 HIS A 158 72.969 27.117 -22.917 1.00 25.00 H new ATOM 0 HE1 HIS A 158 70.898 23.876 -24.588 1.00 25.00 H new ATOM 1235 N ARG A 159 72.839 22.504 -18.395 1.00 25.00 N ATOM 1236 CA ARG A 159 73.017 21.063 -18.201 1.00 25.00 C ATOM 1237 C ARG A 159 72.064 20.541 -17.147 1.00 25.00 C ATOM 1238 O ARG A 159 71.844 21.188 -16.119 1.00 25.00 O ATOM 1239 CB ARG A 159 74.443 20.753 -17.762 1.00 25.00 C ATOM 1240 CG ARG A 159 75.485 20.894 -18.840 1.00 25.00 C ATOM 1241 CD ARG A 159 76.812 20.388 -18.323 1.00 25.00 C ATOM 1242 NE ARG A 159 77.859 20.440 -19.358 1.00 25.00 N ATOM 1243 CZ ARG A 159 79.068 19.910 -19.245 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.455 19.267 -18.166 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 79.906 20.015 -20.242 1.00 25.00 N ATOM 0 H ARG A 159 72.990 23.065 -17.556 1.00 25.00 H new ATOM 0 HA ARG A 159 72.810 20.576 -19.154 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.705 21.414 -16.936 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.475 19.734 -17.377 1.00 25.00 H new ATOM 0 HG2 ARG A 159 75.188 20.331 -19.725 1.00 25.00 H new ATOM 0 HG3 ARG A 159 75.574 21.938 -19.142 1.00 25.00 H new ATOM 0 HD2 ARG A 159 77.119 20.986 -17.465 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.698 19.362 -17.973 1.00 25.00 H new ATOM 0 HE ARG A 159 77.636 20.921 -20.229 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.816 19.162 -17.378 1.00 25.00 H new ATOM 0 HH12 ARG A 159 80.394 18.873 -18.117 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.626 20.501 -21.094 1.00 25.00 H new ATOM 0 HH22 ARG A 159 80.840 19.611 -20.168 1.00 25.00 H new ATOM 1259 N SER A 160 71.536 19.352 -17.394 1.00 25.00 N ATOM 1260 CA SER A 160 70.667 18.676 -16.446 1.00 25.00 C ATOM 1261 C SER A 160 71.486 18.172 -15.260 1.00 25.00 C ATOM 1262 O SER A 160 72.708 18.047 -15.347 1.00 25.00 O ATOM 1263 CB SER A 160 69.983 17.496 -17.144 1.00 25.00 C ATOM 1264 OG SER A 160 70.318 17.483 -18.525 1.00 25.00 O ATOM 0 H SER A 160 71.698 18.830 -18.255 1.00 25.00 H new ATOM 0 HA SER A 160 69.912 19.373 -16.082 1.00 25.00 H new ATOM 0 HB2 SER A 160 70.291 16.560 -16.678 1.00 25.00 H new ATOM 0 HB3 SER A 160 68.902 17.570 -17.025 1.00 25.00 H new ATOM 0 HG SER A 160 69.604 17.041 -19.031 1.00 25.00 H new ATOM 1270 N LEU A 161 70.814 17.882 -14.161 1.00 25.00 N ATOM 1271 CA LEU A 161 71.480 17.449 -12.932 1.00 25.00 C ATOM 1272 C LEU A 161 72.231 16.121 -13.087 1.00 25.00 C ATOM 1273 O LEU A 161 73.358 15.966 -12.582 1.00 25.00 O ATOM 1274 CB LEU A 161 70.441 17.349 -11.818 1.00 25.00 C ATOM 1275 CG LEU A 161 69.748 18.683 -11.471 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.538 18.416 -10.601 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.710 19.648 -10.774 1.00 25.00 C ATOM 0 H LEU A 161 69.798 17.937 -14.088 1.00 25.00 H new ATOM 0 HA LEU A 161 72.237 18.194 -12.685 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.681 16.624 -12.110 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.924 16.960 -10.921 1.00 25.00 H new ATOM 0 HG LEU A 161 69.427 19.156 -12.399 1.00 25.00 H new ATOM 0 HD11 LEU A 161 68.050 19.360 -10.357 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.839 17.774 -11.137 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.853 17.922 -9.682 1.00 25.00 H new ATOM 0 HD21 LEU A 161 70.190 20.578 -10.544 1.00 25.00 H new ATOM 0 HD22 LEU A 161 71.072 19.197 -9.850 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.554 19.858 -11.431 1.00 25.00 H new ATOM 1289 N ALA A 162 71.655 15.181 -13.825 1.00 25.00 N ATOM 1290 CA ALA A 162 72.322 13.893 -14.063 