USER MOD reduce.3.24.130724 H: found=0, std=0, add=598, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 601 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 415 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 420 SER OG : rot -140:sc= 0 USER MOD Single : A 371 SER OG : rot 180:sc= 0 USER MOD Single : A 372 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 394 SER OG : rot 180:sc= 0 USER MOD Single : A 397 SER OG : rot 180:sc= 0 USER MOD Single : A 399 HIS : no HE2:sc= -0.332 K(o=-0.33,f=-2) USER MOD Single : A 403 GLN : amide:sc= -1.09 X(o=-1.1,f=-0.63!) USER MOD Single : A 407 MET CE :methyl -159:sc= -1.77 (180deg=-3.37!) USER MOD Single : A 408 SER OG : rot 180:sc= 0 USER MOD Single : A 409 GLN : amide:sc=-0.00461 X(o=-0.0046,f=0) USER MOD Single : A 411 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0247) USER MOD Single : A 417 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 419 THR OG1 : rot 53:sc= -0.495 USER MOD Single : A 421 GLN : amide:sc=-0.00316 X(o=-0.0032,f=-0.0064) USER MOD Single : A 422 SER OG : rot 180:sc= -0.0195 USER MOD Single : A 424 HIS : no HD1:sc= -0.879 X(o=-0.88,f=-0.95) USER MOD Single : A 427 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 428 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 429 THR OG1 : rot 180:sc= -0.0737 USER MOD Single : A 430 HIS : no HD1:sc= -0.197 X(o=-0.2,f=-0.59) USER MOD Single : A 431 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 364 36.675 1.184 -22.776 1.00 0.00 N ATOM 2 CA GLY A 364 35.594 1.652 -23.626 1.00 0.00 C ATOM 3 C GLY A 364 36.117 2.601 -24.707 1.00 0.00 C ATOM 4 O GLY A 364 37.300 2.941 -24.720 1.00 0.00 O ATOM 0 HA2 GLY A 364 35.099 0.800 -24.093 1.00 0.00 H new ATOM 0 HA3 GLY A 364 34.845 2.163 -23.020 1.00 0.00 H new ATOM 8 N PRO A 365 35.188 3.012 -25.610 1.00 0.00 N ATOM 9 CA PRO A 365 35.543 3.914 -26.692 1.00 0.00 C ATOM 10 C PRO A 365 35.725 5.343 -26.177 1.00 0.00 C ATOM 11 O PRO A 365 35.551 5.605 -24.988 1.00 0.00 O ATOM 12 CB PRO A 365 34.413 3.785 -27.700 1.00 0.00 C ATOM 13 CG PRO A 365 33.246 3.174 -26.941 1.00 0.00 C ATOM 14 CD PRO A 365 33.779 2.630 -25.626 1.00 0.00 C ATOM 0 HA PRO A 365 36.499 3.663 -27.152 1.00 0.00 H new ATOM 0 HB2 PRO A 365 34.144 4.758 -28.112 1.00 0.00 H new ATOM 0 HB3 PRO A 365 34.707 3.154 -28.538 1.00 0.00 H new ATOM 0 HG2 PRO A 365 32.475 3.923 -26.760 1.00 0.00 H new ATOM 0 HG3 PRO A 365 32.786 2.377 -27.525 1.00 0.00 H new ATOM 0 HD2 PRO A 365 33.244 3.054 -24.776 1.00 0.00 H new ATOM 0 HD3 PRO A 365 33.662 1.548 -25.569 1.00 0.00 H new ATOM 22 N LEU A 366 36.072 6.230 -27.098 1.00 0.00 N ATOM 23 CA LEU A 366 36.279 7.626 -26.752 1.00 0.00 C ATOM 24 C LEU A 366 34.974 8.398 -26.961 1.00 0.00 C ATOM 25 O LEU A 366 34.907 9.595 -26.688 1.00 0.00 O ATOM 26 CB LEU A 366 37.465 8.201 -27.529 1.00 0.00 C ATOM 27 CG LEU A 366 38.592 8.800 -26.686 1.00 0.00 C ATOM 28 CD1 LEU A 366 39.953 8.566 -27.345 1.00 0.00 C ATOM 29 CD2 LEU A 366 38.339 10.282 -26.403 1.00 0.00 C ATOM 0 H LEU A 366 36.215 6.009 -28.083 1.00 0.00 H new ATOM 0 HA LEU A 366 36.542 7.722 -25.698 1.00 0.00 H new ATOM 0 HB2 LEU A 366 37.884 7.410 -28.151 1.00 0.00 H new ATOM 0 HB3 LEU A 366 37.093 8.973 -28.203 1.00 0.00 H new ATOM 0 HG LEU A 366 38.607 8.288 -25.724 1.00 0.00 H new ATOM 0 HD11 LEU A 366 40.737 9.002 -26.725 1.00 0.00 H new ATOM 0 HD12 LEU A 366 40.127 7.495 -27.451 1.00 0.00 H new ATOM 0 HD13 LEU A 366 39.966 9.034 -28.329 1.00 0.00 H new ATOM 0 HD21 LEU A 366 39.156 10.682 -25.802 1.00 0.00 H new ATOM 0 HD22 LEU A 366 38.280 10.827 -27.345 1.00 0.00 H new ATOM 0 HD23 LEU A 366 37.400 10.394 -25.860 1.00 0.00 H new ATOM 41 N VAL A 367 33.970 7.680 -27.443 1.00 0.00 N ATOM 42 CA VAL A 367 32.672 8.282 -27.692 1.00 0.00 C ATOM 43 C VAL A 367 31.644 7.685 -26.729 1.00 0.00 C ATOM 44 O VAL A 367 31.825 6.574 -26.234 1.00 0.00 O ATOM 45 CB VAL A 367 32.286 8.106 -29.163 1.00 0.00 C ATOM 46 CG1 VAL A 367 32.693 9.330 -29.986 1.00 0.00 C ATOM 47 CG2 VAL A 367 32.899 6.829 -29.740 1.00 0.00 C ATOM 0 H VAL A 367 34.030 6.687 -27.668 1.00 0.00 H new ATOM 0 HA VAL A 367 32.707 9.355 -27.505 1.00 0.00 H new ATOM 0 HB VAL A 367 31.201 8.012 -29.217 1.00 0.00 H new ATOM 0 HG11 VAL A 367 32.408 9.180 -31.027 1.00 0.00 H new ATOM 0 HG12 VAL A 367 32.190 10.215 -29.596 1.00 0.00 H new ATOM 0 HG13 VAL A 367 33.772 9.469 -29.922 1.00 0.00 H new ATOM 0 HG21 VAL A 367 32.610 6.727 -30.786 1.00 0.00 H new ATOM 0 HG22 VAL A 367 33.985 6.882 -29.667 1.00 0.00 H new ATOM 0 HG23 VAL A 367 32.539 5.967 -29.178 1.00 0.00 H new ATOM 57 N PRO A 368 30.559 8.469 -26.487 1.00 0.00 N ATOM 58 CA PRO A 368 29.503 8.029 -25.592 1.00 0.00 C ATOM 59 C PRO A 368 28.628 6.964 -26.258 1.00 0.00 C ATOM 60 O PRO A 368 28.721 6.746 -27.465 1.00 0.00 O ATOM 61 CB PRO A 368 28.735 9.292 -25.238 1.00 0.00 C ATOM 62 CG PRO A 368 29.098 10.313 -26.305 1.00 0.00 C ATOM 63 CD PRO A 368 30.311 9.790 -27.056 1.00 0.00 C ATOM 0 HA PRO A 368 29.887 7.548 -24.693 1.00 0.00 H new ATOM 0 HB2 PRO A 368 27.661 9.105 -25.225 1.00 0.00 H new ATOM 0 HB3 PRO A 368 29.008 9.650 -24.245 1.00 0.00 H new ATOM 0 HG2 PRO A 368 28.262 10.465 -26.988 1.00 0.00 H new ATOM 0 HG3 PRO A 368 29.318 11.279 -25.850 1.00 0.00 H new ATOM 0 HD2 PRO A 368 30.118 9.730 -28.127 1.00 0.00 H new ATOM 0 HD3 PRO A 368 31.172 10.446 -26.924 1.00 0.00 H new ATOM 71 N ARG A 369 27.799 6.330 -25.443 1.00 0.00 N ATOM 72 CA ARG A 369 26.908 5.295 -25.938 1.00 0.00 C ATOM 73 C ARG A 369 27.615 4.449 -26.998 1.00 0.00 C ATOM 74 O ARG A 369 27.572 4.770 -28.184 1.00 0.00 O ATOM 75 CB ARG A 369 25.640 5.901 -26.542 1.00 0.00 C ATOM 76 CG ARG A 369 24.410 5.059 -26.195 1.00 0.00 C ATOM 77 CD ARG A 369 23.406 5.054 -27.349 1.00 0.00 C ATOM 78 NE ARG A 369 22.247 4.199 -27.007 1.00 0.00 N ATOM 79 CZ ARG A 369 21.356 3.750 -27.901 1.00 0.00 C ATOM 80 NH1 ARG A 369 21.485 4.071 -29.196 1.00 0.00 N ATOM 81 NH2 ARG A 369 20.335 2.979 -27.501 1.00 0.00 N ATOM 0 H ARG A 369 27.725 6.513 -24.442 1.00 0.00 H new ATOM 0 HA ARG A 369 26.629 4.666 -25.092 1.00 0.00 H new ATOM 0 HB2 ARG A 369 25.506 6.917 -26.171 1.00 0.00 H new ATOM 0 HB3 ARG A 369 25.745 5.968 -27.625 1.00 0.00 H new ATOM 0 HG2 ARG A 369 24.716 4.037 -25.970 1.00 0.00 H new ATOM 0 HG3 ARG A 369 23.935 5.455 -25.297 1.00 0.00 H new ATOM 0 HD2 ARG A 369 23.071 6.071 -27.555 1.00 0.00 H new ATOM 0 HD3 ARG A 369 23.884 4.686 -28.257 1.00 0.00 H new ATOM 0 HE ARG A 369 22.119 3.935 -26.030 1.00 0.00 H new ATOM 0 HH11 ARG A 369 22.262 4.657 -29.501 1.00 0.00 H new ATOM 0 HH12 ARG A 369 20.806 3.729 -29.876 1.00 0.00 H new ATOM 0 HH21 ARG A 369 20.236 2.734 -26.516 1.00 0.00 H new ATOM 0 HH22 ARG A 369 19.657 2.637 -28.182 1.00 0.00 H new ATOM 95 N GLY A 370 28.251 3.383 -26.532 1.00 0.00 N ATOM 96 CA GLY A 370 28.967 2.489 -27.426 1.00 0.00 C ATOM 97 C GLY A 370 29.865 1.532 -26.639 1.00 0.00 C ATOM 98 O GLY A 370 30.971 1.897 -26.244 1.00 0.00 O ATOM 0 H GLY A 370 28.285 3.119 -25.547 1.00 0.00 H new ATOM 0 HA2 GLY A 370 28.255 1.918 -28.022 1.00 0.00 H new ATOM 0 HA3 GLY A 370 29.571 3.071 -28.122 1.00 0.00 H new ATOM 102 N SER A 371 29.356 0.326 -26.436 1.00 0.00 N ATOM 103 CA SER A 371 30.098 -0.686 -25.704 1.00 0.00 C ATOM 104 C SER A 371 30.377 -0.203 -24.279 1.00 0.00 C ATOM 105 O SER A 371 30.597 0.986 -24.055 1.00 0.00 O ATOM 106 CB SER A 371 31.410 -1.029 -26.414 1.00 0.00 C ATOM 107 OG SER A 371 31.192 -1.495 -27.743 1.00 0.00 O ATOM 0 H SER A 371 28.438 0.027 -26.766 1.00 0.00 H new ATOM 0 HA SER A 371 29.491 -1.591 -25.662 1.00 0.00 H new ATOM 0 HB2 SER A 371 32.050 -0.147 -26.440 1.00 0.00 H new ATOM 0 HB3 SER A 371 31.941 -1.792 -25.845 1.00 0.00 H new ATOM 0 HG SER A 371 32.053 -1.702 -28.163 1.00 0.00 H new ATOM 113 N MET A 372 30.358 -1.150 -23.353 1.00 0.00 N ATOM 114 CA MET A 372 30.606 -0.836 -21.956 1.00 0.00 C ATOM 115 C MET A 372 29.343 -0.294 -21.284 1.00 0.00 C ATOM 116 O MET A 372 28.959 -0.756 -20.210 1.00 0.00 O ATOM 117 CB MET A 372 31.723 0.204 -21.857 1.00 0.00 C ATOM 118 CG MET A 372 32.439 0.112 -20.508 1.00 0.00 C ATOM 119 SD MET A 372 34.195 -0.087 -20.760 1.00 0.00 S ATOM 120 CE MET A 372 34.268 -1.845 -21.059 1.00 0.00 C ATOM 0 H MET A 372 30.175 -2.135 -23.543 1.00 0.00 H new ATOM 0 HA MET A 372 30.903 -1.751 -21.444 1.00 0.00 H new ATOM 0 HB2 MET A 372 32.439 0.052 -22.664 1.00 0.00 H new ATOM 0 HB3 MET A 372 31.307 1.203 -21.985 1.00 0.00 H new ATOM 