USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 764 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 467 ASN : amide:sc= 0.0296 K(o=0.087,f=-6.5!) USER MOD Set 1.2: A 477 LYS NZ :NH3+ 146:sc= 0.0576 (180deg=-0.396) USER MOD Set 1.3: A 479 GLN :FLIP amide:sc= 0 F(o=-0.58,f=0.087) USER MOD Set 2.1: A 453 TYR OH : rot 178:sc= 0.867 USER MOD Set 2.2: A 458 SER OG : rot -106:sc= 0.0729 USER MOD Set 3.1: A 398 GLN : amide:sc= 0.351 K(o=0.64,f=-2.4!) USER MOD Set 3.2: A 435 LYS NZ :NH3+ -176:sc= 0.285 (180deg=0) USER MOD Set 4.1: A 411 HIS : no HD1:sc= -1.6 X(o=-1.6,f=-2) USER MOD Set 4.2: A 447 CYS SG : rot 180:sc= 0 USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -3 GLY N :NH3+ 133:sc= 0.0176 (180deg=0) USER MOD Single : A 399 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 ASN : amide:sc= -0.0319 K(o=-0.032,f=-0.93) USER MOD Single : A 410 TYR OH : rot 180:sc= 0 USER MOD Single : A 414 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 419 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.5!) USER MOD Single : A 423 GLN :FLIP amide:sc= -0.195 F(o=-1.5!,f=-0.19) USER MOD Single : A 424 MET CE :methyl 147:sc= -0.147 (180deg=-1.34!) USER MOD Single : A 426 MET CE :methyl -173:sc= -0.173 (180deg=-0.398) USER MOD Single : A 430 ASN : amide:sc= -0.437 K(o=-0.44,f=-1.9!) USER MOD Single : A 433 SER OG : rot -150:sc= 0 USER MOD Single : A 440 LYS NZ :NH3+ -160:sc= -0.104 (180deg=-0.485) USER MOD Single : A 441 GLN : amide:sc=-0.00464 K(o=-0.0046,f=-2.9!) USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 445 SER OG : rot 180:sc= 0 USER MOD Single : A 446 LYS NZ :NH3+ -157:sc= 0.493 (180deg=0.342) USER MOD Single : A 452 SER OG : rot 180:sc= -0.0666 USER MOD Single : A 455 ASN : amide:sc= -1.24 K(o=-1.2,f=-6.5!) USER MOD Single : A 460 GLN :FLIP amide:sc= -0.0716 F(o=-0.97,f=-0.072) USER MOD Single : A 464 GLN : amide:sc= -0.114 K(o=-0.11,f=-1.6!) USER MOD Single : A 466 MET CE :methyl -167:sc= 0 (180deg=-0.279) USER MOD Single : A 470 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 473 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0.00901 (180deg=0.00901) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 LYS NZ :NH3+ -133:sc= 0.0461 (180deg=-0.0142) USER MOD Single : A 485 ASN :FLIP amide:sc= -0.0612 F(o=-0.77,f=-0.061) USER MOD Single : A 487 SER OG : rot 180:sc= 0 USER MOD Single : A 488 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 490 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 -12.889 -10.547 1.762 1.00 2.42 N ATOM 2 CA GLY A -3 -12.882 -10.291 3.224 1.00 32.32 C ATOM 3 C GLY A -3 -11.706 -9.439 3.643 1.00 14.40 C ATOM 4 O GLY A -3 -10.623 -9.543 3.059 1.00 40.12 O ATOM 0 H1 GLY A -3 -13.058 -11.558 1.587 1.00 2.42 H new ATOM 0 H2 GLY A -3 -13.643 -9.988 1.315 1.00 2.42 H new ATOM 0 H3 GLY A -3 -11.970 -10.275 1.357 1.00 2.42 H new ATOM 0 HA2 GLY A -3 -13.809 -9.795 3.510 1.00 32.32 H new ATOM 0 HA3 GLY A -3 -12.851 -11.241 3.758 1.00 32.32 H new ATOM 10 N SER A -2 -11.913 -8.602 4.655 1.00 22.54 N ATOM 11 CA SER A -2 -10.868 -7.707 5.144 1.00 43.30 C ATOM 12 C SER A -2 -9.894 -8.457 6.056 1.00 2.43 C ATOM 13 O SER A -2 -10.299 -9.067 7.048 1.00 24.13 O ATOM 14 CB SER A -2 -11.507 -6.526 5.888 1.00 5.01 C ATOM 15 OG SER A -2 -12.377 -5.802 5.029 1.00 20.11 O ATOM 0 H SER A -2 -12.799 -8.524 5.155 1.00 22.54 H new ATOM 0 HA SER A -2 -10.303 -7.326 4.293 1.00 43.30 H new ATOM 0 HB2 SER A -2 -12.062 -6.892 6.752 1.00 5.01 H new ATOM 0 HB3 SER A -2 -10.728 -5.864 6.267 1.00 5.01 H new ATOM 0 HG SER A -2 -12.776 -5.055 5.522 1.00 20.11 H new ATOM 21 N HIS A -1 -8.611 -8.427 5.697 1.00 24.34 N ATOM 22 CA HIS A -1 -7.563 -9.111 6.451 1.00 54.21 C ATOM 23 C HIS A -1 -6.396 -8.158 6.692 1.00 74.33 C ATOM 24 O HIS A -1 -6.286 -7.134 6.009 1.00 22.44 O ATOM 25 CB HIS A -1 -7.085 -10.369 5.700 1.00 71.21 C ATOM 26 CG HIS A -1 -7.994 -11.548 5.863 1.00 11.13 C ATOM 27 ND1 HIS A -1 -7.883 -12.444 6.906 1.00 13.23 N ATOM 28 CD2 HIS A -1 -9.035 -11.974 5.113 1.00 30.04 C ATOM 29 CE1 HIS A -1 -8.814 -13.371 6.785 1.00 32.11 C ATOM 30 NE2 HIS A -1 -9.525 -13.106 5.707 1.00 3.34 N ATOM 0 H HIS A -1 -8.270 -7.928 4.876 1.00 24.34 H new ATOM 0 HA HIS A -1 -7.970 -9.425 7.412 1.00 54.21 H new ATOM 0 HB2 HIS A -1 -6.994 -10.136 4.639 1.00 71.21 H new ATOM 0 HB3 HIS A -1 -6.090 -10.637 6.054 1.00 71.21 H new ATOM 0 HD2 HIS A -1 -9.410 -11.508 4.214 1.00 30.04 H new ATOM 0 HE1 HIS A -1 -8.967 -14.204 7.455 1.00 32.11 H new ATOM 0 HE2 HIS A -1 -10.314 -13.657 5.369 1.00 3.34 H new ATOM 39 N MET A 0 -5.564 -8.471 7.690 1.00 71.23 N ATOM 40 CA MET A 0 -4.355 -7.692 7.988 1.00 21.34 C ATOM 41 C MET A 0 -3.333 -7.783 6.833 1.00 32.14 C ATOM 42 O MET A 0 -3.322 -8.762 6.082 1.00 42.42 O ATOM 43 CB MET A 0 -3.731 -8.212 9.291 1.00 61.41 C ATOM 44 CG MET A 0 -2.733 -7.259 9.942 1.00 71.42 C ATOM 45 SD MET A 0 -1.946 -7.962 11.399 1.00 43.15 S ATOM 46 CE MET A 0 -0.898 -6.601 11.906 1.00 5.51 C ATOM 0 H MET A 0 -5.707 -9.267 8.312 1.00 71.23 H new ATOM 0 HA MET A 0 -4.631 -6.644 8.103 1.00 21.34 H new ATOM 0 HB2 MET A 0 -4.530 -8.422 10.002 1.00 61.41 H new ATOM 0 HB3 MET A 0 -3.230 -9.158 9.086 1.00 61.41 H new ATOM 0 HG2 MET A 0 -1.967 -6.990 9.215 1.00 71.42 H new ATOM 0 HG3 MET A 0 -3.245 -6.338 10.220 1.00 71.42 H new ATOM 0 HE1 MET A 0 -0.343 -6.883 12.801 1.00 5.51 H new ATOM 0 HE2 MET A 0 -0.199 -6.362 11.105 1.00 5.51 H new ATOM 0 HE3 MET A 0 -1.514 -5.728 12.122 1.00 5.51 H new ATOM 56 N GLN A 398 -2.498 -6.733 6.718 1.00 35.15 N ATOM 57 CA GLN A 398 -1.454 -6.604 5.677 1.00 61.41 C ATOM 58 C GLN A 398 -0.516 -7.833 5.610 1.00 41.33 C ATOM 59 O GLN A 398 0.127 -8.180 6.598 1.00 21.33 O ATOM 60 CB GLN A 398 -0.585 -5.311 5.922 1.00 2.22 C ATOM 61 CG GLN A 398 -0.141 -5.028 7.394 1.00 24.15 C ATOM 62 CD GLN A 398 -1.053 -4.065 8.168 1.00 63.33 C ATOM 63 OE1 GLN A 398 -2.240 -3.928 7.876 1.00 4.42 O ATOM 64 NE2 GLN A 398 -0.488 -3.412 9.189 1.00 12.15 N ATOM 0 H GLN A 398 -2.528 -5.937 7.355 1.00 35.15 H new ATOM 0 HA GLN A 398 -1.981 -6.532 4.726 1.00 61.41 H new ATOM 0 HB2 GLN A 398 0.311 -5.382 5.305 1.00 2.22 H new ATOM 0 HB3 GLN A 398 -1.150 -4.450 5.566 1.00 2.22 H new ATOM 0 HG2 GLN A 398 -0.095 -5.974 7.933 1.00 24.15 H new ATOM 0 HG3 GLN A 398 0.869 -4.618 7.382 1.00 24.15 H new ATOM 0 HE21 GLN A 398 0.500 -3.552 9.400 1.00 12.15 H new ATOM 0 HE22 GLN A 398 -1.045 -2.774 9.757 1.00 12.15 H new ATOM 73 N LYS A 399 -0.441 -8.491 4.440 1.00 53.32 N ATOM 74 CA LYS A 399 0.544 -9.561 4.266 1.00 70.43 C ATOM 75 C LYS A 399 1.776 -8.971 3.564 1.00 15.41 C ATOM 76 O LYS A 399 1.734 -8.675 2.365 1.00 13.24 O ATOM 77 CB LYS A 399 0.008 -10.784 3.408 1.00 73.21 C ATOM 78 CG LYS A 399 -1.230 -11.606 3.914 1.00 62.25 C ATOM 79 CD LYS A 399 -1.071 -13.131 3.648 1.00 52.13 C ATOM 80 CE LYS A 399 0.155 -13.728 4.365 1.00 60.04 C ATOM 81 NZ LYS A 399 1.072 -14.410 3.408 1.00 53.33 N ATOM 0 H LYS A 399 -1.031 -8.307 3.629 1.00 53.32 H new ATOM 0 HA LYS A 399 0.779 -9.949 5.257 1.00 70.43 H new ATOM 0 HB2 LYS A 399 -0.237 -10.403 2.416 1.00 73.21 H new ATOM 0 HB3 LYS A 399 0.835 -11.483 3.286 1.00 73.21 H new ATOM 0 HG2 LYS A 399 -1.364 -11.437 4.982 1.00 62.25 H new ATOM 0 HG3 LYS A 399 -2.131 -11.244 3.419 1.00 62.25 H new ATOM 0 HD2 LYS A 399 -1.970 -13.650 3.979 1.00 52.13 H new ATOM 0 HD3 LYS A 399 -0.980 -13.302 2.575 1.00 52.13 H new ATOM 0 HE2 LYS A 399 0.694 -12.936 4.885 1.00 60.04 H new ATOM 0 HE3 LYS A 399 -0.176 -14.439 5.122 1.00 60.04 H new ATOM 0 HZ1 LYS A 399 1.886 -14.800 3.925 1.00 53.33 H new ATOM 0 HZ2 LYS A 399 0.564 -15.181 2.930 1.00 53.33 H new ATOM 0 HZ3 LYS A 399 1.407 -13.725 2.700 1.00 53.33 H new ATOM 95 N GLU A 400 2.875 -8.814 4.316 1.00 2.43 N ATOM 96 CA GLU A 400 4.213 -8.698 3.709 1.00 61.23 C ATOM 97 C GLU A 400 4.715 -10.141 3.518 1.00 21.31 C ATOM 98 O GLU A 400 4.499 -10.957 4.428 1.00 3.13 O ATOM 99 CB GLU A 400 5.183 -7.785 4.569 1.00 3.42 C ATOM 100 CG GLU A 400 5.309 -8.104 6.084 1.00 2.31 C ATOM 101 CD GLU A 400 6.443 -7.329 6.745 1.00 13.41 C ATOM 102 OE1 GLU A 400 6.204 -6.199 7.230 1.00 40.51 O ATOM 103 OE2 GLU A 400 7.578 -7.854 6.799 1.00 25.12 O ATOM 0 H GLU A 400 2.867 -8.765 5.335 1.00 2.43 H new ATOM 0 HA GLU A 400 4.178 -8.188 2.746 1.00 61.23 H new ATOM 0 HB2 GLU A 400 6.178 -7.843 4.129 1.00 3.42 H new ATOM 0 HB3 GLU A 400 4.850 -6.752 4.469 1.00 3.42 H new ATOM 0 HG2 GLU A 400 4.370 -7.865 6.583 1.00 2.31 H new ATOM 0 HG3 GLU A 400 5.477 -9.173 6.215 1.00 2.31 H new ATOM 110 N GLY A 401 5.280 -10.516 2.319 1.00 42.41 N ATOM 111 CA GLY A 401 5.523 -11.924 2.034 1.00 61.11 C ATOM 112 C GLY A 401 6.589 -12.582 2.932 1.00 3.11 C ATOM 113 O GLY A 401 7.288 -11.871 3.661 1.00 61.24 O ATOM 0 H GLY A 401 5.556 -9.870 1.579 