1.00 25.00 C ATOM 1291 C ALA A 162 73.639 14.095 -14.826 1.00 25.00 C ATOM 1292 O ALA A 162 74.589 13.341 -14.639 1.00 25.00 O ATOM 1293 CB ALA A 162 71.399 12.959 -14.839 1.00 25.00 C ATOM 0 H ALA A 162 70.741 15.276 -14.267 1.00 25.00 H new ATOM 0 HA ALA A 162 72.552 13.441 -13.098 1.00 25.00 H new ATOM 0 HB1 ALA A 162 71.904 12.008 -15.010 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.488 12.789 -14.265 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.145 13.412 -15.797 1.00 25.00 H new ATOM 1299 N SER A 163 73.706 15.134 -15.649 1.00 25.00 N ATOM 1300 CA SER A 163 74.912 15.451 -16.415 1.00 25.00 C ATOM 1301 C SER A 163 76.054 15.948 -15.519 1.00 25.00 C ATOM 1302 O SER A 163 77.219 15.940 -15.924 1.00 25.00 O ATOM 1303 CB SER A 163 74.586 16.502 -17.477 1.00 25.00 C ATOM 1304 OG SER A 163 73.464 16.082 -18.236 1.00 25.00 O ATOM 0 H SER A 163 72.932 15.780 -15.806 1.00 25.00 H new ATOM 0 HA SER A 163 75.251 14.532 -16.893 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.378 17.461 -17.002 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.445 16.651 -18.131 1.00 25.00 H new ATOM 0 HG SER A 163 73.256 16.758 -18.914 1.00 25.00 H new ATOM 1310 N TYR A 164 75.723 16.354 -14.298 1.00 25.00 N ATOM 1311 CA TYR A 164 76.734 16.744 -13.307 1.00 25.00 C ATOM 1312 C TYR A 164 77.002 15.585 -12.356 1.00 25.00 C ATOM 1313 O TYR A 164 77.849 15.678 -11.471 1.00 25.00 O ATOM 1314 CB TYR A 164 76.254 17.933 -12.486 1.00 25.00 C ATOM 1315 CG TYR A 164 76.322 19.236 -13.213 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.554 19.911 -13.352 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.164 19.826 -13.748 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.623 21.150 -14.007 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.232 21.068 -14.400 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.463 21.722 -14.520 1.00 25.00 C ATOM 1321 OH TYR A 164 76.563 22.931 -15.138 1.00 25.00 O ATOM 0 H TYR A 164 74.761 16.424 -13.965 1.00 25.00 H new ATOM 0 HA TYR A 164 77.643 17.014 -13.844 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.225 17.755 -12.174 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.855 18.002 -11.579 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.453 19.469 -12.950 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.214 19.320 -13.657 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.571 21.657 -14.112 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.338 21.516 -14.807 1.00 25.00 H new ATOM 0 HH TYR A 164 75.671 23.236 -15.407 1.00 25.00 H new ATOM 1331 N GLY A 165 76.271 14.501 -12.538 1.00 25.00 N ATOM 1332 CA GLY A 165 76.415 13.345 -11.683 1.00 25.00 C ATOM 1333 C GLY A 165 75.567 13.408 -10.428 1.00 25.00 C ATOM 1334 O GLY A 165 75.831 12.666 -9.487 1.00 25.00 O ATOM 0 H GLY A 165 75.571 14.400 -13.273 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.148 12.451 -12.247 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.462 13.242 -11.399 1.00 25.00 H new ATOM 1338 N LEU A 166 74.547 14.262 -10.393 1.00 25.00 N ATOM 1339 CA LEU A 166 73.664 14.299 -9.232 1.00 25.00 C ATOM 1340 C LEU A 166 72.757 13.081 -9.285 1.00 25.00 C ATOM 1341 O LEU A 166 71.650 13.137 -9.822 1.00 25.00 O ATOM 1342 CB LEU A 166 72.802 15.569 -9.210 1.00 25.00 C ATOM 1343 CG LEU A 166 73.333 16.865 -8.577 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.656 16.640 -7.104 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.536 17.425 -9.293 1.00 25.00 C ATOM 0 H LEU A 166 74.315 14.922 -11.135 1.00 25.00 H new ATOM 0 HA LEU A 166 74.276 14.299 -8.330 