0 HG2 MET A 372 32.247 1.012 -19.923 1.00 0.00 H new ATOM 0 HG3 MET A 372 32.048 -0.729 -19.936 1.00 0.00 H new ATOM 0 HE1 MET A 372 35.302 -2.141 -21.237 1.00 0.00 H new ATOM 0 HE2 MET A 372 33.882 -2.378 -20.190 1.00 0.00 H new ATOM 0 HE3 MET A 372 33.665 -2.091 -21.933 1.00 0.00 H new ATOM 130 N ALA A 373 28.731 0.679 -21.943 1.00 0.00 N ATOM 131 CA ALA A 373 27.519 1.289 -21.423 1.00 0.00 C ATOM 132 C ALA A 373 26.319 0.405 -21.768 1.00 0.00 C ATOM 133 O ALA A 373 25.399 0.261 -20.966 1.00 0.00 O ATOM 134 CB ALA A 373 27.380 2.706 -21.983 1.00 0.00 C ATOM 0 H ALA A 373 29.052 1.060 -22.833 1.00 0.00 H new ATOM 0 HA ALA A 373 27.566 1.371 -20.337 1.00 0.00 H new ATOM 0 HB1 ALA A 373 26.471 3.164 -21.593 1.00 0.00 H new ATOM 0 HB2 ALA A 373 28.243 3.301 -21.685 1.00 0.00 H new ATOM 0 HB3 ALA A 373 27.327 2.664 -23.071 1.00 0.00 H new ATOM 140 N LEU A 374 26.369 -0.163 -22.964 1.00 0.00 N ATOM 141 CA LEU A 374 25.297 -1.029 -23.426 1.00 0.00 C ATOM 142 C LEU A 374 25.028 -2.106 -22.373 1.00 0.00 C ATOM 143 O LEU A 374 23.878 -2.473 -22.135 1.00 0.00 O ATOM 144 CB LEU A 374 25.622 -1.592 -24.811 1.00 0.00 C ATOM 145 CG LEU A 374 26.271 -2.978 -24.837 1.00 0.00 C ATOM 146 CD1 LEU A 374 25.211 -4.077 -24.933 1.00 0.00 C ATOM 147 CD2 LEU A 374 27.304 -3.078 -25.961 1.00 0.00 C ATOM 0 H LEU A 374 27.135 -0.041 -23.627 1.00 0.00 H new ATOM 0 HA LEU A 374 24.374 -0.462 -23.546 1.00 0.00 H new ATOM 0 HB2 LEU A 374 24.699 -1.634 -25.390 1.00 0.00 H new ATOM 0 HB3 LEU A 374 26.286 -0.892 -25.319 1.00 0.00 H new ATOM 0 HG LEU A 374 26.803 -3.125 -23.897 1.00 0.00 H new ATOM 0 HD11 LEU A 374 25.698 -5.052 -24.950 1.00 0.00 H new ATOM 0 HD12 LEU A 374 24.547 -4.018 -24.071 1.00 0.00 H new ATOM 0 HD13 LEU A 374 24.632 -3.945 -25.847 1.00 0.00 H new ATOM 0 HD21 LEU A 374 27.750 -4.072 -25.958 1.00 0.00 H new ATOM 0 HD22 LEU A 374 26.816 -2.902 -26.920 1.00 0.00 H new ATOM 0 HD23 LEU A 374 28.082 -2.331 -25.807 1.00 0.00 H new ATOM 159 N ILE A 375 26.107 -2.582 -21.770 1.00 0.00 N ATOM 160 CA ILE A 375 26.002 -3.609 -20.747 1.00 0.00 C ATOM 161 C ILE A 375 25.541 -2.971 -19.435 1.00 0.00 C ATOM 162 O ILE A 375 24.838 -3.602 -18.648 1.00 0.00 O ATOM 163 CB ILE A 375 27.317 -4.382 -20.627 1.00 0.00 C ATOM 164 CG1 ILE A 375 27.757 -4.930 -21.986 1.00 0.00 C ATOM 165 CG2 ILE A 375 27.209 -5.485 -19.572 1.00 0.00 C ATOM 166 CD1 ILE A 375 28.854 -4.057 -22.599 1.00 0.00 C ATOM 0 H ILE A 375 27.059 -2.275 -21.970 1.00 0.00 H new ATOM 0 HA ILE A 375 25.249 -4.347 -21.024 1.00 0.00 H new ATOM 0 HB ILE A 375 28.091 -3.691 -20.293 1.00 0.00 H new ATOM 0 HG12 ILE A 375 28.122 -5.951 -21.870 1.00 0.00 H new ATOM 0 HG13 ILE A 375 26.901 -4.972 -22.660 1.00 0.00 H new ATOM 0 HG21 ILE A 375 28.157 -6.020 -19.506 1.00 0.00 H new ATOM 0 HG22 ILE A 375 26.975 -5.041 -18.604 1.00 0.00 H new ATOM 0 HG23 ILE A 375 26.419 -6.181 -19.853 1.00 0.00 H new ATOM 0 HD11 ILE A 375 29.149 -4.468 -23.564 1.00 0.00 H new ATOM 0 HD12 ILE A 375 28.478 -3.043 -22.736 1.00 0.00 H new ATOM 0 HD13 ILE A 375 29.717 -4.037 -21.934 1.00 0.00 H new ATOM 178 N VAL A 376 25.957 -1.728 -19.241 1.00 0.00 N ATOM 179 CA VAL A 376 25.596 -0.998 -18.037 1.00 0.00 C ATOM 180 C VAL A 376 24.085 -0.754 -18.028 1.00 0.00 C ATOM 181 O VAL A 376 23.398 -1.132 -17.080 1.00 0.00 O ATOM 182 CB VAL A 376 26.410 0.294 -17.945 1.00 0.00 C ATOM 183 CG1 VAL A 376 25.939 1.157 -16.773 1.00 0.00 C ATOM 184 CG2 VAL A 376 27.906 -0.008 -17.836 1.00 0.00 C ATOM 0 H VAL A 376 26.540 -1.208 -19.897 1.00 0.00 H new ATOM 0 HA VAL A 376 25.837 -1.582 -17.149 1.00 0.00 H new ATOM 0 HB VAL A 376 26.247 0.858 -18.863 1.00 0.00 H new ATOM 0 HG11 VAL A 376 26.534 2.069 -16.731 1.00 0.00 H new ATOM 0 HG12 VAL A 376 24.889 1.415 -16.910 1.00 0.00 H new ATOM 0 HG13 VAL A 376 26.058 0.603 -15.842 1.00 0.00 H new ATOM 0 HG21 VAL A 376 28.462 0.927 -17.772 1.00 0.00 H new ATOM 0 HG22 VAL A 376 28.093 -0.603 -16.942 1.00 0.00 H new ATOM 0 HG23 VAL A 376 28.230 -0.563 -18.716 1.00 0.00 H new ATOM 194 N LEU A 377 23.613 -0.125 -19.094 1.00 0.00 N ATOM 195 CA LEU A 377 22.197 0.174 -19.220 1.00 0.00 C ATOM 196 C LEU A 377 21.381 -1.022 -18.725 1.00 0.00 C ATOM 197 O LEU A 377 20.623 -0.906 -17.764 1.00 0.00 O ATOM 198 CB LEU A 377 21.864 0.595 -20.653 1.00 0.00 C ATOM 199 CG LEU A 377 22.111 2.066 -20.995 1.00 0.00 C ATOM 200 CD1 LEU A 377 21.020 2.958 -20.399 1.00 0.00 C ATOM 201 CD2 LEU A 377 23.510 2.502 -20.558 1.00 0.00 C ATOM 0 H LEU A 377 24.186 0.186 -19.878 1.00 0.00 H new ATOM 0 HA LEU A 377 21.930 1.024 -18.592 1.00 0.00 H new ATOM 0 HB2 LEU A 377 22.450 -0.020 -21.336 1.00 0.00 H new ATOM 0 HB3 LEU A 377 20.814 0.370 -20.842 1.00 0.00 H new ATOM 0 HG LEU A 377 22.062 2.178 -22.078 1.00 0.00 H new ATOM 0 HD11 LEU A 377 21.219 3.998 -20.657 1.00 0.00 H new ATOM 0 HD12 LEU A 377 20.050 2.664 -20.800 1.00 0.00 H new ATOM 0 HD13 LEU A 377 21.012 2.848 -19.315 1.00 0.00 H new ATOM 0 HD21 LEU A 377 23.660 3.551 -20.812 1.00 0.00 H new ATOM 0 HD22 LEU A 377 23.612 2.372 -19.481 1.00 0.00 H new ATOM 0 HD23 LEU A 377 24.257 1.894 -21.069 1.00 0.00 H new ATOM 213 N GLY A 378 21.565 -2.145 -19.405 1.00 0.00 N ATOM 214 CA GLY A 378 20.856 -3.361 -19.046 1.00 0.00 C ATOM 215 C GLY A 378 20.971 -3.641 -17.547 1.00 0.00 C ATOM 216 O GLY A 378 20.014 -4.094 -16.921 1.00 0.00 O ATOM 0 H GLY A 378 22.195 -2.238 -20.202 1.00 0.00 H new ATOM 0 HA2 GLY A 378 19.806 -3.269 -19.323 1.00 0.00 H new ATOM 0 HA3 GLY A 378 21.261 -4.202 -19.609 1.00 0.00 H new ATOM 220 N GLY A 379 22.151 -3.360 -17.014 1.00 0.00 N ATOM 221 CA GLY A 379 22.404 -3.576 -15.599 1.00 0.00 C ATOM 222 C GLY A 379 21.745 -2.485 -14.752 1.00 0.00 C ATOM 223 O GLY A 379 21.570 -2.652 -13.546 1.00 0.00 O ATOM 0 H GLY A 379 22.943 -2.985 -17.536 1.00 0.00 H new ATOM 0 HA2 GLY A 379 22.022 -4.553 -15.302 1.00 0.00 H new ATOM 0 HA3 GLY A 379 23.478 -3.585 -15.415 1.00 0.00 H new ATOM 227 N VAL A 380 21.396 -1.394 -15.416 1.00 0.00 N ATOM 228 CA VAL A 380 20.760 -0.276 -14.740 1.00 0.00 C ATOM 229 C VAL A 380 19.241 -0.411 -14.860 1.00 0.00 C ATOM 230 O VAL A 380 18.515 -0.182 -13.893 1.00 0.00 O ATOM 231 CB VAL A 380 21.289 1.045 -15.300 1.00 0.00 C ATOM 232 CG1 VAL A 380 20.502 2.232 -14.742 1.00 0.00 C ATOM 233 CG2 VAL A 380 22.786 1.200 -15.020 1.00 0.00 C ATOM 0 H VAL A 380 21.542 -1.260 -16.417 1.00 0.00 H new ATOM 0 HA VAL A 380 21.004 -0.283 -13.678 1.00 0.00 H new ATOM 0 HB VAL A 380 21.150 1.029 -16.381 1.00 0.00 H new ATOM 0 HG11 VAL A 380 20.899 3.159 -15.156 1.00 0.00 H new ATOM 0 HG12 VAL A 380 19.451 2.133 -15.015 1.00 0.00 H new ATOM 0 HG13 VAL A 380 20.594 2.251 -13.656 1.00 0.00 H new ATOM 0 HG21 VAL A 380 23.136 2.148 -15.429 1.00 0.00 H new ATOM 0 HG22 VAL A 380 22.959 1.183 -13.944 1.00 0.00 H new ATOM 0 HG23 VAL A 380 23.330 0.380 -15.488 1.00 0.00 H new ATOM 243 N ALA A 381 18.804 -0.781 -16.055 1.00 0.00 N ATOM 244 CA ALA A 381 17.384 -0.949 -16.314 1.00 0.00 C ATOM 245 C ALA A 381 16.725 -1.618 -15.106 1.00 0.00 C ATOM 246 O ALA A 381 15.838 -1.041 -14.480 1.00 0.00 O ATOM 247 CB ALA A 381 17.192 -1.752 -17.602 1.00 0.00 C ATOM 0 H ALA A 381 19.408 -0.969 -16.855 1.00 0.00 H new ATOM 0 HA ALA A 381 16.903 0.018 -16.458 1.00 0.00 H new ATOM 0 HB1 ALA A 381 16.127 -1.878 -17.797 1.00 0.00 H new ATOM 0 HB2 ALA A 381 17.652 -1.220 -18.434 1.00 0.00 H new ATOM 0 HB3 ALA A 381 17.660 -2.731 -17.494 1.00 0.00 H new ATOM 253 N GLY A 382 17.185 -2.826 -14.815 1.00 0.00 N ATOM 254 CA GLY A 382 16.651 -3.580 -13.694 1.00 0.00 C ATOM 255 C GLY A 382 16.643 -2.734 -12.419 1.00 0.00 C ATOM 256 O GLY A 382 15.618 -2.626 -11.748 1.00 0.00 O ATOM 0 H GLY A 382 17.922 -3.301 -15.336 1.00 0.00 H new ATOM 0 HA2 GLY A 382 15.637 -3.910 -13.922 1.00 0.00 H new ATOM 0 HA3 GLY A 382 17.250 -4.477 -13.536 1.00 0.00 H new ATOM 260 N LEU A 383 17.798 -2.156 -12.123 1.00 0.00 N ATOM 261 CA LEU A 383 17.937 -1.323 -10.941 1.00 0.00 C ATOM 262 C LEU A 383 16.890 -0.208 -10.982 1.00 0.00 C ATOM 263 O LEU A 383 16.205 0.042 -9.991 1.00 0.00 O ATOM 264 CB LEU A 383 19.373 -0.813 -10.811 1.00 0.00 C ATOM 265 CG LEU A 383 20.232 -1.492 -9.742 1.00 0.00 C ATOM 266 CD1 LEU A 383 19.455 -1.652 -8.434 1.00 0.00 C ATOM 267 CD2 LEU A 383 20.783 -2.827 -10.248 1.00 0.00 C ATOM 0 H LEU A 383 18.646 -2.248 -12.682 1.00 0.00 H new ATOM 0 HA LEU A 383 17.747 -1.906 -10.040 1.00 0.00 H new ATOM 0 HB2 LEU A 383 19.868 -0.931 -11.775 1.00 0.00 H new ATOM 0 HB3 