1.00 42.41 H new ATOM 0 HA2 GLY A 401 4.586 -12.471 2.143 1.00 61.11 H new ATOM 0 HA3 GLY A 401 5.831 -12.023 0.993 1.00 61.11 H new ATOM 117 N PRO A 402 6.714 -13.955 2.932 1.00 63.42 N ATOM 118 CA PRO A 402 7.508 -14.687 3.926 1.00 12.22 C ATOM 119 C PRO A 402 8.999 -14.416 3.881 1.00 12.21 C ATOM 120 O PRO A 402 9.484 -13.615 3.071 1.00 12.11 O ATOM 121 CB PRO A 402 7.240 -16.172 3.611 1.00 14.34 C ATOM 122 CG PRO A 402 6.844 -16.202 2.191 1.00 73.25 C ATOM 123 CD PRO A 402 6.086 -14.932 1.990 1.00 0.14 C ATOM 0 HA PRO A 402 7.213 -14.373 4.927 1.00 12.22 H new ATOM 0 HB2 PRO A 402 8.129 -16.778 3.784 1.00 14.34 H new ATOM 0 HB3 PRO A 402 6.452 -16.573 4.248 1.00 14.34 H new ATOM 0 HG2 PRO A 402 7.714 -16.253 1.537 1.00 73.25 H new ATOM 0 HG3 PRO A 402 6.227 -17.073 1.969 1.00 73.25 H new ATOM 0 HD2 PRO A 402 6.158 -14.588 0.958 1.00 0.14 H new ATOM 0 HD3 PRO A 402 5.026 -15.066 2.208 1.00 0.14 H new ATOM 131 N GLU A 403 9.674 -15.121 4.805 1.00 2.24 N ATOM 132 CA GLU A 403 11.138 -15.244 4.906 1.00 71.44 C ATOM 133 C GLU A 403 11.918 -14.990 3.565 1.00 61.25 C ATOM 134 O GLU A 403 11.913 -15.838 2.663 1.00 21.03 O ATOM 135 CB GLU A 403 11.287 -16.742 5.272 1.00 51.53 C ATOM 136 CG GLU A 403 11.185 -16.953 6.754 1.00 45.05 C ATOM 137 CD GLU A 403 10.761 -18.362 7.139 1.00 34.34 C ATOM 138 OE1 GLU A 403 9.551 -18.647 7.115 1.00 5.41 O ATOM 139 OE2 GLU A 403 11.638 -19.174 7.489 1.00 42.15 O ATOM 0 H GLU A 403 9.191 -15.645 5.535 1.00 2.24 H new ATOM 0 HA GLU A 403 11.546 -14.511 5.602 1.00 71.44 H new ATOM 0 HB2 GLU A 403 10.514 -17.321 4.766 1.00 51.53 H new ATOM 0 HB3 GLU A 403 12.248 -17.112 4.915 1.00 51.53 H new ATOM 0 HG2 GLU A 403 12.150 -16.735 7.211 1.00 45.05 H new ATOM 0 HG3 GLU A 403 10.469 -16.242 7.166 1.00 45.05 H new ATOM 146 N GLY A 404 12.545 -13.779 3.438 1.00 50.21 N ATOM 147 CA GLY A 404 13.455 -13.497 2.349 1.00 25.22 C ATOM 148 C GLY A 404 12.958 -12.450 1.356 1.00 32.23 C ATOM 149 O GLY A 404 13.797 -11.738 0.808 1.00 73.21 O ATOM 0 H GLY A 404 12.418 -13.004 4.089 1.00 50.21 H new ATOM 0 HA2 GLY A 404 14.405 -13.161 2.765 1.00 25.22 H new ATOM 0 HA3 GLY A 404 13.653 -14.424 1.810 1.00 25.22 H new ATOM 153 N ALA A 405 11.631 -12.309 1.087 1.00 73.51 N ATOM 154 CA ALA A 405 11.216 -11.138 0.329 1.00 10.04 C ATOM 155 C ALA A 405 10.142 -10.273 1.000 1.00 12.33 C ATOM 156 O ALA A 405 9.071 -10.741 1.372 1.00 73.32 O ATOM 157 CB ALA A 405 10.782 -11.572 -1.039 1.00 60.14 C ATOM 0 H ALA A 405 10.890 -12.952 1.368 1.00 73.51 H new ATOM 0 HA ALA A 405 12.086 -10.484 0.272 1.00 10.04 H new ATOM 0 HB1 ALA A 405 10.469 -10.701 -1.615 1.00 60.14 H new ATOM 0 HB2 ALA A 405 11.613 -12.063 -1.546 1.00 60.14 H new ATOM 0 HB3 ALA A 405 9.948 -12.268 -0.952 1.00 60.14 H new ATOM 163 N ASN A 406 10.460 -8.988 1.122 1.00 75.35 N ATOM 164 CA ASN A 406 9.450 -7.896 1.328 1.00 30.32 C ATOM 165 C ASN A 406 9.832 -6.652 0.393 1.00 60.31 C ATOM 166 O ASN A 406 10.807 -5.974 0.713 1.00 54.42 O ATOM 167 CB ASN A 406 9.253 -7.579 2.901 1.00 73.42 C ATOM 168 CG ASN A 406 10.407 -7.959 3.836 1.00 63.41 C ATOM 169 OD1 ASN A 406 11.586 -7.825 3.519 1.00 53.22 O ATOM 170 ND2 ASN A 406 10.042 -8.501 5.007 1.00 0.21 N ATOM 0 H ASN A 406 11.421 -8.649 1.084 1.00 75.35 H new ATOM 0 HA ASN A 406 8.454 -8.205 1.010 1.00 30.32 H new ATOM 0 HB2 ASN A 406 9.065 -6.511 3.011 1.00 73.42 H new ATOM 0 HB3 ASN A 406 8.356 -8.097 3.241 1.00 73.42 H new ATOM 0 HD21 ASN A 406 10.753 -8.817 5.666 1.00 0.21 H new ATOM 0 HD22 ASN A 406 9.053 -8.597 5.238 1.00 0.21 H new ATOM 177 N LEU A 407 9.103 -6.307 -0.771 1.00 53.11 N ATOM 178 CA LEU A 407 9.776 -5.538 -1.851 1.00 34.24 C ATOM 179 C LEU A 407 9.044 -4.158 -1.870 1.00 15.10 C ATOM 180 O LEU A 407 7.878 -4.138 -2.246 1.00 72.03 O ATOM 181 CB LEU A 407 9.689 -6.377 -3.254 1.00 31.53 C ATOM 182 CG LEU A 407 10.387 -7.794 -3.353 1.00 14.04 C ATOM 183 CD1 LEU A 407 11.714 -7.903 -2.584 1.00 23.34 C ATOM 184 CD2 LEU A 407 9.457 -8.873 -2.865 1.00 14.35 C ATOM 0 H LEU A 407 8.126 -6.545 -0.944 1.00 53.11 H new ATOM 0 HA LEU A 407 10.843 -5.378 -1.695 1.00 34.24 H new ATOM 0 HB2 LEU A 407 8.633 -6.515 -3.489 1.00 31.53 H new ATOM 0 HB3 LEU A 407 10.111 -5.748 -4.038 1.00 31.53 H new ATOM 0 HG LEU A 407 10.620 -7.923 -4.410 1.00 14.04 H new ATOM 0 HD11 LEU A 407 12.124 -8.906 -2.705 1.00 23.34 H new ATOM 0 HD12 LEU A 407 12.422 -7.172 -2.975 1.00 23.34 H new ATOM 0 HD13 LEU A 407 11.538 -7.709 -1.526 1.00 23.34 H new ATOM 0 HD21 LEU A 407 9.952 -9.841 -2.940 1.00 14.35 H new ATOM 0 HD22 LEU A 407 9.190 -8.681 -1.826 1.00 14.35 H new ATOM 0 HD23 LEU A 407 8.554 -8.879 -3.476 1.00 14.35 H new ATOM 196 N PHE A 408 9.652 -2.975 -1.447 1.00 30.21 N ATOM 197 CA PHE A 408 8.743 -1.841 -1.095 1.00 33.24 C ATOM 198 C PHE A 408 8.571 -0.768 -2.221 1.00 1.21 C ATOM 199 O PHE A 408 9.496 0.011 -2.442 1.00 43.30 O ATOM 200 CB PHE A 408 9.243 -1.084 0.164 1.00 24.44 C ATOM 201 CG PHE A 408 9.700 -1.902 1.363 1.00 43.14 C ATOM 202 CD1 PHE A 408 11.029 -2.283 1.485 1.00 62.54 C ATOM 203 CD2 PHE A 408 8.818 -2.264 2.378 1.00 44.24 C ATOM 204 CE1 PHE A 408 11.453 -3.010 2.577 1.00 60.40 C ATOM 205 CE2 PHE A 408 9.239 -2.990 3.472 1.00 11.34 C ATOM 206 CZ PHE A 408 10.560 -3.366 3.571 1.00 65.41 C ATOM 0 H PHE A 408 10.654 -2.807 -1.354 1.00 30.21 H new ATOM 0 HA PHE A 408 7.782 -2.327 -0.927 1.00 33.24 H new ATOM 0 HB2 PHE A 408 10.073 -0.446 -0.139 1.00 24.44 H new ATOM 0 HB3 PHE A 408 8.440 -0.426 0.497 1.00 24.44 H new ATOM 0 HD1 PHE A 408 11.737 -2.008 0.718 1.00 62.54 H new ATOM 0 HD2 PHE A 408 7.781 -1.970 2.307 1.00 44.24 H new ATOM 0 HE1 PHE A 408 12.489 -3.303 2.657 1.00 60.40 H new ATOM 0 HE2 PHE A 408 8.537 -3.262 4.246 1.00 11.34 H new ATOM 0 HZ PHE A 408 10.898 -3.938 4.423 1.00 65.41 H new ATOM 216 N ILE A 409 7.358 -0.628 -2.857 1.00 41.25 N ATOM 217 CA ILE A 409 7.215 0.266 -4.053 1.00 42.51 C ATOM 218 C ILE A 409 6.501 1.604 -3.774 1.00 31.15 C ATOM 219 O ILE A 409 5.367 1.651 -3.279 1.00 63.34 O ATOM 220 CB ILE A 409 6.557 -0.490 -5.274 1.00 15.34 C ATOM 221 CG1 ILE A 409 5.925 -1.885 -4.916 1.00 44.23 C ATOM 222 CG2 ILE A 409 7.599 -0.701 -6.377 1.00 13.32 C ATOM 223 CD1 ILE A 409 4.448 -1.891 -4.500 1.00 34.44 C ATOM 0 H ILE A 409 6.501 -1.103 -2.573 1.00 41.25 H new ATOM 0 HA ILE A 409 8.237 0.536 -4.320 1.00 42.51 H new ATOM 0 HB ILE A 409 5.740 0.152 -5.604 1.00 15.34 H new ATOM 0 HG12 ILE A 409 6.037 -2.540 -5.780 1.00 44.23 H new ATOM 0 HG13 ILE A 409 6.508 -2.324 -4.106 1.00 44.23 H new ATOM 0 HG21 ILE A 409 7.140 -1.223 -7.216 1.00 13.32 H new ATOM 0 HG22 ILE A 409 7.975 0.266 -6.712 1.00 13.32 H new ATOM 0 HG23 ILE A 409 8.425 -1.296 -5.988 1.00 13.32 H new ATOM 0 HD11 ILE A 409 4.136 -2.912 -4.280 1.00 34.44 H new ATOM 0 HD12 ILE A 409 4.318 -1.273 -3.612 1.00 34.44 H new ATOM 0 HD13 ILE A 409 3.840 -1.493 -5.312 1.00 34.44 H new ATOM 235 N TYR A 410 7.212 2.710 -4.124 1.00 51.23 N ATOM 236 CA TYR A 410 6.761 4.079 -3.769 1.00 55.51 C ATOM 237 C TYR A 410 7.126 5.069 -4.871 1.00 41.01 C ATOM 238 O TYR A 410 7.914 4.709 -5.741 1.00 5.23 O ATOM 239 CB TYR A 410 7.389 4.533 -2.415 1.00 54.11 C ATOM 240 CG TYR A 410 8.890 4.934 -2.442 1.00 73.52 C ATOM 241 CD1 TYR A 410 9.917 4.009 -2.209 1.00 51.44 C ATOM 242 CD2 TYR A 410 9.276 6.263 -2.676 1.00 23.41 C ATOM 243 CE1 TYR A 410 11.249 4.399 -2.211 1.00 42.12 C ATOM 244 CE2 TYR A 410 10.602 6.639 -2.678 1.00 61.30 C ATOM 245 CZ TYR A 410 11.578 5.702 -2.448 1.00 25.51 C ATOM 246 OH TYR A 410 12.899 6.066 -2.453 1.00 52.34 O ATOM 0 H TYR A 410 8.088 2.679 -4.645 1.00 51.23 H new ATOM 0 HA TYR A 410 5.676 4.059 -3.662 1.00 55.51 H new ATOM 0 HB2 TYR A 410 6.817 5.382 -2.042 1.00 54.11 H new ATOM 0 HB3 TYR A 410 7.266 3.724 -1.695 1.00 54.11 H new ATOM 0 HD1 TYR A 410 9.667 2.975 -2.025 1.00 51.44 H new ATOM 0 HD2 TYR A 410 8.516 7.008 -2.859 1.00 23.41 H new ATOM 0 HE1 TYR A 410 12.025 3.671 -2.025 1.00 42.12 H new ATOM 0 HE2 TYR A 410 10.872 7.669 -2.860 1.00 61.30 H new ATOM 0 HH TYR A 410 12.973 7.026 -2.637 1.00 52.34 H new ATOM 256 N HIS A 411 6.598 6.350 -4.795 1.00 32.41 N ATOM 257 CA HIS A 411 6.788 7.346 -5.878 1.00 15.32 C ATOM 258 C HIS A 411 6.062 6.890 -7.166 1.00 14.44 C ATOM 259 O HIS A 411 6.477 7.205 -8.286 1.00 43.44 O ATOM 260 CB HIS A 411 8.293 7.659 -6.117 1.00 55.14 C ATOM 261 CG HIS A 411 8.854 8.791 -5.257 1.00 14.42 C ATOM 262 ND1 HIS A 411 8.052 9.677 -4.542 1.00 51.11 N ATOM 263 CD2 HIS A 411 10.143 9.201 -5.019 1.00 51.52 C ATOM 264 CE1 HIS A 411 8.820 10.560 -3.924 1.00 71.43 C ATOM 265 NE2 HIS A 411 10.079 10.294 -4.189 1.00 73.13 N ATOM 0 H HIS A 411 6.052 6.691 -4.004 1.00 32.41 H new ATOM 0 HA HIS A 411 6.333 8.285 -5.563 1.00 15.32 H new ATOM 0 HB2 HIS A 411 8.873 6.756 -5.928 1.00 55.14 H new