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.543 15.799 -10.243 1.00 25.00 H new ATOM 0 HB3 LEU A 166 71.874 15.318 -8.697 1.00 25.00 H new ATOM 0 HG LEU A 166 72.539 17.606 -8.672 1.00 25.00 H new ATOM 0 HD11 LEU A 166 74.031 17.566 -6.668 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.754 16.330 -6.577 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.415 15.863 -7.012 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.862 18.339 -8.797 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.344 16.694 -9.273 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.273 17.647 -10.327 1.00 25.00 H new ATOM 1357 N LYS A 167 73.241 11.980 -8.744 1.00 25.00 N ATOM 1358 CA LYS A 167 72.461 10.750 -8.642 1.00 25.00 C ATOM 1359 C LYS A 167 71.588 10.811 -7.403 1.00 25.00 C ATOM 1360 O LYS A 167 71.779 11.665 -6.540 1.00 25.00 O ATOM 1361 CB LYS A 167 73.380 9.544 -8.515 1.00 25.00 C ATOM 1362 CG LYS A 167 74.306 9.341 -9.709 1.00 25.00 C ATOM 1363 CD LYS A 167 75.129 8.076 -9.546 1.00 25.00 C ATOM 1364 CE LYS A 167 76.112 8.208 -8.377 1.00 25.00 C ATOM 1365 NZ LYS A 167 76.890 6.954 -8.196 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.184 11.907 -8.362 1.00 25.00 H new ATOM 0 HA LYS A 167 71.852 10.653 -9.541 1.00 25.00 H new ATOM 0 HB2 LYS A 167 73.984 9.654 -7.614 1.00 25.00 H new ATOM 0 HB3 LYS A 167 72.772 8.649 -8.384 1.00 25.00 H new ATOM 0 HG2 LYS A 167 73.718 9.282 -10.625 1.00 25.00 H new ATOM 0 HG3 LYS A 167 74.969 10.200 -9.811 1.00 25.00 H new ATOM 0 HD2 LYS A 167 74.467 7.227 -9.376 1.00 25.00 H new ATOM 0 HD3 LYS A 167 75.677 7.873 -10.466 1.00 25.00 H new ATOM 0 HE2 LYS A 167 76.792 9.040 -8.560 1.00 25.00 H new ATOM 0 HE3 LYS A 167 75.567 8.438 -7.462 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 77.549 7.066 -7.399 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 76.239 6.167 -7.999 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 77.427 6.750 -9.063 1.00 25.00 H new ATOM 1379 N ASP A 168 70.672 9.870 -7.286 1.00 25.00 N ATOM 1380 CA ASP A 168 69.812 9.771 -6.117 1.00 25.00 C ATOM 1381 C ASP A 168 70.660 9.660 -4.848 1.00 25.00 C ATOM 1382 O ASP A 168 71.544 8.816 -4.737 1.00 25.00 O ATOM 1383 CB ASP A 168 68.852 8.572 -6.234 1.00 25.00 C ATOM 1384 CG ASP A 168 69.579 7.245 -6.502 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.247 7.131 -7.562 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.363 6.288 -5.733 1.00 25.00 O1- ATOM 0 H ASP A 168 70.501 9.155 -7.993 1.00 25.00 H new ATOM 0 HA ASP A 168 69.208 10.677 -6.059 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.275 8.484 -5.313 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.141 8.760 -7.039 1.00 25.00 H new ATOM 1391 N GLY A 169 70.393 10.559 -3.914 1.00 25.00 N ATOM 1392 CA GLY A 169 71.108 10.576 -2.646 1.00 25.00 C ATOM 1393 C GLY A 169 72.212 11.616 -2.573 1.00 25.00 C ATOM 1394 O GLY A 169 72.689 11.920 -1.481 1.00 25.00 O ATOM 0 H GLY A 169 69.686 11.288 -4.010 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.396 10.760 -1.842 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.539 9.590 -2.471 1.00 25.00 H new ATOM 1398 N ASP A 170 72.614 12.185 -3.703 1.00 25.00 N ATOM 1399 CA ASP A 170 73.640 13.228 -3.694 1.00 25.00 C ATOM 1400 C ASP A 170 73.057 14.505 -3.084 1.00 25.00 C ATOM 1401 O ASP A 170 71.835 14.728 -3.096 1.00 25.00 O ATOM 1402 CB ASP A 170 74.182 13.493 -5.104 1.00 25.00 C ATOM 1403 CG ASP A 170 75.270 12.496 -5.508 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.219 12.312 -4.714 1.00 25.00 O ATOM 1405 OD2 ASP A 170 75.195 11.916 -6.611 1.00 25.00 