LEU A 383 19.340 0.255 -10.598 1.00 0.00 H new ATOM 0 HG LEU A 383 21.087 -0.849 -9.532 1.00 0.00 H new ATOM 0 HD11 LEU A 383 20.089 -2.137 -7.691 1.00 0.00 H new ATOM 0 HD12 LEU A 383 19.153 -0.671 -8.068 1.00 0.00 H new ATOM 0 HD13 LEU A 383 18.569 -2.262 -8.609 1.00 0.00 H new ATOM 0 HD21 LEU A 383 21.390 -3.289 -9.469 1.00 0.00 H new ATOM 0 HD22 LEU A 383 19.955 -3.489 -10.503 1.00 0.00 H new ATOM 0 HD23 LEU A 383 21.397 -2.656 -11.132 1.00 0.00 H new ATOM 279 N LEU A 384 16.797 0.432 -12.139 1.00 0.00 N ATOM 280 CA LEU A 384 15.845 1.514 -12.322 1.00 0.00 C ATOM 281 C LEU A 384 14.444 1.022 -11.953 1.00 0.00 C ATOM 282 O LEU A 384 13.629 1.788 -11.441 1.00 0.00 O ATOM 283 CB LEU A 384 15.945 2.081 -13.739 1.00 0.00 C ATOM 284 CG LEU A 384 17.152 2.977 -14.020 1.00 0.00 C ATOM 285 CD1 LEU A 384 17.351 3.174 -15.524 1.00 0.00 C ATOM 286 CD2 LEU A 384 17.030 4.310 -13.279 1.00 0.00 C ATOM 0 H LEU A 384 17.366 0.221 -12.959 1.00 0.00 H new ATOM 0 HA LEU A 384 16.078 2.344 -11.655 1.00 0.00 H new ATOM 0 HB2 LEU A 384 15.965 1.248 -14.442 1.00 0.00 H new ATOM 0 HB3 LEU A 384 15.039 2.651 -13.946 1.00 0.00 H new ATOM 0 HG LEU A 384 18.043 2.478 -13.640 1.00 0.00 H new ATOM 0 HD11 LEU A 384 18.216 3.815 -15.696 1.00 0.00 H new ATOM 0 HD12 LEU A 384 17.516 2.207 -15.999 1.00 0.00 H new ATOM 0 HD13 LEU A 384 16.463 3.641 -15.950 1.00 0.00 H new ATOM 0 HD21 LEU A 384 17.901 4.928 -13.496 1.00 0.00 H new ATOM 0 HD22 LEU A 384 16.128 4.827 -13.606 1.00 0.00 H new ATOM 0 HD23 LEU A 384 16.974 4.126 -12.206 1.00 0.00 H new ATOM 298 N LEU A 385 14.207 -0.252 -12.227 1.00 0.00 N ATOM 299 CA LEU A 385 12.919 -0.855 -11.930 1.00 0.00 C ATOM 300 C LEU A 385 12.632 -0.724 -10.433 1.00 0.00 C ATOM 301 O LEU A 385 11.668 -0.070 -10.037 1.00 0.00 O ATOM 302 CB LEU A 385 12.871 -2.296 -12.442 1.00 0.00 C ATOM 303 CG LEU A 385 11.492 -2.816 -12.854 1.00 0.00 C ATOM 304 CD1 LEU A 385 11.199 -2.491 -14.319 1.00 0.00 C ATOM 305 CD2 LEU A 385 11.361 -4.312 -12.561 1.00 0.00 C ATOM 0 H LEU A 385 14.886 -0.884 -12.652 1.00 0.00 H new ATOM 0 HA LEU A 385 12.122 -0.328 -12.455 1.00 0.00 H new ATOM 0 HB2 LEU A 385 13.539 -2.379 -13.299 1.00 0.00 H new ATOM 0 HB3 LEU A 385 13.267 -2.950 -11.665 1.00 0.00 H new ATOM 0 HG LEU A 385 10.740 -2.303 -12.254 1.00 0.00 H new ATOM 0 HD11 LEU A 385 10.213 -2.872 -14.586 1.00 0.00 H new ATOM 0 HD12 LEU A 385 11.223 -1.411 -14.464 1.00 0.00 H new ATOM 0 HD13 LEU A 385 11.952 -2.959 -14.953 1.00 0.00 H new ATOM 0 HD21 LEU A 385 10.372 -4.657 -12.863 1.00 0.00 H new ATOM 0 HD22 LEU A 385 12.122 -4.860 -13.117 1.00 0.00 H new ATOM 0 HD23 LEU A 385 11.496 -4.487 -11.494 1.00 0.00 H new ATOM 317 N PHE A 386 13.487 -1.355 -9.642 1.00 0.00 N ATOM 318 CA PHE A 386 13.337 -1.318 -8.197 1.00 0.00 C ATOM 319 C PHE A 386 13.373 0.122 -7.680 1.00 0.00 C ATOM 320 O PHE A 386 12.596 0.489 -6.800 1.00 0.00 O ATOM 321 CB PHE A 386 14.517 -2.090 -7.605 1.00 0.00 C ATOM 322 CG PHE A 386 14.513 -3.584 -7.936 1.00 0.00 C ATOM 323 CD1 PHE A 386 13.633 -4.415 -7.315 1.00 0.00 C ATOM 324 CD2 PHE A 386 15.388 -4.080 -8.851 1.00 0.00 C ATOM 325 CE1 PHE A 386 13.629 -5.801 -7.623 1.00 0.00 C ATOM 326 CE2 PHE A 386 15.384 -5.467 -9.158 1.00 0.00 C ATOM 327 CZ PHE A 386 14.504 -6.298 -8.537 1.00 0.00 C ATOM 0 H PHE A 386 14.286 -1.895 -9.974 1.00 0.00 H new ATOM 0 HA PHE A 386 12.381 -1.755 -7.910 1.00 0.00 H new ATOM 0 HB2 PHE A 386 15.445 -1.650 -7.970 1.00 0.00 H new ATOM 0 HB3 PHE A 386 14.511 -1.968 -6.522 1.00 0.00 H new ATOM 0 HD1 PHE A 386 12.938 -4.021 -6.588 1.00 0.00 H new ATOM 0 HD2 PHE A 386 16.086 -3.420 -9.344 1.00 0.00 H new ATOM 0 HE1 PHE A 386 12.930 -6.461 -7.131 1.00 0.00 H new ATOM 0 HE2 PHE A 386 16.079 -5.862 -9.884 1.00 0.00 H new ATOM 0 HZ PHE A 386 14.501 -7.353 -8.770 1.00 0.00 H new ATOM 337 N ILE A 387 14.285 0.898 -8.247 1.00 0.00 N ATOM 338 CA ILE A 387 14.433 2.289 -7.854 1.00 0.00 C ATOM 339 C ILE A 387 13.140 3.044 -8.170 1.00 0.00 C ATOM 340 O ILE A 387 12.680 3.856 -7.368 1.00 0.00 O ATOM 341 CB ILE A 387 15.676 2.900 -8.504 1.00 0.00 C ATOM 342 CG1 ILE A 387 16.939 2.534 -7.723 1.00 0.00 C ATOM 343 CG2 ILE A 387 15.522 4.413 -8.668 1.00 0.00 C ATOM 344 CD1 ILE A 387 18.095 2.207 -8.671 1.00 0.00 C ATOM 0 H ILE A 387 14.929 0.590 -8.976 1.00 0.00 H new ATOM 0 HA ILE A 387 14.593 2.366 -6.779 1.00 0.00 H new ATOM 0 HB ILE A 387 15.781 2.477 -9.503 1.00 0.00 H new ATOM 0 HG12 ILE A 387 17.221 3.362 -7.072 1.00 0.00 H new ATOM 0 HG13 ILE A 387 16.738 1.677 -7.080 1.00 0.00 H new ATOM 0 HG21 ILE A 387 16.419 4.822 -9.132 1.00 0.00 H new ATOM 0 HG22 ILE A 387 14.659 4.625 -9.299 1.00 0.00 H new ATOM 0 HG23 ILE A 387 15.378 4.872 -7.690 1.00 0.00 H new ATOM 0 HD11 ILE A 387 18.981 1.950 -8.090 1.00 0.00 H new ATOM 0 HD12 ILE A 387 17.819 1.363 -9.304 1.00 0.00 H new ATOM 0 HD13 ILE A 387 18.310 3.074 -9.296 1.00 0.00 H new ATOM 356 N GLY A 388 12.591 2.750 -9.339 1.00 0.00 N ATOM 357 CA GLY A 388 11.360 3.390 -9.770 1.00 0.00 C ATOM 358 C GLY A 388 10.156 2.834 -9.008 1.00 0.00 C ATOM 359 O GLY A 388 9.182 3.547 -8.773 1.00 0.00 O ATOM 0 H GLY A 388 12.976 2.077 -10.001 1.00 0.00 H new ATOM 0 HA2 GLY A 388 11.430 4.466 -9.610 1.00 0.00 H new ATOM 0 HA3 GLY A 388 11.221 3.235 -10.840 1.00 0.00 H new ATOM 363 N LEU A 389 10.262 1.565 -8.642 1.00 0.00 N ATOM 364 CA LEU A 389 9.194 0.905 -7.911 1.00 0.00 C ATOM 365 C LEU A 389 9.176 1.417 -6.470 1.00 0.00 C ATOM 366 O LEU A 389 8.110 1.671 -5.911 1.00 0.00 O ATOM 367 CB LEU A 389 9.330 -0.615 -8.022 1.00 0.00 C ATOM 368 CG LEU A 389 9.922 -1.326 -6.803 1.00 0.00 C ATOM 369 CD1 LEU A 389 8.963 -1.265 -5.613 1.00 0.00 C ATOM 370 CD2 LEU A 389 10.319 -2.764 -7.146 1.00 0.00 C ATOM 0 H LEU A 389 11.072 0.976 -8.838 1.00 0.00 H new ATOM 0 HA LEU A 389 8.226 1.149 -8.348 1.00 0.00 H new ATOM 0 HB2 LEU A 389 8.344 -1.035 -8.219 1.00 0.00 H new ATOM 0 HB3 LEU A 389 9.952 -0.842 -8.888 1.00 0.00 H new ATOM 0 HG LEU A 389 10.832 -0.802 -6.510 1.00 0.00 H new ATOM 0 HD11 LEU A 389 9.408 -1.778 -4.760 1.00 0.00 H new ATOM 0 HD12 LEU A 389 8.773 -0.224 -5.352 1.00 0.00 H new ATOM 0 HD13 LEU A 389 8.023 -1.750 -5.878 1.00 0.00 H new ATOM 0 HD21 LEU A 389 10.737 -3.247 -6.263 1.00 0.00 H new ATOM 0 HD22 LEU A 389 9.439 -3.315 -7.479 1.00 0.00 H new ATOM 0 HD23 LEU A 389 11.064 -2.756 -7.942 1.00 0.00 H new ATOM 382 N GLY A 390 10.368 1.555 -5.909 1.00 0.00 N ATOM 383 CA GLY A 390 10.502 2.033 -4.544 1.00 0.00 C ATOM 384 C GLY A 390 9.862 3.412 -4.380 1.00 0.00 C ATOM 385 O GLY A 390 9.139 3.655 -3.415 1.00 0.00 O ATOM 0 H GLY A 390 11.250 1.344 -6.375 1.00 0.00 H new ATOM 0 HA2 GLY A 390 10.032 1.327 -3.860 1.00 0.00 H new ATOM 0 HA3 GLY A 390 11.557 2.084 -4.275 1.00 0.00 H new ATOM 389 N ILE A 391 10.150 4.281 -5.338 1.00 0.00 N ATOM 390 CA ILE A 391 9.611 5.630 -5.313 1.00 0.00 C ATOM 391 C ILE A 391 8.123 5.587 -5.667 1.00 0.00 C ATOM 392 O ILE A 391 7.275 5.929 -4.844 1.00 0.00 O ATOM 393 CB ILE A 391 10.431 6.552 -6.216 1.00 0.00 C ATOM 394 CG1 ILE A 391 11.720 6.996 -5.521 1.00 0.00 C ATOM 395 CG2 ILE A 391 9.595 7.743 -6.689 1.00 0.00 C ATOM 396 CD1 ILE A 391 12.951 6.452 -6.249 1.00 0.00 C ATOM 0 H ILE A 391 10.750 4.077 -6.137 1.00 0.00 H new ATOM 0 HA ILE A 391 9.689 6.052 -4.311 1.00 0.00 H new ATOM 0 HB ILE A 391 10.721 5.990 -7.104 1.00 0.00 H new ATOM 0 HG12 ILE A 391 11.764 8.085 -5.489 1.00 0.00 H new ATOM 0 HG13 ILE A 391 11.720 6.646 -4.489 1.00 0.00 H new ATOM 0 HG21 ILE A 391 10.202 8.382 -7.329 1.00 0.00 H new ATOM 0 HG22 ILE A 391 8.733 7.382 -7.250 1.00 0.00 H new ATOM 0 HG23 ILE A 391 9.254 8.314 -5.825 1.00 0.00 H new ATOM 0 HD11 ILE A 391 13.853 6.782 -5.735 1.00 0.00 H new ATOM 0 HD12 ILE A 391 12.917 5.363 -6.258 1.00 0.00 H new ATOM 0 HD13 ILE A 391 12.961 6.823 -7.274 1.00 0.00 H new ATOM 408 N PHE A 392 7.851 5.163 -6.893 1.00 0.00 N ATOM 409 CA PHE A 392 6.481 5.070 -7.366 1.00 0.00 C ATOM 410 C PHE A 392 5.547 4.590 -6.253 1.00 0.00 C ATOM 411 O PHE A 392 4.568 5.260 -5.926 1.00 0.00 O ATOM 412 CB PHE A 392 6.468 4.046 -8.503 1.00 0.00 C ATOM 413 CG PHE A 392 5.085 3.814 -9.115 1.00 0.00 C ATOM 414 CD1 PHE A 392 4.321 4.874 -9.491 1.00 0.00 C ATOM 415 CD2 PHE A 392 4.620 2.547 -9.284 1.00 0.00 C ATOM 416 CE1 PHE A 392 3.038 4.658 -10.060 1.00 0.00 C ATOM 417 CE2 PHE A 392 3.337 2.331 -9.852 1.00 0.00 C ATOM 418 CZ PHE A 392 2.573 3.391 -10.228 1.00 0.00 C ATOM 0 H PHE A 392 8.557 4.880 -7.573 1.00 0.00 H new