ATOM 0 HB3 HIS A 411 8.435 7.914 -7.167 1.00 55.14 H new ATOM 0 HD2 HIS A 411 11.041 8.748 -5.412 1.00 51.52 H new ATOM 0 HE1 HIS A 411 8.468 11.369 -3.302 1.00 71.43 H new ATOM 0 HE2 HIS A 411 10.881 10.816 -3.835 1.00 73.13 H new ATOM 274 N LEU A 412 4.944 6.166 -6.950 1.00 15.05 N ATOM 275 CA LEU A 412 3.931 5.834 -7.984 1.00 5.31 C ATOM 276 C LEU A 412 3.391 7.099 -8.709 1.00 53.22 C ATOM 277 O LEU A 412 3.244 8.163 -8.083 1.00 61.24 O ATOM 278 CB LEU A 412 2.718 5.091 -7.321 1.00 11.35 C ATOM 279 CG LEU A 412 2.061 5.828 -6.120 1.00 33.35 C ATOM 280 CD1 LEU A 412 0.543 5.728 -6.068 1.00 1.53 C ATOM 281 CD2 LEU A 412 2.602 5.415 -4.756 1.00 72.14 C ATOM 0 H LEU A 412 4.712 5.786 -6.033 1.00 15.05 H new ATOM 0 HA LEU A 412 4.425 5.199 -8.719 1.00 5.31 H new ATOM 0 HB2 LEU A 412 1.957 4.922 -8.083 1.00 11.35 H new ATOM 0 HB3 LEU A 412 3.054 4.111 -6.984 1.00 11.35 H new ATOM 0 HG LEU A 412 2.341 6.862 -6.320 1.00 33.35 H new ATOM 0 HD11 LEU A 412 0.172 6.271 -5.199 1.00 1.53 H new ATOM 0 HD12 LEU A 412 0.119 6.161 -6.974 1.00 1.53 H new ATOM 0 HD13 LEU A 412 0.250 4.681 -5.994 1.00 1.53 H new ATOM 0 HD21 LEU A 412 2.089 5.977 -3.976 1.00 72.14 H new ATOM 0 HD22 LEU A 412 2.433 4.349 -4.605 1.00 72.14 H new ATOM 0 HD23 LEU A 412 3.671 5.623 -4.710 1.00 72.14 H new ATOM 293 N PRO A 413 3.126 7.016 -10.062 1.00 73.21 N ATOM 294 CA PRO A 413 2.539 8.131 -10.840 1.00 70.44 C ATOM 295 C PRO A 413 1.088 8.433 -10.448 1.00 62.41 C ATOM 296 O PRO A 413 0.448 7.640 -9.778 1.00 51.24 O ATOM 297 CB PRO A 413 2.630 7.659 -12.307 1.00 64.35 C ATOM 298 CG PRO A 413 2.684 6.179 -12.224 1.00 65.31 C ATOM 299 CD PRO A 413 3.420 5.856 -10.951 1.00 32.22 C ATOM 0 HA PRO A 413 3.071 9.064 -10.657 1.00 70.44 H new ATOM 0 HB2 PRO A 413 1.767 7.992 -12.884 1.00 64.35 H new ATOM 0 HB3 PRO A 413 3.516 8.061 -12.798 1.00 64.35 H new ATOM 0 HG2 PRO A 413 1.681 5.753 -12.212 1.00 65.31 H new ATOM 0 HG3 PRO A 413 3.199 5.759 -13.088 1.00 65.31 H new ATOM 0 HD2 PRO A 413 3.071 4.920 -10.515 1.00 32.22 H new ATOM 0 HD3 PRO A 413 4.491 5.747 -11.125 1.00 32.22 H new ATOM 307 N GLN A 414 0.625 9.621 -10.836 1.00 12.44 N ATOM 308 CA GLN A 414 -0.762 10.110 -10.566 1.00 1.11 C ATOM 309 C GLN A 414 -1.879 9.197 -11.205 1.00 54.44 C ATOM 310 O GLN A 414 -3.036 9.264 -10.782 1.00 62.21 O ATOM 311 CB GLN A 414 -0.843 11.593 -11.061 1.00 32.32 C ATOM 312 CG GLN A 414 -1.603 11.869 -12.401 1.00 64.14 C ATOM 313 CD GLN A 414 -1.151 13.159 -13.055 1.00 13.34 C ATOM 314 OE1 GLN A 414 -1.686 14.230 -12.777 1.00 60.33 O ATOM 315 NE2 GLN A 414 -0.156 13.065 -13.926 1.00 12.53 N ATOM 0 H GLN A 414 1.194 10.291 -11.353 1.00 12.44 H new ATOM 0 HA GLN A 414 -0.961 10.061 -9.496 1.00 1.11 H new ATOM 0 HB2 GLN A 414 -1.318 12.183 -10.277 1.00 32.32 H new ATOM 0 HB3 GLN A 414 0.175 11.967 -11.169 1.00 32.32 H new ATOM 0 HG2 GLN A 414 -1.441 11.038 -13.088 1.00 64.14 H new ATOM 0 HG3 GLN A 414 -2.674 11.917 -12.207 1.00 64.14 H new ATOM 0 HE21 GLN A 414 0.260 12.156 -14.128 1.00 12.53 H new ATOM 0 HE22 GLN A 414 0.193 13.902 -14.394 1.00 12.53 H new ATOM 324 N GLU A 415 -1.527 8.345 -12.211 1.00 71.34 N ATOM 325 CA GLU A 415 -2.498 7.393 -12.831 1.00 30.12 C ATOM 326 C GLU A 415 -2.485 6.027 -12.077 1.00 63.33 C ATOM 327 O GLU A 415 -3.509 5.347 -12.006 1.00 45.25 O ATOM 328 CB GLU A 415 -2.195 7.211 -14.354 1.00 4.32 C ATOM 329 CG GLU A 415 -3.300 7.673 -15.347 1.00 72.51 C ATOM 330 CD GLU A 415 -2.767 7.754 -16.767 1.00 35.43 C ATOM 331 OE1 GLU A 415 -2.630 6.699 -17.415 1.00 62.11 O ATOM 332 OE2 GLU A 415 -2.475 8.882 -17.231 1.00 5.33 O ATOM 0 H GLU A 415 -0.588 8.297 -12.607 1.00 71.34 H new ATOM 0 HA GLU A 415 -3.501 7.811 -12.742 1.00 30.12 H new ATOM 0 HB2 GLU A 415 -1.280 7.756 -14.586 1.00 4.32 H new ATOM 0 HB3 GLU A 415 -1.993 6.156 -14.537 1.00 4.32 H new ATOM 0 HG2 GLU A 415 -4.139 6.978 -15.310 1.00 72.51 H new ATOM 0 HG3 GLU A 415 -3.681 8.648 -15.043 1.00 72.51 H new ATOM 339 N PHE A 416 -1.308 5.632 -11.541 1.00 35.03 N ATOM 340 CA PHE A 416 -1.207 4.498 -10.537 1.00 41.33 C ATOM 341 C PHE A 416 -1.568 4.968 -9.089 1.00 51.03 C ATOM 342 O PHE A 416 -1.698 6.157 -8.829 1.00 15.23 O ATOM 343 CB PHE A 416 0.140 3.683 -10.578 1.00 42.20 C ATOM 344 CG PHE A 416 0.449 2.862 -11.832 1.00 61.34 C ATOM 345 CD1 PHE A 416 -0.522 2.441 -12.764 1.00 22.13 C ATOM 346 CD2 PHE A 416 1.768 2.495 -12.057 1.00 10.22 C ATOM 347 CE1 PHE A 416 -0.150 1.685 -13.879 1.00 54.55 C ATOM 348 CE2 PHE A 416 2.124 1.750 -13.166 1.00 1.34 C ATOM 349 CZ PHE A 416 1.168 1.347 -14.070 1.00 41.23 C ATOM 0 H PHE A 416 -0.413 6.063 -11.770 1.00 35.03 H new ATOM 0 HA PHE A 416 -1.962 3.781 -10.859 1.00 41.33 H new ATOM 0 HB2 PHE A 416 0.960 4.386 -10.430 1.00 42.20 H new ATOM 0 HB3 PHE A 416 0.145 3.004 -9.726 1.00 42.20 H new ATOM 0 HD1 PHE A 416 -1.559 2.704 -12.615 1.00 22.13 H new ATOM 0 HD2 PHE A 416 2.530 2.797 -11.354 1.00 10.22 H new ATOM 0 HE1 PHE A 416 -0.898 1.367 -14.590 1.00 54.55 H new ATOM 0 HE2 PHE A 416 3.158 1.483 -13.324 1.00 1.34 H new ATOM 0 HZ PHE A 416 1.455 0.763 -14.932 1.00 41.23 H new ATOM 359 N GLY A 417 -1.777 4.003 -8.175 1.00 51.42 N ATOM 360 CA GLY A 417 -2.655 4.166 -6.995 1.00 45.52 C ATOM 361 C GLY A 417 -2.956 2.762 -6.423 1.00 50.44 C ATOM 362 O GLY A 417 -2.283 1.832 -6.873 1.00 40.02 O ATOM 0 H GLY A 417 -1.341 3.083 -8.232 1.00 51.42 H new ATOM 0 HA2 GLY A 417 -2.170 4.788 -6.242 1.00 45.52 H new ATOM 0 HA3 GLY A 417 -3.580 4.669 -7.276 1.00 45.52 H new ATOM 366 N ASP A 418 -3.908 2.534 -5.460 1.00 15.50 N ATOM 367 CA ASP A 418 -3.899 1.204 -4.783 1.00 22.11 C ATOM 368 C ASP A 418 -4.629 0.013 -5.481 1.00 14.04 C ATOM 369 O ASP A 418 -4.052 -1.079 -5.484 1.00 53.22 O ATOM 370 CB ASP A 418 -4.236 1.187 -3.273 1.00 74.33 C ATOM 371 CG ASP A 418 -5.567 1.835 -2.937 1.00 35.11 C ATOM 372 OD1 ASP A 418 -5.637 3.081 -2.851 1.00 42.13 O ATOM 373 OD2 ASP A 418 -6.548 1.091 -2.748 1.00 14.51 O ATOM 0 H ASP A 418 -4.628 3.191 -5.159 1.00 15.50 H new ATOM 0 HA ASP A 418 -2.831 1.022 -4.899 1.00 22.11 H new ATOM 0 HB2 ASP A 418 -4.246 0.155 -2.924 1.00 74.33 H new ATOM 0 HB3 ASP A 418 -3.444 1.700 -2.727 1.00 74.33 H new ATOM 378 N GLN A 419 -5.869 0.142 -6.069 1.00 44.11 N ATOM 379 CA GLN A 419 -6.466 -1.019 -6.752 1.00 43.24 C ATOM 380 C GLN A 419 -5.663 -1.274 -8.071 1.00 74.11 C ATOM 381 O GLN A 419 -5.608 -2.392 -8.571 1.00 44.13 O ATOM 382 CB GLN A 419 -8.011 -0.856 -6.994 1.00 24.41 C ATOM 383 CG GLN A 419 -8.425 0.007 -8.209 1.00 34.25 C ATOM 384 CD GLN A 419 -8.575 -0.838 -9.474 1.00 70.11 C ATOM 385 OE1 GLN A 419 -8.976 -2.002 -9.407 1.00 35.01 O ATOM 386 NE2 GLN A 419 -8.223 -0.295 -10.630 1.00 73.45 N ATOM 0 H GLN A 419 -6.431 0.993 -6.076 1.00 44.11 H new ATOM 0 HA GLN A 419 -6.388 -1.897 -6.110 1.00 43.24 H new ATOM 0 HB2 GLN A 419 -8.445 -1.848 -7.115 1.00 24.41 H new ATOM 0 HB3 GLN A 419 -8.454 -0.421 -6.098 1.00 24.41 H new ATOM 0 HG2 GLN A 419 -9.367 0.511 -7.994 1.00 34.25 H new ATOM 0 HG3 GLN A 419 -7.679 0.784 -8.376 1.00 34.25 H new ATOM 0 HE21 GLN A 419 -7.894 0.670 -10.661 1.00 73.45 H new ATOM 0 HE22 GLN A 419 -8.281 -0.842 -11.489 1.00 73.45 H new ATOM 395 N ASP A 420 -5.000 -0.190 -8.572 1.00 75.25 N ATOM 396 CA ASP A 420 -4.162 -0.197 -9.806 1.00 12.01 C ATOM 397 C ASP A 420 -2.727 -0.701 -9.555 1.00 2.31 C ATOM 398 O ASP A 420 -1.961 -0.784 -10.499 1.00 42.44 O ATOM 399 CB ASP A 420 -4.034 1.200 -10.477 1.00 14.14 C ATOM 400 CG ASP A 420 -5.114 2.181 -10.028 1.00 31.35 C ATOM 401 OD1 ASP A 420 -6.270 2.086 -10.507 1.00 32.13 O ATOM 402 OD2 ASP A 420 -4.817 3.030 -9.172 1.00 40.10 O ATOM 0 H ASP A 420 -5.035 0.725 -8.122 1.00 75.25 H new ATOM 0 HA ASP A 420 -4.696 -0.879 -10.467 1.00 12.01 H new ATOM 0 HB2 ASP A 420 -3.054 1.618 -10.248 1.00 14.14 H new ATOM 0 HB3 ASP A 420 -4.085 1.083 -11.559 1.00 14.14 H new ATOM 407 N ILE A 421 -2.315 -0.956 -8.294 1.00 21.42 N ATOM 408 CA ILE A 421 -0.842 -1.167 -8.011 1.00 73.41 C ATOM 409 C ILE A 421 -0.445 -2.603 -8.401 1.00 4.14 C ATOM 410 O ILE A 421 0.723 -2.933 -8.607 1.00 53.32 O ATOM 411 CB ILE A 421 -0.454 -0.795 -6.523 1.00 21.13 C ATOM 412 CG1 ILE A 421 1.027 -0.218 -6.371 1.00 62.34 C ATOM 413 CG2 ILE A 421 -0.673 -1.995 -5.566 1.00 32.24 C ATOM 414 CD1 ILE A 421 1.264 0.594 -5.065 1.00 35.34 C ATOM 0 H ILE A 421 -2.929 -1.022 -7.482 1.00 21.42 H new ATOM 0 HA ILE A 421 -0.263 -0.479 -8.628 1.00 73.41 H new ATOM 0 HB ILE A 421 -1.129 0.013 -6.239 1.00 21.13 H new ATOM 0 HG12 ILE A 421 1.733 -1.048 -6.403 1.00 62.34 H new ATOM 0 HG13 ILE A 421 1.246 0.420 -7.227 1.00 62.34 H new ATOM 0 HG21 ILE A 421 -0.397 -1.707 -4.552 1.00 32.24 H new ATOM 0 HG22 ILE A 421 -1.722 -2.290 -5.587 1.00 32.24 H new ATOM 0 HG23 ILE A 421 -0.054 -2.833 -5.886 1.00 32.24 H new ATOM 0 HD11 