O1- ATOM 0 H ASP A 170 72.253 11.948 -4.627 1.00 25.00 H new ATOM 0 HA ASP A 170 74.479 12.889 -3.087 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.362 13.442 -5.821 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.585 14.505 -5.151 1.00 25.00 H new ATOM 1410 N VAL A 171 73.934 15.336 -2.530 1.00 25.00 N ATOM 1411 CA VAL A 171 73.525 16.541 -1.805 1.00 25.00 C ATOM 1412 C VAL A 171 74.229 17.789 -2.345 1.00 25.00 C ATOM 1413 O VAL A 171 75.429 17.766 -2.633 1.00 25.00 O ATOM 1414 CB VAL A 171 73.780 16.360 -0.258 1.00 25.00 C ATOM 1415 CG1 VAL A 171 75.228 15.948 0.034 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.418 17.632 0.543 1.00 25.00 C ATOM 0 H VAL A 171 74.944 15.197 -2.569 1.00 25.00 H new ATOM 0 HA VAL A 171 72.456 16.686 -1.962 1.00 25.00 H new ATOM 0 HB VAL A 171 73.120 15.556 0.069 1.00 25.00 H new ATOM 0 HG11 VAL A 171 75.364 15.833 1.109 1.00 25.00 H new ATOM 0 HG12 VAL A 171 75.444 15.002 -0.462 1.00 25.00 H new ATOM 0 HG13 VAL A 171 75.907 16.716 -0.338 1.00 25.00 H new ATOM 0 HG21 VAL A 171 73.609 17.462 1.602 1.00 25.00 H new ATOM 0 HG22 VAL A 171 74.026 18.467 0.194 1.00 25.00 H new ATOM 0 HG23 VAL A 171 72.363 17.865 0.398 1.00 25.00 H new ATOM 1426 N VAL A 172 73.487 18.884 -2.470 1.00 25.00 N ATOM 1427 CA VAL A 172 74.070 20.161 -2.891 1.00 25.00 C ATOM 1428 C VAL A 172 74.008 21.107 -1.709 1.00 25.00 C ATOM 1429 O VAL A 172 73.233 20.898 -0.774 1.00 25.00 O ATOM 1430 CB VAL A 172 73.317 20.796 -4.101 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.372 19.868 -5.309 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.864 21.097 -3.761 1.00 25.00 C ATOM 0 H VAL A 172 72.484 18.917 -2.288 1.00 25.00 H new ATOM 0 HA VAL A 172 75.095 19.983 -3.216 1.00 25.00 H new ATOM 0 HB VAL A 172 73.817 21.735 -4.338 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.842 20.326 -6.144 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.411 19.696 -5.589 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.902 18.917 -5.059 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.371 21.538 -4.627 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.356 20.173 -3.486 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.823 21.796 -2.925 1.00 25.00 H new ATOM 1442 N ILE A 173 74.814 22.153 -1.743 1.00 25.00 N ATOM 1443 CA ILE A 173 74.828 23.150 -0.681 1.00 25.00 C ATOM 1444 C ILE A 173 74.468 24.485 -1.320 1.00 25.00 C ATOM 1445 O ILE A 173 75.011 24.854 -2.365 1.00 25.00 O ATOM 1446 CB ILE A 173 76.217 23.214 0.017 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.530 21.854 0.677 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.261 24.368 1.065 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.976 21.710 1.176 1.00 25.00 C ATOM 0 H ILE A 173 75.473 22.337 -2.499 1.00 25.00 H new ATOM 0 HA ILE A 173 74.109 22.891 0.097 1.00 25.00 H new ATOM 0 HB ILE A 173 76.980 23.424 -0.733 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.852 21.707 1.518 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.325 21.060 -0.041 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.242 24.392 1.539 1.00 25.00 H new ATOM 0 HG22 ILE A 173 76.076 25.319 0.567 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.496 24.200 1.823 1.00 25.00 H new ATOM 0 HD11 ILE A 173 78.110 20.726 1.625 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.663 21.822 0.337 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.183 22.480 1.920 1.00 25.00 H new ATOM 1461 N LEU A 174 73.551 25.198 -0.697 1.00 25.00 N ATOM 1462 CA LEU A 174 73.098 26.493 -1.166 1.00 25.00 C ATOM 1463 C LEU A 