ATOM 0 HA PHE A 392 6.135 6.049 -7.696 1.00 0.00 H new ATOM 0 HB2 PHE A 392 7.149 4.379 -9.286 1.00 0.00 H new ATOM 0 HB3 PHE A 392 6.852 3.097 -8.128 1.00 0.00 H new ATOM 0 HD1 PHE A 392 4.690 5.880 -9.357 1.00 0.00 H new ATOM 0 HD2 PHE A 392 5.227 1.705 -8.986 1.00 0.00 H new ATOM 0 HE1 PHE A 392 2.431 5.500 -10.359 1.00 0.00 H new ATOM 0 HE2 PHE A 392 2.968 1.325 -9.985 1.00 0.00 H new ATOM 0 HZ PHE A 392 1.597 3.227 -10.660 1.00 0.00 H new ATOM 428 N PHE A 393 5.883 3.434 -5.700 1.00 0.00 N ATOM 429 CA PHE A 393 5.088 2.857 -4.630 1.00 0.00 C ATOM 430 C PHE A 393 4.842 3.877 -3.517 1.00 0.00 C ATOM 431 O PHE A 393 3.714 4.038 -3.054 1.00 0.00 O ATOM 432 CB PHE A 393 5.887 1.682 -4.062 1.00 0.00 C ATOM 433 CG PHE A 393 5.735 0.384 -4.857 1.00 0.00 C ATOM 434 CD1 PHE A 393 5.630 0.425 -6.212 1.00 0.00 C ATOM 435 CD2 PHE A 393 5.706 -0.811 -4.208 1.00 0.00 C ATOM 436 CE1 PHE A 393 5.490 -0.780 -6.950 1.00 0.00 C ATOM 437 CE2 PHE A 393 5.566 -2.016 -4.946 1.00 0.00 C ATOM 438 CZ PHE A 393 5.461 -1.975 -6.301 1.00 0.00 C ATOM 0 H PHE A 393 6.696 2.881 -5.973 1.00 0.00 H new ATOM 0 HA PHE A 393 4.119 2.541 -5.016 1.00 0.00 H new ATOM 0 HB2 PHE A 393 6.942 1.955 -4.030 1.00 0.00 H new ATOM 0 HB3 PHE A 393 5.572 1.505 -3.034 1.00 0.00 H new ATOM 0 HD1 PHE A 393 5.653 1.374 -6.727 1.00 0.00 H new ATOM 0 HD2 PHE A 393 5.789 -0.843 -3.132 1.00 0.00 H new ATOM 0 HE1 PHE A 393 5.407 -0.748 -8.026 1.00 0.00 H new ATOM 0 HE2 PHE A 393 5.543 -2.965 -4.431 1.00 0.00 H new ATOM 0 HZ PHE A 393 5.355 -2.892 -6.862 1.00 0.00 H new ATOM 448 N SER A 394 5.918 4.541 -3.119 1.00 0.00 N ATOM 449 CA SER A 394 5.834 5.542 -2.069 1.00 0.00 C ATOM 450 C SER A 394 4.858 6.647 -2.476 1.00 0.00 C ATOM 451 O SER A 394 3.905 6.937 -1.754 1.00 0.00 O ATOM 452 CB SER A 394 7.210 6.135 -1.762 1.00 0.00 C ATOM 453 OG SER A 394 7.360 6.450 -0.380 1.00 0.00 O ATOM 0 H SER A 394 6.852 4.405 -3.505 1.00 0.00 H new ATOM 0 HA SER A 394 5.467 5.058 -1.164 1.00 0.00 H new ATOM 0 HB2 SER A 394 7.984 5.427 -2.058 1.00 0.00 H new ATOM 0 HB3 SER A 394 7.357 7.036 -2.357 1.00 0.00 H new ATOM 0 HG SER A 394 8.252 6.824 -0.225 1.00 0.00 H new ATOM 459 N VAL A 395 5.129 7.235 -3.633 1.00 0.00 N ATOM 460 CA VAL A 395 4.287 8.303 -4.145 1.00 0.00 C ATOM 461 C VAL A 395 2.826 7.850 -4.121 1.00 0.00 C ATOM 462 O VAL A 395 1.948 8.596 -3.690 1.00 0.00 O ATOM 463 CB VAL A 395 4.761 8.720 -5.539 1.00 0.00 C ATOM 464 CG1 VAL A 395 3.686 9.532 -6.263 1.00 0.00 C ATOM 465 CG2 VAL A 395 6.076 9.497 -5.461 1.00 0.00 C ATOM 0 H VAL A 395 5.920 6.992 -4.230 1.00 0.00 H new ATOM 0 HA VAL A 395 4.364 9.187 -3.512 1.00 0.00 H new ATOM 0 HB VAL A 395 4.942 7.814 -6.117 1.00 0.00 H new ATOM 0 HG11 VAL A 395 4.048 9.816 -7.251 1.00 0.00 H new ATOM 0 HG12 VAL A 395 2.783 8.930 -6.367 1.00 0.00 H new ATOM 0 HG13 VAL A 395 3.459 10.430 -5.688 1.00 0.00 H new ATOM 0 HG21 VAL A 395 6.391 9.781 -6.465 1.00 0.00 H new ATOM 0 HG22 VAL A 395 5.934 10.394 -4.858 1.00 0.00 H new ATOM 0 HG23 VAL A 395 6.842 8.870 -5.004 1.00 0.00 H new ATOM 475 N ARG A 396 2.610 6.629 -4.590 1.00 0.00 N ATOM 476 CA ARG A 396 1.270 6.068 -4.628 1.00 0.00 C ATOM 477 C ARG A 396 0.684 5.999 -3.216 1.00 0.00 C ATOM 478 O ARG A 396 0.839 4.995 -2.524 1.00 0.00 O ATOM 479 CB ARG A 396 1.278 4.665 -5.239 1.00 0.00 C ATOM 480 CG ARG A 396 1.530 4.725 -6.746 1.00 0.00 C ATOM 481 CD ARG A 396 0.746 3.634 -7.478 1.00 0.00 C ATOM 482 NE ARG A 396 0.005 4.221 -8.617 1.00 0.00 N ATOM 483 CZ ARG A 396 -0.970 3.589 -9.285 1.00 0.00 C ATOM 484 NH1 ARG A 396 -1.327 2.346 -8.931 1.00 0.00 N ATOM 485 NH2 ARG A 396 -1.587 4.198 -10.305 1.00 0.00 N ATOM 0 H ARG A 396 3.341 6.013 -4.947 1.00 0.00 H new ATOM 0 HA ARG A 396 0.655 6.719 -5.249 1.00 0.00 H new ATOM 0 HB2 ARG A 396 2.049 4.061 -4.761 1.00 0.00 H new ATOM 0 HB3 ARG A 396 0.324 4.175 -5.045 1.00 0.00 H new ATOM 0 HG2 ARG A 396 1.240 5.704 -7.128 1.00 0.00 H new ATOM 0 HG3 ARG A 396 2.595 4.608 -6.945 1.00 0.00 H new ATOM 0 HD2 ARG A 396 1.428 2.863 -7.836 1.00 0.00 H new ATOM 0 HD3 ARG A 396 0.051 3.151 -6.791 1.00 0.00 H new ATOM 0 HE ARG A 396 0.252 5.166 -8.912 1.00 0.00 H new ATOM 0 HH11 ARG A 396 -0.857 1.882 -8.154 1.00 0.00 H new ATOM 0 HH12 ARG A 396 -2.069 1.864 -9.439 1.00 0.00 H new ATOM 0 HH21 ARG A 396 -1.315 5.144 -10.574 1.00 0.00 H new ATOM 0 HH22 ARG A 396 -2.329 3.716 -10.813 1.00 0.00 H new ATOM 499 N SER A 397 0.021 7.081 -2.832 1.00 0.00 N ATOM 500 CA SER A 397 -0.589 7.156 -1.515 1.00 0.00 C ATOM 501 C SER A 397 -1.701 6.112 -1.394 1.00 0.00 C ATOM 502 O SER A 397 -2.576 6.029 -2.255 1.00 0.00 O ATOM 503 CB SER A 397 -1.144 8.556 -1.244 1.00 0.00 C ATOM 504 OG SER A 397 -0.430 9.220 -0.205 1.00 0.00 O ATOM 0 H SER A 397 -0.107 7.912 -3.410 1.00 0.00 H new ATOM 0 HA SER A 397 0.179 6.948 -0.770 1.00 0.00 H new ATOM 0 HB2 SER A 397 -1.092 9.150 -2.157 1.00 0.00 H new ATOM 0 HB3 SER A 397 -2.197 8.482 -0.971 1.00 0.00 H new ATOM 0 HG SER A 397 -0.813 10.111 -0.063 1.00 0.00 H new ATOM 510 N ARG A 398 -1.631 5.341 -0.319 1.00 0.00 N ATOM 511 CA ARG A 398 -2.620 4.305 -0.074 1.00 0.00 C ATOM 512 C ARG A 398 -3.968 4.934 0.286 1.00 0.00 C ATOM 513 O ARG A 398 -4.090 5.604 1.311 1.00 0.00 O ATOM 514 CB ARG A 398 -2.178 3.378 1.059 1.00 0.00 C ATOM 515 CG ARG A 398 -1.993 1.945 0.555 1.00 0.00 C ATOM 516 CD ARG A 398 -2.616 0.938 1.524 1.00 0.00 C ATOM 517 NE ARG A 398 -1.552 0.198 2.239 1.00 0.00 N ATOM 518 CZ ARG A 398 -0.822 0.712 3.238 1.00 0.00 C ATOM 519 NH1 ARG A 398 -1.035 1.970 3.646 1.00 0.00 N ATOM 520 NH2 ARG A 398 0.123 -0.033 3.828 1.00 0.00 N ATOM 0 H ARG A 398 -0.904 5.413 0.393 1.00 0.00 H new ATOM 0 HA ARG A 398 -2.721 3.719 -0.988 1.00 0.00 H new ATOM 0 HB2 ARG A 398 -1.243 3.740 1.486 1.00 0.00 H new ATOM 0 HB3 ARG A 398 -2.920 3.394 1.857 1.00 0.00 H new ATOM 0 HG2 ARG A 398 -2.451 1.840 -0.429 1.00 0.00 H new ATOM 0 HG3 ARG A 398 -0.931 1.732 0.437 1.00 0.00 H new ATOM 0 HD2 ARG A 398 -3.254 1.457 2.240 1.00 0.00 H new ATOM 0 HD3 ARG A 398 -3.251 0.241 0.978 1.00 0.00 H new ATOM 0 HE ARG A 398 -1.363 -0.763 1.953 1.00 0.00 H new ATOM 0 HH11 ARG A 398 -1.753 2.537 3.196 1.00 0.00 H new ATOM 0 HH12 ARG A 398 -0.479 2.361 4.407 1.00 0.00 H new ATOM 0 HH21 ARG A 398 0.286 -0.990 3.516 1.00 0.00 H new ATOM 0 HH22 ARG A 398 0.679 0.357 4.589 1.00 0.00 H new ATOM 534 N HIS A 399 -4.945 4.696 -0.576 1.00 0.00 N ATOM 535 CA HIS A 399 -6.279 5.231 -0.361 1.00 0.00 C ATOM 536 C HIS A 399 -7.130 4.202 0.386 1.00 0.00 C ATOM 537 O HIS A 399 -7.233 3.051 -0.037 1.00 0.00 O ATOM 538 CB HIS A 399 -6.908 5.671 -1.684 1.00 0.00 C ATOM 539 CG HIS A 399 -6.804 4.644 -2.786 1.00 0.00 C ATOM 540 ND1 HIS A 399 -7.472 3.432 -2.747 1.00 0.00 N ATOM 541 CD2 HIS A 399 -6.104 4.660 -3.957 1.00 0.00 C ATOM 542 CE1 HIS A 399 -7.180 2.757 -3.849 1.00 0.00 C ATOM 543 NE2 HIS A 399 -6.331 3.519 -4.597 1.00 0.00 N ATOM 0 H HIS A 399 -4.840 4.140 -1.425 1.00 0.00 H new ATOM 0 HA HIS A 399 -6.220 6.124 0.261 1.00 0.00 H new ATOM 0 HB2 HIS A 399 -7.960 5.902 -1.515 1.00 0.00 H new ATOM 0 HB3 HIS A 399 -6.428 6.592 -2.014 1.00 0.00 H new ATOM 0 HD1 HIS A 399 -8.085 3.113 -1.997 1.00 0.00 H new ATOM 0 HD2 HIS A 399 -5.472 5.464 -4.304 1.00 0.00 H new ATOM 0 HE1 HIS A 399 -7.549 1.776 -4.109 1.00 0.00 H new ATOM 552 N ARG A 400 -7.718 4.653 1.484 1.00 0.00 N ATOM 553 CA ARG A 400 -8.557 3.786 2.294 1.00 0.00 C ATOM 554 C ARG A 400 -9.392 2.868 1.399 1.00 0.00 C ATOM 555 O ARG A 400 -9.960 3.315 0.404 1.00 0.00 O ATOM 556 CB ARG A 400 -9.492 4.603 3.188 1.00 0.00 C ATOM 557 CG ARG A 400 -8.702 5.383 4.240 1.00 0.00 C ATOM 558 CD ARG A 400 -9.518 6.561 4.778 1.00 0.00 C ATOM 559 NE ARG A 400 -8.656 7.441 5.597 1.00 0.00 N ATOM 560 CZ ARG A 400 -8.931 8.725 5.864 1.00 0.00 C ATOM 561 NH1 ARG A 400 -10.047 9.286 5.377 1.00 0.00 N ATOM 562 NH2 ARG A 400 -8.092 9.449 6.617 1.00 0.00 N ATOM 0 H ARG A 400 -7.630 5.608 1.832 1.00 0.00 H new ATOM 0 HA ARG A 400 -7.902 3.186 2.925 1.00 0.00 H new ATOM 0 HB2 ARG A 400 -10.072 5.295 2.577 1.00 0.00 H new ATOM 0 HB3 ARG A 400 -10.203 3.939 3.680 1.00 0.00 H new ATOM 0 HG2 ARG A 400 -8.430 4.720 5.061 1.00 0.00 H new ATOM 0 HG3 ARG A 400 -7.772 5.749 3.804 1.00 0.00 H new ATOM 0 HD2 ARG A 400 -9.946 7.126 3.950 1.00 0.00 H new ATOM 0 HD3 ARG A 400 -10.351 6.194 5.378 1.00 0.00 H new ATOM 0 HE ARG A 400 -7.798 7.046 5.983 1.00 0.00 H new ATOM 0 HH11 ARG A 400 -10.686 8.735 4.804 1.00 0.00 H new ATOM 0 HH12 ARG A 400 -10.257 10.263 5.580 1.00 0.00 H new ATOM 0 HH21 ARG A 400 -7.243 9.023 6.988 1.00 0.00 H new ATOM 0 HH22 ARG A 400 -8.303 10.426 6.819 1.00 0.00 H new ATOM 576 N ARG A 401 -9.440 1.601 1.785 1.00 0.00 N ATOM 577 CA ARG A 401 -10.195 0.617 1.030 1.00 0.00 C ATOM 578 C ARG A 401 -10.794 -0.430 1.972 1.00 0.00 C ATOM 579 O ARG A 401 -10.160 -1.443 2.263 1.00 0.00 O ATOM 580 CB ARG A 401 -9.310 -0.084 -0.002 1.00 0.00 C ATOM 581 CG ARG A 401 -10.145 -0.965 -0.934 1.00 0.00 C ATOM 582 CD ARG A 401 -9.998 -0.517 -2.390 1.00 0.00 C ATOM 583 NE ARG A 401 -10.933 -1.276 -3.250 1.00 0.00 N ATOM 584 CZ ARG A 401 -11.034 -1.114 -4.576 1.00 0.00 C ATOM 585 NH1 ARG A 401 -10.259 -0.218 -5.202 1.00 0.00 N ATOM 586 NH2 ARG A 401 -11.910 -1.847 -5.276 1.00 0.00 N ATOM 0 H ARG A 401 -8.968 1.234 2.611 1.00 0.00 H new ATOM 0 HA ARG A 401 -10.995 1.143 0.509 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -8.769 0.660 -0.587 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -8.564 -0.693 0.508 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -9.831 -2.004 -0.836 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -11.194 -0.920 -0.640 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -10.200 0.551 -2.473 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -8.973 -0.674 -2.726 1.00 0.00 H new ATOM 0 HE ARG A 401 -11.539 -1.966 -2.805 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -9.592 0.340 -4.669 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -10.336 -0.094 -6.212 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -12.500 -2.529 -4.799 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -11.987 -1.723 -6.286 1.00 0.00 H new ATOM 600 N ARG A 402 -12.008 -0.148 2.423 1.00 0.00 N ATOM 601 CA ARG A 402 -12.699 -1.052 3.326 1.00 0.00 C ATOM 602 C ARG A 402 -13.791 -0.304 4.093 1.00 0.00 C ATOM 603 O ARG A 402 -14.757 -0.910 4.555 1.00 0.00 O ATOM 604 CB ARG A 402 -11.726 -1.684 4.324 1.00 0.00 C ATOM 605 CG ARG A 402 -11.457 -3.149 3.975 1.00 0.00 C ATOM 606 CD ARG A 402 -10.284 -3.700 4.788 1.00 0.00 C ATOM 607 NE ARG A 402 -9.209 -4.159 3.880 1.00 0.00 N ATOM 608 CZ ARG A 402 -8.250 -3.364 3.389 1.00 0.00 C ATOM 609 NH1 ARG A 402 -8.224 -2.064 3.715 1.00 0.00 N ATOM 610 NH2 ARG A 402 -7.315 -3.868 2.571 1.00 0.00 N ATOM 0 H ARG A 402 -12.530 0.694 2.180 1.00 0.00 H new ATOM 0 HA ARG A 402 -13.149 -1.842 2.724 1.00 0.00 H new ATOM 0 HB2 ARG A 402 -10.788 -1.128 4.324 1.00 0.00 H new ATOM 0 HB3 ARG A 402 -12.137 -1.616 5.331 1.00 0.00 H new ATOM 0 HG2 ARG A 402 -12.350 -3.743 4.170 1.00 0.00 H new ATOM 0 HG3 ARG A 402 -11.240 -3.239 2.911 1.00 0.00 H new ATOM 0 HD2 ARG A 402 -9.901 -2.930 5.457 1.00 0.00 H new ATOM 0 HD3 ARG A 402 -10.621 -4.527 5.413 1.00 0.00 H new ATOM 0 HE ARG A 402 -9.198 -5.143 3.611 1.00 0.00 H new ATOM 0 HH11 ARG A 402 -8.935 -1.680 4.337 1.00 0.00 H new ATOM 0 HH12 ARG A 402 -7.493 -1.459 3.341 1.00 0.00 H new ATOM 0 HH21 ARG A 402 -7.334 -4.857 2.323 1.00 0.00 H new ATOM 0 HH22 ARG A 402 -6.584 -3.262 2.197 1.00 0.00 H new ATOM 624 N GLN A 403 -13.602 1.003 4.205 1.00 0.00 N ATOM 625 CA GLN A 403 -14.559 1.840 4.908 1.00 0.00 C ATOM 626 C GLN A 403 -14.110 2.060 6.354 1.00 0.00 C ATOM 627 O GLN A 403 -14.824 2.679 7.142 1.00 0.00 O ATOM 628 CB GLN A 403 -15.962 1.232 4.856 1.00 0.00 C ATOM 629 CG GLN A 403 -16.225 0.354 6.081 1.00 0.00 C ATOM 630 CD GLN A 403 -17.203 -0.774 5.748 1.00 0.00 C ATOM 631 OE1 GLN A 403 -16.823 -1.905 5.491 1.00 0.00 O ATOM 632 NE2 GLN A 403 -18.481 -0.406 5.768 1.00 0.00 N ATOM 0 H GLN A 403 -12.800 1.503 3.821 1.00 0.00 H new ATOM 0 HA GLN A 403 -14.600 2.808 4.409 1.00 0.00 H new ATOM 0 HB2 GLN A 403 -16.705 2.028 4.808 1.00 0.00 H new ATOM 0 HB3 GLN A 403 -16.072 0.638 3.948 1.00 0.00 H new ATOM 0 HG2 GLN A 403 -15.286 -0.068 6.439 1.00 0.00 H new ATOM 0 HG3 GLN A 403 -16.629 0.963 6.889 1.00 0.00 H new ATOM 0 HE21 GLN A 403 -18.731 0.557 5.991 1.00 0.00 H new ATOM 0 HE22 GLN A 403 -19.211 -1.087 5.560 1.00 0.00 H new ATOM 641 N ALA A 404 -12.930 1.542 6.659 1.00 0.00 N ATOM 642 CA ALA A 404 -12.377 1.674 7.996 1.00 0.00 C ATOM 643 C ALA A 404 -10.977 2.285 7.907 1.00 0.00 C ATOM 644 O ALA A 404 -10.828 3.506 7.906 1.00 0.00 O ATOM 645 CB ALA A 404 -12.374 0.308 8.685 1.00 0.00 C ATOM 0 H ALA A 404 -12.341 1.030 6.003 1.00 0.00 H new ATOM 0 HA ALA A 404 -12.990 2.342 8.600 1.00 0.00 H new ATOM 0 HB1 ALA A 404 -11.959 0.407 9.688 1.00 0.00 H new ATOM 0 HB2 ALA A 404 -13.395 -0.069 8.750 1.00 0.00 H new ATOM 0 HB3 ALA A 404 -11.766 -0.389 8.108 1.00 0.00 H new ATOM 651 N GLU A 405 -9.987 1.408 7.834 1.00 0.00 N ATOM 652 CA GLU A 405 -8.605 1.846 7.744 1.00 0.00 C ATOM 653 C GLU A 405 -8.205 2.604 9.012 1.00 0.00 C ATOM 654 O GLU A 405 -7.518 2.059 9.875 1.00 0.00 O ATOM 655 CB GLU A 405 -8.381 2.705 6.498 1.00 0.00 C ATOM 656 CG GLU A 405 -8.110 1.832 5.272 1.00 0.00 C ATOM 657 CD GLU A 405 -6.697 2.066 4.733 1.00 0.00 C ATOM 658 OE1 GLU A 405 -6.099 3.119 4.999 1.00 0.00 O ATOM 659 OE2 GLU A 405 -6.221 1.106 4.014 1.00 0.00 O ATOM 0 H GLU A 405 -10.115 0.396 7.835 1.00 0.00 H new ATOM 0 HA GLU A 405 -7.970 0.964 7.655 1.00 0.00 H new ATOM 0 HB2 GLU A 405 -9.257 3.328 6.319 1.00 0.00 H new ATOM 0 HB3 GLU A 405 -7.540 3.378 6.663 1.00 0.00 H new ATOM 0 HG2 GLU A 405 -8.233 0.781 5.535 1.00 0.00 H new ATOM 0 HG3 GLU A 405 -8.841 2.054 4.494 1.00 0.00 H new ATOM 667 N ARG A 406 -8.652 3.849 9.084 1.00 0.00 N ATOM 668 CA ARG A 406 -8.349 4.687 10.232 1.00 0.00 C ATOM 669 C ARG A 406 -9.490 4.626 11.249 1.00 0.00 C ATOM 670 O ARG A 406 -9.250 4.607 12.456 1.00 0.00 O ATOM 671 CB ARG A 406 -8.129 6.141 9.809 1.00 0.00 C ATOM 672 CG ARG A 406 -6.760 6.645 10.270 1.00 0.00 C ATOM 673 CD ARG A 406 -6.259 7.773 9.366 1.00 0.00 C ATOM 674 NE ARG A 406 -4.834 7.556 9.028 1.00 0.00 N ATOM 675 CZ ARG A 406 -4.070 8.448 8.384 1.00 0.00 C ATOM 676 NH1 ARG A 406 -4.589 9.624 8.004 1.00 0.00 N ATOM 677 NH2 ARG A 406 -2.788 8.165 8.119 1.00 0.00 N ATOM 0 H ARG A 406 -9.221 4.298 8.366 1.00 0.00 H new ATOM 0 HA ARG A 406 -7.433 4.310 10.686 1.00 0.00 H new ATOM 0 HB2 ARG A 406 -8.205 6.223 8.725 1.00 0.00 H new ATOM 0 HB3 ARG A 406 -8.913 6.769 10.232 1.00 0.00 H new ATOM 0 HG2 ARG A 406 -6.827 7.000 11.298 1.00 0.00 H new ATOM 0 HG3 ARG A 406 -6.044 5.823 10.263 1.00 0.00 H new ATOM 0 HD2 ARG A 406 -6.856 7.812 8.455 1.00 0.00 H new ATOM 0 HD3 ARG A 406 -6.380 8.733 9.868 1.00 0.00 H new ATOM 0 HE ARG A 406 -4.407 6.671 9.303 1.00 0.00 H new ATOM 0 HH11 ARG A 406 -5.565 9.839 8.205 1.00 0.00 H new ATOM 0 HH12 ARG A 406 -4.007 10.303 7.514 1.00 0.00 H new ATOM 0 HH21 ARG A 406 -2.393 7.270 8.408 1.00 0.00 H new ATOM 0 HH22 ARG A 406 -2.207 8.845 7.629 1.00 0.00 H new ATOM 691 N MET A 407 -10.707 4.597 10.725 1.00 0.00 N ATOM 692 CA MET A 407 -11.885 4.538 11.573 1.00 0.00 C ATOM 693 C MET A 407 -11.802 3.361 12.547 1.00 0.00 C ATOM 694 O MET A 407 -12.019 3.527 13.747 1.00 0.00 O ATOM 695 CB MET A 407 -13.134 4.393 10.702 1.00 0.00 C ATOM 696 CG MET A 407 -13.834 5.741 10.516 1.00 0.00 C ATOM 697 SD MET A 407 -14.317 6.401 12.103 1.00 0.00 S ATOM 698 CE MET A 407 -14.947 4.920 12.876 1.00 0.00 C ATOM 0 H MET A 407 -10.902 4.613 9.724 1.00 0.00 H new ATOM 0 HA MET A 407 -11.939 5.460 12.152 1.00 0.00 H new ATOM 0 HB2 MET A 407 -12.858 3.986 9.729 1.00 0.00 H new ATOM 0 HB3 MET A 407 -13.821 3.683 11.162 1.00 0.00 H new ATOM 0 HG2 MET A 407 -13.168 6.439 10.010 1.00 0.00 H new ATOM 0 HG3 MET A 407 -14.711 5.620 9.881 1.00 0.00 H new ATOM 0 HE1 MET A 407 -15.615 5.192 13.693 1.00 0.00 H new ATOM 0 HE2 MET A 407 -15.495 4.331 12.141 1.00 0.00 H new ATOM 0 HE3 MET A 407 -14.116 4.332 13.267 1.00 0.00 H new ATOM 708 N SER A 408 -11.488 2.199 11.995 1.00 0.00 N ATOM 709 CA SER A 408 -11.373 0.995 12.800 1.00 0.00 C ATOM 710 C SER A 408 -10.433 1.242 13.981 1.00 0.00 C ATOM 711 O SER A 408 -10.485 0.527 14.981 1.00 0.00 O ATOM 712 CB SER A 408 -10.873 -0.183 11.961 1.00 0.00 C ATOM 713 OG SER A 408 -10.308 -1.212 12.769 1.00 0.00 O ATOM 0 H SER A 408 -11.310 2.065 11.000 1.00 0.00 H new ATOM 0 HA SER A 408 -12.363 0.742 13.179 1.00 0.00 H new ATOM 0 HB2 SER A 408 -11.700 -0.591 11.380 1.00 0.00 H new ATOM 0 HB3 SER A 408 -10.127 0.170 11.249 1.00 0.00 H new ATOM 0 HG SER A 408 -10.002 -1.946 12.197 1.00 0.00 H new ATOM 719 N GLN A 409 -9.596 2.257 13.827 1.00 0.00 N ATOM 720 CA GLN A 409 -8.645 2.608 14.869 1.00 0.00 C ATOM 721 C GLN A 409 -9.177 