USER MOD reduce.3.24.130724 H: found=0, std=0, add=672, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 667 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 417 SER OG : rot -87:sc= 0.104 USER MOD Set 1.2: A 418 THR OG1 : rot 180:sc= 0 USER MOD Single : A 416 SER OG : rot 180:sc= 0.0368 USER MOD Single : A 425 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00448) USER MOD Single : A 426 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.157) USER MOD Single : A 432 ASN : amide:sc= -0.491 X(o=-0.49,f=0) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 SER OG : rot 72:sc= 0.13 USER MOD Single : A 440 SER OG : rot 180:sc= 0 USER MOD Single : A 441 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 THR OG1 : rot 180:sc= 0.114 USER MOD Single : A 444 SER OG : rot 71:sc= 0.474 USER MOD Single : A 447 SER OG : rot -19:sc= 0.114! USER MOD Single : A 449 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 452 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 457 THR OG1 : rot 81:sc= 0.258 USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 461 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 SER OG : rot 180:sc= 0 USER MOD Single : A 466 SER OG : rot -49:sc= 0.433 USER MOD Single : A 470 SER OG : rot 180:sc= 0 USER MOD Single : A 471 ASN : amide:sc= -0.195 K(o=-0.2,f=-1.5!) USER MOD Single : A 472 GLN : amide:sc= -0.043 X(o=-0.043,f=0) USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= -1.3 K(o=-1.3,f=-0.012) USER MOD Single : A 479 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 480 SER OG : rot 180:sc= 0.00142 USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 492 HIS : no HD1:sc= -0.446 X(o=-0.45,f=-0.89) USER MOD Single : A 493 HIS : no HD1:sc= -0.122 X(o=-0.12,f=-0.3) USER MOD Single : A 494 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 495 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 496 HIS : no HD1:sc= -0.959 K(o=-0.96,f=-0.21) USER MOD Single : A 497 HIS : no HD1:sc= -0.21 X(o=-0.21,f=-0.045) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 414 -17.511 0.015 -9.208 1.00 63.00 N ATOM 2 CA GLU A 414 -17.193 0.239 -7.803 1.00 50.13 C ATOM 3 C GLU A 414 -16.463 1.565 -7.615 1.00 65.22 C ATOM 4 O GLU A 414 -15.329 1.731 -8.066 1.00 52.51 O ATOM 5 CB GLU A 414 -16.338 -0.908 -7.262 1.00 62.12 C ATOM 6 CG GLU A 414 -17.126 -2.177 -6.986 1.00 12.03 C ATOM 7 CD GLU A 414 -16.999 -3.198 -8.100 1.00 24.42 C ATOM 8 OE1 GLU A 414 -15.856 -3.465 -8.531 1.00 54.12 O ATOM 9 OE2 GLU A 414 -18.038 -3.729 -8.541 1.00 40.30 O ATOM 0 HA GLU A 414 -18.130 0.278 -7.247 1.00 50.13 H new ATOM 0 HB2 GLU A 414 -15.547 -1.130 -7.979 1.00 62.12 H new ATOM 0 HB3 GLU A 414 -15.852 -0.585 -6.341 1.00 62.12 H new ATOM 0 HG2 GLU A 414 -16.779 -2.619 -6.052 1.00 12.03 H new ATOM 0 HG3 GLU A 414 -18.177 -1.924 -6.848 1.00 12.03 H new ATOM 16 N ALA A 415 -17.120 2.507 -6.947 1.00 51.22 N ATOM 17 CA ALA A 415 -16.534 3.818 -6.698 1.00 15.33 C ATOM 18 C ALA A 415 -15.518 3.758 -5.562 1.00 64.03 C ATOM 19 O ALA A 415 -14.839 4.743 -5.271 1.00 10.41 O ATOM 20 CB ALA A 415 -17.624 4.831 -6.379 1.00 4.11 C ATOM 0 H ALA A 415 -18.059 2.386 -6.568 1.00 51.22 H new ATOM 0 HA ALA A 415 -16.012 4.133 -7.602 1.00 15.33 H new ATOM 0 HB1 ALA A 415 -17.172 5.806 -6.195 1.00 4.11 H new ATOM 0 HB2 ALA A 415 -18.312 4.903 -7.222 1.00 4.11 H new ATOM 0 HB3 ALA A 415 -18.170 4.511 -5.491 1.00 4.11 H new ATOM 26 N SER A 416 -15.417 2.596 -4.926 1.00 31.03 N ATOM 27 CA SER A 416 -14.484 2.409 -3.819 1.00 54.24 C ATOM 28 C SER A 416 -13.092 2.058 -4.335 1.00 54.20 C ATOM 29 O SER A 416 -12.095 2.249 -3.640 1.00 43.21 O ATOM 30 CB SER A 416 -14.987 1.308 -2.883 1.00 71.40 C ATOM 31 OG SER A 416 -16.312 0.927 -3.208 1.00 33.01 O ATOM 0 H SER A 416 -15.969 1.770 -5.157 1.00 31.03 H new ATOM 0 HA SER A 416 -14.421 3.346 -3.266 1.00 54.24 H new ATOM 0 HB2 SER A 416 -14.329 0.441 -2.950 1.00 71.40 H new ATOM 0 HB3 SER A 416 -14.949 1.658 -1.851 1.00 71.40 H new ATOM 0 HG SER A 416 -16.609 0.221 -2.596 1.00 33.01 H new ATOM 37 N SER A 417 -13.034 1.543 -5.559 1.00 1.11 N ATOM 38 CA SER A 417 -11.766 1.161 -6.168 1.00 62.14 C ATOM 39 C SER A 417 -10.858 2.376 -6.339 1.00 11.22 C ATOM 40 O SER A 417 -9.636 2.273 -6.229 1.00 64.22 O ATOM 41 CB SER A 417 -12.006 0.496 -7.525 1.00 14.45 C ATOM 42 OG SER A 417 -12.214 1.464 -8.538 1.00 51.02 O ATOM 0 H SER A 417 -13.851 1.381 -6.148 1.00 1.11 H new ATOM 0 HA SER A 417 -11.273 0.450 -5.505 1.00 62.14 H new ATOM 0 HB2 SER A 417 -11.151 -0.128 -7.784 1.00 14.45 H new ATOM 0 HB3 SER A 417 -12.873 -0.162 -7.463 1.00 14.45 H new ATOM 0 HG SER A 417 -13.164 1.704 -8.571 1.00 51.02 H new ATOM 48 N THR A 418 -11.465 3.527 -6.609 1.00 3.40 N ATOM 49 CA THR A 418 -10.714 4.762 -6.796 1.00 24.41 C ATOM 50 C THR A 418 -10.240 5.326 -5.461 1.00 72.14 C ATOM 51 O THR A 418 -9.237 6.036 -5.398 1.00 35.21 O ATOM 52 CB THR A 418 -11.556 5.828 -7.521 1.00 55.33 C ATOM 53 OG1 THR A 418 -12.296 5.226 -8.589 1.00 53.01 O ATOM 54 CG2 THR A 418 -10.671 6.935 -8.072 1.00 21.20 C ATOM 0 H THR A 418 -12.475 3.630 -6.703 1.00 3.40 H new ATOM 0 HA THR A 418 -9.848 4.514 -7.410 1.00 24.41 H new ATOM 0 HB THR A 418 -12.248 6.263 -6.800 1.00 55.33 H new ATOM 0 HG1 THR A 418 -12.830 5.911 -9.044 1.00 53.01 H new ATOM 0 HG21 THR A 418 -11.289 7.676 -8.580 1.00 21.20 H new ATOM 0 HG22 THR A 418 -10.132 7.412 -7.253 1.00 21.20 H new ATOM 0 HG23 THR A 418 -9.957 6.512 -8.779 1.00 21.20 H new ATOM 62 N ALA A 419 -10.968 5.004 -4.397 1.00 51.44 N ATOM 63 CA ALA A 419 -10.621 5.477 -3.063 1.00 21.44 C ATOM 64 C ALA A 419 -9.355 4.796 -2.552 1.00 23.34 C ATOM 65 O ALA A 419 -8.650 5.337 -1.699 1.00 70.33 O ATOM 66 CB ALA A 419 -11.775 5.238 -2.101 1.00 71.41 C ATOM 0 H ALA A 419 -11.802 4.418 -4.433 1.00 51.44 H new ATOM 0 HA ALA A 419 -10.428 6.548 -3.123 1.00 21.44 H new ATOM 0 HB1 ALA A 419 -11.501 5.596 -1.109 1.00 71.41 H new ATOM 0 HB2 ALA A 419 -12.657 5.775 -2.450 1.00 71.41 H new ATOM 0 HB3 ALA A 419 -11.995 4.171 -2.054 1.00 71.41 H new ATOM 72 N ILE A 420 -9.073 3.610 -3.078 1.00 33.32 N ATOM 73 CA ILE A 420 -7.892 2.856 -2.675 1.00 5.23 C ATOM 74 C ILE A 420 -6.613 3.592 -3.062 1.00 73.03 C ATOM 75 O ILE A 420 -5.533 3.291 -2.551 1.00 54.24 O ATOM 76 CB ILE A 420 -7.875 1.453 -3.309 1.00 72.14 C ATOM 77 CG1 ILE A 420 -9.220 0.755 -3.090 1.00 61.44 C ATOM 78 CG2 ILE A 420 -6.741 0.622 -2.728 1.00 1.34 C ATOM 79 CD1 ILE A 420 -9.605 0.627 -1.633 1.00 44.02 C ATOM 0 H ILE A 420 -9.646 3.149 -3.785 1.00 33.32 H new ATOM 0 HA ILE A 420 -7.937 2.754 -1.591 1.00 5.23 H new ATOM 0 HB ILE A 420 -7.710 1.557 -4.381 1.00 72.14 H new ATOM 0 HG12 ILE A 420 -9.998 1.310 -3.615 1.00 61.44 H new ATOM 0 HG13 ILE A 420 -9.181 -0.239 -3.536 1.00 61.44 H new ATOM 0 HG21 ILE A 420 -6.743 -0.367 -3.186 1.00 1.34 H new ATOM 0 HG22 ILE A 420 -5.789 1.114 -2.929 1.00 1.34 H new ATOM 0 HG23 ILE A 420 -6.877 0.523 -1.651 1.00 1.34 H new ATOM 0 HD11 ILE A 420 -10.568 0.123 -1.554 1.00 44.02 H new ATOM 0 HD12 ILE A 420 -8.848 0.047 -1.106 1.00 44.02 H new ATOM 0 HD13 ILE A 420 -9.677 1.619 -1.187 1.00 44.02 H new ATOM 91 N ARG A 421 -6.742 4.556 -3.966 1.00 43.12 N ATOM 92 CA ARG A 421 -5.597 5.336 -4.420 1.00 64.54 C ATOM 93 C ARG A 421 -4.913 6.033 -3.248 1.00 71.14 C ATOM 94 O ARG A 421 -3.734 6.379 -3.321 1.00 53.22 O ATOM 95 CB ARG A 421 -6.037 6.372 -5.457 1.00 71.55 C ATOM 96 CG ARG A 421 -4.987 6.655 -6.519 1.00 73.41 C ATOM 97 CD ARG A 421 -5.478 6.262 -7.904 1.00 65.31 C ATOM 98 NE ARG A 421 -5.897 4.864 -7.962 1.00 1.32 N ATOM 99 CZ ARG A 421 -6.470 4.312 -9.026 1.00 12.42 C ATOM 100 NH1 ARG A 421 -6.689 5.036 -10.115 1.00 55.21 N ATOM 101 NH2 ARG A 421 -6.824 3.034 -9.001 1.00 51.10 N ATOM 0 H ARG A 421 -7.628 4.816 -4.399 1.00 43.12 H new ATOM 0 HA ARG A 421 -4.884 4.652 -4.879 1.00 64.54 H new ATOM 0 HB2 ARG A 421 -6.948 6.023 -5.943 1.00 71.55 H new ATOM 0 HB3 ARG A 421 -6.285 7.302 -4.946 1.00 71.55 H new ATOM 0 HG2 ARG A 421 -4.733 7.715 -6.509 1.00 73.41 H new ATOM 0 HG3 ARG A 421 -4.074 6.107 -6.286 1.00 73.41 H new ATOM 0 HD2 ARG A 421 -6.313 6.902 -8.187 1.00 65.31 H new ATOM 0 HD3 ARG A 421 -4.684 6.433 -8.631 1.00 65.31 H new ATOM 0 HE ARG A 421 -5.741 4.280 -7.141 1.00 1.32 H new ATOM 0 HH11 ARG A 421 -6.417 6.019 -10.137 1.00 55.21 H new ATOM 0 HH12 ARG A 421 -7.129 4.610 -10.931 1.00 55.21 H new ATOM 0 HH21 ARG A 421 -6.656 2.475 -8.165 1.00 51.10 H new ATOM 0 HH22 ARG A 421 -7.264 2.611 -9.818 1.00 51.10 H new ATOM 115 N ALA A 422 -5.662 6.235 -2.168 1.00 62.42 N ATOM 116 CA ALA A 422 -5.127 6.889 -0.980 1.00 72.54 C ATOM 117 C ALA A 422 -4.425 5.885 -0.071 1.00 42.33 C ATOM 118 O ALA A 422 -3.547 6.250 0.713 1.00 41.23 O ATOM 119 CB ALA A 422 -6.239 7.601 -0.225 1.00 35.05 C ATOM 0 H ALA A 422 -6.640 5.955 -2.092 1.00 62.42 H new ATOM 0 HA ALA A 422 -4.391 7.626 -1.300 1.00 72.54 H new ATOM 0 HB1 ALA A 422 -5.826 8.085 0.660 1.00 35.05 H new ATOM 0 HB2 ALA A 422 -6.694 8.352 -0.871 1.00 35.05 H new ATOM 0 HB3 ALA A 422 -6.995 6.877 0.077 1.00 35.05 H new ATOM 125 N LEU A 423 -4.817 4.621 -0.180 1.00 31.05 N ATOM 126 CA LEU A 423 -4.225 3.564 0.634 1.00 43.40 C ATOM 127 C LEU A 423 -2.752 3.372 0.290 1.00 61.11 C ATOM 128 O LEU A 423 -1.900 3.304 1.176 1.00 64.13 O ATOM 129 CB LEU A 423 -4.983 2.252 0.431 1.00 13.21 C ATOM 130 CG LEU A 423 -5.905 1.825 1.575 1.00 21.22 C ATOM 131 CD1 LEU A 423 -5.090 1.330 2.760 1.00 41.44 C ATOM 132 CD2 LEU A 423 -6.808 2.977 1.990 1.00 73.04 C ATOM 0 H LEU A 423 -5.542 4.302 -0.823 1.00 31.05 H new ATOM 0 HA LEU A 423 -4.299 3.861 1.680 1.00 43.40 