ILE A 421 2.294 0.950 -5.040 1.00 35.34 H new ATOM 0 HD12 ILE A 421 0.585 1.446 -5.038 1.00 35.34 H new ATOM 0 HD13 ILE A 421 1.080 -0.045 -4.201 1.00 35.34 H new ATOM 426 N LEU A 422 -1.496 -3.415 -8.513 1.00 4.54 N ATOM 427 CA LEU A 422 -1.493 -4.754 -9.057 1.00 24.24 C ATOM 428 C LEU A 422 -1.208 -4.701 -10.610 1.00 64.41 C ATOM 429 O LEU A 422 -0.773 -5.703 -11.165 1.00 0.20 O ATOM 430 CB LEU A 422 -2.871 -5.433 -8.632 1.00 25.21 C ATOM 431 CG LEU A 422 -3.291 -6.808 -9.201 1.00 2.35 C ATOM 432 CD1 LEU A 422 -4.316 -7.434 -8.254 1.00 75.22 C ATOM 433 CD2 LEU A 422 -3.952 -6.699 -10.577 1.00 12.15 C ATOM 0 H LEU A 422 -2.425 -3.128 -8.204 1.00 4.54 H new ATOM 0 HA LEU A 422 -0.692 -5.377 -8.660 1.00 24.24 H new ATOM 0 HB2 LEU A 422 -2.859 -5.527 -7.546 1.00 25.21 H new ATOM 0 HB3 LEU A 422 -3.664 -4.728 -8.882 1.00 25.21 H new ATOM 0 HG LEU A 422 -2.386 -7.408 -9.297 1.00 2.35 H new ATOM 0 HD11 LEU A 422 -4.623 -8.406 -8.641 1.00 75.22 H new ATOM 0 HD12 LEU A 422 -3.870 -7.561 -7.268 1.00 75.22 H new ATOM 0 HD13 LEU A 422 -5.186 -6.782 -8.178 1.00 75.22 H new ATOM 0 HD21 LEU A 422 -4.226 -7.694 -10.929 1.00 12.15 H new ATOM 0 HD22 LEU A 422 -4.847 -6.081 -10.503 1.00 12.15 H new ATOM 0 HD23 LEU A 422 -3.254 -6.245 -11.281 1.00 12.15 H new ATOM 445 N GLN A 423 -1.368 -3.497 -11.294 1.00 24.11 N ATOM 446 CA GLN A 423 -1.275 -3.391 -12.761 1.00 74.31 C ATOM 447 C GLN A 423 0.179 -3.564 -13.275 1.00 64.21 C ATOM 448 O GLN A 423 0.381 -3.818 -14.464 1.00 42.42 O ATOM 449 CB GLN A 423 -1.860 -2.053 -13.322 1.00 61.32 C ATOM 450 CG GLN A 423 -3.398 -1.924 -13.266 1.00 3.24 C ATOM 451 CD GLN A 423 -3.969 -1.010 -14.336 1.00 3.12 C ATOM 452 OE1 GLN A 423 -3.344 -0.961 -15.506 1.00 11.52 O flip ATOM 453 NE2 GLN A 423 -4.988 -0.367 -14.113 1.00 31.44 N flip ATOM 0 H GLN A 423 -1.560 -2.610 -10.829 1.00 24.11 H new ATOM 0 HA GLN A 423 -1.886 -4.213 -13.135 1.00 74.31 H new ATOM 0 HB2 GLN A 423 -1.423 -1.224 -12.765 1.00 61.32 H new ATOM 0 HB3 GLN A 423 -1.541 -1.944 -14.359 1.00 61.32 H new ATOM 0 HG2 GLN A 423 -3.842 -2.914 -13.371 1.00 3.24 H new ATOM 0 HG3 GLN A 423 -3.688 -1.547 -12.285 1.00 3.24 H new ATOM 0 HE21 GLN A 423 -5.441 -0.430 -13.201 1.00 31.44 H new ATOM 0 HE22 GLN A 423 -5.383 0.231 -14.839 1.00 31.44 H new ATOM 462 N MET A 424 1.188 -3.417 -12.384 1.00 21.22 N ATOM 463 CA MET A 424 2.607 -3.497 -12.806 1.00 62.45 C ATOM 464 C MET A 424 3.172 -4.940 -12.838 1.00 52.24 C ATOM 465 O MET A 424 3.697 -5.367 -13.867 1.00 41.43 O ATOM 466 CB MET A 424 3.527 -2.604 -11.933 1.00 45.35 C ATOM 467 CG MET A 424 3.891 -1.222 -12.512 1.00 13.35 C ATOM 468 SD MET A 424 5.109 -1.310 -13.848 1.00 74.14 S ATOM 469 CE MET A 424 4.091 -1.319 -15.321 1.00 11.50 C ATOM 0 H MET A 424 1.051 -3.246 -11.388 1.00 21.22 H new ATOM 0 HA MET A 424 2.606 -3.124 -13.830 1.00 62.45 H new ATOM 0 HB2 MET A 424 3.042 -2.453 -10.969 1.00 45.35 H new ATOM 0 HB3 MET A 424 4.452 -3.149 -11.743 1.00 45.35 H new ATOM 0 HG2 MET A 424 2.986 -0.741 -12.884 1.00 13.35 H new ATOM 0 HG3 MET A 424 4.282 -0.592 -11.713 1.00 13.35 H new ATOM 0 HE1 MET A 424 4.613 -0.804 -16.127 1.00 11.50 H new ATOM 0 HE2 MET A 424 3.890 -2.348 -15.618 1.00 11.50 H new ATOM 0 HE3 MET A 424 3.149 -0.810 -15.115 1.00 11.50 H new ATOM 479 N PHE A 425 3.036 -5.699 -11.739 1.00 42.11 N ATOM 480 CA PHE A 425 3.746 -6.978 -11.544 1.00 10.21 C ATOM 481 C PHE A 425 3.012 -8.215 -12.081 1.00 51.24 C ATOM 482 O PHE A 425 3.398 -9.323 -11.750 1.00 11.24 O ATOM 483 CB PHE A 425 4.267 -7.163 -10.095 1.00 54.23 C ATOM 484 CG PHE A 425 5.458 -6.303 -9.746 1.00 35.24 C ATOM 485 CD1 PHE A 425 5.408 -4.899 -9.802 1.00 74.31 C ATOM 486 CD2 PHE A 425 6.652 -6.910 -9.362 1.00 10.43 C ATOM 487 CE1 PHE A 425 6.508 -4.147 -9.485 1.00 13.33 C ATOM 488 CE2 PHE A 425 7.740 -6.157 -9.043 1.00 60.33 C ATOM 489 CZ PHE A 425 7.680 -4.771 -9.105 1.00 12.52 C ATOM 0 H PHE A 425 2.431 -5.445 -10.958 1.00 42.11 H new ATOM 0 HA PHE A 425 4.626 -6.896 -12.182 1.00 10.21 H new ATOM 0 HB2 PHE A 425 3.458 -6.941 -9.400 1.00 54.23 H new ATOM 0 HB3 PHE A 425 4.535 -8.210 -9.949 1.00 54.23 H new ATOM 0 HD1 PHE A 425 4.493 -4.408 -10.098 1.00 74.31 H new ATOM 0 HD2 PHE A 425 6.715 -7.987 -9.317 1.00 10.43 H new ATOM 0 HE1 PHE A 425 6.459 -3.069 -9.532 1.00 13.33 H new ATOM 0 HE2 PHE A 425 8.657 -6.641 -8.739 1.00 60.33 H new ATOM 0 HZ PHE A 425 8.550 -4.181 -8.856 1.00 12.52 H new ATOM 499 N MET A 426 1.938 -8.036 -12.865 1.00 73.15 N ATOM 500 CA MET A 426 1.096 -9.145 -13.236 1.00 63.45 C ATOM 501 C MET A 426 1.730 -9.974 -14.375 1.00 24.22 C ATOM 502 O MET A 426 1.674 -11.203 -14.327 1.00 50.41 O ATOM 503 CB MET A 426 -0.309 -8.653 -13.559 1.00 44.15 C ATOM 504 CG MET A 426 -1.205 -8.711 -12.342 1.00 21.40 C ATOM 505 SD MET A 426 -1.497 -10.423 -11.884 1.00 42.32 S ATOM 506 CE MET A 426 -2.389 -10.203 -10.369 1.00 3.12 C ATOM 0 H MET A 426 1.647 -7.135 -13.244 1.00 73.15 H new ATOM 0 HA MET A 426 1.007 -9.826 -12.389 1.00 63.45 H new ATOM 0 HB2 MET A 426 -0.262 -7.629 -13.930 1.00 44.15 H new ATOM 0 HB3 MET A 426 -0.735 -9.262 -14.356 1.00 44.15 H new ATOM 0 HG2 MET A 426 -0.742 -8.177 -11.512 1.00 21.40 H new ATOM 0 HG3 MET A 426 -2.152 -8.214 -12.552 1.00 21.40 H new ATOM 0 HE1 MET A 426 -2.538 -11.171 -9.891 1.00 3.12 H new ATOM 0 HE2 MET A 426 -1.821 -9.553 -9.703 1.00 3.12 H new ATOM 0 HE3 MET A 426 -3.357 -9.749 -10.580 1.00 3.12 H new ATOM 516 N PRO A 427 2.372 -9.336 -15.425 1.00 71.02 N ATOM 517 CA PRO A 427 3.299 -10.075 -16.297 1.00 3.01 C ATOM 518 C PRO A 427 4.693 -10.294 -15.672 1.00 35.31 C ATOM 519 O PRO A 427 5.591 -10.830 -16.330 1.00 41.03 O ATOM 520 CB PRO A 427 3.370 -9.242 -17.589 1.00 14.42 C ATOM 521 CG PRO A 427 2.824 -7.888 -17.279 1.00 73.24 C ATOM 522 CD PRO A 427 2.164 -7.942 -15.917 1.00 32.21 C ATOM 0 HA PRO A 427 2.940 -11.089 -16.475 1.00 3.01 H new ATOM 0 HB2 PRO A 427 4.399 -9.169 -17.942 1.00 14.42 H new ATOM 0 HB3 PRO A 427 2.793 -9.716 -18.383 1.00 14.42 H new ATOM 0 HG2 PRO A 427 3.623 -7.146 -17.285 1.00 73.24 H new ATOM 0 HG3 PRO A 427 2.103 -7.586 -18.039 1.00 73.24 H new ATOM 0 HD2 PRO A 427 2.609 -7.216 -15.237 1.00 32.21 H new ATOM 0 HD3 PRO A 427 1.102 -7.705 -15.986 1.00 32.21 H new ATOM 530 N PHE A 428 4.868 -9.872 -14.413 1.00 51.10 N ATOM 531 CA PHE A 428 6.125 -10.114 -13.687 1.00 52.22 C ATOM 532 C PHE A 428 5.940 -11.143 -12.536 1.00 52.41 C ATOM 533 O PHE A 428 6.828 -11.233 -11.692 1.00 23.22 O ATOM 534 CB PHE A 428 6.830 -8.800 -13.138 1.00 70.32 C ATOM 535 CG PHE A 428 7.342 -7.802 -14.169 1.00 20.24 C ATOM 536 CD1 PHE A 428 8.055 -8.234 -15.278 1.00 74.14 C ATOM 537 CD2 PHE A 428 7.174 -6.420 -13.990 1.00 52.33 C ATOM 538 CE1 PHE A 428 8.577 -7.332 -16.184 1.00 10.14 C ATOM 539 CE2 PHE A 428 7.707 -5.514 -14.896 1.00 30.41 C ATOM 540 CZ PHE A 428 8.406 -5.977 -15.991 1.00 71.24 C ATOM 0 H PHE A 428 4.163 -9.365 -13.878 1.00 51.10 H new ATOM 0 HA PHE A 428 6.796 -10.532 -14.438 1.00 52.22 H new ATOM 0 HB2 PHE A 428 6.123 -8.283 -12.490 1.00 70.32 H new ATOM 0 HB3 PHE A 428 7.671 -9.103 -12.515 1.00 70.32 H new ATOM 0 HD1 PHE A 428 8.204 -9.292 -15.435 1.00 74.14 H new ATOM 0 HD2 PHE A 428 6.622 -6.057 -13.135 1.00 52.33 H new ATOM 0 HE1 PHE A 428 9.121 -7.689 -17.046 1.00 10.14 H new ATOM 0 HE2 PHE A 428 7.575 -4.453 -14.745 1.00 30.41 H new ATOM 0 HZ PHE A 428 8.821 -5.276 -16.700 1.00 71.24 H new ATOM 550 N GLY A 429 4.811 -11.929 -12.479 1.00 72.41 N ATOM 551 CA GLY A 429 4.768 -13.049 -11.503 1.00 73.25 C ATOM 552 C GLY A 429 3.530 -13.019 -10.513 1.00 34.23 C ATOM 553 O GLY A 429 2.595 -12.258 -10.752 1.00 64.31 O ATOM 0 H GLY A 429 3.979 -11.813 -13.058 1.00 72.41 H new ATOM 0 HA2 GLY A 429 4.754 -13.991 -12.052 1.00 73.25 H new ATOM 0 HA3 GLY A 429 5.686 -13.036 -10.915 1.00 73.25 H new ATOM 557 N ASN A 430 3.501 -13.865 -9.410 1.00 11.22 N ATOM 558 CA ASN A 430 2.296 -13.988 -8.487 1.00 74.11 C ATOM 559 C ASN A 430 2.117 -12.779 -7.457 1.00 60.42 C ATOM 560 O ASN A 430 2.998 -12.585 -6.617 1.00 60.11 O ATOM 561 CB ASN A 430 2.360 -15.349 -7.727 1.00 21.33 C ATOM 562 CG ASN A 430 1.015 -15.745 -7.121 1.00 42.43 C ATOM 563 OD1 ASN A 430 0.761 -15.526 -5.939 1.00 12.03 O ATOM 564 ND2 ASN A 430 0.121 -16.302 -7.947 1.00 33.03 N ATOM 0 H ASN A 430 4.284 -14.461 -9.143 1.00 11.22 H new ATOM 0 HA ASN A 430 1.416 -13.945 -9.129 1.00 74.11 H new ATOM 0 HB2 ASN A 430 2.689 -16.129 -8.413 1.00 21.33 H new ATOM 0 HB3 ASN A 430 3.107 -15.285 -6.935 1.00 21.33 H new ATOM 0 HD21 ASN A 430 -0.803 -16.558 -7.600 1.00 33.03 H new ATOM 0 HD22 ASN A 430 0.364 -16.470 -8.923 1.00 33.03 H new ATOM 571 N VAL A 431 0.986 -11.938 -7.508 1.00 51.32 N ATOM 572 CA VAL A 431 0.697 -10.956 -6.387 1.00 62.34 C ATOM 573 C VAL A 431 -0.029 -11.685 -5.200 1.00 42.41 C