3.777 15.700 1.00 0.00 C ATOM 722 O GLN A 409 -9.211 3.706 16.928 1.00 0.00 O ATOM 723 CB GLN A 409 -7.275 2.937 14.273 1.00 0.00 C ATOM 724 CG GLN A 409 -6.534 3.962 15.134 1.00 0.00 C ATOM 725 CD GLN A 409 -5.021 3.752 15.056 1.00 0.00 C ATOM 726 OE1 GLN A 409 -4.471 2.806 15.597 1.00 0.00 O ATOM 727 NE2 GLN A 409 -4.381 4.683 14.355 1.00 0.00 N ATOM 0 H GLN A 409 -9.556 2.848 12.997 1.00 0.00 H new ATOM 0 HA GLN A 409 -8.521 1.747 15.526 1.00 0.00 H new ATOM 0 HB2 GLN A 409 -6.681 2.027 14.193 1.00 0.00 H new ATOM 0 HB3 GLN A 409 -7.398 3.327 13.263 1.00 0.00 H new ATOM 0 HG2 GLN A 409 -6.783 4.970 14.801 1.00 0.00 H new ATOM 0 HG3 GLN A 409 -6.863 3.878 16.170 1.00 0.00 H new ATOM 0 HE21 GLN A 409 -4.903 5.449 13.928 1.00 0.00 H new ATOM 0 HE22 GLN A 409 -3.368 4.632 14.244 1.00 0.00 H new ATOM 736 N ILE A 410 -9.578 4.827 14.998 1.00 0.00 N ATOM 737 CA ILE A 410 -10.106 6.010 15.656 1.00 0.00 C ATOM 738 C ILE A 410 -11.160 5.590 16.683 1.00 0.00 C ATOM 739 O ILE A 410 -11.119 6.024 17.833 1.00 0.00 O ATOM 740 CB ILE A 410 -10.621 7.014 14.623 1.00 0.00 C ATOM 741 CG1 ILE A 410 -9.496 7.934 14.145 1.00 0.00 C ATOM 742 CG2 ILE A 410 -11.813 7.801 15.169 1.00 0.00 C ATOM 743 CD1 ILE A 410 -10.012 8.942 13.116 1.00 0.00 C ATOM 0 H ILE A 410 -9.548 4.883 13.980 1.00 0.00 H new ATOM 0 HA ILE A 410 -9.316 6.526 16.201 1.00 0.00 H new ATOM 0 HB ILE A 410 -10.974 6.459 13.754 1.00 0.00 H new ATOM 0 HG12 ILE A 410 -9.069 8.464 14.996 1.00 0.00 H new ATOM 0 HG13 ILE A 410 -8.696 7.338 13.706 1.00 0.00 H new ATOM 0 HG21 ILE A 410 -12.159 8.507 14.414 1.00 0.00 H new ATOM 0 HG22 ILE A 410 -12.620 7.112 15.419 1.00 0.00 H new ATOM 0 HG23 ILE A 410 -11.511 8.345 16.064 1.00 0.00 H new ATOM 0 HD11 ILE A 410 -9.192 9.584 12.793 1.00 0.00 H new ATOM 0 HD12 ILE A 410 -10.417 8.409 12.256 1.00 0.00 H new ATOM 0 HD13 ILE A 410 -10.795 9.552 13.566 1.00 0.00 H new ATOM 755 N LYS A 411 -12.079 4.750 16.230 1.00 0.00 N ATOM 756 CA LYS A 411 -13.142 4.266 17.095 1.00 0.00 C ATOM 757 C LYS A 411 -12.584 4.037 18.501 1.00 0.00 C ATOM 758 O LYS A 411 -13.280 4.256 19.492 1.00 0.00 O ATOM 759 CB LYS A 411 -13.805 3.028 16.487 1.00 0.00 C ATOM 760 CG LYS A 411 -15.320 3.057 16.703 1.00 0.00 C ATOM 761 CD LYS A 411 -16.053 2.419 15.521 1.00 0.00 C ATOM 762 CE LYS A 411 -16.347 0.942 15.792 1.00 0.00 C ATOM 763 NZ LYS A 411 -15.144 0.119 15.536 1.00 0.00 N ATOM 0 H LYS A 411 -12.110 4.392 15.275 1.00 0.00 H new ATOM 0 HA LYS A 411 -13.932 5.012 17.183 1.00 0.00 H new ATOM 0 HB2 LYS A 411 -13.587 2.981 15.420 1.00 0.00 H new ATOM 0 HB3 LYS A 411 -13.387 2.128 16.938 1.00 0.00 H new ATOM 0 HG2 LYS A 411 -15.571 2.526 17.621 1.00 0.00 H new ATOM 0 HG3 LYS A 411 -15.654 4.087 16.830 1.00 0.00 H new ATOM 0 HD2 LYS A 411 -16.986 2.951 15.337 1.00 0.00 H new ATOM 0 HD3 LYS A 411 -15.448 2.514 14.619 1.00 0.00 H new ATOM 0 HE2 LYS A 411 -16.670 0.813 16.825 1.00 0.00 H new ATOM 0 HE3 LYS A 411 -17.167 0.606 15.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 -15.391 -0.889 15.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 -14.783 0.319 14.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 -14.411 0.348 16.238 1.00 0.00 H new ATOM 777 N ARG A 412 -11.334 3.599 18.544 1.00 0.00 N ATOM 778 CA ARG A 412 -10.676 3.338 19.813 1.00 0.00 C ATOM 779 C ARG A 412 -10.040 4.620 20.354 1.00 0.00 C ATOM 780 O ARG A 412 -10.228 4.966 21.520 1.00 0.00 O ATOM 781 CB ARG A 412 -9.595 2.266 19.662 1.00 0.00 C ATOM 782 CG ARG A 412 -10.121 1.065 18.873 1.00 0.00 C ATOM 783 CD ARG A 412 -11.473 0.601 19.417 1.00 0.00 C ATOM 784 NE ARG A 412 -11.568 -0.874 19.346 1.00 0.00 N ATOM 785 CZ ARG A 412 -11.969 -1.550 18.261 1.00 0.00 C ATOM 786 NH1 ARG A 412 -12.315 -0.887 17.149 1.00 0.00 N ATOM 787 NH2 ARG A 412 -12.024 -2.889 18.287 1.00 0.00 N ATOM 0 H ARG A 412 -10.760 3.418 17.721 1.00 0.00 H new ATOM 0 HA ARG A 412 -11.432 2.980 20.512 1.00 0.00 H new ATOM 0 HB2 ARG A 412 -8.728 2.688 19.154 1.00 0.00 H new ATOM 0 HB3 ARG A 412 -9.260 1.940 20.647 1.00 0.00 H new ATOM 0 HG2 ARG A 412 -10.221 1.332 17.821 1.00 0.00 H new ATOM 0 HG3 ARG A 412 -9.403 0.247 18.928 1.00 0.00 H new ATOM 0 HD2 ARG A 412 -11.592 0.932 20.449 1.00 0.00 H new ATOM 0 HD3 ARG A 412 -12.281 1.054 18.842 1.00 0.00 H new ATOM 0 HE ARG A 412 -11.312 -1.410 20.175 1.00 0.00 H new ATOM 0 HH11 ARG A 412 -12.273 0.132 17.129 1.00 0.00 H new ATOM 0 HH12 ARG A 412 -12.620 -1.401 16.323 1.00 0.00 H new ATOM 0 HH21 ARG A 412 -11.760 -3.394 19.133 1.00 0.00 H new ATOM 0 HH22 ARG A 412 -12.329 -3.403 17.461 1.00 0.00 H new ATOM 801 N LEU A 413 -9.301 5.290 19.482 1.00 0.00 N ATOM 802 CA LEU A 413 -8.636 6.526 19.859 1.00 0.00 C ATOM 803 C LEU A 413 -9.600 7.391 20.674 1.00 0.00 C ATOM 804 O LEU A 413 -9.174 8.150 21.543 1.00 0.00 O ATOM 805 CB LEU A 413 -8.075 7.231 18.622 1.00 0.00 C ATOM 806 CG LEU A 413 -7.437 8.601 18.862 1.00 0.00 C ATOM 807 CD1 LEU A 413 -8.483 9.622 19.313 1.00 0.00 C ATOM 808 CD2 LEU A 413 -6.273 8.498 19.850 1.00 0.00 C ATOM 0 H LEU A 413 -9.148 5.001 18.516 1.00 0.00 H new ATOM 0 HA LEU A 413 -7.777 6.317 20.497 1.00 0.00 H new ATOM 0 HB2 LEU A 413 -7.330 6.580 18.164 1.00 0.00 H new ATOM 0 HB3 LEU A 413 -8.882 7.350 17.899 1.00 0.00 H new ATOM 0 HG LEU A 413 -7.027 8.957 17.917 1.00 0.00 H new ATOM 0 HD11 LEU A 413 -8.003 10.587 19.477 1.00 0.00 H new ATOM 0 HD12 LEU A 413 -9.248 9.723 18.543 1.00 0.00 H new ATOM 0 HD13 LEU A 413 -8.944 9.284 20.241 1.00 0.00 H new ATOM 0 HD21 LEU A 413 -5.837 9.485 20.003 1.00 0.00 H new ATOM 0 HD22 LEU A 413 -6.637 8.110 20.802 1.00 0.00 H new ATOM 0 HD23 LEU A 413 -5.515 7.825 19.450 1.00 0.00 H new ATOM 820 N LEU A 414 -10.880 7.246 20.365 1.00 0.00 N ATOM 821 CA LEU A 414 -11.908 8.004 21.059 1.00 0.00 C ATOM 822 C LEU A 414 -12.608 7.097 22.072 1.00 0.00 C ATOM 823 O LEU A 414 -12.773 7.469 23.233 1.00 0.00 O ATOM 824 CB LEU A 414 -12.861 8.656 20.056 1.00 0.00 C ATOM 825 CG LEU A 414 -12.244 9.078 18.721 1.00 0.00 C ATOM 826 CD1 LEU A 414 -13.296 9.089 17.610 1.00 0.00 C ATOM 827 CD2 LEU A 414 -11.532 10.426 18.847 1.00 0.00 C ATOM 0 H LEU A 414 -11.229 6.615 19.644 1.00 0.00 H new ATOM 0 HA LEU A 414 -11.462 8.825 21.621 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -13.675 7.960 19.853 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -13.303 9.536 20.524 1.00 0.00 H new ATOM 0 HG LEU A 414 -11.491 8.340 18.445 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -12.831 9.392 16.672 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -13.719 8.090 17.499 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -14.088 9.792 17.866 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -11.103 10.702 17.884 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -12.247 11.188 19.157 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -10.738 10.350 19.590 1.00 0.00 H new ATOM 839 N SER A 415 -13.001 5.924 21.597 1.00 0.00 N ATOM 840 CA SER A 415 -13.679 4.961 22.447 1.00 0.00 C ATOM 841 C SER A 415 -12.936 3.624 22.420 1.00 0.00 C ATOM 842 O SER A 415 -13.298 2.724 21.663 1.00 0.00 O ATOM 843 CB SER A 415 -15.133 4.769 22.011 1.00 0.00 C ATOM 844 OG SER A 415 -16.000 5.731 22.605 1.00 0.00 O ATOM 0 H SER A 415 -12.862 5.619 20.634 1.00 0.00 H new ATOM 0 HA SER A 415 -13.682 5.347 23.466 1.00 0.00 H new ATOM 0 HB2 SER A 415 -15.199 4.843 20.926 1.00 0.00 H new ATOM 0 HB3 SER A 415 -15.464 3.766 22.283 1.00 0.00 H new ATOM 0 HG SER A 415 -16.918 5.576 22.301 1.00 0.00 H new ATOM 850 N GLU A 416 -11.911 3.536 23.254 1.00 0.00 N ATOM 851 CA GLU A 416 -11.114 2.324 23.335 1.00 0.00 C ATOM 852 C GLU A 416 -11.911 1.209 24.014 1.00 0.00 C ATOM 853 O GLU A 416 -11.622 0.029 23.822 1.00 0.00 O ATOM 854 CB GLU A 416 -9.797 2.582 24.071 1.00 0.00 C ATOM 855 CG GLU A 416 -8.709 1.614 23.602 1.00 0.00 C ATOM 856 CD GLU A 416 -9.035 0.179 24.019 1.00 0.00 C ATOM 857 OE1 GLU A 416 -9.322 -0.074 25.199 1.00 0.00 O ATOM 858 OE2 GLU A 416 -8.983 -0.691 23.068 1.00 0.00 O ATOM 0 H GLU A 416 -11.614 4.285 23.880 1.00 0.00 H new ATOM 0 HA GLU A 416 -10.870 2.005 22.322 1.00 0.00 H new ATOM 0 HB2 GLU A 416 -9.475 3.609 23.898 1.00 0.00 H new ATOM 0 HB3 GLU A 416 -9.949 2.472 25.145 1.00 0.00 H new ATOM 0 HG2 GLU A 416 -8.612 1.668 22.518 1.00 0.00 H new ATOM 0 HG3 GLU A 416 -7.748 1.910 24.023 1.00 0.00 H new ATOM 866 N LYS A 417 -12.900 1.622 24.794 1.00 0.00 N ATOM 867 CA LYS A 417 -13.741 0.672 25.502 1.00 0.00 C ATOM 868 C LYS A 417 -14.507 -0.180 24.487 1.00 0.00 C ATOM 869 O LYS A 417 -14.931 0.319 23.447 1.00 0.00 O ATOM 870 CB LYS A 417 -14.644 1.398 26.501 1.00 0.00 C ATOM 871 CG LYS A 417 -13.875 1.759 27.773 1.00 0.00 C ATOM 872 CD LYS A 417 -14.790 1.717 28.999 1.00 0.00 C ATOM 873 CE LYS A 417 -14.264 0.731 30.043 1.00 0.00 C ATOM 874 NZ LYS A 417 -14.410 1.290 31.405 1.00 0.00 N ATOM 0 H LYS A 417 -13.137 2.602 24.951 1.00 0.00 H new ATOM 0 HA LYS A 417 -13.131 -0.009 26.095 1.00 0.00 H new ATOM 0 HB2 LYS A 417 -15.044 2.303 26.044 1.00 0.00 H new ATOM 0 HB3 LYS A 417 -15.495 0.766 26.753 1.00 0.00 H new ATOM 0 HG2 LYS A 417 -13.046 1.065 27.910 1.00 0.00 H new ATOM 0 HG3 LYS A 417 -13.444 2.755 27.671 1.00 0.00 H new ATOM 0 HD2 LYS A 417 -14.862 2.712 29.438 1.00 0.00 H new ATOM 0 HD3 LYS A 417 -15.797 1.429 28.696 1.00 0.00 H new ATOM 0 HE2 LYS A 417 -14.809 -0.210 29.970 1.00 0.00 H new ATOM 0 HE3 LYS A 417 -13.215 0.508 29.