H new ATOM 0 HB2 LEU A 423 -5.580 2.337 -0.477 1.00 13.21 H new ATOM 0 HB3 LEU A 423 -4.256 1.458 0.261 1.00 13.21 H new ATOM 0 HG LEU A 423 -6.533 1.006 1.224 1.00 21.22 H new ATOM 0 HD11 LEU A 423 -5.762 1.031 3.564 1.00 41.44 H new ATOM 0 HD12 LEU A 423 -4.486 0.475 2.455 1.00 41.44 H new ATOM 0 HD13 LEU A 423 -4.437 2.129 3.111 1.00 41.44 H new ATOM 0 HD21 LEU A 423 -7.457 2.655 2.805 1.00 73.04 H new ATOM 0 HD22 LEU A 423 -6.197 3.816 2.322 1.00 73.04 H new ATOM 0 HD23 LEU A 423 -7.418 3.286 1.141 1.00 73.04 H new ATOM 144 N VAL A 424 -2.458 3.287 -1.004 1.00 72.12 N ATOM 145 CA VAL A 424 -1.088 3.106 -1.467 1.00 21.35 C ATOM 146 C VAL A 424 -0.265 4.373 -1.258 1.00 73.54 C ATOM 147 O VAL A 424 0.961 4.355 -1.362 1.00 63.31 O ATOM 148 CB VAL A 424 -1.044 2.719 -2.957 1.00 73.13 C ATOM 149 CG1 VAL A 424 0.374 2.367 -3.377 1.00 24.45 C ATOM 150 CG2 VAL A 424 -1.992 1.562 -3.233 1.00 55.24 C ATOM 0 H VAL A 424 -3.151 3.341 -1.750 1.00 72.12 H new ATOM 0 HA VAL A 424 -0.660 2.296 -0.877 1.00 21.35 H new ATOM 0 HB VAL A 424 -1.369 3.576 -3.547 1.00 73.13 H new ATOM 0 HG11 VAL A 424 0.384 2.096 -4.433 1.00 24.45 H new ATOM 0 HG12 VAL A 424 1.025 3.226 -3.216 1.00 24.45 H new ATOM 0 HG13 VAL A 424 0.731 1.525 -2.783 1.00 24.45 H new ATOM 0 HG21 VAL A 424 -1.949 1.301 -4.290 1.00 55.24 H new ATOM 0 HG22 VAL A 424 -1.698 0.700 -2.634 1.00 55.24 H new ATOM 0 HG23 VAL A 424 -3.009 1.855 -2.973 1.00 55.24 H new ATOM 160 N LYS A 425 -0.950 5.473 -0.964 1.00 24.13 N ATOM 161 CA LYS A 425 -0.283 6.751 -0.738 1.00 53.54 C ATOM 162 C LYS A 425 0.288 6.826 0.674 1.00 74.54 C ATOM 163 O LYS A 425 1.428 7.246 0.872 1.00 5.33 O ATOM 164 CB LYS A 425 -1.262 7.906 -0.965 1.00 50.31 C ATOM 165 CG LYS A 425 -0.834 8.857 -2.069 1.00 3.02 C ATOM 166 CD LYS A 425 -1.592 8.594 -3.358 1.00 72.12 C ATOM 167 CE LYS A 425 -1.417 9.733 -4.351 1.00 53.14 C ATOM 168 NZ LYS A 425 -2.386 10.837 -4.104 1.00 71.33 N ATOM 0 H LYS A 425 -1.966 5.506 -0.877 1.00 24.13 H new ATOM 0 HA LYS A 425 0.540 6.833 -1.448 1.00 53.54 H new ATOM 0 HB2 LYS A 425 -2.243 7.498 -1.209 1.00 50.31 H new ATOM 0 HB3 LYS A 425 -1.372 8.466 -0.036 1.00 50.31 H new ATOM 0 HG2 LYS A 425 -1.003 9.885 -1.750 1.00 3.02 H new ATOM 0 HG3 LYS A 425 0.236 8.751 -2.247 1.00 3.02 H new ATOM 0 HD2 LYS A 425 -1.241 7.664 -3.804 1.00 72.12 H new ATOM 0 HD3 LYS A 425 -2.651 8.462 -3.138 1.00 72.12 H new ATOM 0 HE2 LYS A 425 -0.400 10.120 -4.284 1.00 53.14 H new ATOM 0 HE3 LYS A 425 -1.548 9.355 -5.365 1.00 53.14 H new ATOM 0 HZ1 LYS A 425 -2.213 11.609 -4.779 1.00 71.33 H new ATOM 0 HZ2 LYS A 425 -3.356 10.482 -4.226 1.00 71.33 H new ATOM 0 HZ3 LYS A 425 -2.267 11.193 -3.134 1.00 71.33 H new ATOM 182 N LYS A 426 -0.510 6.412 1.653 1.00 42.34 N ATOM 183 CA LYS A 426 -0.083 6.429 3.047 1.00 12.22 C ATOM 184 C LYS A 426 1.265 5.733 3.211 1.00 12.31 C ATOM 185 O LYS A 426 2.148 6.226 3.915 1.00 70.01 O ATOM 186 CB LYS A 426 -1.131 5.749 3.931 1.00 62.53 C ATOM 187 CG LYS A 426 -1.137 6.252 5.364 1.00 21.24 C ATOM 188 CD LYS A 426 -2.469 6.888 5.727 1.00 65.02 C ATOM 189 CE LYS A 426 -2.653 6.973 7.233 1.00 20.15 C ATOM 190 NZ LYS A 426 -1.500 7.641 7.897 1.00 2.51 N ATOM 0 H LYS A 426 -1.456 6.061 1.506 1.00 42.34 H new ATOM 0 HA LYS A 426 0.024 7.469 3.356 1.00 12.22 H new ATOM 0 HB2 LYS A 426 -2.118 5.906 3.496 1.00 62.53 H new ATOM 0 HB3 LYS A 426 -0.950 4.674 3.933 1.00 62.53 H new ATOM 0 HG2 LYS A 426 -0.932 5.424 6.042 1.00 21.24 H new ATOM 0 HG3 LYS A 426 -0.337 6.980 5.498 1.00 21.24 H new ATOM 0 HD2 LYS A 426 -2.526 7.887 5.295 1.00 65.02 H new ATOM 0 HD3 LYS A 426 -3.282 6.306 5.292 1.00 65.02 H new ATOM 0 HE2 LYS A 426 -3.568 7.522 7.456 1.00 20.15 H new ATOM 0 HE3 LYS A 426 -2.775 5.970 7.641 1.00 20.15 H new ATOM 0 HZ1 LYS A 426 -1.741 7.847 8.887 1.00 2.51 H new ATOM 0 HZ2 LYS A 426 -0.671 7.014 7.866 1.00 2.51 H new ATOM 0 HZ3 LYS A 426 -1.282 8.529 7.402 1.00 2.51 H new ATOM 204 N LEU A 427 1.416 4.586 2.559 1.00 21.11 N ATOM 205 CA LEU A 427 2.658 3.823 2.631 1.00 5.44 C ATOM 206 C LEU A 427 3.862 4.713 2.337 1.00 31.30 C ATOM 207 O LEU A 427 4.843 4.711 3.080 1.00 25.45 O ATOM 208 CB LEU A 427 2.619 2.654 1.646 1.00 61.10 C ATOM 209 CG LEU A 427 1.328 1.835 1.626 1.00 3.03 C ATOM 210 CD1 LEU A 427 1.570 0.473 0.995 1.00 74.23 C ATOM 211 CD2 LEU A 427 0.773 1.681 3.035 1.00 70.22 C ATOM 0 H LEU A 427 0.695 4.163 1.975 1.00 21.11 H new ATOM 0 HA LEU A 427 2.758 3.433 3.644 1.00 5.44 H new ATOM 0 HB2 LEU A 427 2.794 3.044 0.643 1.00 61.10 H new ATOM 0 HB3 LEU A 427 3.447 1.984 1.876 1.00 61.10 H new ATOM 0 HG LEU A 427 0.592 2.366 1.023 1.00 3.03 H new ATOM 0 HD11 LEU A 427 0.640 -0.096 0.989 1.00 74.23 H new ATOM 0 HD12 LEU A 427 1.922 0.603 -0.028 1.00 74.23 H new ATOM 0 HD13 LEU A 427 2.322 -0.066 1.571 1.00 74.23 H new ATOM 0 HD21 LEU A 427 -0.146 1.096 3.002 1.00 70.22 H new ATOM 0 HD22 LEU A 427 1.506 1.172 3.661 1.00 70.22 H new ATOM 0 HD23 LEU A 427 0.561 2.665 3.452 1.00 70.22 H new ATOM 223 N ILE A 428 3.778 5.471 1.249 1.00 31.22 N ATOM 224 CA ILE A 428 4.860 6.368 0.859 1.00 55.40 C ATOM 225 C ILE A 428 4.860 7.632 1.712 1.00 41.13 C ATOM 226 O ILE A 428 5.874 8.322 1.817 1.00 74.35 O ATOM 227 CB ILE A 428 4.754 6.762 -0.626 1.00 2.34 C ATOM 228 CG1 ILE A 428 4.515 5.523 -1.490 1.00 64.24 C ATOM 229 CG2 ILE A 428 6.014 7.490 -1.071 1.00 5.24 C ATOM 230 CD1 ILE A 428 5.612 4.488 -1.379 1.00 4.02 C ATOM 0 H ILE A 428 2.973 5.482 0.622 1.00 31.22 H new ATOM 0 HA ILE A 428 5.793 5.827 1.017 1.00 55.40 H new ATOM 0 HB ILE A 428 3.906 7.435 -0.748 1.00 2.34 H new ATOM 0 HG12 ILE A 428 3.567 5.068 -1.204 1.00 64.24 H new ATOM 0 HG13 ILE A 428 4.420 5.829 -2.532 1.00 64.24 H new ATOM 0 HG21 ILE A 428 5.925 7.762 -2.123 1.00 5.24 H new ATOM 0 HG22 ILE A 428 6.144 8.392 -0.472 1.00 5.24 H new ATOM 0 HG23 ILE A 428 6.877 6.838 -0.937 1.00 5.24 H new ATOM 0 HD11 ILE A 428 5.376 3.637 -2.018 1.00 4.02 H new ATOM 0 HD12 ILE A 428 6.559 4.926 -1.694 1.00 4.02 H new ATOM 0 HD13 ILE A 428 5.693 4.153 -0.345 1.00 4.02 H new ATOM 242 N ALA A 429 3.716 7.929 2.320 1.00 45.35 N ATOM 243 CA ALA A 429 3.586 9.108 3.167 1.00 44.34 C ATOM 244 C ALA A 429 4.700 9.164 4.207 1.00 50.14 C ATOM 245 O ALA A 429 5.113 10.243 4.629 1.00 33.33 O ATOM 246 CB ALA A 429 2.225 9.123 3.846 1.00 74.31 C ATOM 0 H ALA A 429 2.867 7.370 2.242 1.00 45.35 H new ATOM 0 HA ALA A 429 3.673 9.991 2.533 1.00 44.34 H new ATOM 0 HB1 ALA A 429 2.142 10.009 4.475 1.00 74.31 H new ATOM 0 HB2 ALA A 429 1.441 9.141 3.089 1.00 74.31 H new ATOM 0 HB3 ALA A 429 2.115 8.230 4.461 1.00 74.31 H new ATOM 252 N ALA A 430 5.180 7.994 4.615 1.00 1.31 N ATOM 253 CA ALA A 430 6.247 7.910 5.605 1.00 53.33 C ATOM 254 C ALA A 430 7.199 6.762 5.288 1.00 4.24 C ATOM 255 O ALA A 430 7.538 5.966 6.163 1.00 40.11 O ATOM 256 CB ALA A 430 5.660 7.742 6.999 1.00 20.14 C ATOM 0 H ALA A 430 4.847 7.092 4.276 1.00 1.31 H new ATOM 0 HA ALA A 430 6.816 8.839 5.571 1.00 53.33 H new ATOM 0 HB1 ALA A 430 6.467 7.681 7.729 1.00 20.14 H new ATOM 0 HB2 ALA A 430 5.025 8.597 7.232 1.00 20.14 H new ATOM 0 HB3 ALA A 430 5.067 6.828 7.036 1.00 20.14 H new ATOM 262 N GLU A 431 7.628 6.685 4.032 1.00 4.44 N ATOM 263 CA GLU A 431 8.542 5.634 3.600 1.00 34.43 C ATOM 264 C GLU A 431 9.962 6.173 3.454 1.00 23.00 C ATOM 265 O GLU A 431 10.169 7.272 2.941 1.00 4.13 O ATOM 266 CB GLU A 431 8.073 5.033 2.274 1.00 23.33 C ATOM 267 CG GLU A 431 8.393 5.899 1.067 1.00 32.20 C ATOM 268 CD GLU A 431 9.778 5.632 0.509 1.00 43.21 C ATOM 269 OE1 GLU A 431 10.043 4.479 0.108 1.00 45.22 O ATOM 270 OE2 GLU A 431 10.595 6.575 0.473 1.00 22.12 O ATOM 0 H GLU A 431 7.357 7.338 3.296 1.00 4.44 H new ATOM 0 HA GLU A 431 8.545 4.855 4.362 1.00 34.43 H new ATOM 0 HB2 GLU A 431 8.538 4.056 2.143 1.00 23.33 H new ATOM 0 HB3 GLU A 431 6.996 4.870 2.319 1.00 23.33 H new ATOM 0 HG2 GLU A 431 7.651 5.720 0.289 1.00 32.20 H new ATOM 0 HG3 GLU A 431 8.314 6.950 1.347 1.00 32.20 H new ATOM 277 N ASN A 432 10.936 5.391 3.909 1.00 14.40 N ATOM 278 CA ASN A 432 12.336 5.790 3.830 1.00 54.21 C ATOM 279 C ASN A 432 13.254 4.576 3.940 1.00 21.13 C ATOM 280 O ASN A 432 13.939 4.374 4.943 1.00 3.22 O ATOM 281 CB ASN A 432 12.665 6.795 4.935 1.00 53.02 C ATOM 282 CG ASN A 432 13.648 7.856 4.479 1.00 41.12 C ATOM 283 OD1 ASN A 432 13.428 9.050 4.681 1.00 30.24 O ATOM 284 ND2 ASN A 432 14.739 7.423 3.858 1.00 2.12 N ATOM 0 H ASN A 432 10.781 4.478 4.336 1.00 14.40 H new ATOM 0 HA ASN A 432 12.500 6.261 2.861 1.00 54.21 H new ATOM 0 HB2 ASN A 432 11.746 7.276 5.270 1.00 53.02 H new ATOM 0 HB3 ASN A 432 13.079 6.265 5.793 1.00 53.02 H new ATOM 0 HD21 ASN A 432 15.436 8.090 3.527 1.00 2.12 H new ATOM 0 HD22 ASN A 432 14.880 6.423 3.712 1.00 2.12 H new ATOM 291 N PRO A 433 13.271 3.749 2.884 1.00 12.34 N ATOM 292 CA PRO A 433 14.101 2.542 2.838 1.00 3.33 C ATOM 293 C PRO A 433 15.588 2.865 2.732 1.00 45.13 C ATOM 294 O PRO A 433 16.402 2.342 3.492 1.00 63.22 O ATOM 295 CB PRO A 433 13.618 1.828 1.573 1.00 34.25 C ATOM 296 CG PRO A 433 13.064 2.911 0.714 1.00 12.23 C ATOM 297 CD PRO A 433 12.480 3.928 1.655 1.00 24.24 C ATOM 0 HA PRO A 433 14.003 1.945 3.745 1.00 3.33 H new ATOM 0 HB2 PRO A 433 14.436 1.308 1.075 1.00 34.25 H new ATOM 0 HB3 PRO A 433 12.860 1.080 1.806 1.00 34.25 H new ATOM 0 HG2 PRO A 433 13.843 3.355 0.094 1.00 12.23 H new ATOM 0 HG3 PRO A 433 12.302 2.522 0.038 1.00 12.23 H new ATOM 0 HD2 PRO A 433 12.573 4.940 1.261 1.00 24.24 H new ATOM 0 HD3 PRO A 433 11.419 3.751 1.831 1.00 24.24 H new ATOM 305 N ALA A 434 15.935 3.731 1.785 1.00 35.32 N ATOM 306 CA ALA A 434 17.323 4.125 1.582 