ATOM 574 O VAL A 431 -0.767 -12.651 -5.442 1.00 41.24 O ATOM 575 CB VAL A 431 -0.185 -9.673 -6.725 1.00 4.13 C ATOM 576 CG1 VAL A 431 0.306 -8.815 -7.894 1.00 43.15 C ATOM 577 CG2 VAL A 431 -1.688 -9.958 -6.860 1.00 11.31 C ATOM 0 H VAL A 431 0.308 -11.929 -8.270 1.00 51.32 H new ATOM 0 HA VAL A 431 1.695 -10.586 -6.151 1.00 62.34 H new ATOM 0 HB VAL A 431 -0.039 -9.070 -5.829 1.00 4.13 H new ATOM 0 HG11 VAL A 431 -0.369 -7.971 -8.034 1.00 43.15 H new ATOM 0 HG12 VAL A 431 1.309 -8.446 -7.679 1.00 43.15 H new ATOM 0 HG13 VAL A 431 0.328 -9.417 -8.803 1.00 43.15 H new ATOM 0 HG21 VAL A 431 -2.215 -9.032 -7.090 1.00 11.31 H new ATOM 0 HG22 VAL A 431 -1.851 -10.678 -7.662 1.00 11.31 H new ATOM 0 HG23 VAL A 431 -2.066 -10.367 -5.923 1.00 11.31 H new ATOM 587 N ILE A 432 0.182 -11.276 -3.912 1.00 53.12 N ATOM 588 CA ILE A 432 -0.646 -11.867 -2.802 1.00 55.13 C ATOM 589 C ILE A 432 -1.510 -10.772 -2.107 1.00 2.02 C ATOM 590 O ILE A 432 -2.735 -10.863 -2.150 1.00 64.21 O ATOM 591 CB ILE A 432 0.153 -12.751 -1.749 1.00 3.32 C ATOM 592 CG1 ILE A 432 1.543 -13.240 -2.311 1.00 40.30 C ATOM 593 CG2 ILE A 432 -0.697 -13.974 -1.298 1.00 52.02 C ATOM 594 CD1 ILE A 432 1.655 -14.671 -2.886 1.00 73.14 C ATOM 0 H ILE A 432 0.873 -10.583 -3.623 1.00 53.12 H new ATOM 0 HA ILE A 432 -1.306 -12.582 -3.294 1.00 55.13 H new ATOM 0 HB ILE A 432 0.351 -12.113 -0.888 1.00 3.32 H new ATOM 0 HG12 ILE A 432 1.844 -12.545 -3.095 1.00 40.30 H new ATOM 0 HG13 ILE A 432 2.274 -13.150 -1.507 1.00 40.30 H new ATOM 0 HG21 ILE A 432 -0.131 -14.565 -0.578 1.00 52.02 H new ATOM 0 HG22 ILE A 432 -1.620 -13.625 -0.835 1.00 52.02 H new ATOM 0 HG23 ILE A 432 -0.936 -14.590 -2.165 1.00 52.02 H new ATOM 0 HD11 ILE A 432 2.675 -14.847 -3.229 1.00 73.14 H new ATOM 0 HD12 ILE A 432 1.403 -15.395 -2.111 1.00 73.14 H new ATOM 0 HD13 ILE A 432 0.967 -14.781 -3.724 1.00 73.14 H new ATOM 606 N SER A 433 -0.896 -9.719 -1.485 1.00 4.15 N ATOM 607 CA SER A 433 -1.706 -8.603 -0.858 1.00 42.45 C ATOM 608 C SER A 433 -1.071 -7.176 -1.074 1.00 45.44 C ATOM 609 O SER A 433 0.161 -7.096 -1.153 1.00 63.30 O ATOM 610 CB SER A 433 -1.822 -8.845 0.664 1.00 31.25 C ATOM 611 OG SER A 433 -2.503 -10.060 0.941 1.00 34.32 O ATOM 0 H SER A 433 0.115 -9.612 -1.401 1.00 4.15 H new ATOM 0 HA SER A 433 -2.680 -8.616 -1.348 1.00 42.45 H new ATOM 0 HB2 SER A 433 -0.827 -8.874 1.107 1.00 31.25 H new ATOM 0 HB3 SER A 433 -2.353 -8.014 1.128 1.00 31.25 H new ATOM 0 HG SER A 433 -2.976 -9.982 1.796 1.00 34.32 H new ATOM 617 N ALA A 434 -1.882 -6.042 -1.165 1.00 53.23 N ATOM 618 CA ALA A 434 -1.274 -4.652 -1.130 1.00 1.44 C ATOM 619 C ALA A 434 -2.120 -3.527 -0.573 1.00 45.42 C ATOM 620 O ALA A 434 -3.349 -3.522 -0.666 1.00 11.30 O ATOM 621 CB ALA A 434 -0.893 -4.129 -2.471 1.00 54.14 C ATOM 0 H ALA A 434 -2.898 -6.064 -1.258 1.00 53.23 H new ATOM 0 HA ALA A 434 -0.435 -4.865 -0.467 1.00 1.44 H new ATOM 0 HB1 ALA A 434 -0.466 -3.132 -2.365 1.00 54.14 H new ATOM 0 HB2 ALA A 434 -0.157 -4.793 -2.925 1.00 54.14 H new ATOM 0 HB3 ALA A 434 -1.777 -4.079 -3.107 1.00 54.14 H new ATOM 627 N LYS A 435 -1.386 -2.508 -0.072 1.00 44.42 N ATOM 628 CA LYS A 435 -1.977 -1.210 0.329 1.00 63.40 C ATOM 629 C LYS A 435 -0.972 -0.051 0.131 1.00 73.22 C ATOM 630 O LYS A 435 0.237 -0.283 0.219 1.00 11.55 O ATOM 631 CB LYS A 435 -2.422 -1.224 1.804 1.00 63.01 C ATOM 632 CG LYS A 435 -1.924 -2.413 2.622 1.00 30.04 C ATOM 633 CD LYS A 435 -2.764 -2.622 3.872 1.00 1.32 C ATOM 634 CE LYS A 435 -2.699 -1.423 4.797 1.00 35.25 C ATOM 635 NZ LYS A 435 -3.440 -1.665 6.059 1.00 31.30 N ATOM 0 H LYS A 435 -0.377 -2.560 0.065 1.00 44.42 H new ATOM 0 HA LYS A 435 -2.846 -1.055 -0.310 1.00 63.40 H new ATOM 0 HB2 LYS A 435 -2.077 -0.306 2.280 1.00 63.01 H new ATOM 0 HB3 LYS A 435 -3.511 -1.211 1.838 1.00 63.01 H new ATOM 0 HG2 LYS A 435 -1.951 -3.314 2.009 1.00 30.04 H new ATOM 0 HG3 LYS A 435 -0.884 -2.251 2.905 1.00 30.04 H new ATOM 0 HD2 LYS A 435 -3.800 -2.807 3.588 1.00 1.32 H new ATOM 0 HD3 LYS A 435 -2.415 -3.509 4.401 1.00 1.32 H new ATOM 0 HE2 LYS A 435 -1.658 -1.194 5.024 1.00 35.25 H new ATOM 0 HE3 LYS A 435 -3.114 -0.551 4.292 1.00 35.25 H new ATOM 0 HZ1 LYS A 435 -3.431 -0.801 6.638 1.00 31.30 H new ATOM 0 HZ2 LYS A 435 -4.423 -1.925 5.840 1.00 31.30 H new ATOM 0 HZ3 LYS A 435 -2.986 -2.439 6.585 1.00 31.30 H new ATOM 649 N VAL A 436 -1.449 1.200 -0.128 1.00 3.34 N ATOM 650 CA VAL A 436 -0.588 2.371 0.117 1.00 51.54 C ATOM 651 C VAL A 436 -0.950 2.917 1.481 1.00 55.32 C ATOM 652 O VAL A 436 -2.146 3.061 1.772 1.00 21.13 O ATOM 653 CB VAL A 436 -0.625 3.567 -0.959 1.00 23.25 C ATOM 654 CG1 VAL A 436 0.528 3.437 -1.943 1.00 44.41 C ATOM 655 CG2 VAL A 436 -1.948 3.747 -1.741 1.00 2.15 C ATOM 0 H VAL A 436 -2.380 1.409 -0.489 1.00 3.34 H new ATOM 0 HA VAL A 436 0.433 1.998 0.037 1.00 51.54 H new ATOM 0 HB VAL A 436 -0.531 4.466 -0.349 1.00 23.25 H new ATOM 0 HG11 VAL A 436 0.486 4.255 -2.663 1.00 44.41 H new ATOM 0 HG12 VAL A 436 1.474 3.477 -1.403 1.00 44.41 H new ATOM 0 HG13 VAL A 436 0.451 2.486 -2.470 1.00 44.41 H new ATOM 0 HG21 VAL A 436 -1.850 4.582 -2.434 1.00 2.15 H new ATOM 0 HG22 VAL A 436 -2.168 2.837 -2.299 1.00 2.15 H new ATOM 0 HG23 VAL A 436 -2.759 3.949 -1.042 1.00 2.15 H new ATOM 665 N PHE A 437 0.042 3.129 2.378 1.00 34.43 N ATOM 666 CA PHE A 437 -0.210 3.983 3.513 1.00 40.41 C ATOM 667 C PHE A 437 -0.441 5.422 3.034 1.00 11.34 C ATOM 668 O PHE A 437 0.503 6.178 2.764 1.00 63.23 O ATOM 669 CB PHE A 437 0.966 3.901 4.489 1.00 15.13 C ATOM 670 CG PHE A 437 1.142 2.548 5.132 1.00 71.04 C ATOM 671 CD1 PHE A 437 0.406 2.214 6.260 1.00 1.54 C ATOM 672 CD2 PHE A 437 2.038 1.615 4.622 1.00 73.10 C ATOM 673 CE1 PHE A 437 0.554 0.979 6.862 1.00 30.21 C ATOM 674 CE2 PHE A 437 2.191 0.378 5.225 1.00 10.00 C ATOM 675 CZ PHE A 437 1.449 0.060 6.348 1.00 4.24 C ATOM 0 H PHE A 437 0.979 2.730 2.325 1.00 34.43 H new ATOM 0 HA PHE A 437 -1.108 3.652 4.035 1.00 40.41 H new ATOM 0 HB2 PHE A 437 1.882 4.161 3.959 1.00 15.13 H new ATOM 0 HB3 PHE A 437 0.827 4.647 5.271 1.00 15.13 H new ATOM 0 HD1 PHE A 437 -0.291 2.928 6.673 1.00 1.54 H new ATOM 0 HD2 PHE A 437 2.621 1.858 3.746 1.00 73.10 H new ATOM 0 HE1 PHE A 437 -0.031 0.732 7.736 1.00 30.21 H new ATOM 0 HE2 PHE A 437 2.890 -0.338 4.819 1.00 10.00 H new ATOM 0 HZ PHE A 437 1.569 -0.903 6.822 1.00 4.24 H new ATOM 685 N ILE A 438 -1.728 5.755 2.906 1.00 22.14 N ATOM 686 CA ILE A 438 -2.176 7.116 2.495 1.00 55.15 C ATOM 687 C ILE A 438 -3.189 7.644 3.553 1.00 73.13 C ATOM 688 O ILE A 438 -4.126 6.905 3.876 1.00 52.20 O ATOM 689 CB ILE A 438 -2.853 7.119 0.997 1.00 14.32 C ATOM 690 CG1 ILE A 438 -3.570 8.476 0.670 1.00 20.43 C ATOM 691 CG2 ILE A 438 -3.851 5.936 0.772 1.00 4.04 C ATOM 692 CD1 ILE A 438 -4.296 8.536 -0.698 1.00 1.13 C ATOM 0 H ILE A 438 -2.494 5.105 3.080 1.00 22.14 H new ATOM 0 HA ILE A 438 -1.305 7.770 2.445 1.00 55.15 H new ATOM 0 HB ILE A 438 -2.015 6.988 0.312 1.00 14.32 H new ATOM 0 HG12 ILE A 438 -4.297 8.681 1.456 1.00 20.43 H new ATOM 0 HG13 ILE A 438 -2.829 9.275 0.704 1.00 20.43 H new ATOM 0 HG21 ILE A 438 -4.263 5.995 -0.235 1.00 4.04 H new ATOM 0 HG22 ILE A 438 -3.326 4.989 0.895 1.00 4.04 H new ATOM 0 HG23 ILE A 438 -4.660 5.999 1.500 1.00 4.04 H new ATOM 0 HD11 ILE A 438 -4.757 9.516 -0.823 1.00 1.13 H new ATOM 0 HD12 ILE A 438 -3.576 8.369 -1.499 1.00 1.13 H new ATOM 0 HD13 ILE A 438 -5.066 7.766 -0.735 1.00 1.13 H new ATOM 704 N ASP A 439 -3.036 8.865 4.166 1.00 11.40 N ATOM 705 CA ASP A 439 -4.197 9.430 4.815 1.00 35.35 C ATOM 706 C ASP A 439 -5.173 9.949 3.718 1.00 25.24 C ATOM 707 O ASP A 439 -4.852 10.940 3.051 1.00 2.33 O ATOM 708 CB ASP A 439 -3.751 10.464 5.870 1.00 70.21 C ATOM 709 CG ASP A 439 -3.447 9.752 7.188 1.00 11.42 C ATOM 710 OD1 ASP A 439 -2.378 9.095 7.312 1.00 32.05 O ATOM 711 OD2 ASP A 439 -4.313 9.807 8.082 1.00 72.31 O ATOM 0 H ASP A 439 -2.178 9.415 4.208 1.00 11.40 H new ATOM 0 HA ASP A 439 -4.760 8.690 5.383 1.00 35.35 H new ATOM 0 HB2 ASP A 439 -2.867 10.997 5.521 1.00 70.21 H new ATOM 0 HB3 ASP A 439 -4.534 11.208 6.019 1.00 70.21 H new ATOM 716 N LYS A 440 -6.349 9.222 3.494 1.00 21.20 N ATOM 717 CA LYS A 440 -7.219 9.370 2.272 1.00 61.43 C ATOM 718 C LYS A 440 -7.849 10.780 2.083 1.00 44.44 C ATOM 719 O LYS A 440 -8.545 10.989 1.090 1.00 35.25 O ATOM 720 CB LYS A 440 -8.373 8.302 2.179 1.00 75.41 C ATOM 721 CG LYS A 440 -7.939 6.835 1.948 1.00 71.04 C ATOM 722 CD LYS A 440 -7.627 6.058 3.235 1.00 21.51 C ATOM 723 CE LYS A 440 -7.482 4.559 2.963 1.00 14.44 C ATOM 724 NZ LYS A 440 -8.747 3.954 2.452 1.00 12.03 N ATOM 0 H LYS A 440 -6.702 8.531 4.156 1.00 21.20 H new ATOM 0 HA LYS A 440 -6.503 9.204 1.467 1.00 61.43 H new ATOM 0 HB2 LYS A 440 -8.953 8.345 3.101 1.00 75.41 H new ATOM 0 HB3 LYS A 440 -9.041 