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 417 -14.048 0.607 32.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 417 -13.870 2.176 31.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 417 -15.414 1.480 31.596 1.00 0.00 H new ATOM 888 N LYS A 418 -14.660 -1.452 24.827 1.00 0.00 N ATOM 889 CA LYS A 418 -15.366 -2.378 23.958 1.00 0.00 C ATOM 890 C LYS A 418 -16.859 -2.039 23.966 1.00 0.00 C ATOM 891 O LYS A 418 -17.363 -1.462 24.927 1.00 0.00 O ATOM 892 CB LYS A 418 -15.062 -3.823 24.356 1.00 0.00 C ATOM 893 CG LYS A 418 -14.080 -4.467 23.375 1.00 0.00 C ATOM 894 CD LYS A 418 -14.784 -5.495 22.488 1.00 0.00 C ATOM 895 CE LYS A 418 -13.850 -6.002 21.388 1.00 0.00 C ATOM 896 NZ LYS A 418 -13.629 -7.459 21.526 1.00 0.00 N ATOM 0 H LYS A 418 -14.307 -1.862 25.692 1.00 0.00 H new ATOM 0 HA LYS A 418 -15.020 -2.275 22.929 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -14.644 -3.847 25.362 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -15.987 -4.399 24.381 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -13.624 -3.697 22.753 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -13.273 -4.950 23.927 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -15.124 -6.333 23.096 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -15.670 -5.047 22.039 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -14.279 -5.784 20.410 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -12.896 -5.477 21.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -12.993 -7.787 20.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -13.200 -7.659 22.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -14.539 -7.957 21.452 1.00 0.00 H new ATOM 910 N THR A 419 -17.523 -2.413 22.882 1.00 0.00 N ATOM 911 CA THR A 419 -18.947 -2.156 22.751 1.00 0.00 C ATOM 912 C THR A 419 -19.298 -0.788 23.338 1.00 0.00 C ATOM 913 O THR A 419 -19.821 -0.699 24.447 1.00 0.00 O ATOM 914 CB THR A 419 -19.699 -3.312 23.414 1.00 0.00 C ATOM 915 OG1 THR A 419 -18.912 -3.626 24.560 1.00 0.00 O ATOM 916 CG2 THR A 419 -19.662 -4.592 22.576 1.00 0.00 C ATOM 0 H THR A 419 -17.101 -2.892 22.086 1.00 0.00 H new ATOM 0 HA THR A 419 -19.246 -2.112 21.704 1.00 0.00 H new ATOM 0 HB THR A 419 -20.735 -3.020 23.586 1.00 0.00 H new ATOM 0 HG1 THR A 419 -18.764 -2.814 25.088 1.00 0.00 H new ATOM 0 HG21 THR A 419 -20.210 -5.381 23.092 1.00 0.00 H new ATOM 0 HG22 THR A 419 -20.122 -4.405 21.606 1.00 0.00 H new ATOM 0 HG23 THR A 419 -18.627 -4.903 22.433 1.00 0.00 H new ATOM 924 N SER A 420 -18.996 0.246 22.566 1.00 0.00 N ATOM 925 CA SER A 420 -19.273 1.607 22.995 1.00 0.00 C ATOM 926 C SER A 420 -20.568 2.105 22.351 1.00 0.00 C ATOM 927 O SER A 420 -21.554 2.354 23.044 1.00 0.00 O ATOM 928 CB SER A 420 -18.113 2.541 22.647 1.00 0.00 C ATOM 929 OG SER A 420 -17.364 2.917 23.800 1.00 0.00 O ATOM 0 H SER A 420 -18.562 0.169 21.646 1.00 0.00 H new ATOM 0 HA SER A 420 -19.391 1.607 24.079 1.00 0.00 H new ATOM 0 HB2 SER A 420 -17.454 2.049 21.931 1.00 0.00 H new ATOM 0 HB3 SER A 420 -18.502 3.435 22.160 1.00 0.00 H new ATOM 0 HG SER A 420 -17.117 3.863 23.736 1.00 0.00 H new ATOM 935 N GLN A 421 -20.524 2.236 21.034 1.00 0.00 N ATOM 936 CA GLN A 421 -21.681 2.700 20.289 1.00 0.00 C ATOM 937 C GLN A 421 -22.538 1.513 19.844 1.00 0.00 C ATOM 938 O GLN A 421 -23.689 1.384 20.259 1.00 0.00 O ATOM 939 CB GLN A 421 -21.257 3.549 19.089 1.00 0.00 C ATOM 940 CG GLN A 421 -22.474 4.008 18.284 1.00 0.00 C ATOM 941 CD GLN A 421 -22.085 4.339 16.841 1.00 0.00 C ATOM 942 OE1 GLN A 421 -21.722 3.478 16.056 1.00 0.00 O ATOM 943 NE2 GLN A 421 -22.180 5.630 16.538 1.00 0.00 N ATOM 0 H GLN A 421 -19.704 2.029 20.463 1.00 0.00 H new ATOM 0 HA GLN A 421 -22.281 3.331 20.945 1.00 0.00 H new ATOM 0 HB2 GLN A 421 -20.696 4.418 19.434 1.00 0.00 H new ATOM 0 HB3 GLN A 421 -20.590 2.972 18.449 1.00 0.00 H new ATOM 0 HG2 GLN A 421 -23.234 3.226 18.289 1.00 0.00 H new ATOM 0 HG3 GLN A 421 -22.916 4.886 18.755 1.00 0.00 H new ATOM 0 HE21 GLN A 421 -22.491 6.298 17.243 1.00 0.00 H new ATOM 0 HE22 GLN A 421 -21.942 5.953 15.600 1.00 0.00 H new ATOM 952 N SER A 422 -21.943 0.675 19.007 1.00 0.00 N ATOM 953 CA SER A 422 -22.637 -0.497 18.503 1.00 0.00 C ATOM 954 C SER A 422 -21.744 -1.732 18.636 1.00 0.00 C ATOM 955 O SER A 422 -20.520 -1.617 18.664 1.00 0.00 O ATOM 956 CB SER A 422 -23.059 -0.302 17.045 1.00 0.00 C ATOM 957 OG SER A 422 -24.463 -0.471 16.868 1.00 0.00 O ATOM 0 H SER A 422 -20.988 0.785 18.666 1.00 0.00 H new ATOM 0 HA SER A 422 -23.538 -0.643 19.098 1.00 0.00 H new ATOM 0 HB2 SER A 422 -22.769 0.695 16.714 1.00 0.00 H new ATOM 0 HB3 SER A 422 -22.526 -1.014 16.415 1.00 0.00 H new ATOM 0 HG SER A 422 -24.692 -0.337 15.925 1.00 0.00 H new ATOM 963 N PRO A 423 -22.408 -2.916 18.718 1.00 0.00 N ATOM 964 CA PRO A 423 -21.688 -4.171 18.848 1.00 0.00 C ATOM 965 C PRO A 423 -21.053 -4.579 17.517 1.00 0.00 C ATOM 966 O PRO A 423 -19.830 -4.646 17.403 1.00 0.00 O ATOM 967 CB PRO A 423 -22.722 -5.169 19.343 1.00 0.00 C ATOM 968 CG PRO A 423 -24.077 -4.555 19.029 1.00 0.00 C ATOM 969 CD PRO A 423 -23.857 -3.090 18.688 1.00 0.00 C ATOM 0 HA PRO A 423 -20.852 -4.106 19.544 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -22.605 -6.132 18.846 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -22.612 -5.347 20.413 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -24.547 -5.075 18.194 1.00 0.00 H new ATOM 0 HG3 PRO A 423 -24.747 -4.652 19.883 1.00 0.00 H new ATOM 0 HD2 PRO A 423 -24.265 -2.846 17.707 1.00 0.00 H new ATOM 0 HD3 PRO A 423 -24.349 -2.437 19.409 1.00 0.00 H new ATOM 977 N HIS A 424 -21.912 -4.841 16.543 1.00 0.00 N ATOM 978 CA HIS A 424 -21.451 -5.241 15.225 1.00 0.00 C ATOM 979 C HIS A 424 -22.621 -5.210 14.240 1.00 0.00 C ATOM 980 O HIS A 424 -23.759 -4.953 14.630 1.00 0.00 O ATOM 981 CB HIS A 424 -20.759 -6.604 15.281 1.00 0.00 C ATOM 982 CG HIS A 424 -19.846 -6.879 14.111 1.00 0.00 C ATOM 983 ND1 HIS A 424 -18.733 -6.104 13.830 1.00 0.00 N ATOM 984 CD2 HIS A 424 -19.891 -7.849 13.154 1.00 0.00 C ATOM 985 CE1 HIS A 424 -18.144 -6.595 12.750 1.00 0.00 C ATOM 986 NE2 HIS A 424 -18.863 -7.676 12.332 1.00 0.00 N ATOM 0 H HIS A 424 -22.926 -4.784 16.641 1.00 0.00 H new ATOM 0 HA HIS A 424 -20.703 -4.533 14.868 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -20.181 -6.668 16.203 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -21.519 -7.384 15.326 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -20.637 -8.626 13.078 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -17.251 -6.207 12.282 1.00 0.00 H new ATOM 0 HE2 HIS A 424 -18.647 -8.256 11.521 1.00 0.00 H new ATOM 995 N ARG A 425 -22.302 -5.477 12.982 1.00 0.00 N ATOM 996 CA ARG A 425 -23.313 -5.483 11.938 1.00 0.00 C ATOM 997 C ARG A 425 -23.659 -6.920 11.544 1.00 0.00 C ATOM 998 O ARG A 425 -24.810 -7.339 11.657 1.00 0.00 O ATOM 999 CB ARG A 425 -22.832 -4.723 10.701 1.00 0.00 C ATOM 1000 CG ARG A 425 -23.991 -3.992 10.021 1.00 0.00 C ATOM 1001 CD ARG A 425 -23.475 -2.913 9.067 1.00 0.00 C ATOM 1002 NE ARG A 425 -24.360 -2.818 7.885 1.00 0.00 N ATOM 1003 CZ ARG A 425 -23.991 -2.286 6.711 1.00 0.00 C ATOM 1004 NH1 ARG A 425 -22.752 -1.800 6.556 1.00 0.00 N ATOM 1005 NH2 ARG A 425 -24.861 -2.242 5.693 1.00 0.00 N ATOM 0 H ARG A 425 -21.357 -5.691 12.662 1.00 0.00 H new ATOM 0 HA ARG A 425 -24.200 -4.987 12.332 1.00 0.00 H new ATOM 0 HB2 ARG A 425 -22.063 -4.006 10.987 1.00 0.00 H new ATOM 0 HB3 ARG A 425 -22.374 -5.419 9.998 1.00 0.00 H