1.00 22.00 C ATOM 307 C ALA A 434 18.124 3.001 0.932 1.00 10.41 C ATOM 308 O ALA A 434 18.483 3.080 -0.243 1.00 40.13 O ATOM 309 CB ALA A 434 17.956 4.530 2.905 1.00 31.42 C ATOM 0 H ALA A 434 15.273 4.173 1.147 1.00 35.32 H new ATOM 0 HA ALA A 434 17.336 4.982 0.908 1.00 22.00 H new ATOM 0 HB1 ALA A 434 18.993 4.822 2.738 1.00 31.42 H new ATOM 0 HB2 ALA A 434 17.406 5.370 3.329 1.00 31.42 H new ATOM 0 HB3 ALA A 434 17.923 3.688 3.597 1.00 31.42 H new ATOM 315 N LYS A 435 18.400 1.956 1.703 1.00 32.21 N ATOM 316 CA LYS A 435 19.158 0.815 1.204 1.00 42.11 C ATOM 317 C LYS A 435 18.270 -0.107 0.374 1.00 1.24 C ATOM 318 O LYS A 435 18.503 -0.329 -0.814 1.00 52.05 O ATOM 319 CB LYS A 435 19.774 0.036 2.368 1.00 70.13 C ATOM 320 CG LYS A 435 21.254 0.308 2.567 1.00 30.12 C ATOM 321 CD LYS A 435 21.944 -0.848 3.273 1.00 44.44 C ATOM 322 CE LYS A 435 22.962 -0.352 4.289 1.00 72.44 C ATOM 323 NZ LYS A 435 24.137 -1.263 4.386 1.00 44.53 N ATOM 0 H LYS A 435 18.110 1.875 2.677 1.00 32.21 H new ATOM 0 HA LYS A 435 19.957 1.193 0.566 1.00 42.11 H new ATOM 0 HB2 LYS A 435 19.241 0.287 3.285 1.00 70.13 H new ATOM 0 HB3 LYS A 435 19.629 -1.031 2.197 1.00 70.13 H new ATOM 0 HG2 LYS A 435 21.727 0.479 1.600 1.00 30.12 H new ATOM 0 HG3 LYS A 435 21.382 1.220 3.150 1.00 30.12 H new ATOM 0 HD2 LYS A 435 21.199 -1.466 3.774 1.00 44.44 H new ATOM 0 HD3 LYS A 435 22.441 -1.481 2.537 1.00 44.44 H new ATOM 0 HE2 LYS A 435 23.298 0.646 4.009 1.00 72.44 H new ATOM 0 HE3 LYS A 435 22.487 -0.266 5.266 1.00 72.44 H new ATOM 0 HZ1 LYS A 435 24.808 -0.891 5.088 1.00 44.53 H new ATOM 0 HZ2 LYS A 435 23.819 -2.209 4.678 1.00 44.53 H new ATOM 0 HZ3 LYS A 435 24.605 -1.326 3.459 1.00 44.53 H new ATOM 337 N PRO A 436 17.226 -0.656 1.012 1.00 11.13 N ATOM 338 CA PRO A 436 16.281 -1.561 0.351 1.00 14.24 C ATOM 339 C PRO A 436 15.404 -0.841 -0.667 1.00 2.11 C ATOM 340 O PRO A 436 15.487 0.379 -0.820 1.00 42.31 O ATOM 341 CB PRO A 436 15.431 -2.092 1.508 1.00 15.30 C ATOM 342 CG PRO A 436 15.515 -1.037 2.557 1.00 71.12 C ATOM 343 CD PRO A 436 16.887 -0.436 2.429 1.00 42.31 C ATOM 0 HA PRO A 436 16.791 -2.341 -0.215 1.00 14.24 H new ATOM 0 HB2 PRO A 436 14.400 -2.259 1.197 1.00 15.30 H new ATOM 0 HB3 PRO A 436 15.812 -3.045 1.874 1.00 15.30 H new ATOM 0 HG2 PRO A 436 14.743 -0.281 2.413 1.00 71.12 H new ATOM 0 HG3 PRO A 436 15.365 -1.461 3.550 1.00 71.12 H new ATOM 0 HD2 PRO A 436 16.886 0.624 2.682 1.00 42.31 H new ATOM 0 HD3 PRO A 436 17.602 -0.922 3.093 1.00 42.31 H new ATOM 351 N LEU A 437 14.564 -1.601 -1.361 1.00 1.51 N ATOM 352 CA LEU A 437 13.671 -1.034 -2.365 1.00 22.13 C ATOM 353 C LEU A 437 12.273 -0.820 -1.793 1.00 71.10 C ATOM 354 O LEU A 437 11.912 -1.408 -0.773 1.00 22.32 O ATOM 355 CB LEU A 437 13.599 -1.952 -3.587 1.00 52.44 C ATOM 356 CG LEU A 437 14.201 -1.397 -4.878 1.00 63.14 C ATOM 357 CD1 LEU A 437 15.647 -1.846 -5.030 1.00 14.42 C ATOM 358 CD2 LEU A 437 13.377 -1.833 -6.082 1.00 24.51 C ATOM 0 H LEU A 437 14.483 -2.611 -1.247 1.00 1.51 H new ATOM 0 HA LEU A 437 14.071 -0.066 -2.667 1.00 22.13 H new ATOM 0 HB2 LEU A 437 14.106 -2.886 -3.345 1.00 52.44 H new ATOM 0 HB3 LEU A 437 12.553 -2.196 -3.773 1.00 52.44 H new ATOM 0 HG LEU A 437 14.183 -0.308 -4.825 1.00 63.14 H new ATOM 0 HD11 LEU A 437 16.058 -1.441 -5.955 1.00 14.42 H new ATOM 0 HD12 LEU A 437 16.231 -1.484 -4.184 1.00 14.42 H new ATOM 0 HD13 LEU A 437 15.689 -2.935 -5.061 1.00 14.42 H new ATOM 0 HD21 LEU A 437 13.820 -1.429 -6.992 1.00 24.51 H new ATOM 0 HD22 LEU A 437 13.362 -2.921 -6.138 1.00 24.51 H new ATOM 0 HD23 LEU A 437 12.358 -1.461 -5.979 1.00 24.51 H new ATOM 370 N SER A 438 11.490 0.024 -2.457 1.00 32.24 N ATOM 371 CA SER A 438 10.132 0.316 -2.014 1.00 2.31 C ATOM 372 C SER A 438 9.341 -0.971 -1.799 1.00 70.12 C ATOM 373 O SER A 438 9.777 -2.053 -2.193 1.00 10.41 O ATOM 374 CB SER A 438 9.419 1.203 -3.037 1.00 34.10 C ATOM 375 OG SER A 438 10.278 1.531 -4.114 1.00 71.41 O ATOM 0 H SER A 438 11.773 0.518 -3.304 1.00 32.24 H new ATOM 0 HA SER A 438 10.192 0.846 -1.064 1.00 2.31 H new ATOM 0 HB2 SER A 438 8.536 0.689 -3.416 1.00 34.10 H new ATOM 0 HB3 SER A 438 9.073 2.116 -2.553 1.00 34.10 H new ATOM 0 HG SER A 438 10.418 0.739 -4.674 1.00 71.41 H new ATOM 381 N ASP A 439 8.177 -0.845 -1.172 1.00 50.14 N ATOM 382 CA ASP A 439 7.323 -1.997 -0.906 1.00 3.44 C ATOM 383 C ASP A 439 7.986 -2.945 0.088 1.00 54.11 C ATOM 384 O ASP A 439 7.542 -4.079 0.270 1.00 51.20 O ATOM 385 CB ASP A 439 7.010 -2.738 -2.206 1.00 1.10 C ATOM 386 CG ASP A 439 6.906 -1.802 -3.395 1.00 70.20 C ATOM 387 OD1 ASP A 439 6.303 -0.719 -3.247 1.00 4.12 O ATOM 388 OD2 ASP A 439 7.429 -2.154 -4.473 1.00 73.02 O ATOM 0 H ASP A 439 7.803 0.043 -0.838 1.00 50.14 H new ATOM 0 HA ASP A 439 6.391 -1.636 -0.471 1.00 3.44 H new ATOM 0 HB2 ASP A 439 7.788 -3.477 -2.396 1.00 1.10 H new ATOM 0 HB3 ASP A 439 6.073 -3.283 -2.093 1.00 1.10 H new ATOM 393 N SER A 440 9.051 -2.474 0.728 1.00 62.30 N ATOM 394 CA SER A 440 9.779 -3.283 1.700 1.00 41.55 C ATOM 395 C SER A 440 9.771 -2.618 3.073 1.00 61.41 C ATOM 396 O SER A 440 9.825 -3.291 4.102 1.00 33.44 O ATOM 397 CB SER A 440 11.219 -3.504 1.234 1.00 4.24 C ATOM 398 OG SER A 440 11.752 -4.700 1.775 1.00 52.24 O ATOM 0 H SER A 440 9.429 -1.537 0.592 1.00 62.30 H new ATOM 0 HA SER A 440 9.280 -4.249 1.781 1.00 41.55 H new ATOM 0 HB2 SER A 440 11.249 -3.548 0.145 1.00 4.24 H new ATOM 0 HB3 SER A 440 11.836 -2.658 1.536 1.00 4.24 H new ATOM 0 HG SER A 440 12.673 -4.819 1.461 1.00 52.24 H new ATOM 404 N LYS A 441 9.704 -1.291 3.080 1.00 23.34 N ATOM 405 CA LYS A 441 9.689 -0.532 4.326 1.00 75.51 C ATOM 406 C LYS A 441 8.269 -0.414 4.873 1.00 64.04 C ATOM 407 O LYS A 441 8.022 -0.684 6.049 1.00 61.24 O ATOM 408 CB LYS A 441 10.280 0.862 4.105 1.00 31.32 C ATOM 409 CG LYS A 441 11.577 1.099 4.859 1.00 14.44 C ATOM 410 CD LYS A 441 11.352 1.119 6.362 1.00 13.11 C ATOM 411 CE LYS A 441 12.519 0.492 7.109 1.00 71.11 C ATOM 412 NZ LYS A 441 13.223 1.483 7.968 1.00 31.02 N ATOM 0 H LYS A 441 9.659 -0.718 2.237 1.00 23.34 H new ATOM 0 HA LYS A 441 10.298 -1.066 5.056 1.00 75.51 H new ATOM 0 HB2 LYS A 441 10.457 1.008 3.039 1.00 31.32 H new ATOM 0 HB3 LYS A 441 9.549 1.610 4.412 1.00 31.32 H new ATOM 0 HG2 LYS A 441 12.293 0.317 4.608 1.00 14.44 H new ATOM 0 HG3 LYS A 441 12.015 2.046 4.543 1.00 14.44 H new ATOM 0 HD2 LYS A 441 11.215 2.147 6.697 1.00 13.11 H new ATOM 0 HD3 LYS A 441 10.435 0.581 6.601 1.00 13.11 H new ATOM 0 HE2 LYS A 441 12.156 -0.330 7.726 1.00 71.11 H new ATOM 0 HE3 LYS A 441 13.223 0.067 6.393 1.00 71.11 H new ATOM 0 HZ1 LYS A 441 14.012 1.017 8.460 1.00 31.02 H new ATOM 0 HZ2 LYS A 441 13.592 2.255 7.377 1.00 31.02 H new ATOM 0 HZ3 LYS A 441 12.558 1.870 8.668 1.00 31.02 H new ATOM 426 N LEU A 442 7.341 -0.010 4.013 1.00 44.12 N ATOM 427 CA LEU A 442 5.945 0.143 4.408 1.00 10.34 C ATOM 428 C LEU A 442 5.430 -1.122 5.086 1.00 31.34 C ATOM 429 O LEU A 442 4.706 -1.057 6.081 1.00 74.54 O ATOM 430 CB LEU A 442 5.082 0.470 3.190 1.00 43.45 C ATOM 431 CG LEU A 442 5.322 -0.387 1.947 1.00 45.02 C ATOM 432 CD1 LEU A 442 4.393 -1.590 1.940 1.00 74.10 C ATOM 433 CD2 LEU A 442 5.134 0.441 0.684 1.00 73.32 C ATOM 0 H LEU A 442 7.530 0.218 3.037 1.00 44.12 H new ATOM 0 HA LEU A 442 5.883 0.966 5.120 1.00 10.34 H new ATOM 0 HB2 LEU A 442 4.035 0.374 3.476 1.00 43.45 H new ATOM 0 HB3 LEU A 442 5.246 1.514 2.924 1.00 43.45 H new ATOM 0 HG LEU A 442 6.350 -0.748 1.972 1.00 45.02 H new ATOM 0 HD11 LEU A 442 4.579 -2.188 1.048 1.00 74.10 H new ATOM 0 HD12 LEU A 442 4.576 -2.196 2.827 1.00 74.10 H new ATOM 0 HD13 LEU A 442 3.357 -1.250 1.940 1.00 74.10 H new ATOM 0 HD21 LEU A 442 5.309 -0.185 -0.191 1.00 73.32 H new ATOM 0 HD22 LEU A 442 4.117 0.832 0.653 1.00 73.32 H new ATOM 0 HD23 LEU A 442 5.841 1.270 0.684 1.00 73.32 H new ATOM 445 N THR A 443 5.809 -2.275 4.543 1.00 32.41 N ATOM 446 CA THR A 443 5.387 -3.556 5.095 1.00 2.13 C ATOM 447 C THR A 443 5.982 -3.781 6.480 1.00 30.21 C ATOM 448 O THR A 443 5.388 -4.457 7.319 1.00 12.25 O ATOM 449 CB THR A 443 5.794 -4.724 4.178 1.00 33.52 C ATOM 450 OG1 THR A 443 6.586 -4.239 3.088 1.00 13.13 O ATOM 451 CG2 THR A 443 4.565 -5.442 3.639 1.00 21.12 C ATOM 0 H THR A 443 6.408 -2.347 3.721 1.00 32.41 H new ATOM 0 HA THR A 443 4.300 -3.525 5.171 1.00 2.13 H new ATOM 0 HB THR A 443 6.380 -5.431 4.765 1.00 33.52 H new ATOM 0 HG1 THR A 443 6.842 -4.988 2.511 1.00 13.13 H new ATOM 0 HG21 THR A 443 4.877 -6.263 2.994 1.00 21.12 H new ATOM 0 HG22 THR A 443 3.980 -5.836 4.470 1.00 21.12 H new ATOM 0 HG23 THR A 443 3.957 -4.742 3.066 1.00 21.12 H new ATOM 459 N SER A 444 7.159 -3.209 6.713 1.00 25.41 N ATOM 460 CA SER A 444 7.838 -3.350 7.997 1.00 72.02 C ATOM 461 C SER A 444 7.040 -2.677 9.109 1.00 2.34 C ATOM 462 O SER A 444 6.720 -3.298 10.124 1.00 0.04 O ATOM 463 CB SER A 444 9.241 -2.749 7.925 1.00 24.34 C ATOM 464 OG SER A 444 9.931 -3.198 6.770 1.00 55.43 O ATOM 0 H SER A 444 7.663 -2.643 6.030 1.00 25.41 H new ATOM 0 HA SER A 444 7.918 -4.413 8.223 1.00 72.02 H new ATOM 0 HB2 SER A 444 9.174 -1.661 7.912 1.00 24.34 H new ATOM 0 HB3 SER A 444 9.803 -3.023 8.818 1.00 24.34 H new ATOM 0 HG SER A 444 9.536 -2.788 5.973 1.00 55.43 H new ATOM 470 N LEU A 445 6.721 -1.402 8.911 1.00 30.12 N ATOM 471 CA LEU A 445 5.960 -0.642 9.897 1.00 71.13 C ATOM 472 C LEU A 445 4.659 -1.355 10.248 1.00 52.11 C ATOM 473 O LEU A 445 4.156 -1.238 11.367 1.00 71.42 O ATOM 474 CB LEU A 445 5.660 0.761 9.367 1.00 54.05 C ATOM 475 CG LEU A 445 6.464 1.901 9.991 1.00 51.34 C ATOM 476 CD1 LEU A 445 6.603 3.055 9.011 1.00 44.03 C ATOM 477 CD2 LEU A 445 