8.592 1.368 1.00 75.41 H new ATOM 0 HG2 LYS A 440 -8.730 6.316 1.407 1.00 71.04 H new ATOM 0 HG3 LYS A 440 -7.056 6.826 1.309 1.00 71.04 H new ATOM 0 HD2 LYS A 440 -6.707 6.439 3.678 1.00 21.51 H new ATOM 0 HD3 LYS A 440 -8.422 6.222 3.962 1.00 21.51 H new ATOM 0 HE2 LYS A 440 -6.685 4.399 2.237 1.00 14.44 H new ATOM 0 HE3 LYS A 440 -7.184 4.052 3.881 1.00 14.44 H new ATOM 0 HZ1 LYS A 440 -8.724 2.925 2.600 1.00 12.03 H new ATOM 0 HZ2 LYS A 440 -9.557 4.359 2.963 1.00 12.03 H new ATOM 0 HZ3 LYS A 440 -8.843 4.156 1.436 1.00 12.03 H new ATOM 738 N GLN A 441 -7.616 11.718 3.039 1.00 22.54 N ATOM 739 CA GLN A 441 -8.120 13.115 2.962 1.00 14.45 C ATOM 740 C GLN A 441 -7.895 13.842 1.590 1.00 11.40 C ATOM 741 O GLN A 441 -8.887 14.231 0.961 1.00 34.30 O ATOM 742 CB GLN A 441 -7.480 14.011 4.090 1.00 5.50 C ATOM 743 CG GLN A 441 -7.515 13.474 5.557 1.00 63.32 C ATOM 744 CD GLN A 441 -8.913 13.493 6.188 1.00 35.14 C ATOM 745 OE1 GLN A 441 -9.931 13.344 5.514 1.00 64.42 O ATOM 746 NE2 GLN A 441 -8.969 13.694 7.501 1.00 45.41 N ATOM 0 H GLN A 441 -7.075 11.527 3.882 1.00 22.54 H new ATOM 0 HA GLN A 441 -9.196 13.003 3.092 1.00 14.45 H new ATOM 0 HB2 GLN A 441 -6.438 14.190 3.824 1.00 5.50 H new ATOM 0 HB3 GLN A 441 -7.984 14.978 4.075 1.00 5.50 H new ATOM 0 HG2 GLN A 441 -7.134 12.453 5.570 1.00 63.32 H new ATOM 0 HG3 GLN A 441 -6.841 14.073 6.170 1.00 63.32 H new ATOM 0 HE21 GLN A 441 -8.109 13.814 8.036 1.00 45.41 H new ATOM 0 HE22 GLN A 441 -9.872 13.728 7.974 1.00 45.41 H new ATOM 755 N THR A 442 -6.644 14.014 1.107 1.00 72.12 N ATOM 756 CA THR A 442 -6.359 14.862 -0.071 1.00 21.44 C ATOM 757 C THR A 442 -5.381 14.187 -1.072 1.00 70.34 C ATOM 758 O THR A 442 -4.858 14.905 -1.939 1.00 0.13 O ATOM 759 CB THR A 442 -5.815 16.282 0.351 1.00 32.44 C ATOM 760 OG1 THR A 442 -4.765 16.128 1.311 1.00 14.32 O ATOM 761 CG2 THR A 442 -6.919 17.164 0.946 1.00 71.42 C ATOM 0 H THR A 442 -5.817 13.577 1.515 1.00 72.12 H new ATOM 0 HA THR A 442 -7.312 14.994 -0.583 1.00 21.44 H new ATOM 0 HB THR A 442 -5.439 16.772 -0.547 1.00 32.44 H new ATOM 0 HG1 THR A 442 -4.427 17.011 1.571 1.00 14.32 H new ATOM 0 HG21 THR A 442 -6.502 18.132 1.223 1.00 71.42 H new ATOM 0 HG22 THR A 442 -7.708 17.307 0.208 1.00 71.42 H new ATOM 0 HG23 THR A 442 -7.333 16.681 1.831 1.00 71.42 H new ATOM 769 N ASN A 443 -5.129 12.820 -0.960 1.00 44.33 N ATOM 770 CA ASN A 443 -4.135 12.106 -1.775 1.00 74.22 C ATOM 771 C ASN A 443 -2.714 12.525 -1.396 1.00 71.43 C ATOM 772 O ASN A 443 -1.885 12.838 -2.263 1.00 63.12 O ATOM 773 CB ASN A 443 -4.407 12.252 -3.294 1.00 5.12 C ATOM 774 CG ASN A 443 -3.975 11.023 -4.111 1.00 71.42 C ATOM 775 OD1 ASN A 443 -2.985 10.363 -3.800 1.00 52.44 O ATOM 776 ND2 ASN A 443 -4.741 10.702 -5.153 1.00 40.25 N ATOM 0 H ASN A 443 -5.621 12.218 -0.300 1.00 44.33 H new ATOM 0 HA ASN A 443 -4.232 11.043 -1.554 1.00 74.22 H new ATOM 0 HB2 ASN A 443 -5.471 12.427 -3.450 1.00 5.12 H new ATOM 0 HB3 ASN A 443 -3.881 13.131 -3.667 1.00 5.12 H new ATOM 0 HD21 ASN A 443 -4.513 9.886 -5.721 1.00 40.25 H new ATOM 0 HD22 ASN A 443 -5.555 11.272 -5.382 1.00 40.25 H new ATOM 783 N LEU A 444 -2.423 12.551 -0.084 1.00 44.32 N ATOM 784 CA LEU A 444 -0.980 12.597 0.297 1.00 10.11 C ATOM 785 C LEU A 444 -0.454 11.165 0.644 1.00 15.33 C ATOM 786 O LEU A 444 -1.008 10.526 1.542 1.00 11.04 O ATOM 787 CB LEU A 444 -0.591 13.749 1.389 1.00 20.30 C ATOM 788 CG LEU A 444 -1.134 13.852 2.878 1.00 12.43 C ATOM 789 CD1 LEU A 444 -0.707 12.745 3.880 1.00 35.02 C ATOM 790 CD2 LEU A 444 -0.624 15.166 3.470 1.00 71.31 C ATOM 0 H LEU A 444 -3.096 12.542 0.683 1.00 44.32 H new ATOM 0 HA LEU A 444 -0.435 12.932 -0.585 1.00 10.11 H new ATOM 0 HB2 LEU A 444 0.495 13.717 1.474 1.00 20.30 H new ATOM 0 HB3 LEU A 444 -0.846 14.698 0.918 1.00 20.30 H new ATOM 0 HG LEU A 444 -2.215 13.759 2.770 1.00 12.43 H new ATOM 0 HD11 LEU A 444 -1.152 12.945 4.855 1.00 35.02 H new ATOM 0 HD12 LEU A 444 -1.048 11.775 3.518 1.00 35.02 H new ATOM 0 HD13 LEU A 444 0.379 12.737 3.972 1.00 35.02 H new ATOM 0 HD21 LEU A 444 -0.981 15.266 4.495 1.00 71.31 H new ATOM 0 HD22 LEU A 444 0.466 15.169 3.464 1.00 71.31 H new ATOM 0 HD23 LEU A 444 -0.993 16.001 2.874 1.00 71.31 H new ATOM 802 N SER A 445 0.571 10.580 -0.117 1.00 70.25 N ATOM 803 CA SER A 445 1.270 9.424 0.455 1.00 22.25 C ATOM 804 C SER A 445 2.555 9.867 1.130 1.00 34.14 C ATOM 805 O SER A 445 3.103 10.932 0.813 1.00 34.54 O ATOM 806 CB SER A 445 1.555 8.346 -0.609 1.00 23.04 C ATOM 807 OG SER A 445 2.298 8.878 -1.697 1.00 54.43 O ATOM 0 H SER A 445 0.881 10.884 -1.040 1.00 70.25 H new ATOM 0 HA SER A 445 0.616 8.976 1.203 1.00 22.25 H new ATOM 0 HB2 SER A 445 2.108 7.523 -0.157 1.00 23.04 H new ATOM 0 HB3 SER A 445 0.614 7.935 -0.975 1.00 23.04 H new ATOM 0 HG SER A 445 2.465 8.172 -2.355 1.00 54.43 H new ATOM 813 N LYS A 446 3.046 9.034 2.048 1.00 74.44 N ATOM 814 CA LYS A 446 4.279 9.301 2.780 1.00 12.14 C ATOM 815 C LYS A 446 5.537 9.002 1.931 1.00 45.14 C ATOM 816 O LYS A 446 6.657 9.115 2.433 1.00 22.12 O ATOM 817 CB LYS A 446 4.247 8.428 4.033 1.00 63.45 C ATOM 818 CG LYS A 446 4.318 6.934 3.726 1.00 32.30 C ATOM 819 CD LYS A 446 3.890 6.116 4.921 1.00 64.44 C ATOM 820 CE LYS A 446 4.572 4.765 4.944 1.00 11.13 C ATOM 821 NZ LYS A 446 4.164 3.968 6.131 1.00 64.34 N ATOM 0 H LYS A 446 2.597 8.154 2.304 1.00 74.44 H new ATOM 0 HA LYS A 446 4.338 10.359 3.037 1.00 12.14 H new ATOM 0 HB2 LYS A 446 5.082 8.700 4.679 1.00 63.45 H new ATOM 0 HB3 LYS A 446 3.333 8.635 4.589 1.00 63.45 H new ATOM 0 HG2 LYS A 446 3.678 6.703 2.874 1.00 32.30 H new ATOM 0 HG3 LYS A 446 5.335 6.665 3.442 1.00 32.30 H new ATOM 0 HD2 LYS A 446 4.125 6.658 5.837 1.00 64.44 H new ATOM 0 HD3 LYS A 446 2.809 5.978 4.900 1.00 64.44 H new ATOM 0 HE2 LYS A 446 4.326 4.217 4.035 1.00 11.13 H new ATOM 0 HE3 LYS A 446 5.653 4.902 4.951 1.00 11.13 H new ATOM 0 HZ1 LYS A 446 4.894 3.257 6.339 1.00 64.34 H new ATOM 0 HZ2 LYS A 446 4.051 4.598 6.950 1.00 64.34 H new ATOM 0 HZ3 LYS A 446 3.261 3.491 5.935 1.00 64.34 H new ATOM 835 N CYS A 447 5.316 8.655 0.638 1.00 52.20 N ATOM 836 CA CYS A 447 6.351 8.213 -0.305 1.00 0.44 C ATOM 837 C CYS A 447 7.080 6.962 0.202 1.00 31.43 C ATOM 838 O CYS A 447 8.312 6.906 0.209 1.00 50.11 O ATOM 839 CB CYS A 447 7.341 9.355 -0.611 1.00 31.21 C ATOM 840 SG CYS A 447 6.547 10.873 -1.194 1.00 61.13 S ATOM 0 H CYS A 447 4.386 8.679 0.221 1.00 52.20 H new ATOM 0 HA CYS A 447 5.855 7.941 -1.237 1.00 0.44 H new ATOM 0 HB2 CYS A 447 7.913 9.578 0.289 1.00 31.21 H new ATOM 0 HB3 CYS A 447 8.052 9.015 -1.364 1.00 31.21 H new ATOM 0 HG CYS A 447 7.453 11.776 -1.424 1.00 61.13 H new ATOM 846 N PHE A 448 6.305 5.956 0.647 1.00 54.05 N ATOM 847 CA PHE A 448 6.892 4.700 1.133 1.00 30.11 C ATOM 848 C PHE A 448 5.879 3.522 0.959 1.00 33.33 C ATOM 849 O PHE A 448 4.683 3.695 1.235 1.00 22.13 O ATOM 850 CB PHE A 448 7.395 4.917 2.595 1.00 50.43 C ATOM 851 CG PHE A 448 8.643 4.140 2.984 1.00 51.42 C ATOM 852 CD1 PHE A 448 8.596 2.790 3.330 1.00 23.02 C ATOM 853 CD2 PHE A 448 9.889 4.779 2.986 1.00 64.53 C ATOM 854 CE1 PHE A 448 9.752 2.107 3.664 1.00 51.43 C ATOM 855 CE2 PHE A 448 11.035 4.096 3.311 1.00 23.11 C ATOM 856 CZ PHE A 448 10.972 2.758 3.650 1.00 74.44 C ATOM 0 H PHE A 448 5.286 5.989 0.679 1.00 54.05 H new ATOM 0 HA PHE A 448 7.761 4.412 0.541 1.00 30.11 H new ATOM 0 HB2 PHE A 448 7.591 5.980 2.738 1.00 50.43 H new ATOM 0 HB3 PHE A 448 6.592 4.646 3.280 1.00 50.43 H new ATOM 0 HD1 PHE A 448 7.648 2.273 3.337 1.00 23.02 H new ATOM 0 HD2 PHE A 448 9.950 5.826 2.728 1.00 64.53 H new ATOM 0 HE1 PHE A 448 9.701 1.063 3.936 1.00 51.43 H new ATOM 0 HE2 PHE A 448 11.987 4.605 3.302 1.00 23.11 H new ATOM 0 HZ PHE A 448 11.874 2.221 3.904 1.00 74.44 H new ATOM 866 N GLY A 449 6.374 2.348 0.462 1.00 44.13 N ATOM 867 CA GLY A 449 5.482 1.180 0.118 1.00 74.33 C ATOM 868 C GLY A 449 5.803 -0.164 0.844 1.00 21.40 C ATOM 869 O GLY A 449 6.631 -0.178 1.755 1.00 53.35 O ATOM 0 H GLY A 449 7.365 2.180 0.291 1.00 44.13 H new ATOM 0 HA2 GLY A 449 4.452 1.456 0.345 1.00 74.33 H new ATOM 0 HA3 GLY A 449 5.537 1.011 -0.957 1.00 74.33 H new ATOM 873 N PHE A 450 5.052 -1.270 0.508 1.00 4.11 N ATOM 874 CA PHE A 450 5.522 -2.697 0.796 1.00 12.12 C ATOM 875 C PHE A 450 4.867 -3.697 -0.241 1.00 1.02 C ATOM 876 O PHE A 450 3.835 -3.303 -0.804 1.00 52.11 O ATOM 877 CB PHE A 450 5.248 -3.101 2.310 1.00 13.12 C ATOM 878 CG PHE A 450 3.879 -3.662 2.635 1.00 50.13 C ATOM 879 CD1 PHE A 450 3.563 -4.987 2.361 1.00 40.32 C ATOM 880 CD2 PHE A 450 2.905 -2.855 3.197 1.00 71.24 C ATOM 881 CE1 PHE A 450 2.308 -5.481 2.608 1.00 62.54 C ATOM 882 CE2 PHE A 450 1.650 -3.349 3.461 1.00 31.41 C ATOM 883 CZ PHE A 450 1.348 -4.663 3.156 1.00 1.10 C ATOM 0 H PHE A 450 4.142 -1.216 0.050 1.00 