174 73.473 27.516 -0.099 1.00 25.00 C ATOM 1464 O LEU A 174 73.261 27.268 1.078 1.00 25.00 O ATOM 1465 CB LEU A 174 71.580 26.461 -1.353 1.00 25.00 C ATOM 1466 CG LEU A 174 70.968 27.700 -2.015 1.00 25.00 C ATOM 1467 CD1 LEU A 174 70.893 27.489 -3.522 1.00 25.00 C ATOM 1468 CD2 LEU A 174 69.587 27.976 -1.456 1.00 25.00 C ATOM 0 H LEU A 174 73.093 24.890 0.161 1.00 25.00 H new ATOM 0 HA LEU A 174 73.558 26.751 -2.120 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.324 25.587 -1.952 1.00 25.00 H new ATOM 0 HB3 LEU A 174 71.114 26.325 -0.377 1.00 25.00 H new ATOM 0 HG LEU A 174 71.600 28.562 -1.803 1.00 25.00 H new ATOM 0 HD11 LEU A 174 70.458 28.371 -3.992 1.00 25.00 H new ATOM 0 HD12 LEU A 174 71.896 27.325 -3.917 1.00 25.00 H new ATOM 0 HD13 LEU A 174 70.272 26.619 -3.737 1.00 25.00 H new ATOM 0 HD21 LEU A 174 69.169 28.860 -1.939 1.00 25.00 H new ATOM 0 HD22 LEU A 174 68.940 27.119 -1.645 1.00 25.00 H new ATOM 0 HD23 LEU A 174 69.657 28.148 -0.382 1.00 25.00 H new ATOM 1480 N ARG A 175 74.029 28.648 -0.495 1.00 25.00 N ATOM 1481 CA ARG A 175 74.352 29.719 0.456 1.00 25.00 C ATOM 1482 C ARG A 175 73.588 30.963 0.065 1.00 25.00 C ATOM 1483 O ARG A 175 73.787 31.497 -1.019 1.00 25.00 O ATOM 1484 CB ARG A 175 75.850 30.021 0.467 1.00 25.00 C ATOM 1485 CG ARG A 175 76.681 28.933 1.114 1.00 25.00 C ATOM 1486 CD ARG A 175 78.124 29.379 1.225 1.00 25.00 C ATOM 1487 NE ARG A 175 78.937 28.397 1.959 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.233 28.525 2.231 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.924 29.571 1.845 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.841 27.591 2.903 1.00 25.00 N ATOM 0 H ARG A 175 74.269 28.857 -1.464 1.00 25.00 H new ATOM 0 HA ARG A 175 74.068 29.395 1.457 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.191 30.166 -0.558 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.020 30.959 0.995 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.286 28.702 2.103 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.619 28.018 0.525 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.539 29.524 0.227 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.170 30.343 1.732 1.00 25.00 H new ATOM 0 HE ARG A 175 78.470 27.551 2.285 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.469 30.317 1.320 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.917 29.638 2.070 1.00 25.00 H new ATOM 0 HH21 ARG A 175 80.324 26.769 3.216 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.834 27.680 3.116 1.00 25.00 H new ATOM 1504 N GLN A 176 72.699 31.410 0.955 1.00 25.00 N ATOM 1505 CA GLN A 176 71.861 32.604 0.727 1.00 25.00 C ATOM 1506 C GLN A 176 72.424 33.820 1.474 1.00 25.00 C ATOM 1507 O GLN A 176 72.822 33.770 2.626 1.00 25.00 O ATOM 1508 CB GLN A 176 70.390 32.310 1.124 1.00 25.00 C ATOM 1509 CG GLN A 176 69.397 33.321 0.503 1.00 25.00 C ATOM 1510 CD GLN A 176 68.892 34.331 1.497 1.00 25.00 C ATOM 1511 OE1 GLN A 176 69.596 34.968 2.245 1.00 25.00 O ATOM 1512 NE2 GLN A 176 67.578 34.488 1.543 1.00 25.00 N ATOM 1513 OXT GLN A 176 72.526 34.813 0.809 1.00 25.00 O ATOM 0 H GLN A 176 72.535 30.959 1.855 1.00 25.00 H new ATOM 0 HA GLN A 176 71.877 32.847 -0.335 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.125 31.302 0.805 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.298 32.335 2.210 1.00 25.00 H new ATOM 0 HG2 GLN A 176 69.884 33.842 -0.321 1.00 25.00 H new ATOM 0 HG3 GLN A 176 68.551 32.779 0.081 1.00 25.00 H new ATOM 0 HE21 GLN A 176 66.978 33.954 0.915 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.166 35.143 2.207 1.00 25.00 H new