5.808 2.371 11.282 1.00 44.30 C ATOM 0 H LEU A 445 6.977 -0.873 8.077 1.00 30.12 H new ATOM 0 HA LEU A 445 6.563 -0.561 10.801 1.00 71.13 H new ATOM 0 HB2 LEU A 445 5.835 0.766 8.291 1.00 54.05 H new ATOM 0 HB3 LEU A 445 4.600 0.966 9.518 1.00 54.05 H new ATOM 0 HG LEU A 445 7.461 1.530 10.227 1.00 51.34 H new ATOM 0 HD11 LEU A 445 7.178 3.857 9.473 1.00 44.03 H new ATOM 0 HD12 LEU A 445 7.117 2.710 8.114 1.00 44.03 H new ATOM 0 HD13 LEU A 445 5.614 3.426 8.743 1.00 44.03 H new ATOM 0 HD21 LEU A 445 6.394 3.183 11.713 1.00 44.30 H new ATOM 0 HD22 LEU A 445 4.799 2.724 11.070 1.00 44.30 H new ATOM 0 HD23 LEU A 445 5.761 1.543 11.989 1.00 44.30 H new ATOM 489 N LEU A 446 4.118 -2.096 9.287 1.00 42.15 N ATOM 490 CA LEU A 446 2.875 -2.831 9.496 1.00 62.25 C ATOM 491 C LEU A 446 3.140 -4.164 10.187 1.00 3.23 C ATOM 492 O LEU A 446 2.397 -4.568 11.083 1.00 61.44 O ATOM 493 CB LEU A 446 2.171 -3.069 8.159 1.00 41.24 C ATOM 494 CG LEU A 446 1.007 -2.131 7.837 1.00 0.20 C ATOM 495 CD1 LEU A 446 0.394 -2.482 6.489 1.00 1.24 C ATOM 496 CD2 LEU A 446 -0.045 -2.190 8.934 1.00 13.35 C ATOM 0 H LEU A 446 4.520 -2.204 8.356 1.00 42.15 H new ATOM 0 HA LEU A 446 2.231 -2.231 10.139 1.00 62.25 H new ATOM 0 HB2 LEU A 446 2.910 -2.985 7.362 1.00 41.24 H new ATOM 0 HB3 LEU A 446 1.800 -4.094 8.144 1.00 41.24 H new ATOM 0 HG LEU A 446 1.391 -1.112 7.784 1.00 0.20 H new ATOM 0 HD11 LEU A 446 -0.433 -1.804 6.277 1.00 1.24 H new ATOM 0 HD12 LEU A 446 1.150 -2.387 5.710 1.00 1.24 H new ATOM 0 HD13 LEU A 446 0.025 -3.507 6.513 1.00 1.24 H new ATOM 0 HD21 LEU A 446 -0.866 -1.516 8.688 1.00 13.35 H new ATOM 0 HD22 LEU A 446 -0.425 -3.208 9.020 1.00 13.35 H new ATOM 0 HD23 LEU A 446 0.400 -1.888 9.882 1.00 13.35 H new ATOM 508 N SER A 447 4.205 -4.841 9.769 1.00 40.12 N ATOM 509 CA SER A 447 4.568 -6.130 10.348 1.00 51.32 C ATOM 510 C SER A 447 5.136 -5.953 11.753 1.00 74.30 C ATOM 511 O SER A 447 5.281 -6.920 12.501 1.00 42.15 O ATOM 512 CB SER A 447 5.588 -6.843 9.458 1.00 14.32 C ATOM 513 OG SER A 447 6.187 -7.931 10.142 1.00 42.53 O ATOM 0 H SER A 447 4.832 -4.519 9.032 1.00 40.12 H new ATOM 0 HA SER A 447 3.666 -6.739 10.414 1.00 51.32 H new ATOM 0 HB2 SER A 447 5.098 -7.203 8.554 1.00 14.32 H new ATOM 0 HB3 SER A 447 6.358 -6.138 9.144 1.00 14.32 H new ATOM 0 HG SER A 447 6.063 -7.818 11.108 1.00 42.53 H new ATOM 519 N GLU A 448 5.455 -4.711 12.104 1.00 51.31 N ATOM 520 CA GLU A 448 6.008 -4.408 13.419 1.00 44.12 C ATOM 521 C GLU A 448 5.075 -4.889 14.526 1.00 54.02 C ATOM 522 O GLU A 448 5.506 -5.133 15.652 1.00 34.14 O ATOM 523 CB GLU A 448 6.251 -2.904 13.559 1.00 13.11 C ATOM 524 CG GLU A 448 7.639 -2.468 13.123 1.00 2.13 C ATOM 525 CD GLU A 448 8.603 -2.340 14.287 1.00 61.14 C ATOM 526 OE1 GLU A 448 8.372 -1.474 15.156 1.00 4.31 O ATOM 527 OE2 GLU A 448 9.589 -3.106 14.328 1.00 72.21 O ATOM 0 H GLU A 448 5.340 -3.899 11.497 1.00 51.31 H new ATOM 0 HA GLU A 448 6.958 -4.933 13.516 1.00 44.12 H new ATOM 0 HB2 GLU A 448 5.509 -2.368 12.967 1.00 13.11 H new ATOM 0 HB3 GLU A 448 6.099 -2.615 14.599 1.00 13.11 H new ATOM 0 HG2 GLU A 448 8.034 -3.189 12.407 1.00 2.13 H new ATOM 0 HG3 GLU A 448 7.570 -1.511 12.607 1.00 2.13 H new ATOM 534 N GLN A 449 3.793 -5.022 14.196 1.00 21.24 N ATOM 535 CA GLN A 449 2.799 -5.473 15.162 1.00 23.51 C ATOM 536 C GLN A 449 2.276 -6.859 14.799 1.00 62.13 C ATOM 537 O GLN A 449 1.995 -7.676 15.673 1.00 33.05 O ATOM 538 CB GLN A 449 1.639 -4.479 15.233 1.00 42.20 C ATOM 539 CG GLN A 449 1.836 -3.251 14.359 1.00 53.25 C ATOM 540 CD GLN A 449 0.773 -2.195 14.588 1.00 71.01 C ATOM 541 OE1 GLN A 449 -0.413 -2.431 14.357 1.00 1.24 O ATOM 542 NE2 GLN A 449 1.194 -1.021 15.045 1.00 34.23 N ATOM 0 H GLN A 449 3.420 -4.824 13.268 1.00 21.24 H new ATOM 0 HA GLN A 449 3.279 -5.531 16.139 1.00 23.51 H new ATOM 0 HB2 GLN A 449 0.720 -4.984 14.934 1.00 42.20 H new ATOM 0 HB3 GLN A 449 1.506 -4.161 16.267 1.00 42.20 H new ATOM 0 HG2 GLN A 449 2.818 -2.822 14.558 1.00 53.25 H new ATOM 0 HG3 GLN A 449 1.826 -3.550 13.311 1.00 53.25 H new ATOM 0 HE21 GLN A 449 2.187 -0.869 15.223 1.00 34.23 H new ATOM 0 HE22 GLN A 449 0.524 -0.271 15.218 1.00 34.23 H new ATOM 551 N GLY A 450 2.146 -7.115 13.501 1.00 23.42 N ATOM 552 CA GLY A 450 1.656 -8.403 13.045 1.00 62.53 C ATOM 553 C GLY A 450 1.000 -8.323 11.681 1.00 63.14 C ATOM 554 O GLY A 450 0.824 -9.340 11.008 1.00 1.14 O ATOM 0 H GLY A 450 2.371 -6.454 12.757 1.00 23.42 H new ATOM 0 HA2 GLY A 450 2.484 -9.110 13.006 1.00 62.53 H new ATOM 0 HA3 GLY A 450 0.939 -8.792 13.768 1.00 62.53 H new ATOM 558 N ILE A 451 0.635 -7.113 11.271 1.00 44.12 N ATOM 559 CA ILE A 451 -0.006 -6.905 9.978 1.00 10.42 C ATOM 560 C ILE A 451 0.839 -7.480 8.846 1.00 14.12 C ATOM 561 O ILE A 451 2.065 -7.523 8.935 1.00 41.04 O ATOM 562 CB ILE A 451 -0.256 -5.409 9.708 1.00 61.23 C ATOM 563 CG1 ILE A 451 -0.993 -4.772 10.887 1.00 2.43 C ATOM 564 CG2 ILE A 451 -1.049 -5.229 8.422 1.00 25.23 C ATOM 565 CD1 ILE A 451 -2.291 -5.465 11.235 1.00 54.30 C ATOM 0 H ILE A 451 0.772 -6.261 11.816 1.00 44.12 H new ATOM 0 HA ILE A 451 -0.963 -7.425 10.013 1.00 10.42 H new ATOM 0 HB ILE A 451 0.706 -4.910 9.592 1.00 61.23 H new ATOM 0 HG12 ILE A 451 -0.341 -4.781 11.760 1.00 2.43 H new ATOM 0 HG13 ILE A 451 -1.200 -3.727 10.654 1.00 2.43 H new ATOM 0 HG21 ILE A 451 -1.218 -4.167 8.244 1.00 25.23 H new ATOM 0 HG22 ILE A 451 -0.490 -5.652 7.587 1.00 25.23 H new ATOM 0 HG23 ILE A 451 -2.008 -5.739 8.512 1.00 25.23 H new ATOM 0 HD11 ILE A 451 -2.758 -4.959 12.080 1.00 54.30 H new ATOM 0 HD12 ILE A 451 -2.962 -5.433 10.377 1.00 54.30 H new ATOM 0 HD13 ILE A 451 -2.090 -6.503 11.500 1.00 54.30 H new ATOM 577 N MET A 452 0.173 -7.921 7.784 1.00 1.22 N ATOM 578 CA MET A 452 0.864 -8.491 6.633 1.00 65.03 C ATOM 579 C MET A 452 -0.038 -8.489 5.402 1.00 33.43 C ATOM 580 O MET A 452 -0.549 -9.533 4.993 1.00 3.14 O ATOM 581 CB MET A 452 1.323 -9.917 6.942 1.00 24.12 C ATOM 582 CG MET A 452 0.212 -10.813 7.464 1.00 35.50 C ATOM 583 SD MET A 452 0.669 -11.675 8.980 1.00 30.43 S ATOM 584 CE MET A 452 -0.579 -12.959 9.029 1.00 31.24 C ATOM 0 H MET A 452 -0.843 -7.895 7.696 1.00 1.22 H new ATOM 0 HA MET A 452 1.738 -7.874 6.422 1.00 65.03 H new ATOM 0 HB2 MET A 452 1.741 -10.359 6.038 1.00 24.12 H new ATOM 0 HB3 MET A 452 2.125 -9.880 7.679 1.00 24.12 H new ATOM 0 HG2 MET A 452 -0.679 -10.212 7.647 1.00 35.50 H new ATOM 0 HG3 MET A 452 -0.049 -11.545 6.699 1.00 35.50 H new ATOM 0 HE1 MET A 452 -0.429 -13.578 9.913 1.00 31.24 H new ATOM 0 HE2 MET A 452 -1.568 -12.503 9.068 1.00 31.24 H new ATOM 0 HE3 MET A 452 -0.500 -13.578 8.135 1.00 31.24 H new ATOM 594 N VAL A 453 -0.230 -7.312 4.817 1.00 52.04 N ATOM 595 CA VAL A 453 -1.070 -7.176 3.633 1.00 71.14 C ATOM 596 C VAL A 453 -0.340 -6.426 2.524 1.00 21.43 C ATOM 597 O VAL A 453 -0.406 -6.806 1.355 1.00 13.30 O ATOM 598 CB VAL A 453 -2.383 -6.438 3.957 1.00 30.11 C ATOM 599 CG1 VAL A 453 -3.424 -7.411 4.488 1.00 53.22 C ATOM 600 CG2 VAL A 453 -2.131 -5.318 4.954 1.00 43.25 C ATOM 0 H VAL A 453 0.184 -6.439 5.143 1.00 52.04 H new ATOM 0 HA VAL A 453 -1.303 -8.185 3.294 1.00 71.14 H new ATOM 0 HB VAL A 453 -2.768 -5.996 3.038 1.00 30.11 H new ATOM 0 HG11 VAL A 453 -4.345 -6.872 4.712 1.00 53.22 H new ATOM 0 HG12 VAL A 453 -3.624 -8.175 3.737 1.00 53.22 H new ATOM 0 HG13 VAL A 453 -3.050 -7.884 5.396 1.00 53.22 H new ATOM 0 HG21 VAL A 453 -3.069 -4.807 5.172 1.00 43.25 H new ATOM 0 HG22 VAL A 453 -1.723 -5.735 5.874 1.00 43.25 H new ATOM 0 HG23 VAL A 453 -1.420 -4.608 4.531 1.00 43.25 H new ATOM 610 N ALA A 454 0.358 -5.359 2.899 1.00 14.32 N ATOM 611 CA ALA A 454 1.104 -4.557 1.938 1.00 43.35 C ATOM 612 C ALA A 454 1.959 -5.438 1.034 1.00 71.11 C ATOM 613 O ALA A 454 2.226 -5.089 -0.116 1.00 71.42 O ATOM 614 CB ALA A 454 1.973 -3.539 2.661 1.00 40.22 C ATOM 0 H ALA A 454 0.422 -5.030 3.862 1.00 14.32 H new ATOM 0 HA ALA A 454 0.387 -4.026 1.312 1.00 43.35 H new ATOM 0 HB1 ALA A 454 2.524 -2.947 1.930 1.00 40.22 H new ATOM 0 HB2 ALA A 454 1.342 -2.881 3.259 1.00 40.22 H new ATOM 0 HB3 ALA A 454 2.676 -4.058 3.312 1.00 40.22 H new ATOM 620 N ARG A 455 2.386 -6.581 1.561 1.00 62.22 N ATOM 621 CA ARG A 455 3.213 -7.511 0.802 1.00 71.00 C ATOM 622 C ARG A 455 2.597 -7.796 -0.564 1.00 63.14 C ATOM 623 O ARG A 455 3.166 -7.445 -1.599 1.00 21.12 O ATOM 624 CB ARG A 455 3.389 -8.819 1.576 1.00 40.04 C ATOM 625 CG ARG A 455 4.842 -9.189 1.823 1.00 1.02 C ATOM 626 CD ARG A 455 5.282 -10.342 0.934 1.00 20.53 C ATOM 627 NE ARG A 455 6.465 -11.019 1.461 1.00 43.34 N ATOM 628 CZ ARG A 455 6.865 -12.219 1.057 1.00 30.24 C ATOM 629 NH1 ARG A 455 6.182 -12.872 0.128 1.00 42.12 N ATOM 630 NH2 ARG A 455 7.952 -12.769 1.584 1.00 21.23 N ATOM 0 H ARG A 455 2.173 -6.885 2.511 1.00 62.22 H new ATOM 0 HA ARG A 455 4.190 -7.050 0.653 1.00 71.00 H new ATOM 0 HB2 ARG A 455 2.876 -8.736 2.534 1.00 40.04 H new ATOM 0 HB3 ARG A 455 2.906 -9.626 1.024 1.00 40.04 H new ATOM 0 HG2 ARG A 455 5.476 -8.322 1.637 1.00 1.02 H new ATOM 0 HG3 ARG A 455 4.976 -9.463 2.869 1.00 1.02 H new ATOM 0 HD2 ARG A 455 4.466 -11.059 0.839 1.00 20.53 H new ATOM 0 HD3 ARG A 455 5.495 -9.967 -0.067 1.00 20.53 H new ATOM 0 HE ARG A 455 7.013 -10.544 2.178 1.00 43.34 H new ATOM 0 HH11 ARG A 455 5.346 -12.453 -0.279 1.00 42.12 H new ATOM 0 HH12 ARG A 455 6.492 -13.794 -0.180 1.00 42.12 H new ATOM 0 HH21 ARG A 455 8.480 -12.270 2.300 1.00 21.23 H new ATOM 0 HH22 ARG A 455 8.259 -13.691 1.273 1.00 21.23 H new ATOM 644 N ARG A 456 1.431 -8.434 -0.561 1.00 50.41 N ATOM 645 CA ARG A 456 0.738 -8.767 -1.801 1.00 1.43 C ATOM 646 C ARG A 456 -0.123 -7.599 -2.272 1.00 72.24 C ATOM 647 O ARG A 456 -0.240 -7.344 -3.471 1.00 3.34 O ATOM 648 CB ARG A 456 -0.131 -10.011 -1.605 1.00 21.13 C ATOM 649 CG ARG A 456 -0.448 -10.741 -2.899 1.00 24.51 C ATOM 650 CD ARG A 456 -1.636 -10.117 -3.615 1.00 70.42 C ATOM 651 NE ARG A 456 -2.615 -11.120 -4.027 1.00 2.23 N ATOM 652 CZ ARG A 456 -3.444 -11.725 -3.184 1.00 54.31 C ATOM 653 NH1 ARG A 456 -3.414 -11.431 -1.892 1.00 33.34 N ATOM 654 NH2 ARG A 456 -4.308 -12.626 -3.634 1.00 71.14 N ATOM 0 H ARG A 456 0.946 -8.731 0.286 1.00 50.41 H new ATOM 0 HA ARG A 456 1.488 -8.973 -2.565 1.00 1.43 H new ATOM 0 HB2 ARG A 456 0.377 -10.696 -0.926 1.00 21.13 H new ATOM 0 HB3 ARG A 456 -1.065 -9.720 -1.124 1.00 21.13 H new ATOM 0 HG2 ARG A 456 0.424 -10.720 -3.553 1.00 24.51 H new ATOM 0 HG3 ARG A 456 -0.660 -11.788 -2.684 1.00 24.51 H new ATOM 0 HD2 ARG A 456 -2.115 -9.391 -2.958 1.00 70.42 H new ATOM 0 HD3 ARG A 456 -1.286 -9.571 -4.491 1.00 70.42 H new ATOM 0 HE ARG A 456 -2.665 -11.369 -5.015 1.00 2.23 H new ATOM 0 HH11 ARG A 456 -2.753 -10.738 -1.542 1.00 33.34 H new ATOM 0 HH12 ARG A 456 -4.052 -11.898 -1.248 1.00 33.34 H new ATOM 0 HH21 ARG A 456 -4.336 -12.854 -4.628 1.00 71.14 H new ATOM 0 HH22 ARG A 456 -4.944 -13.090 -2.986 1.00 71.14 H new ATOM 668 N THR A 457 -0.729 -6.895 -1.321 1.00 20.14 N ATOM 669 CA THR A 457 -1.581 -5.756 -1.638 1.00 51.24 C ATOM 670 C THR A 457 -0.859 -4.762 -2.540 1.00 24.24 C ATOM 671 O THR A 457 -1.305 -4.477 -3.650 1.00 52.55 O ATOM 672 CB THR A 457 -2.046 -5.030 -0.363 1.00 13.22 C ATOM 673 OG1 THR A 457 -2.960 -5.857 0.367 1.00 30.31 O ATOM 674 CG2 THR A 457 -2.716 -3.708 -0.706 1.00 53.42 C ATOM 0 H THR A 457 -0.645 -7.094 -0.324 1.00 20.14 H new ATOM 0 HA THR A 457 -2.452 -6.150 -2.161 1.00 51.24 H new ATOM 0 HB THR A 457 -1.169 -4.827 0.252 1.00 13.22 H new ATOM 0 HG1 THR A 457 -2.458 -6.517 0.889 1.00 30.31 H new ATOM 0 HG21 THR A 457 -3.036 -3.214 0.211 1.00 53.42 H new ATOM 0 HG22 THR A 457 -2.010 -3.069 -1.235 1.00 53.42 H new ATOM 0 HG23 THR A 457 -3.583 -3.893 -1.340 1.00 53.42 H new ATOM 682 N VAL A 458 0.263 -4.238 -2.055 1.00 61.13 N ATOM 683 CA VAL A 458 1.050 -3.277 -2.819 1.00 41.23 C ATOM 684 C VAL A 458 1.322 -3.786 -4.230 1.00 61.43 C ATOM 685 O VAL A 458 1.252 -3.030 -5.199 1.00 13.35 O ATOM 686 CB VAL A 458 2.392 -2.974 -2.128 1.00 12.24 C ATOM 687 CG1 VAL A 458 3.276 -2.122 -3.025 1.00 61.15 C ATOM 688 CG2 VAL A 458 2.159 -2.289 -0.789 1.00 53.21 C ATOM 0 H VAL A 458 0.647 -4.463 -1.137 1.00 61.13 H new ATOM 0 HA VAL A 458 0.462 -2.361 -2.873 1.00 41.23 H new ATOM 0 HB VAL A 458 2.906 -3.917 -1.944 1.00 12.24 H new ATOM 0 HG11 VAL A 458 4.220 -1.919 -2.519 1.00 61.15 H new ATOM 0 HG12 VAL A 458 3.471 -2.655 -3.956 1.00 61.15 H new ATOM 0 HG13 VAL A 458 2.772 -1.181 -3.244 1.00 61.15 H new ATOM 0 HG21 VAL A 458 3.118 -2.082 -0.314 1.00 53.21 H new ATOM 0 HG22 VAL A 458 1.623 -1.353 -0.947 1.00 53.21 H new ATOM 0 HG23 VAL A 458 1.568 -2.941 -0.145 1.00 53.21 H new ATOM 698 N ALA A 459 1.631 -5.074 -4.340 1.00 15.42 N ATOM 699 CA ALA A 459 1.910 -5.686 -5.633 1.00 31.14 C ATOM 700 C ALA A 459 0.651 -5.761 -6.488 1.00 41.55 C ATOM 701 O ALA A 459 0.710 -5.633 -7.711 1.00 70.25 O ATOM 702 CB ALA A 459 2.505 -7.074 -5.442 1.00 54.44 C ATOM 0 H ALA A 459 1.694 -5.714 -3.548 1.00 15.42 H new ATOM 0 HA ALA A 459 2.634 -5.061 -6.155 1.00 31.14 H new ATOM 0 HB1 ALA A 459 2.709 -7.520 -6.416 1.00 54.44 H new ATOM 0 HB2 ALA A 459 3.434 -6.997 -4.877 1.00 54.44 H new ATOM 0 HB3 ALA A 459 1.799 -7.701 -4.897 1.00 54.44 H new ATOM 708 N LYS A 460 -0.489 -5.969 -5.838 1.00 70.51 N ATOM 709 CA LYS A 460 -1.764 -6.062 -6.538 1.00 43.32 C ATOM 710 C LYS A 460 -2.132 -4.726 -7.178 1.00 25.22 C ATOM 711 O LYS A 460 -2.551 -4.675 -8.334 1.00 52.01 O ATOM 712 CB LYS A 460 -2.870 -6.497 -5.574 1.00 61.43 C ATOM 713 CG LYS A 460 -3.422 -7.882 -5.867 1.00 41.14 C ATOM 714 CD LYS A 460 -4.750 -8.112 -5.167 1.00 32.43 C ATOM 715 CE LYS A 460 -5.292 -9.506 -5.444 1.00 22.11 C ATOM 716 NZ LYS A 460 -6.329 -9.906 -4.452 1.00 22.43 N ATOM 0 H LYS A 460 -0.556 -6.076 -4.826 1.00 70.51 H new ATOM 0 HA LYS A 460 -1.662 -6.809 -7.326 1.00 43.32 H new ATOM 0 HB2 LYS A 460 -2.481 -6.478 -4.556 1.00 61.43 H new ATOM 0 HB3 LYS A 460 -3.684 -5.774 -5.618 1.00 61.43 H new ATOM 0 HG2 LYS A 460 -3.551 -8.003 -6.943 1.00 41.14 H new ATOM 0 HG3 LYS A 460 -2.704 -8.636 -5.545 1.00 41.14 H new ATOM 0 HD2 LYS A 460 -4.625 -7.976 -4.093 1.00 32.43 H new ATOM 0 HD3 LYS A 460 -5.472 -7.367 -5.500 1.00 32.43 H new ATOM 0 HE2 LYS A 460 -5.718 -9.537 -6.447 1.00 22.11 H new ATOM 0 HE3 LYS A 460 -4.473 -10.225 -5.423 1.00 22.11 H new ATOM 0 HZ1 LYS A 460 -6.673 -10.862 -4.676 1.00 22.43 H new ATOM 0 HZ2 LYS A 460 -5.916 -9.901 -3.497 1.00 22.43 H new ATOM 0 HZ3 LYS A 460 -7.123 -9.235 -4.490 1.00 22.43 H new ATOM 730 N TYR A 461 -1.969 -3.648 -6.419 1.00 24.30 N ATOM 731 CA TYR A 461 -2.283 -2.312 -6.912 1.00 70.14 C ATOM 732 C TYR A 461 -1.144 -1.763 -7.765 1.00 61.21 C ATOM 733 O TYR A 461 -1.348 -0.884 -8.603 1.00 2.10 O ATOM 734 CB TYR A 461 -2.560 -1.367 -5.742 1.00 42.34 C ATOM 735 CG TYR A 461 -3.790 -1.733 -4.945 1.00 53.32 C ATOM 736 CD1 TYR A 461 -5.022 -1.896 -5.568 1.00 55.54 C ATOM 737 CD2 TYR A 461 -3.723 -1.917 -3.570 1.00 35.10 C ATOM 738 CE1 TYR A 461 -6.151 -2.230 -4.843 1.00 63.44 C ATOM 739 CE2 TYR A 461 -4.846 -2.253 -2.838 1.00 25.34 C ATOM 740 CZ TYR A 461 -6.057 -2.408 -3.479 1.00 60.20 C ATOM 741 OH TYR A 461 -7.177 -2.742 -2.753 1.00 41.42 O ATOM 0 H TYR A 461 -1.621 -3.673 -5.460 1.00 24.30 H new ATOM 0 HA TYR A 461 -3.176 -2.383 -7.534 1.00 70.14 H new ATOM 0 HB2 TYR A 461 -1.696 -1.362 -5.078 1.00 42.34 H new ATOM 0 HB3 TYR A 461 -2.674 -0.353 -6.125 1.00 42.34 H new ATOM 0 HD1 TYR A 461 -5.099 -1.759 -6.637 1.00 55.54 H new ATOM 0 HD2 TYR A 461 -2.777 -1.795 -3.064 1.00 35.10 H new ATOM 0 HE1 TYR A 461 -7.101 -2.351 -5.342 1.00 63.44 H new ATOM 0 HE2 TYR A 461 -4.776 -2.393 -1.769 1.00 25.34 H new ATOM 0 HH TYR A 461 -6.939 -2.831 -1.807 1.00 41.42 H new ATOM 751 N ARG A 462 0.057 -2.291 -7.548 1.00 5.13 N ATOM 752 CA ARG A 462 1.230 -1.855 -8.296 1.00 11.34 C ATOM 753 C ARG A 462 0.972 -1.916 -9.797 1.00 75.23 C ATOM 754 O ARG A 462 1.300 -0.986 -10.533 1.00 11.53 O ATOM 755 CB ARG A 462 2.439 -2.720 -7.939 1.00 20.43 C ATOM 756 CG ARG A 462 3.645 -2.481 -8.833 1.00 4.13 C ATOM 757 CD ARG A 462 4.883 -3.186 -8.300 1.00 12.31 C ATOM 758 NE ARG A 462 6.049 -2.961 -9.149 1.00 25.21 N ATOM 759 CZ ARG A 462 7.230 -3.532 -8.942 1.00 2.24 C ATOM 760 NH1 ARG A 462 7.401 -4.357 -7.919 1.00 33.04 N ATOM 761 NH2 ARG A 462 8.244 -3.278 -9.760 1.00 13.44 N ATOM 0 H ARG A 462 0.243 -3.021 -6.860 1.00 5.13 H new ATOM 0 HA ARG A 462 1.439 -0.821 -8.024 1.00 11.34 H new ATOM 0 HB2 ARG A 462 2.721 -2.526 -6.904 1.00 20.43 H new ATOM 0 HB3 ARG A 462 2.154 -3.770 -8.001 1.00 20.43 H new ATOM 0 HG2 ARG A 462 3.428 -2.836 -9.841 1.00 4.13 H new ATOM 0 HG3 ARG A 462 3.838 -1.411 -8.907 1.00 4.13 H new ATOM 0 HD2 ARG A 462 5.096 -2.832 -7.291 1.00 12.31 H new ATOM 0 HD3 ARG A 462 4.688 -4.256 -8.228 1.00 12.31 H new ATOM 0 HE ARG A 462 5.951 -2.331 -9.945 1.00 25.21 H new ATOM 0 HH11 ARG A 462 6.624 -4.555 -7.288 1.00 33.04 H new ATOM 0 HH12 ARG A 462 8.309 -4.794 -7.763 1.00 33.04 H new ATOM 0 HH21 ARG A 462 8.117 -2.644 -10.549 1.00 13.44 H new ATOM 0 HH22 ARG A 462 9.151 -3.717 -9.600 1.00 13.44 H new ATOM 775 N GLU A 463 0.381 -3.021 -10.246 1.00 44.30 N ATOM 776 CA GLU A 463 0.080 -3.204 -11.661 1.00 1.23 C ATOM 777 C GLU A 463 -0.693 -2.009 -12.212 1.00 25.20 C ATOM 778 O GLU A 463 -0.582 -1.675 -13.392 1.00 2.14 O ATOM 779 CB GLU A 463 -0.726 -4.487 -11.871 1.00 20.42 C ATOM 780 CG GLU A 463 0.099 -5.755 -11.721 1.00 51.10 C ATOM 781 CD GLU A 463 -0.478 -6.922 -12.500 1.00 63.20 C ATOM 782 OE1 GLU A 463 -1.376 -7.605 -11.968 1.00 15.33 O ATOM 783 OE2 GLU A 463 -0.028 -7.151 -13.643 1.00 60.24 O ATOM 0 H GLU A 463 0.102 -3.801 -9.651 1.00 44.30 H new ATOM 0 HA GLU A 463 1.024 -3.284 -12.200 1.00 1.23 H new ATOM 0 HB2 GLU A 463 -1.548 -4.511 -11.155 1.00 20.42 H new ATOM 0 HB3 GLU A 463 -1.171 -4.468 -12.866 1.00 20.42 H new ATOM 0 HG2 GLU A 463 1.117 -5.564 -12.061 1.00 51.10 H new ATOM 0 HG3 GLU A 463 0.160 -6.022 -10.666 1.00 51.10 H new ATOM 790 N SER A 464 -1.476 -1.370 -11.350 1.00 55.45 N ATOM 791 CA SER A 464 -2.273 -0.216 -11.750 1.00 23.04 C ATOM 792 C SER A 464 -2.152 0.908 -10.725 1.00 42.34 C ATOM 793 O SER A 464 -3.155 1.395 -10.201 1.00 50.11 O ATOM 794 CB SER A 464 -3.740 -0.614 -11.917 1.00 42.05 C ATOM 795 OG SER A 464 -3.915 -1.451 -13.047 1.00 73.21 O ATOM 0 H SER A 464 -1.576 -1.632 -10.369 1.00 55.45 H new ATOM 0 HA SER A 464 -1.892 0.144 -12.706 1.00 23.04 H new ATOM 0 HB2 SER A 464 -4.084 -1.130 -11.021 1.00 42.05 H new ATOM 0 HB3 SER A 464 -4.353 0.281 -12.025 1.00 42.05 H new ATOM 0 HG SER A 464 -4.861 -1.693 -13.131 1.00 73.21 H new ATOM 801 N LEU A 465 -0.920 1.316 -10.446 1.00 21.23 N ATOM 802 CA LEU A 465 -0.666 2.383 -9.484 1.00 33.21 C ATOM 803 C LEU A 465 -1.498 3.619 -9.810 1.00 11.31 C ATOM 804 O LEU A 465 -2.183 4.164 -8.945 1.00 53.35 O ATOM 805 CB LEU A 465 0.821 2.742 -9.471 1.00 44.55 C ATOM 806 CG LEU A 465 1.504 2.818 -10.837 1.00 52.25 C ATOM 807 CD1 LEU A 465 2.017 4.225 -11.101 1.00 2.52 C ATOM 808 CD2 LEU A 465 2.641 1.810 -10.921 1.00 21.24 C ATOM 0 H LEU A 465 -0.080 0.924 -10.872 1.00 21.23 H new ATOM 0 HA LEU A 465 -0.954 2.024 -8.496 1.00 33.21 H new ATOM 0 HB2 LEU A 465 0.938 3.705 -8.975 1.00 44.55 H new ATOM 0 HB3 LEU A 465 1.347 2.005 -8.864 1.00 44.55 H new ATOM 