new ATOM 0 HG2 ARG A 425 -24.603 -4.706 9.471 1.00 0.00 H new ATOM 0 HG3 ARG A 425 -24.632 -3.538 10.776 1.00 0.00 H new ATOM 0 HD2 ARG A 425 -23.434 -1.952 9.580 1.00 0.00 H new ATOM 0 HD3 ARG A 425 -22.459 -3.150 8.753 1.00 0.00 H new ATOM 0 HE ARG A 425 -25.310 -3.180 7.969 1.00 0.00 H new ATOM 0 HH11 ARG A 425 -22.090 -1.835 7.331 1.00 0.00 H new ATOM 0 HH12 ARG A 425 -22.471 -1.395 5.663 1.00 0.00 H new ATOM 0 HH21 ARG A 425 -25.804 -2.613 5.811 1.00 0.00 H new ATOM 0 HH22 ARG A 425 -24.581 -1.837 4.800 1.00 0.00 H new ATOM 1019 N PHE A 426 -22.641 -7.636 11.088 1.00 0.00 N ATOM 1020 CA PHE A 426 -22.824 -9.018 10.676 1.00 0.00 C ATOM 1021 C PHE A 426 -23.955 -9.140 9.653 1.00 0.00 C ATOM 1022 O PHE A 426 -24.657 -8.168 9.379 1.00 0.00 O ATOM 1023 CB PHE A 426 -23.196 -9.813 11.929 1.00 0.00 C ATOM 1024 CG PHE A 426 -22.687 -11.256 11.924 1.00 0.00 C ATOM 1025 CD1 PHE A 426 -21.351 -11.506 11.956 1.00 0.00 C ATOM 1026 CD2 PHE A 426 -23.571 -12.289 11.888 1.00 0.00 C ATOM 1027 CE1 PHE A 426 -20.878 -12.845 11.952 1.00 0.00 C ATOM 1028 CE2 PHE A 426 -23.099 -13.628 11.884 1.00 0.00 C ATOM 1029 CZ PHE A 426 -21.762 -13.877 11.916 1.00 0.00 C ATOM 0 H PHE A 426 -21.688 -7.285 10.995 1.00 0.00 H new ATOM 0 HA PHE A 426 -21.911 -9.393 10.214 1.00 0.00 H new ATOM 0 HB2 PHE A 426 -22.796 -9.301 12.804 1.00 0.00 H new ATOM 0 HB3 PHE A 426 -24.281 -9.822 12.033 1.00 0.00 H new ATOM 0 HD1 PHE A 426 -20.649 -10.686 11.984 1.00 0.00 H new ATOM 0 HD2 PHE A 426 -24.632 -12.091 11.862 1.00 0.00 H new ATOM 0 HE1 PHE A 426 -19.817 -13.043 11.978 1.00 0.00 H new ATOM 0 HE2 PHE A 426 -23.801 -14.448 11.856 1.00 0.00 H new ATOM 0 HZ PHE A 426 -21.403 -14.895 11.913 1.00 0.00 H new ATOM 1039 N GLN A 427 -24.097 -10.343 9.117 1.00 0.00 N ATOM 1040 CA GLN A 427 -25.132 -10.605 8.131 1.00 0.00 C ATOM 1041 C GLN A 427 -26.042 -11.740 8.605 1.00 0.00 C ATOM 1042 O GLN A 427 -25.860 -12.271 9.699 1.00 0.00 O ATOM 1043 CB GLN A 427 -24.519 -10.927 6.766 1.00 0.00 C ATOM 1044 CG GLN A 427 -23.742 -9.729 6.217 1.00 0.00 C ATOM 1045 CD GLN A 427 -23.465 -9.894 4.721 1.00 0.00 C ATOM 1046 OE1 GLN A 427 -23.194 -10.977 4.230 1.00 0.00 O ATOM 1047 NE2 GLN A 427 -23.548 -8.762 4.028 1.00 0.00 N ATOM 0 H GLN A 427 -23.513 -11.147 9.347 1.00 0.00 H new ATOM 0 HA GLN A 427 -25.736 -9.705 8.019 1.00 0.00 H new ATOM 0 HB2 GLN A 427 -23.854 -11.786 6.856 1.00 0.00 H new ATOM 0 HB3 GLN A 427 -25.307 -11.205 6.066 1.00 0.00 H new ATOM 0 HG2 GLN A 427 -24.310 -8.814 6.387 1.00 0.00 H new ATOM 0 HG3 GLN A 427 -22.800 -9.624 6.756 1.00 0.00 H new ATOM 0 HE21 GLN A 427 -23.780 -7.889 4.503 1.00 0.00 H new ATOM 0 HE22 GLN A 427 -23.380 -8.766 3.022 1.00 0.00 H new ATOM 1056 N LYS A 428 -27.002 -12.079 7.757 1.00 0.00 N ATOM 1057 CA LYS A 428 -27.942 -13.141 8.076 1.00 0.00 C ATOM 1058 C LYS A 428 -27.607 -14.379 7.242 1.00 0.00 C ATOM 1059 O LYS A 428 -27.154 -14.262 6.104 1.00 0.00 O ATOM 1060 CB LYS A 428 -29.381 -12.653 7.902 1.00 0.00 C ATOM 1061 CG LYS A 428 -29.705 -12.417 6.425 1.00 0.00 C ATOM 1062 CD LYS A 428 -29.331 -10.995 6.003 1.00 0.00 C ATOM 1063 CE LYS A 428 -28.472 -11.007 4.737 1.00 0.00 C ATOM 1064 NZ LYS A 428 -28.627 -9.737 3.993 1.00 0.00 N ATOM 0 H LYS A 428 -27.149 -11.637 6.849 1.00 0.00 H new ATOM 0 HA LYS A 428 -27.852 -13.428 9.124 1.00 0.00 H new ATOM 0 HB2 LYS A 428 -30.071 -13.388 8.316 1.00 0.00 H new ATOM 0 HB3 LYS A 428 -29.526 -11.729 8.462 1.00 0.00 H new ATOM 0 HG2 LYS A 428 -29.164 -13.137 5.811 1.00 0.00 H new ATOM 0 HG3 LYS A 428 -30.768 -12.584 6.251 1.00 0.00 H new ATOM 0 HD2 LYS A 428 -30.236 -10.414 5.827 1.00 0.00 H new ATOM 0 HD3 LYS A 428 -28.788 -10.503 6.810 1.00 0.00 H new ATOM 0 HE2 LYS A 428 -27.425 -11.154 5.002 1.00 0.00 H new ATOM 0 HE3 LYS A 428 -28.761 -11.845 4.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 -28.037 -9.762 3.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 -29.624 -9.612 3.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 -28.329 -8.943 4.595 1.00 0.00 H new ATOM 1078 N THR A 429 -27.841 -15.538 7.841 1.00 0.00 N ATOM 1079 CA THR A 429 -27.570 -16.796 7.167 1.00 0.00 C ATOM 1080 C THR A 429 -28.636 -17.833 7.526 1.00 0.00 C ATOM 1081 O THR A 429 -28.998 -17.979 8.693 1.00 0.00 O ATOM 1082 CB THR A 429 -26.150 -17.232 7.534 1.00 0.00 C ATOM 1083 OG1 THR A 429 -25.315 -16.290 6.867 1.00 0.00 O ATOM 1084 CG2 THR A 429 -25.770 -18.576 6.908 1.00 0.00 C ATOM 0 H THR A 429 -28.215 -15.632 8.785 1.00 0.00 H new ATOM 0 HA THR A 429 -27.622 -16.684 6.084 1.00 0.00 H new ATOM 0 HB THR A 429 -26.059 -17.298 8.618 1.00 0.00 H new ATOM 0 HG1 THR A 429 -24.375 -16.497 7.052 1.00 0.00 H new ATOM 0 HG21 THR A 429 -24.753 -18.839 7.200 1.00 0.00 H new ATOM 0 HG22 THR A 429 -26.458 -19.347 7.255 1.00 0.00 H new ATOM 0 HG23 THR A 429 -25.828 -18.501 5.822 1.00 0.00 H new ATOM 1092 N HIS A 430 -29.109 -18.528 6.502 1.00 0.00 N ATOM 1093 CA HIS A 430 -30.126 -19.548 6.694 1.00 0.00 C ATOM 1094 C HIS A 430 -30.397 -20.259 5.367 1.00 0.00 C ATOM 1095 O HIS A 430 -29.889 -19.850 4.324 1.00 0.00 O ATOM 1096 CB HIS A 430 -31.389 -18.945 7.313 1.00 0.00 C ATOM 1097 CG HIS A 430 -32.324 -18.315 6.308 1.00 0.00 C ATOM 1098 ND1 HIS A 430 -31.876 -17.575 5.228 1.00 0.00 N ATOM 1099 CD2 HIS A 430 -33.686 -18.323 6.231 1.00 0.00 C ATOM 1100 CE1 HIS A 430 -32.929 -17.161 4.539 1.00 0.00 C ATOM 1101 NE2 HIS A 430 -34.050 -17.625 5.163 1.00 0.00 N ATOM 0 H HIS A 430 -28.806 -18.405 5.536 1.00 0.00 H new ATOM 0 HA HIS A 430 -29.767 -20.297 7.400 1.00 0.00 H new ATOM 0 HB2 HIS A 430 -31.925 -19.725 7.853 1.00 0.00 H new ATOM 0 HB3 HIS A 430 -31.099 -18.192 8.046 1.00 0.00 H new ATOM 0 HD2 HIS A 430 -34.355 -18.814 6.922 1.00 0.00 H new ATOM 0 HE1 HIS A 430 -32.904 -16.561 3.641 1.00 0.00 H new ATOM 0 HE2 HIS A 430 -35.010 -17.462 4.859 1.00 0.00 H new ATOM 1110 N SER A 431 -31.197 -21.312 5.450 1.00 0.00 N ATOM 1111 CA SER A 431 -31.542 -22.084 4.268 1.00 0.00 C ATOM 1112 C SER A 431 -32.705 -23.028 4.581 1.00 0.00 C ATOM 1113 O SER A 431 -32.592 -23.892 5.449 1.00 0.00 O ATOM 1114 CB SER A 431 -30.338 -22.878 3.758 1.00 0.00 C ATOM 1115 OG SER A 431 -29.409 -23.167 4.799 1.00 0.00 O ATOM 0 H SER A 431 -31.616 -21.649 6.317 1.00 0.00 H new ATOM 0 HA SER A 431 -31.845 -21.391 3.483 1.00 0.00 H new ATOM 0 HB2 SER A 431 -30.682 -23.810 3.310 1.00 0.00 H new ATOM 0 HB3 SER A 431 -29.837 -22.312 2.972 1.00 0.00 H new ATOM 0 HG SER A 431 -28.656 -23.676 4.433 1.00 0.00 H new ATOM 1121 N PRO A 432 -33.826 -22.824 3.838 1.00 0.00 N ATOM 1122 CA PRO A 432 -35.009 -23.646 4.028 1.00 0.00 C ATOM 1123 C PRO A 432 -34.815 -25.036 3.417 1.00 0.00 C ATOM 1124 O PRO A 432 -34.963 -26.046 4.103 1.00 0.00 O ATOM 1125 CB PRO A 432 -36.140 -22.865 3.378 1.00 0.00 C ATOM 1126 CG PRO A 432 -35.474 -21.864 2.448 1.00 0.00 C ATOM 1127 CD PRO A 432 -33.997 -21.810 2.802 1.00 0.00 C ATOM 0 HA PRO A 432 -35.225 -23.834 5.080 1.00 0.00 H new ATOM 0 HB2 PRO A 432 -36.806 -23.528 2.826 1.00 0.00 H new ATOM 0 HB3 PRO A 432 -36.746 -22.358 4.129 1.00 0.00 H new ATOM 0 HG2 PRO A 432 -35.607 -22.162 1.408 1.00 0.00 H new ATOM 0 HG3 PRO A 432 -35.929 -20.880 2.558 1.00 0.00 H new ATOM 0 HD2 PRO A 432 -33.374 -22.023 1.933 1.00 0.00 H new ATOM 0 HD3 PRO A 432 -33.713 -20.822 3.164 1.00 0.00 H new ATOM 1135 N ILE A 433 -34.486 -25.042 2.133 1.00 0.00 N ATOM 1136 CA ILE A 433 -34.270 -26.291 1.422 1.00 0.00 C ATOM 1137 C ILE A 433 -32.779 -26.636 1.449 1.00 0.00 C ATOM 1138 O ILE A 433 -32.363 -27.551 2.158 1.00 0.00 O ATOM 1139 CB ILE A 433 -34.858 -26.213 0.012 1.00 0.00 C ATOM 1140 CG1 ILE A 433 -36.358 -25.916 0.060 1.00 0.00 C ATOM 1141 CG2 ILE A 433 -34.551 -27.485 -0.781 1.00 0.00 C ATOM 1142 CD1 ILE A 433 -36.773 -25.003 -1.096 1.00 0.00 C ATOM 0 H ILE A 433 -34.364 -24.202 1.567 1.00 0.00 H new ATOM 0 HA ILE A 433 -34.796 -27.108 1.917 1.00 0.00 H new ATOM 0 HB ILE A 433 -34.382 -25.384 -0.512 1.00 0.00 H new ATOM 0 HG12 ILE A 433 -36.919 -26.849 0.011 1.00 0.00 H new ATOM 0 HG13 ILE A 433 -36.609 -25.443 1.010 1.00 0.00 H new ATOM 0 HG21 ILE A 433 -34.980 -27.404 -1.780 1.00 0.00 H new ATOM 0 HG22 ILE A 433 -33.471 -27.613 -0.859 1.00 0.00 H new ATOM 0 HG23 ILE A 433 -34.982 -28.346 -0.270 1.00 0.00 H new ATOM 0 HD11 ILE A 433 -37.844 -24.807 -1.039 1.00 0.00 H new ATOM 0 HD12 ILE A 433 -36.228 -24.061 -1.030 1.00 0.00 H new ATOM 0 HD13 ILE A 433 -36.543 -25.489 -2.044 1.00 0.00 H new TER 1154 ILE A 433