0 HG LEU A 465 0.769 2.572 -11.603 1.00 52.25 H new ATOM 0 HD11 LEU A 465 2.500 4.259 -12.078 1.00 2.52 H new ATOM 0 HD12 LEU A 465 1.182 4.926 -11.084 1.00 2.52 H new ATOM 0 HD13 LEU A 465 2.737 4.500 -10.331 1.00 2.52 H new ATOM 0 HD21 LEU A 465 3.116 1.878 -11.900 1.00 21.24 H new ATOM 0 HD22 LEU A 465 3.376 2.025 -10.145 1.00 21.24 H new ATOM 0 HD23 LEU A 465 2.247 0.804 -10.778 1.00 21.24 H new ATOM 820 N SER A 466 -1.434 4.055 -11.064 1.00 61.44 N ATOM 821 CA SER A 466 -2.180 5.227 -11.505 1.00 10.14 C ATOM 822 C SER A 466 -1.925 6.413 -10.579 1.00 75.54 C ATOM 823 O SER A 466 -2.788 7.274 -10.403 1.00 31.21 O ATOM 824 CB SER A 466 -3.678 4.917 -11.554 1.00 22.33 C ATOM 825 OG SER A 466 -4.390 5.944 -12.221 1.00 3.34 O ATOM 0 H SER A 466 -0.873 3.614 -11.793 1.00 61.44 H new ATOM 0 HA SER A 466 -1.838 5.489 -12.506 1.00 10.14 H new ATOM 0 HB2 SER A 466 -3.839 3.968 -12.065 1.00 22.33 H new ATOM 0 HB3 SER A 466 -4.062 4.803 -10.540 1.00 22.33 H new ATOM 0 HG SER A 466 -4.123 6.815 -11.859 1.00 3.34 H new ATOM 831 N ILE A 467 -0.734 6.450 -9.990 1.00 53.35 N ATOM 832 CA ILE A 467 -0.365 7.529 -9.083 1.00 42.24 C ATOM 833 C ILE A 467 -0.182 8.842 -9.837 1.00 42.32 C ATOM 834 O ILE A 467 0.342 8.879 -10.950 1.00 61.22 O ATOM 835 CB ILE A 467 0.931 7.204 -8.319 1.00 12.05 C ATOM 836 CG1 ILE A 467 0.605 6.639 -6.935 1.00 22.14 C ATOM 837 CG2 ILE A 467 1.801 8.446 -8.198 1.00 40.01 C ATOM 838 CD1 ILE A 467 0.781 5.139 -6.838 1.00 3.55 C ATOM 0 H ILE A 467 -0.009 5.745 -10.125 1.00 53.35 H new ATOM 0 HA ILE A 467 -1.181 7.634 -8.368 1.00 42.24 H new ATOM 0 HB ILE A 467 1.485 6.450 -8.878 1.00 12.05 H new ATOM 0 HG12 ILE A 467 1.244 7.120 -6.195 1.00 22.14 H new ATOM 0 HG13 ILE A 467 -0.424 6.893 -6.681 1.00 22.14 H new ATOM 0 HG21 ILE A 467 2.714 8.200 -7.655 1.00 40.01 H new ATOM 0 HG22 ILE A 467 2.058 8.809 -9.193 1.00 40.01 H new ATOM 0 HG23 ILE A 467 1.256 9.221 -7.659 1.00 40.01 H new ATOM 0 HD11 ILE A 467 0.533 4.808 -5.830 1.00 3.55 H new ATOM 0 HD12 ILE A 467 0.122 4.648 -7.554 1.00 3.55 H new ATOM 0 HD13 ILE A 467 1.816 4.879 -7.061 1.00 3.55 H new ATOM 850 N PRO A 468 -0.622 9.947 -9.217 1.00 20.11 N ATOM 851 CA PRO A 468 -0.515 11.284 -9.810 1.00 33.12 C ATOM 852 C PRO A 468 0.927 11.776 -9.874 1.00 72.24 C ATOM 853 O PRO A 468 1.831 11.206 -9.262 1.00 13.21 O ATOM 854 CB PRO A 468 -1.336 12.159 -8.861 1.00 11.43 C ATOM 855 CG PRO A 468 -1.298 11.443 -7.555 1.00 42.04 C ATOM 856 CD PRO A 468 -1.256 9.977 -7.889 1.00 12.44 C ATOM 0 HA PRO A 468 -0.868 11.302 -10.841 1.00 33.12 H new ATOM 0 HB2 PRO A 468 -0.910 13.159 -8.777 1.00 11.43 H new ATOM 0 HB3 PRO A 468 -2.359 12.277 -9.218 1.00 11.43 H new ATOM 0 HG2 PRO A 468 -0.424 11.736 -6.974 1.00 42.04 H new ATOM 0 HG3 PRO A 468 -2.175 11.681 -6.953 1.00 42.04 H new ATOM 0 HD2 PRO A 468 -0.679 9.414 -7.155 1.00 12.44 H new ATOM 0 HD3 PRO A 468 -2.255 9.541 -7.911 1.00 12.44 H new ATOM 864 N PRO A 469 1.150 12.859 -10.634 1.00 32.50 N ATOM 865 CA PRO A 469 2.481 13.452 -10.796 1.00 75.30 C ATOM 866 C PRO A 469 2.976 14.123 -9.519 1.00 63.05 C ATOM 867 O PRO A 469 2.225 14.275 -8.556 1.00 2.52 O ATOM 868 CB PRO A 469 2.275 14.490 -11.901 1.00 70.14 C ATOM 869 CG PRO A 469 0.829 14.841 -11.825 1.00 23.32 C ATOM 870 CD PRO A 469 0.120 13.588 -11.392 1.00 43.10 C ATOM 0 HA PRO A 469 3.235 12.702 -11.033 1.00 75.30 H new ATOM 0 HB2 PRO A 469 2.904 15.366 -11.744 1.00 70.14 H new ATOM 0 HB3 PRO A 469 2.533 14.084 -12.879 1.00 70.14 H new ATOM 0 HG2 PRO A 469 0.661 15.650 -11.114 1.00 23.32 H new ATOM 0 HG3 PRO A 469 0.460 15.184 -12.791 1.00 23.32 H new ATOM 0 HD2 PRO A 469 -0.750 13.811 -10.775 1.00 43.10 H new ATOM 0 HD3 PRO A 469 -0.234 13.011 -12.246 1.00 43.10 H new ATOM 878 N SER A 470 4.243 14.524 -9.519 1.00 71.41 N ATOM 879 CA SER A 470 4.838 15.176 -8.360 1.00 25.13 C ATOM 880 C SER A 470 4.887 14.227 -7.166 1.00 51.24 C ATOM 881 O SER A 470 5.093 14.651 -6.030 1.00 73.43 O ATOM 882 CB SER A 470 4.048 16.434 -7.993 1.00 41.12 C ATOM 883 OG SER A 470 4.908 17.548 -7.831 1.00 71.02 O ATOM 0 H SER A 470 4.877 14.408 -10.310 1.00 71.41 H new ATOM 0 HA SER A 470 5.858 15.459 -8.619 1.00 25.13 H new ATOM 0 HB2 SER A 470 3.315 16.647 -8.771 1.00 41.12 H new ATOM 0 HB3 SER A 470 3.493 16.262 -7.071 1.00 41.12 H new ATOM 0 HG SER A 470 4.378 18.339 -7.599 1.00 71.02 H new ATOM 889 N ASN A 471 4.694 12.939 -7.435 1.00 44.13 N ATOM 890 CA ASN A 471 4.714 11.929 -6.385 1.00 33.43 C ATOM 891 C ASN A 471 5.263 10.606 -6.912 1.00 11.11 C ATOM 892 O ASN A 471 4.965 9.541 -6.374 1.00 62.11 O ATOM 893 CB ASN A 471 3.307 11.720 -5.821 1.00 31.13 C ATOM 894 CG ASN A 471 3.258 11.887 -4.313 1.00 44.04 C ATOM 895 OD1 ASN A 471 4.273 11.756 -3.630 1.00 0.24 O ATOM 896 ND2 ASN A 471 2.073 12.178 -3.789 1.00 65.14 N ATOM 0 H ASN A 471 4.522 12.572 -8.371 1.00 44.13 H new ATOM 0 HA ASN A 471 5.369 12.283 -5.589 1.00 33.43 H new ATOM 0 HB2 ASN A 471 2.623 12.431 -6.285 1.00 31.13 H new ATOM 0 HB3 ASN A 471 2.957 10.722 -6.085 1.00 31.13 H new ATOM 0 HD21 ASN A 471 1.978 12.302 -2.781 1.00 65.14 H new ATOM 0 HD22 ASN A 471 1.258 12.277 -4.394 1.00 65.14 H new ATOM 903 N GLN A 472 6.067 10.686 -7.968 1.00 35.53 N ATOM 904 CA GLN A 472 6.658 9.494 -8.568 1.00 13.35 C ATOM 905 C GLN A 472 8.066 9.256 -8.032 1.00 75.11 C ATOM 906 O GLN A 472 8.556 8.126 -8.030 1.00 14.54 O ATOM 907 CB GLN A 472 6.696 9.631 -10.091 1.00 21.40 C ATOM 908 CG GLN A 472 5.478 10.334 -10.669 1.00 22.41 C ATOM 909 CD GLN A 472 4.983 9.686 -11.946 1.00 73.25 C ATOM 910 OE1 GLN A 472 5.023 10.289 -13.019 1.00 43.01 O ATOM 911 NE2 GLN A 472 4.510 8.449 -11.838 1.00 64.12 N ATOM 0 H GLN A 472 6.324 11.561 -8.425 1.00 35.53 H new ATOM 0 HA GLN A 472 6.038 8.638 -8.302 1.00 13.35 H new ATOM 0 HB2 GLN A 472 7.592 10.182 -10.376 1.00 21.40 H new ATOM 0 HB3 GLN A 472 6.777 8.639 -10.535 1.00 21.40 H new ATOM 0 HG2 GLN A 472 4.677 10.331 -9.930 1.00 22.41 H new ATOM 0 HG3 GLN A 472 5.725 11.377 -10.867 1.00 22.41 H new ATOM 0 HE21 GLN A 472 4.495 7.986 -10.929 1.00 64.12 H new ATOM 0 HE22 GLN A 472 4.162 7.962 -12.664 1.00 64.12 H new ATOM 920 N ARG A 473 8.711 10.325 -7.578 1.00 12.30 N ATOM 921 CA ARG A 473 10.062 10.232 -7.041 1.00 1.04 C ATOM 922 C ARG A 473 11.052 9.825 -8.128 1.00 61.53 C ATOM 923 O ARG A 473 12.191 9.456 -7.840 1.00 1.21 O ATOM 924 CB ARG A 473 10.108 9.224 -5.891 1.00 21.42 C ATOM 925 CG ARG A 473 11.180 9.529 -4.857 1.00 21.21 C ATOM 926 CD ARG A 473 11.567 8.284 -4.072 1.00 11.52 C ATOM 927 NE ARG A 473 12.976 7.946 -4.242 1.00 21.44 N ATOM 928 CZ ARG A 473 13.966 8.598 -3.642 1.00 4.33 C ATOM 929 NH1 ARG A 473 13.701 9.619 -2.837 1.00 73.24 N ATOM 930 NH2 ARG A 473 15.224 8.231 -3.846 1.00 63.52 N ATOM 0 H ARG A 473 8.319 11.267 -7.572 1.00 12.30 H new ATOM 0 HA ARG A 473 10.345 11.215 -6.665 1.00 1.04 H new ATOM 0 HB2 ARG A 473 9.136 9.202 -5.399 1.00 21.42 H new ATOM 0 HB3 ARG A 473 10.281 8.228 -6.299 1.00 21.42 H new ATOM 0 HG2 ARG A 473 12.061 9.936 -5.354 1.00 21.21 H new ATOM 0 HG3 ARG A 473 10.818 10.295 -4.171 1.00 21.21 H new ATOM 0 HD2 ARG A 473 11.357 8.443 -3.014 1.00 11.52 H new ATOM 0 HD3 ARG A 473 10.951 7.445 -4.396 1.00 11.52 H new ATOM 0 HE ARG A 473 13.214 7.166 -4.855 1.00 21.44 H new ATOM 0 HH11 ARG A 473 12.735 9.905 -2.677 1.00 73.24 H new ATOM 0 HH12 ARG A 473 14.463 10.118 -2.378 1.00 73.24 H new ATOM 0 HH21 ARG A 473 15.433 7.447 -4.464 1.00 63.52 H new ATOM 0 HH22 ARG A 473 15.983 8.733 -3.385 1.00 63.52 H new ATOM 944 N LYS A 474 10.610 9.894 -9.380 1.00 20.54 N ATOM 945 CA LYS A 474 11.457 9.533 -10.511 1.00 61.13 C ATOM 946 C LYS A 474 10.871 10.061 -11.817 1.00 72.35 C ATOM 947 O LYS A 474 10.586 9.291 -12.734 1.00 63.51 O ATOM 948 CB LYS A 474 11.619 8.013 -10.589 1.00 44.43 C ATOM 949 CG LYS A 474 12.849 7.572 -11.364 1.00 43.42 C ATOM 950 CD LYS A 474 13.919 7.016 -10.441 1.00 63.41 C ATOM 951 CE LYS A 474 15.314 7.238 -11.008 1.00 4.33 C ATOM 952 NZ LYS A 474 16.370 7.036 -9.977 1.00 63.25 N ATOM 0 H LYS A 474 9.670 10.197 -9.637 1.00 20.54 H new ATOM 0 HA LYS A 474 12.436 9.988 -10.361 1.00 61.13 H new ATOM 0 HB2 LYS A 474 11.673 7.609 -9.578 1.00 44.43 H new ATOM 0 HB3 LYS A 474 10.732 7.585 -11.057 1.00 44.43 H new ATOM 0 HG2 LYS A 474 12.567 6.814 -12.095 1.00 43.42 H new ATOM 0 HG3 LYS A 474 13.252 8.418 -11.921 1.00 43.42 H new ATOM 0 HD2 LYS A 474 13.842 7.493 -9.464 1.00 63.41 H new ATOM 0 HD3 LYS A 474 13.752 5.950 -10.289 1.00 63.41 H new ATOM 0 HE2 LYS A 474 15.482 6.553 -11.839 1.00 4.33 H new ATOM 0 HE3 LYS A 474 15.386 8.249 -11.409 1.00 4.33 H new ATOM 0 HZ1 LYS A 474 17.305 7.196 -10.402 1.00 63.25 H new ATOM 0 HZ2 LYS A 474 16.225 7.707 -9.196 1.00 63.25 H new ATOM 0 HZ3 LYS A 474 16.318 6.063 -9.612 1.00 63.25 H new ATOM 966 N GLN A 475 10.696 11.375 -11.894 1.00 22.05 N ATOM 967 CA GLN A 475 10.146 12.004 -13.090 1.00 13.15 C ATOM 968 C GLN A 475 11.256 12.578 -13.963 1.00 50.03 C ATOM 969 O GLN A 475 12.361 12.842 -13.487 1.00 22.20 O ATOM 970 CB GLN A 475 9.161 13.109 -12.702 1.00 24.13 C ATOM 971 CG GLN A 475 9.722 14.096 -11.691 1.00 44.10 C ATOM 972 CD GLN A 475 9.057 13.982 -10.334 1.00 22.14 C ATOM 973 OE1 GLN A 475 8.707 14.987 -9.714 1.00 45.15 O ATOM 974 NE2 GLN A 475 8.880 12.753 -9.863 1.00 4.32 N ATOM 0 H GLN A 475 10.927 12.026 -11.143 1.00 22.05 H new ATOM 0 HA GLN A 475 9.618 11.241 -13.662 1.00 13.15 H new ATOM 0 HB2 GLN A 475 8.863 13.651 -13.600 1.00 24.13 H new ATOM 0 HB3 GLN A 475 8.260 12.653 -12.291 1.00 24.13 H new ATOM 0 HG2 GLN A 475 10.794 13.929 -11.582 1.00 44.10 H new ATOM 0 HG3 GLN A 475 9.595 15.110 -12.070 1.00 44.10 H new ATOM 0 HE21 GLN A 475 9.185 11.948 -10.410 1.00 4.32 H new ATOM 0 HE22 GLN A 475 8.439 12.614 -8.954 1.00 4.32 H new ATOM 983 N LEU A 476 10.956 12.769 -15.243 1.00 32.51 N ATOM 984 CA LEU A 476 11.929 13.311 -16.185 1.00 73.30 C ATOM 985 C LEU A 476 13.124 12.374 -16.333 1.00 2.54 C ATOM 986 O LEU A 476 13.361 11.513 -15.485 1.00 41.51 O ATOM 987 CB LEU A 476 12.401 14.690 -15.722 1.00 21.15 C ATOM 988 CG LEU A 476 12.261 15.824 -16.739 1.00 12.45 C ATOM 989 CD1 LEU A 476 10.794 16.121 -17.007 1.00 15.04 C ATOM 990 CD2 LEU A 476 12.978 17.073 -16.246 1.00 61.43 C ATOM 0 H LEU A 476 10.046 12.556 -15.652 1.00 32.51 H new ATOM 0 HA LEU A 476 11.444 13.407 -17.157 1.00 73.30 H new ATOM 0 HB2 LEU A 476 11.842 14.961 -14.826 1.00 21.15 H new ATOM 0 HB3 LEU A 476 13.449 14.615 -15.433 1.00 21.15 H new ATOM 0 HG LEU A 476 12.724 15.508 -17.674 1.00 12.45 H new ATOM 0 HD11 LEU A 476 10.713 16.930 -17.733 1.00 15.04 H new ATOM 0 HD12 LEU A 476 10.309 15.229 -17.403 1.00 15.04 H new ATOM 0 HD13 LEU A 476 10.307 16.417 -16.078 1.00 15.04 H new ATOM 0 HD21 LEU A 476 12.868 17.870 -16.982 1.00 61.43 H new ATOM 0 HD22 LEU A 476 12.544 17.392 -15.298 1.00 61.43 H new ATOM 0 HD23 LEU A 476 14.036 16.853 -16.104 1.00 61.43 H new ATOM 1002 N VAL A 477 13.876 12.550 -17.415 1.00 4.05 N ATOM 1003 CA VAL A 477 15.049 11.724 -17.673 1.00 73.04 C ATOM 1004 C VAL A 477 16.224 12.570 -18.150 1.00 2.25 C ATOM 1005 O VAL A 477 16.067 13.752 -18.455 1.00 73.50 O ATOM 1006 CB VAL A 477 14.751 10.639 -18.725 1.00 40.15 C ATOM 1007 CG1 VAL A 477 13.738 9.639 -18.189 1.00 42.41 C ATOM 1008 CG2 VAL A 477 14.256 11.272 -20.016 1.00 41.11 C ATOM 0 H VAL A 477 13.693 13.257 -18.127 1.00 4.05 H new ATOM 0 HA VAL A 477 15.311 11.244 -16.730 1.00 73.04 H new ATOM 0 HB VAL A 477 15.675 10.103 -18.941 1.00 40.15 H new ATOM 0 HG11 VAL A 477 13.540 8.880 -18.946 1.00 42.41 H new ATOM 0 HG12 VAL A 477 14.136 9.163 -17.293 1.00 42.41 H new ATOM 0 HG13 VAL A 477 12.811 10.157 -17.943 1.00 42.41 H new ATOM 0 HG21 VAL A 477 14.050 10.491 -20.748 1.00 41.11 H new ATOM 0 HG22 VAL A 477 13.343 11.834 -19.819 1.00 41.11 H new ATOM 0 HG23 VAL A 477 15.019 11.945 -20.407 1.00 41.11 H new ATOM 1018 N ALA A 478 17.401 11.956 -18.213 1.00 61.11 N ATOM 1019 CA ALA A 478 18.603 12.653 -18.656 1.00 34.32 C ATOM 1020 C ALA A 478 19.656 11.668 -19.153 1.00 12.32 C ATOM 1021 O ALA A 478 19.657 10.500 -18.767 1.00 25.42 O ATOM 1022 CB ALA A 478 19.164 13.506 -17.528 1.00 33.12 C ATOM 0 H ALA A 478 17.548 10.978 -17.963 1.00 61.11 H new ATOM 0 HA ALA A 478 18.331 13.304 -19.487 1.00 34.32 H new ATOM 0 HB1 ALA A 478 20.061 14.021 -17.873 1.00 33.12 H new ATOM 0 HB2 ALA A 478 18.419 14.241 -17.222 1.00 33.12 H new ATOM 0 HB3 ALA A 478 19.414 12.869 -16.680 1.00 33.12 H new ATOM 1028 N ASN A 479 20.551 12.149 -20.010 1.00 70.44 N ATOM 1029 CA ASN A 479 21.609 11.310 -20.561 1.00 2.02 C ATOM 1030 C ASN A 479 22.700 11.060 -19.523 1.00 34.21 C ATOM 1031 O ASN A 479 23.401 10.050 -19.576 1.00 65.21 O ATOM 1032 CB ASN A 479 22.213 11.965 -21.804 1.00 52.11 C ATOM 1033 CG ASN A 479 21.781 11.280 -23.087 1.00 13.34 C ATOM 1034 OD1 ASN A 479 22.179 10.149 -23.363 1.00 34.33 O ATOM 1035 ND2 ASN A 479 20.962 11.965 -23.876 1.00 33.34 N ATOM 0 H ASN A 479 20.565 13.115 -20.338 1.00 70.44 H new ATOM 0 HA ASN A 479 21.171 10.352 -20.841 1.00 2.02 H new ATOM 0 HB2 ASN A 479 21.918 13.014 -21.838 1.00 52.11 H new ATOM 0 HB3 ASN A 479 23.300 11.942 -21.731 1.00 52.11 H new ATOM 0 HD21 ASN A 479 20.637 11.556 -24.752 1.00 33.34 H new ATOM 0 HD22 ASN A 479 20.658 12.900 -23.606 1.00 33.34 H new ATOM 1042 N SER A 480 22.835 11.986 -18.579 1.00 52.23 N ATOM 1043 CA SER A 480 23.842 11.868 -17.532 1.00 11.02 C ATOM 1044 C SER A 480 23.407 10.860 -16.472 1.00 64.12 C ATOM 1045 O SER A 480 24.238 10.186 -15.863 1.00 40.24 O ATOM 1046 CB SER A 480 24.094 13.230 -16.882 1.00 23.52 C ATOM 1047 OG SER A 480 23.848 14.284 -17.797 1.00 5.43 O ATOM 0 H SER A 480 22.260 12.826 -18.518 1.00 52.23 H new ATOM 0 HA SER A 480 24.766 11.514 -17.989 1.00 11.02 H new ATOM 0 HB2 SER A 480 23.452 13.344 -16.009 1.00 23.52 H new ATOM 0 HB3 SER A 480 25.124 13.283 -16.529 1.00 23.52 H new ATOM 0 HG SER A 480 24.014 15.144 -17.358 1.00 5.43 H new ATOM 1053 N SER A 481 22.099 10.763 -16.258 1.00 33.41 N ATOM 1054 CA SER A 481 21.553 9.839 -15.270 1.00 4.34 C ATOM 1055 C SER A 481 21.903 8.397 -15.621 1.00 63.13 C ATOM 1056 O SER A 481 22.019 7.542 -14.743 1.00 52.24 O ATOM 1057 CB SER A 481 20.034 9.999 -15.176 1.00 2.12 C ATOM 1058 OG SER A 481 19.677 10.878 -14.123 1.00 25.13 O ATOM 0 H SER A 481 21.398 11.312 -16.755 1.00 33.41 H new ATOM 0 HA SER A 481 21.997 10.076 -14.303 1.00 4.34 H new ATOM 0 HB2 SER A 481 19.647 10.382 -16.120 1.00 2.12 H new ATOM 0 HB3 SER A 481 19.572 9.025 -15.013 1.00 2.12 H new ATOM 0 HG SER A 481 18.702 10.964 -14.085 1.00 25.13 H new ATOM 1064 N SER A 482 22.072 8.134 -16.914 1.00 1.13 N ATOM 1065 CA SER A 482 22.405 6.795 -17.383 1.00 31.30 C ATOM 1066 C SER A 482 23.899 6.522 -17.233 1.00 3.52 C ATOM 1067 O SER A 482 24.303 5.484 -16.709 1.00 73.23 O ATOM 1068 CB SER A 482 21.990 6.626 -18.846 1.00 52.51 C ATOM 1069 OG SER A 482 20.760 5.929 -18.949 1.00 72.35 O ATOM 0 H SER A 482 21.984 8.831 -17.654 1.00 1.13 H new ATOM 0 HA SER A 482 21.858 6.077 -16.772 1.00 31.30 H new ATOM 0 HB2 SER A 482 21.898 7.605 -19.317 1.00 52.51 H new ATOM 0 HB3 SER A 482 22.765 6.084 -19.387 1.00 52.51 H new ATOM 0 HG SER A 482 20.515 5.835 -19.893 1.00 72.35 H new ATOM 1075 N VAL A 483 24.715 7.463 -17.697 1.00 0.50 N ATOM 1076 CA VAL A 483 26.165 7.326 -17.614 1.00 10.41 C ATOM 1077 C VAL A 483 26.687 7.818 -16.268 1.00 74.43 C ATOM 1078 O VAL A 483 25.910 8.170 -15.381 1.00 14.25 O ATOM 1079 CB VAL A 483 26.867 8.108 -18.740 1.00 73.53 C ATOM 1080 CG1 VAL A 483 26.392 7.624 -20.103 1.00 32.45 C ATOM 1081 CG2 VAL A 483 26.627 9.602 -18.583 1.00 31.20 C ATOM 0 H VAL A 483 24.397 8.328 -18.134 1.00 0.50 H new ATOM 0 HA VAL A 483 26.390 6.265 -17.723 1.00 10.41 H new ATOM 0 HB VAL A 483 27.939 7.927 -18.669 1.00 73.53 H new ATOM 0 HG11 VAL A 483 26.899 8.188 -20.886 1.00 32.45 H new ATOM 0 HG12 VAL A 483 26.621 6.564 -20.213 1.00 32.45 H new ATOM 0 HG13 VAL A 483 25.316 7.773 -20.187 1.00 32.45 H new ATOM 0 HG21 VAL A 483 27.131 10.138 -19.388 1.00 31.20 H new ATOM 0 HG22 VAL A 483 25.557 9.805 -18.626 1.00 31.20 H new ATOM 0 HG23 VAL A 483 27.021 9.935 -17.623 1.00 31.20 H new ATOM 1091 N ASP A 484 28.007 7.838 -16.125 1.00 12.43 N ATOM 1092 CA ASP A 484 28.635 8.287 -14.887 1.00 54.45 C ATOM 1093 C ASP A 484 28.260 7.372 -13.725 1.00 14.10 C ATOM 1094 O ASP A 484 27.616 7.799 -12.766 1.00 40.53 O ATOM 1095 CB ASP A 484 28.220 9.725 -14.573 1.00 4.11 C ATOM 1096 CG ASP A 484 29.242 10.449 -13.718 1.00 55.11 C ATOM 1097 OD1 ASP A 484 29.345 10.124 -12.515 1.00 45.43 O ATOM 1098 OD2 ASP A 484 29.938 11.338 -14.250 1.00 42.41 O ATOM 0 H ASP A 484 28.663 7.549 -16.850 1.00 12.43 H new ATOM 0 HA ASP A 484 29.716 8.249 -15.022 1.00 54.45 H new ATOM 0 HB2 ASP A 484 28.079 10.271 -15.506 1.00 4.11 H new ATOM 0 HB3 ASP A 484 27.259 9.719 -14.058 1.00 4.11 H new ATOM 1103 N LYS A 485 28.667 6.111 -13.816 1.00 63.11 N ATOM 1104 CA LYS A 485 28.377 5.134 -12.774 1.00 14.34 C ATOM 1105 C LYS A 485 29.490 5.103 -11.732 1.00 11.41 C ATOM 1106 O LYS A 485 30.597 5.584 -11.976 1.00 12.12 O ATOM 1107 CB LYS A 485 28.196 3.743 -13.385 1.00 64.34 C ATOM 1108 CG LYS A 485 27.395 2.793 -12.513 1.00 10.43 C ATOM 1109 CD LYS A 485 26.730 1.704 -13.337 1.00 21.13 C ATOM 1110 CE LYS A 485 27.681 0.545 -13.597 1.00 52.42 C ATOM 1111 NZ LYS A 485 27.608 0.073 -15.008 1.00 54.41 N ATOM 0 H LYS A 485 29.200 5.741 -14.603 1.00 63.11 H new ATOM 0 HA LYS A 485 27.451 5.430 -12.282 1.00 14.34 H new ATOM 0 HB2 LYS A 485 27.700 3.842 -14.350 1.00 64.34 H new ATOM 0 HB3 LYS A 485 29.178 3.308 -13.574 1.00 64.34 H new ATOM 0 HG2 LYS A 485 28.051 2.339 -11.771 1.00 10.43 H new ATOM 0 HG3 LYS A 485 26.635 3.352 -11.967 1.00 10.43 H new ATOM 0 HD2 LYS A 485 25.845 1.340 -12.815 1.00 21.13 H new ATOM 0 HD3 LYS A 485 26.392 2.119 -14.286 1.00 21.13 H new ATOM 0 HE2 LYS A 485 28.701 0.854 -13.370 1.00 52.42 H new ATOM 0 HE3 LYS A 485 27.441 -0.279 -12.925 1.00 52.42 H new ATOM 0 HZ1 LYS A 485 28.271 -0.717 -15.145 1.00 54.41 H new ATOM 0 HZ2 LYS A 485 26.641 -0.246 -15.218 1.00 54.41 H new ATOM 0 HZ3 LYS A 485 27.862 0.852 -15.648 1.00 54.41 H new ATOM 1125 N LEU A 486 29.190 4.533 -10.570 1.00 21.21 N ATOM 1126 CA LEU A 486 30.166 4.437 -9.490 1.00 32.13 C ATOM 1127 C LEU A 486 30.446 2.980 -9.136 1.00 32.33 C ATOM 1128 O LEU A 486 30.898 2.675 -8.033 1.00 21.30 O ATOM 1129 CB LEU A 486 29.664 5.187 -8.254 1.00 31.40 C ATOM 1130 CG LEU A 486 30.534 6.350 -7.776 1.00 52.35 C ATOM 1131 CD1 LEU A 486 30.644 7.414 -8.858 1.00 21.41 C ATOM 1132 CD2 LEU A 486 29.969 6.947 -6.496 1.00 1.25 C ATOM 0 H LEU A 486 28.279 4.130 -10.352 1.00 21.21 H new ATOM 0 HA LEU A 486 31.095 4.893 -9.832 1.00 32.13 H new ATOM 0 HB2 LEU A 486 28.666 5.570 -8.466 1.00 31.40 H new ATOM 0 HB3 LEU A 486 29.565 4.473 -7.436 1.00 31.40 H new ATOM 0 HG LEU A 486 31.533 5.969 -7.566 1.00 52.35 H new ATOM 0 HD11 LEU A 486 31.267 8.234 -8.500 1.00 21.41 H new ATOM 0 HD12 LEU A 486 31.094 6.980 -9.751 1.00 21.41 H new ATOM 0 HD13 LEU A 486 29.650 7.792 -9.099 1.00 21.41 H new ATOM 0 HD21 LEU A 486 30.601 7.773 -6.170 1.00 1.25 H new ATOM 0 HD22 LEU A 486 28.959 7.313 -6.680 1.00 1.25 H new ATOM 0 HD23 LEU A 486 29.942 6.183 -5.719 1.00 1.25 H new ATOM 1144 N ALA A 487 30.175 2.085 -10.081 1.00 31.22 N ATOM 1145 CA ALA A 487 30.402 0.660 -9.870 1.00 13.12 C ATOM 1146 C ALA A 487 31.887 0.323 -9.951 1.00 53.31 C ATOM 1147 O ALA A 487 32.328 -0.703 -9.434 1.00 23.03 O ATOM 1148 CB ALA A 487 29.617 -0.154 -10.887 1.00 15.00 C ATOM 0 H ALA A 487 29.798 2.321 -10.999 1.00 31.22 H new ATOM 0 HA ALA A 487 30.053 0.405 -8.869 1.00 13.12 H new ATOM 0 HB1 ALA A 487 29.795 -1.216 -10.719 1.00 15.00 H new ATOM 0 HB2 ALA A 487 28.553 0.057 -10.779 1.00 15.00 H new ATOM 0 HB3 ALA A 487 29.939 0.113 -11.893 1.00 15.00 H new ATOM 1154 N ALA A 488 32.651 1.192 -10.604 1.00 34.33 N ATOM 1155 CA ALA A 488 34.087 0.986 -10.752 1.00 34.45 C ATOM 1156 C ALA A 488 34.807 1.172 -9.421 1.00 21.43 C ATOM 1157 O ALA A 488 35.618 0.337 -9.021 1.00 0.23 O ATOM 1158 CB ALA A 488 34.652 1.935 -11.797 1.00 71.34 C ATOM 0 H ALA A 488 32.300 2.045 -11.039 1.00 34.33 H new ATOM 0 HA ALA A 488 34.250 -0.039 -11.084 1.00 34.45 H new ATOM 0 HB1 ALA A 488 35.725 1.770 -11.897 1.00 71.34 H new ATOM 0 HB2 ALA A 488 34.166 1.752 -12.755 1.00 71.34 H new ATOM 0 HB3 ALA A 488 34.471 2.965 -11.489 1.00 71.34 H new ATOM 1164 N ALA A 489 34.508 2.274 -8.740 1.00 72.42 N ATOM 1165 CA ALA A 489 35.127 2.569 -7.454 1.00 31.42 C ATOM 1166 C ALA A 489 34.938 1.415 -6.476 1.00 71.54 C ATOM 1167 O ALA A 489 35.771 1.189 -5.597 1.00 51.11 O ATOM 1168 CB ALA A 489 34.553 3.853 -6.875 1.00 50.31 C ATOM 0 H ALA A 489 33.841 2.977 -9.058 1.00 72.42 H new ATOM 0 HA ALA A 489 36.197 2.702 -7.616 1.00 31.42 H new ATOM 0 HB1 ALA A 489 35.024 4.061 -5.914 1.00 50.31 H new ATOM 0 HB2 ALA A 489 34.745 4.679 -7.560 1.00 50.31 H new ATOM 0 HB3 ALA A 489 33.478 3.740 -6.735 1.00 50.31 H new ATOM 1174 N LEU A 490 33.838 0.686 -6.633 1.00 51.33 N ATOM 1175 CA LEU A 490 33.539 -0.446 -5.763 1.00 51.04 C ATOM 1176 C LEU A 490 34.547 -1.572 -5.969 1.00 34.43 C ATOM 1177 O LEU A 490 34.801 -2.363 -5.061 1.00 22.50 O ATOM 1178 CB LEU A 490 32.123 -0.959 -6.029 1.00 54.52 C ATOM 1179 CG LEU A 490 31.068 -0.587 -4.986 1.00 61.55 C ATOM 1180 CD1 LEU A 490 29.710 -0.400 -5.644 1.00 2.30 C ATOM 1181 CD2 LEU A 490 30.994 -1.652 -3.901 1.00 10.32 C ATOM 0 H LEU A 490 33.138 0.859 -7.355 1.00 51.33 H new ATOM 0 HA LEU A 490 33.607 -0.106 -4.730 1.00 51.04 H new ATOM 0 HB2 LEU A 490 31.797 -0.580 -6.998 1.00 54.52 H new ATOM 0 HB3 LEU A 490 32.160 -2.046 -6.107 1.00 54.52 H new ATOM 0 HG LEU A 490 31.358 0.357 -4.524 1.00 61.55 H new ATOM 0 HD11 LEU A 490 28.972 -0.136 -4.887 1.00 2.30 H new ATOM 0 HD12 LEU A 490 29.771 0.397 -6.385 1.00 2.30 H new ATOM 0 HD13 LEU A 490 29.412 -1.327 -6.133 1.00 2.30 H new ATOM 0 HD21 LEU A 490 30.239 -1.372 -3.167 1.00 10.32 H new ATOM 0 HD22 LEU A 490 30.727 -2.609 -4.349 1.00 10.32 H new ATOM 0 HD23 LEU A 490 31.963 -1.739 -3.409 1.00 10.32 H new ATOM 1193 N GLU A 491 35.118 -1.636 -7.167 1.00 65.42 N ATOM 1194 CA GLU A 491 36.100 -2.665 -7.491 1.00 74.12 C ATOM 1195 C GLU A 491 37.521 -2.142 -7.297 1.00 54.10 C ATOM 1196 O GLU A 491 38.467 -2.645 -7.904 1.00 4.13 O ATOM 1197 CB GLU A 491 35.914 -3.144 -8.933 1.00 12.11 C ATOM 1198 CG GLU A 491 34.732 -4.081 -9.115 1.00 12.20 C ATOM 1199 CD GLU A 491 34.305 -4.207 -10.563 1.00 63.05 C ATOM 1200 OE1 GLU A 491 33.455 -3.404 -11.004 1.00 74.41 O ATOM 1201 OE2 GLU A 491 34.820 -5.109 -11.259 1.00 1.51 O ATOM 0 H GLU A 491 34.918 -0.988 -7.929 1.00 65.42 H new ATOM 0 HA GLU A 491 35.944 -3.505 -6.814 1.00 74.12 H new ATOM 0 HB2 GLU A 491 35.783 -2.277 -9.581 1.00 12.11 H new ATOM 0 HB3 GLU A 491 36.822 -3.651 -9.259 1.00 12.11 H new ATOM 0 HG2 GLU A 491 34.992 -5.067 -8.730 1.00 12.20 H new ATOM 0 HG3 GLU A 491 33.892 -3.719 -8.523 1.00 12.20 H new ATOM 1208 N HIS A 492 37.661 -1.130 -6.447 1.00 3.15 N ATOM 1209 CA HIS A 492 38.965 -0.539 -6.172 1.00 4.43 C ATOM 1210 C HIS A 492 39.963 -1.604 -5.728 1.00 64.12 C ATOM 1211 O HIS A 492 39.580 -2.723 -5.385 1.00 72.12 O ATOM 1212 CB HIS A 492 38.843 0.541 -5.096 1.00 42.14 C ATOM 1213 CG HIS A 492 38.787 1.933 -5.648 1.00 43.00 C ATOM 1214 ND1 HIS A 492 37.958 2.911 -5.140 1.00 71.33 N ATOM 1215 CD2 HIS A 492 39.466 2.509 -6.668 1.00 71.13 C ATOM 1216 CE1 HIS A 492 38.128 4.028 -5.826 1.00 32.12 C ATOM 1217 NE2 HIS A 492 39.038 3.810 -6.759 1.00 14.42 N ATOM 0 H HIS A 492 36.888 -0.703 -5.937 1.00 3.15 H new ATOM 0 HA HIS A 492 39.331 -0.085 -7.093 1.00 4.43 H new ATOM 0 HB2 HIS A 492 37.944 0.356 -4.507 1.00 42.14 H new ATOM 0 HB3 HIS A 492 39.691 0.462 -4.416 1.00 42.14 H new ATOM 0 HD2 HIS A 492 40.207 2.033 -7.294 1.00 71.13 H new ATOM 0 HE1 HIS A 492 37.611 4.960 -5.653 1.00 32.12 H new ATOM 0 HE2 HIS A 492 39.369 4.497 -7.437 1.00 14.42 H new ATOM 1225 N HIS A 493 41.244 -1.250 -5.738 1.00 41.24 N ATOM 1226 CA HIS A 493 42.297 -2.176 -5.337 1.00 61.53 C ATOM 1227 C HIS A 493 42.683 -1.960 -3.877 1.00 23.52 C ATOM 1228 O HIS A 493 42.575 -0.851 -3.353 1.00 53.35 O ATOM 1229 CB HIS A 493 43.524 -2.005 -6.233 1.00 31.42 C ATOM 1230 CG HIS A 493 44.041 -0.600 -6.279 1.00 74.12 C ATOM 1231 ND1 HIS A 493 43.697 0.296 -7.269 1.00 33.04 N ATOM 1232 CD2 HIS A 493 44.880 0.063 -5.449 1.00 72.44 C ATOM 1233 CE1 HIS A 493 44.303 1.449 -7.047 1.00 31.22 C ATOM 1234 NE2 HIS A 493 45.027 1.333 -5.948 1.00 15.41 N ATOM 0 H HIS A 493 41.578 -0.328 -6.020 1.00 41.24 H new ATOM 0 HA HIS A 493 41.916 -3.191 -5.447 1.00 61.53 H new ATOM 0 HB2 HIS A 493 44.317 -2.664 -5.879 1.00 31.42 H new ATOM 0 HB3 HIS A 493 43.272 -2.324 -7.244 1.00 31.42 H new ATOM 0 HD2 HIS A 493 45.347 -0.334 -4.560 1.00 72.44 H new ATOM 0 HE1 HIS A 493 44.221 2.335 -7.659 1.00 31.22 H new ATOM 0 HE2 HIS A 493 45.602 2.068 -5.537 1.00 15.41 H new ATOM 1242 N HIS A 494 43.134 -3.027 -3.225 1.00 11.34 N ATOM 1243 CA HIS A 494 43.536 -2.955 -1.824 1.00 44.55 C ATOM 1244 C HIS A 494 44.072 -4.298 -1.343 1.00 21.22 C ATOM 1245 O HIS A 494 43.732 -5.347 -1.892 1.00 73.31 O ATOM 1246 CB HIS A 494 42.356 -2.521 -0.955 1.00 72.24 C ATOM 1247 CG HIS A 494 42.684 -1.405 -0.012 1.00 41.32 C ATOM 1248 ND1 HIS A 494 42.682 -1.553 1.359 1.00 50.52 N ATOM 1249 CD2 HIS A 494 43.028 -0.117 -0.250 1.00 20.32 C ATOM 1250 CE1 HIS A 494 43.008 -0.404 1.924 1.00 45.05 C ATOM 1251 NE2 HIS A 494 43.224 0.483 0.969 1.00 2.33 N ATOM 0 H HIS A 494 43.230 -3.952 -3.644 1.00 11.34 H new ATOM 0 HA HIS A 494 44.332 -2.215 -1.737 1.00 44.55 H new ATOM 0 HB2 HIS A 494 41.535 -2.210 -1.601 1.00 72.24 H new ATOM 0 HB3 HIS A 494 42.003 -3.378 -0.381 1.00 72.24 H new ATOM 0 HD2 HIS A 494 43.129 0.351 -1.218 1.00 20.32 H new ATOM 0 HE1 HIS A 494 43.085 -0.221 2.986 1.00 45.05 H new ATOM 0 HE2 HIS A 494 43.493 1.456 1.114 1.00 2.33 H new ATOM 1259 N HIS A 495 44.912 -4.260 -0.313 1.00 65.23 N ATOM 1260 CA HIS A 495 45.496 -5.476 0.242 1.00 2.15 C ATOM 1261 C HIS A 495 45.261 -5.552 1.748 1.00 22.31 C ATOM 1262 O HIS A 495 44.549 -6.433 2.232 1.00 30.21 O ATOM 1263 CB HIS A 495 46.995 -5.530 -0.054 1.00 63.35 C ATOM 1264 CG HIS A 495 47.312 -5.916 -1.467 1.00 21.32 C ATOM 1265 ND1 HIS A 495 47.354 -7.225 -1.897 1.00 31.11 N ATOM 1266 CD2 HIS A 495 47.601 -5.156 -2.549 1.00 20.20 C ATOM 1267 CE1 HIS A 495 47.658 -7.254 -3.183 1.00 2.13 C ATOM 1268 NE2 HIS A 495 47.813 -6.011 -3.602 1.00 52.24 N ATOM 0 H HIS A 495 45.203 -3.401 0.154 1.00 65.23 H new ATOM 0 HA HIS A 495 45.010 -6.330 -0.229 1.00 2.15 H new ATOM 0 HB2 HIS A 495 47.434 -4.554 0.155 1.00 63.35 H new ATOM 0 HB3 HIS A 495 47.466 -6.243 0.623 1.00 63.35 H new ATOM 0 HD2 HIS A 495 47.655 -4.078 -2.579 1.00 20.20 H new ATOM 0 HE1 HIS A 495 47.762 -8.143 -3.788 1.00 2.13 H new ATOM 0 HE2 HIS A 495 48.052 -5.732 -4.554 1.00 52.24 H new ATOM 1276 N HIS A 496 45.864 -4.624 2.484 1.00 54.23 N ATOM 1277 CA HIS A 496 45.720 -4.586 3.935 1.00 74.41 C ATOM 1278 C HIS A 496 46.284 -3.287 4.504 1.00 42.35 C ATOM 1279 O HIS A 496 46.863 -2.480 3.777 1.00 24.51 O ATOM 1280 CB HIS A 496 46.428 -5.783 4.570 1.00 13.20 C ATOM 1281 CG HIS A 496 47.861 -5.921 4.156 1.00 4.12 C ATOM 1282 ND1 HIS A 496 48.448 -7.135 3.869 1.00 32.12 N ATOM 1283 CD2 HIS A 496 48.825 -4.987 3.980 1.00 30.11 C ATOM 1284 CE1 HIS A 496 49.711 -6.942 3.536 1.00 65.41 C ATOM 1285 NE2 HIS A 496 49.965 -5.647 3.595 1.00 22.21 N ATOM 0 H HIS A 496 46.457 -3.888 2.100 1.00 54.23 H new ATOM 0 HA HIS A 496 44.657 -4.634 4.171 1.00 74.41 H new ATOM 0 HB2 HIS A 496 46.379 -5.690 5.655 1.00 13.20 H new ATOM 0 HB3 HIS A 496 45.892 -6.694 4.304 1.00 13.20 H new ATOM 0 HD2 HIS A 496 48.717 -3.921 4.117 1.00 30.11 H new ATOM 0 HE1 HIS A 496 50.417 -7.712 3.262 1.00 65.41 H new ATOM 0 HE2 HIS A 496 50.863 -5.209 3.388 1.00 22.21 H new ATOM 1293 N HIS A 497 46.107 -3.091 5.807 1.00 62.41 N ATOM 1294 CA HIS A 497 46.599 -1.890 6.472 1.00 15.40 C ATOM 1295 C HIS A 497 46.107 -0.634 5.757 1.00 3.44 C ATOM 1296 O HIS A 497 46.376 0.486 6.196 1.00 71.34 O ATOM 1297 CB HIS A 497 48.126 -1.897 6.523 1.00 21.52 C ATOM 1298 CG HIS A 497 48.683 -2.586 7.731 1.00 13.41 C ATOM 1299 ND1 HIS A 497 50.033 -2.666 7.996 1.00 32.05 N ATOM 1300 CD2 HIS A 497 48.062 -3.227 8.748 1.00 41.22 C ATOM 1301 CE1 HIS A 497 50.219 -3.328 9.124 1.00 15.11 C ATOM 1302 NE2 HIS A 497 49.039 -3.679 9.601 1.00 14.50 N ATOM 0 H HIS A 497 45.627 -3.748 6.422 1.00 62.41 H new ATOM 0 HA HIS A 497 46.211 -1.884 7.490 1.00 15.40 H new ATOM 0 HB2 HIS A 497 48.509 -2.386 5.627 1.00 21.52 H new ATOM 0 HB3 HIS A 497 48.487 -0.869 6.503 1.00 21.52 H new ATOM 0 HD2 HIS A 497 46.997 -3.359 8.867 1.00 41.22 H new ATOM 0 HE1 HIS A 497 51.174 -3.545 9.579 1.00 15.11 H new ATOM 0 HE2 HIS A 497 48.879 -4.201 10.463 1.00 14.50 H new TER 1310 HIS A 497