4.11 H new ATOM 0 HA PHE A 450 6.603 -2.754 0.665 1.00 12.12 H new ATOM 0 HB2 PHE A 450 5.995 -3.838 2.604 1.00 13.12 H new ATOM 0 HB3 PHE A 450 5.409 -2.219 2.930 1.00 13.12 H new ATOM 0 HD1 PHE A 450 4.318 -5.638 1.947 1.00 40.32 H new ATOM 0 HD2 PHE A 450 3.134 -1.826 3.431 1.00 71.24 H new ATOM 0 HE1 PHE A 450 2.074 -6.509 2.373 1.00 62.54 H new ATOM 0 HE2 PHE A 450 0.901 -2.711 3.906 1.00 31.41 H new ATOM 0 HZ PHE A 450 0.357 -5.048 3.348 1.00 1.10 H new ATOM 893 N VAL A 451 5.403 -4.986 -0.531 1.00 43.40 N ATOM 894 CA VAL A 451 4.499 -5.988 -1.253 1.00 44.44 C ATOM 895 C VAL A 451 4.959 -7.496 -1.125 1.00 62.33 C ATOM 896 O VAL A 451 6.127 -7.762 -0.810 1.00 11.03 O ATOM 897 CB VAL A 451 4.123 -5.505 -2.764 1.00 73.22 C ATOM 898 CG1 VAL A 451 5.325 -5.349 -3.654 1.00 23.43 C ATOM 899 CG2 VAL A 451 3.117 -6.368 -3.546 1.00 1.25 C ATOM 0 H VAL A 451 6.343 -5.310 -0.301 1.00 43.40 H new ATOM 0 HA VAL A 451 3.554 -5.985 -0.710 1.00 44.44 H new ATOM 0 HB VAL A 451 3.646 -4.550 -2.544 1.00 73.22 H new ATOM 0 HG11 VAL A 451 5.005 -5.026 -4.645 1.00 23.43 H new ATOM 0 HG12 VAL A 451 5.998 -4.604 -3.229 1.00 23.43 H new ATOM 0 HG13 VAL A 451 5.845 -6.304 -3.734 1.00 23.43 H new ATOM 0 HG21 VAL A 451 2.957 -5.935 -4.533 1.00 1.25 H new ATOM 0 HG22 VAL A 451 3.510 -7.379 -3.652 1.00 1.25 H new ATOM 0 HG23 VAL A 451 2.170 -6.402 -3.007 1.00 1.25 H new ATOM 909 N SER A 452 4.007 -8.480 -1.352 1.00 30.24 N ATOM 910 CA SER A 452 4.173 -9.902 -1.058 1.00 1.10 C ATOM 911 C SER A 452 4.497 -10.674 -2.375 1.00 62.43 C ATOM 912 O SER A 452 3.669 -10.661 -3.289 1.00 24.33 O ATOM 913 CB SER A 452 2.777 -10.347 -0.472 1.00 62.23 C ATOM 914 OG SER A 452 2.868 -11.531 0.283 1.00 74.01 O ATOM 0 H SER A 452 3.094 -8.267 -1.754 1.00 30.24 H new ATOM 0 HA SER A 452 4.988 -10.104 -0.363 1.00 1.10 H new ATOM 0 HB2 SER A 452 2.377 -9.549 0.154 1.00 62.23 H new ATOM 0 HB3 SER A 452 2.072 -10.494 -1.290 1.00 62.23 H new ATOM 0 HG SER A 452 1.982 -11.768 0.628 1.00 74.01 H new ATOM 920 N TYR A 453 5.703 -11.307 -2.513 1.00 32.31 N ATOM 921 CA TYR A 453 5.993 -12.134 -3.708 1.00 30.23 C ATOM 922 C TYR A 453 6.456 -13.587 -3.312 1.00 61.12 C ATOM 923 O TYR A 453 7.213 -13.676 -2.350 1.00 52.31 O ATOM 924 CB TYR A 453 7.077 -11.344 -4.544 1.00 22.44 C ATOM 925 CG TYR A 453 7.336 -11.870 -5.970 1.00 32.55 C ATOM 926 CD1 TYR A 453 7.933 -13.107 -6.252 1.00 52.13 C ATOM 927 CD2 TYR A 453 6.992 -11.080 -7.067 1.00 41.12 C ATOM 928 CE1 TYR A 453 8.161 -13.510 -7.548 1.00 54.20 C ATOM 929 CE2 TYR A 453 7.210 -11.468 -8.346 1.00 31.32 C ATOM 930 CZ TYR A 453 7.805 -12.695 -8.598 1.00 50.24 C ATOM 931 OH TYR A 453 8.026 -13.124 -9.887 1.00 61.22 O ATOM 0 H TYR A 453 6.461 -11.259 -1.832 1.00 32.31 H new ATOM 0 HA TYR A 453 5.098 -12.289 -4.311 1.00 30.23 H new ATOM 0 HB2 TYR A 453 6.767 -10.301 -4.612 1.00 22.44 H new ATOM 0 HB3 TYR A 453 8.018 -11.362 -3.994 1.00 22.44 H new ATOM 0 HD1 TYR A 453 8.219 -13.755 -5.437 1.00 52.13 H new ATOM 0 HD2 TYR A 453 6.533 -10.119 -6.889 1.00 41.12 H new ATOM 0 HE1 TYR A 453 8.620 -14.468 -7.741 1.00 54.20 H new ATOM 0 HE2 TYR A 453 6.922 -10.826 -9.165 1.00 31.32 H new ATOM 0 HH TYR A 453 7.691 -12.452 -10.517 1.00 61.22 H new ATOM 941 N ASP A 454 5.922 -14.716 -3.995 1.00 5.44 N ATOM 942 CA ASP A 454 6.505 -16.126 -3.954 1.00 61.42 C ATOM 943 C ASP A 454 7.776 -16.357 -3.084 1.00 45.53 C ATOM 944 O ASP A 454 7.668 -16.631 -1.880 1.00 30.32 O ATOM 945 CB ASP A 454 6.823 -16.640 -5.378 1.00 4.54 C ATOM 946 CG ASP A 454 5.641 -16.587 -6.322 1.00 51.11 C ATOM 947 OD1 ASP A 454 4.740 -17.438 -6.189 1.00 42.43 O ATOM 948 OD2 ASP A 454 5.631 -15.713 -7.219 1.00 23.14 O ATOM 0 H ASP A 454 5.086 -14.652 -4.576 1.00 5.44 H new ATOM 0 HA ASP A 454 5.703 -16.681 -3.467 1.00 61.42 H new ATOM 0 HB2 ASP A 454 7.637 -16.047 -5.795 1.00 4.54 H new ATOM 0 HB3 ASP A 454 7.179 -17.668 -5.313 1.00 4.54 H new ATOM 953 N ASN A 455 8.977 -16.263 -3.707 1.00 0.12 N ATOM 954 CA ASN A 455 10.243 -16.642 -3.067 1.00 15.20 C ATOM 955 C ASN A 455 11.416 -15.871 -3.703 1.00 20.13 C ATOM 956 O ASN A 455 11.434 -15.685 -4.920 1.00 12.12 O ATOM 957 CB ASN A 455 10.397 -18.192 -3.189 1.00 11.31 C ATOM 958 CG ASN A 455 10.632 -18.958 -1.882 1.00 53.01 C ATOM 959 OD1 ASN A 455 11.215 -18.447 -0.929 1.00 42.51 O ATOM 960 ND2 ASN A 455 10.173 -20.221 -1.852 1.00 3.12 N ATOM 0 H ASN A 455 9.086 -15.923 -4.663 1.00 0.12 H new ATOM 0 HA ASN A 455 10.246 -16.376 -2.010 1.00 15.20 H new ATOM 0 HB2 ASN A 455 9.498 -18.589 -3.661 1.00 11.31 H new ATOM 0 HB3 ASN A 455 11.229 -18.401 -3.862 1.00 11.31 H new ATOM 0 HD21 ASN A 455 10.304 -20.792 -1.017 1.00 3.12 H new ATOM 0 HD22 ASN A 455 9.694 -20.609 -2.665 1.00 3.12 H new ATOM 967 N PRO A 456 12.383 -15.341 -2.872 1.00 60.45 N ATOM 968 CA PRO A 456 13.517 -14.456 -3.306 1.00 43.11 C ATOM 969 C PRO A 456 14.295 -14.777 -4.630 1.00 62.44 C ATOM 970 O PRO A 456 14.719 -13.841 -5.297 1.00 11.24 O ATOM 971 CB PRO A 456 14.504 -14.523 -2.120 1.00 74.24 C ATOM 972 CG PRO A 456 13.911 -15.479 -1.130 1.00 11.01 C ATOM 973 CD PRO A 456 12.436 -15.471 -1.387 1.00 12.01 C ATOM 0 HA PRO A 456 13.078 -13.489 -3.552 1.00 43.11 H new ATOM 0 HB2 PRO A 456 15.485 -14.864 -2.450 1.00 74.24 H new ATOM 0 HB3 PRO A 456 14.643 -13.538 -1.674 1.00 74.24 H new ATOM 0 HG2 PRO A 456 14.324 -16.480 -1.257 1.00 11.01 H new ATOM 0 HG3 PRO A 456 14.131 -15.170 -0.108 1.00 11.01 H new ATOM 0 HD2 PRO A 456 11.956 -16.386 -1.040 1.00 12.01 H new ATOM 0 HD3 PRO A 456 11.939 -14.640 -0.886 1.00 12.01 H new ATOM 981 N VAL A 457 14.509 -16.061 -5.020 1.00 72.14 N ATOM 982 CA VAL A 457 15.286 -16.366 -6.249 1.00 54.12 C ATOM 983 C VAL A 457 14.483 -16.081 -7.568 1.00 23.41 C ATOM 984 O VAL A 457 15.081 -16.082 -8.637 1.00 72.53 O ATOM 985 CB VAL A 457 16.027 -17.778 -6.269 1.00 3.02 C ATOM 986 CG1 VAL A 457 17.155 -17.824 -5.241 1.00 4.20 C ATOM 987 CG2 VAL A 457 15.117 -18.963 -6.008 1.00 3.53 C ATOM 0 H VAL A 457 14.166 -16.880 -4.518 1.00 72.14 H new ATOM 0 HA VAL A 457 16.106 -15.649 -6.213 1.00 54.12 H new ATOM 0 HB VAL A 457 16.413 -17.866 -7.285 1.00 3.02 H new ATOM 0 HG11 VAL A 457 17.642 -18.799 -5.278 1.00 4.20 H new ATOM 0 HG12 VAL A 457 17.884 -17.046 -5.466 1.00 4.20 H new ATOM 0 HG13 VAL A 457 16.746 -17.661 -4.244 1.00 4.20 H new ATOM 0 HG21 VAL A 457 15.700 -19.883 -6.039 1.00 3.53 H new ATOM 0 HG22 VAL A 457 14.656 -18.858 -5.026 1.00 3.53 H new ATOM 0 HG23 VAL A 457 14.340 -19.000 -6.771 1.00 3.53 H new ATOM 997 N SER A 458 13.129 -15.841 -7.497 1.00 21.20 N ATOM 998 CA SER A 458 12.368 -15.359 -8.676 1.00 24.02 C ATOM 999 C SER A 458 12.375 -13.790 -8.762 1.00 62.35 C ATOM 1000 O SER A 458 12.197 -13.246 -9.850 1.00 20.32 O ATOM 1001 CB SER A 458 10.872 -15.885 -8.731 1.00 21.12 C ATOM 1002 OG SER A 458 10.229 -15.446 -9.920 1.00 72.43 O ATOM 0 H SER A 458 12.568 -15.973 -6.655 1.00 21.20 H new ATOM 0 HA SER A 458 12.888 -15.777 -9.538 1.00 24.02 H new ATOM 0 HB2 SER A 458 10.862 -16.974 -8.687 1.00 21.12 H new ATOM 0 HB3 SER A 458 10.323 -15.526 -7.861 1.00 21.12 H new ATOM 0 HG SER A 458 9.591 -14.734 -9.703 1.00 72.43 H new ATOM 1008 N ALA A 459 12.633 -13.048 -7.637 1.00 74.44 N ATOM 1009 CA ALA A 459 12.172 -11.671 -7.523 1.00 52.34 C ATOM 1010 C ALA A 459 13.120 -10.574 -8.086 1.00 2.31 C ATOM 1011 O ALA A 459 12.633 -9.481 -8.399 1.00 73.35 O ATOM 1012 CB ALA A 459 11.826 -11.375 -6.056 1.00 42.44 C ATOM 0 H ALA A 459 13.148 -13.393 -6.827 1.00 74.44 H new ATOM 0 HA ALA A 459 11.295 -11.612 -8.167 1.00 52.34 H new ATOM 0 HB1 ALA A 459 11.480 -10.345 -5.964 1.00 42.44 H new ATOM 0 HB2 ALA A 459 11.040 -12.053 -5.724 1.00 42.44 H new ATOM 0 HB3 ALA A 459 12.712 -11.516 -5.437 1.00 42.44 H new ATOM 1018 N GLN A 460 14.454 -10.823 -8.221 1.00 24.02 N ATOM 1019 CA GLN A 460 15.407 -9.736 -8.569 1.00 5.31 C ATOM 1020 C GLN A 460 15.247 -9.208 -10.022 1.00 61.42 C ATOM 1021 O GLN A 460 15.616 -8.062 -10.286 1.00 32.14 O ATOM 1022 CB GLN A 460 16.905 -10.062 -8.248 1.00 64.13 C ATOM 1023 CG GLN A 460 17.269 -10.134 -6.750 1.00 60.33 C ATOM 1024 CD GLN A 460 16.988 -11.479 -6.090 1.00 21.53 C ATOM 1025 OE1 GLN A 460 17.227 -12.579 -6.805 1.00 63.14 O flip ATOM 1026 NE2 GLN A 460 16.628 -11.528 -4.918 1.00 12.11 N flip ATOM 0 H GLN A 460 14.882 -11.741 -8.098 1.00 24.02 H new ATOM 0 HA GLN A 460 15.120 -8.926 -7.899 1.00 5.31 H new ATOM 0 HB2 GLN A 460 17.157 -11.016 -8.710 1.00 64.13 H new ATOM 0 HB3 GLN A 460 17.531 -9.304 -8.719 1.00 64.13 H new ATOM 0 HG2 GLN A 460 18.328 -9.903 -6.636 1.00 60.33 H new ATOM 0 HG3 GLN A 460 16.715 -9.361 -6.218 1.00 60.33 H new ATOM 0 HE21 GLN A 460 16.454 -10.666 -4.401 1.00 12.11 H new ATOM 0 HE22 GLN A 460 16.503 -12.431 -4.460 1.00 12.11 H new ATOM 1035 N ALA A 461 14.726 -10.045 -10.956 1.00 53.23 N ATOM 1036 CA ALA A 461 14.260 -9.590 -12.284 1.00 34.25 C ATOM 1037 C ALA A 461 13.374 -8.224 -12.351 1.00 11.31 C ATOM 1038 O ALA A 461 13.363 -7.624 -13.426 1.00 24.10 O ATOM 1039 CB ALA A 461 13.687 -10.807 -13.101 1.00 14.00 C ATOM 0 H ALA A 461 14.619 -11.048 -10.807 1.00 53.23 H new ATOM 0 HA ALA A 461 15.152 -9.225 -12.792 1.00 34.25 H new ATOM 0 HB1 ALA A 461 13.346 -10.462 -14.077 1.00 14.00 H new ATOM 0 HB2 ALA A 461 14.467 -11.556 -13.233 1.00 14.00 H new ATOM 0 HB3 ALA A 461 12.850 -11.247 -12.559 1.00 14.00 H new ATOM 1045 N ALA A 462 12.640 -7.710 -11.254 1.00 35.41 N ATOM 1046 CA ALA A 462 12.126 -6.255 -11.198 1.00 31.22 C ATOM 1047 C ALA A 462 13.149 -5.300 -10.576 1.00 54.12 C ATOM 1048 O ALA A 462 13.372 -4.206 -11.100 1.00 72.03 O ATOM 1049 CB ALA A 462 10.824 -6.096 -10.397 1.00 44.51 C ATOM 0 H ALA A 462 12.402 -8.263 -10.431 1.00 35.41 H new ATOM 0 HA ALA A 462 11.946 -6.003 -12.243 1.00 31.22 H new ATOM 0 HB1 ALA A 462 10.521 -5.049 -10.399 1.00 44.51 H new ATOM 0 HB2 ALA A 462 10.040 -6.702 -10.852 1.00 44.51 H new ATOM 0 HB3 ALA A 462 10.986 -6.425 -9.370 1.00 44.51 H new ATOM 1055 N ILE A 463 13.681 -5.720 -9.412 1.00 52.23 N ATOM 1056 CA ILE A 463 14.586 -4.934 -8.526 1.00 61.14 C ATOM 1057 C ILE A 463 15.704 -4.099 -9.249 1.00 5.23 C ATOM 1058 O ILE A 463 15.982 -2.980 -8.811 1.00 4.14 O ATOM 1059 CB ILE A 463 15.124 -5.836 -7.317 1.00 3.23 C ATOM 1060 CG1 ILE A 463 13.946 -6.751 -6.818 1.00 3.45 C ATOM 1061 CG2 ILE A 463 15.705 -4.984 -6.149 1.00 10.14 C ATOM 1062 CD1 ILE A 463 14.162 -7.494 -5.511 1.00 62.50 C ATOM 0 H ILE A 463 13.490 -6.651 -9.041 1.00 52.23 H new ATOM 0 HA ILE A 463 13.965 -4.145 -8.103 1.00 61.14 H new ATOM 0 HB ILE A 463 15.950 -6.449 -7.679 1.00 3.23 H new ATOM 0 HG12 ILE A 463 13.055 -6.131 -6.713 1.00 3.45 H new ATOM 0 HG13 ILE A 463 13.734 -7.485 -7.595 1.00 3.45 H new ATOM 0 HG21 ILE A 463 16.055 -5.645 -5.356 1.00 10.14 H new ATOM 0 HG22 ILE A 463 16.538 -4.384 -6.516 1.00 10.14 H new ATOM 0 HG23 ILE A 463 14.929 -4.327 -5.757 1.00 10.14 H new ATOM 0 HD11 ILE A 463 13.278 -8.088 -5.280 1.00 62.50 H new ATOM 0 HD12 ILE A 463 15.026 -8.152 -5.605 1.00 62.50 H new ATOM 0 HD13 ILE A 463 14.337 -6.777 -4.709 1.00 62.50 H new ATOM 1074 N GLN A 464 16.330 -4.592 -10.341 1.00 24.23 N ATOM 1075 CA GLN A 464 17.251 -3.757 -11.136 1.00 1.55 C ATOM 1076 C GLN A 464 16.608 -2.983 -12.364 1.00 74.25 C ATOM 1077 O GLN A 464 17.076 -1.874 -12.628 1.00 22.12 O ATOM 1078 CB GLN A 464 18.569 -4.521 -11.504 1.00 53.53 C ATOM 1079 CG GLN A 464 19.367 -5.040 -10.297 1.00 11.24 C ATOM 1080 CD GLN A 464 18.944 -6.436 -9.860 1.00 4.54 C ATOM 1081 OE1 GLN A 464 18.471 -7.239 -10.662 1.00 70.41 O ATOM 1082 NE2 GLN A 464 19.133 -6.741 -8.589 1.00 65.10 N ATOM 0 H GLN A 464 16.216 -5.545 -10.685 1.00 24.23 H new ATOM 0 HA GLN A 464 17.521 -2.944 -10.462 1.00 1.55 H new ATOM 0 HB2 GLN A 464 18.317 -5.365 -12.146 1.00 53.53 H new ATOM 0 HB3 GLN A 464 19.208 -3.857 -12.087 1.00 53.53 H new ATOM 0 HG2 GLN A 464 20.428 -5.049 -10.547 1.00 11.24 H new ATOM 0 HG3 GLN A 464 19.242 -4.350 -9.462 1.00 11.24 H new ATOM 0 HE21 GLN A 464 19.528 -6.049 -7.952 1.00 65.10 H new ATOM 0 HE22 GLN A 464 18.884 -7.668 -8.245 1.00 65.10 H new ATOM 1091 N ALA A 465 15.581 -3.510 -13.141 1.00 23.32 N ATOM 1092 CA ALA A 465 14.918 -2.656 -14.220 1.00 20.22 C ATOM 1093 C ALA A 465 14.201 -1.356 -13.671 1.00 30.23 C ATOM 1094 O ALA A 465 14.296 -0.310 -14.311 1.00 42.42 O ATOM 1095 CB ALA A 465 14.004 -3.453 -15.244 1.00 71.50 C ATOM 0 H ALA A 465 15.213 -4.457 -13.052 1.00 23.32 H new ATOM 0 HA ALA A 465 15.771 -2.312 -14.805 1.00 20.22 H new ATOM 0 HB1 ALA A 465 13.580 -2.759 -15.969 1.00 71.50 H new ATOM 0 HB2 ALA A 465 14.605 -4.199 -15.764 1.00 71.50 H new ATOM 0 HB3 ALA A 465 13.199 -3.950 -14.703 1.00 71.50 H new ATOM 1101 N MET A 466 13.486 -1.417 -12.521 1.00 1.41 N ATOM 1102 CA MET A 466 12.928 -0.188 -11.840 1.00 31.25 C ATOM 1103 C MET A 466 13.893 0.561 -10.847 1.00 45.11 C ATOM 1104 O MET A 466 13.407 1.281 -9.974 1.00 44.14 O ATOM 1105 CB MET A 466 11.634 -0.497 -11.037 1.00 41.44 C ATOM 1106 CG MET A 466 10.341 -0.469 -11.846 1.00 31.55 C ATOM 1107 SD MET A 466 10.149 -1.858 -12.980 1.00 64.43 S ATOM 1108 CE MET A 466 9.122 -2.945 -11.997 1.00 32.31 C ATOM 0 H MET A 466 13.275 -2.290 -12.037 1.00 1.41 H new ATOM 0 HA MET A 466 12.745 0.467 -12.692 1.00 31.25 H new ATOM 0 HB2 MET A 466 11.736 -1.482 -10.581 1.00 41.44 H new ATOM 0 HB3 MET A 466 11.550 0.224 -10.224 1.00 41.44 H new ATOM 0 HG2 MET A 466 9.495 -0.456 -11.158 1.00 31.55 H new ATOM 0 HG3 MET A 466 10.302 0.459 -12.416 1.00 31.55 H new ATOM 0 HE1 MET A 466 9.101 -3.936 -12.451 1.00 32.31 H new ATOM 0 HE2 MET A 466 9.529 -3.017 -10.989 1.00 32.31 H new ATOM 0 HE3 MET A 466 8.109 -2.546 -11.951 1.00 32.31 H new ATOM 1118 N ASN A 467 15.227 0.426 -10.959 1.00 51.53 N ATOM 1119 CA ASN A 467 16.160 1.106 -10.036 1.00 34.30 C ATOM 1120 C ASN A 467 16.493 2.546 -10.519 1.00 42.43 C ATOM 1121 O ASN A 467 17.268 2.669 -11.465 1.00 33.43 O ATOM 1122 CB ASN A 467 17.442 0.245 -9.919 1.00 75.43 C ATOM 1123 CG ASN A 467 18.127 0.456 -8.577 1.00 62.11 C ATOM 1124 OD1 ASN A 467 17.484 0.811 -7.584 1.00 41.23 O ATOM 1125 ND2 ASN A 467 19.429 0.230 -8.527 1.00 63.53 N ATOM 0 H ASN A 467 15.682 -0.143 -11.673 1.00 51.53 H new ATOM 0 HA ASN A 467 15.692 1.208 -9.057 1.00 34.30 H new ATOM 0 HB2 ASN A 467 17.188 -0.808 -10.039 1.00 75.43 H new ATOM 0 HB3 ASN A 467 18.130 0.501 -10.725 1.00 75.43 H new ATOM 0 HD21 ASN A 467 19.934 0.348 -7.648 1.00 63.53 H new ATOM 0 HD22 ASN A 467 19.929 -0.062 -9.367 1.00 63.53 H new ATOM 1132 N GLY A 468 15.940 3.661 -9.901 1.00 43.21 N ATOM 1133 CA GLY A 468 16.283 4.993 -10.411 1.00 24.34 C ATOM 1134 C GLY A 468 15.503 5.416 -11.660 1.00 45.33 C ATOM 1135 O GLY A 468 15.910 6.349 -12.346 1.00 22.35 O ATOM 0 H GLY A 468 15.302 3.641 -9.106 1.00 43.21 H new ATOM 0 HA2 GLY A 468 16.108 5.726 -9.623 1.00 24.34 H new ATOM 0 HA3 GLY A 468 17.349 5.018 -10.638 1.00 24.34 H new ATOM 1139 N PHE A 469 14.388 4.746 -11.940 1.00 21.14 N ATOM 1140 CA PHE A 469 13.687 4.872 -13.231 1.00 51.02 C ATOM 1141 C PHE A 469 12.703 6.065 -13.101 1.00 63.14 C ATOM 1142 O PHE A 469 11.763 5.980 -12.304 1.00 13.33 O ATOM 1143 CB PHE A 469 12.996 3.478 -13.570 1.00 70.41 C ATOM 1144 CG PHE A 469 12.177 3.376 -14.860 1.00 22.25 C ATOM 1145 CD1 PHE A 469 12.779 3.226 -16.114 1.00 20.34 C ATOM 1146 CD2 PHE A 469 10.789 3.378 -14.806 1.00 71.05 C ATOM 1147 CE1 PHE A 469 12.002 3.102 -17.256 1.00 14.14 C ATOM 1148 CE2 PHE A 469 10.021 3.250 -15.931 1.00 4.32 C ATOM 1149 CZ PHE A 469 10.622 3.116 -17.164 1.00 13.43 C ATOM 0 H PHE A 469 13.941 4.102 -11.288 1.00 21.14 H new ATOM 0 HA PHE A 469 14.351 5.087 -14.068 1.00 51.02 H new ATOM 0 HB2 PHE A 469 13.777 2.719 -13.610 1.00 70.41 H new ATOM 0 HB3 PHE A 469 12.342 3.219 -12.738 1.00 70.41 H new ATOM 0 HD1 PHE A 469 13.856 3.207 -16.193 1.00 20.34 H new ATOM 0 HD2 PHE A 469 10.302 3.484 -13.848 1.00 71.05 H new ATOM 0 HE1 PHE A 469 12.476 2.994 -18.220 1.00 14.14 H new ATOM 0 HE2 PHE A 469 8.944 3.254 -15.853 1.00 4.32 H new ATOM 0 HZ PHE A 469 10.018 3.022 -18.054 1.00 13.43 H new ATOM 1159 N GLN A 470 12.952 7.211 -13.819 1.00 33.41 N ATOM 1160 CA GLN A 470 12.137 8.426 -13.638 1.00 14.22 C ATOM 1161 C GLN A 470 10.733 8.292 -14.250 1.00 11.33 C ATOM 1162 O GLN A 470 10.574 7.756 -15.351 1.00 63.20 O ATOM 1163 CB GLN A 470 12.880 9.629 -14.242 1.00 11.42 C ATOM 1164 CG GLN A 470 13.517 10.571 -13.212 1.00 41.32 C ATOM 1165 CD GLN A 470 12.625 11.739 -12.779 1.00 71.54 C ATOM 1166 OE1 GLN A 470 11.316 11.624 -12.958 1.00 75.13 O flip ATOM 1167 NE2 GLN A 470 13.127 12.766 -12.338 1.00 5.04 N flip ATOM 0 H GLN A 470 13.697 7.301 -14.509 1.00 33.41 H new ATOM 0 HA GLN A 470 11.993 8.577 -12.568 1.00 14.22 H new ATOM 0 HB2 GLN A 470 13.660 9.260 -14.908 1.00 11.42 H new ATOM 0 HB3 GLN A 470 12.182 10.200 -14.854 1.00 11.42 H new ATOM 0 HG2 GLN A 470 13.789 9.992 -12.329 1.00 41.32 H new ATOM 0 HG3 GLN A 470 14.441 10.972 -13.628 1.00 41.32 H new ATOM 0 HE21 GLN A 470 14.137 12.826 -12.211 1.00 5.04 H new ATOM 0 HE22 GLN A 470 12.535 13.561 -12.098 1.00 5.04 H new ATOM 1176 N ILE A 471 9.723 8.820 -13.533 1.00 44.31 N ATOM 1177 CA ILE A 471 8.303 8.551 -13.837 1.00 74.53 C ATOM 1178 C ILE A 471 7.505 9.846 -13.454 1.00 61.55 C ATOM 1179 O ILE A 471 7.104 9.982 -12.290 1.00 34.45 O ATOM 1180 CB ILE A 471 7.733 7.255 -13.028 1.00 63.43 C ATOM 1181 CG1 ILE A 471 8.534 5.941 -13.366 1.00 14.23 C ATOM 1182 CG2 ILE A 471 6.226 7.041 -13.313 1.00 34.44 C ATOM 1183 CD1 ILE A 471 8.335 4.744 -12.412 1.00 24.42 C ATOM 0 H ILE A 471 9.865 9.439 -12.735 1.00 44.31 H new ATOM 0 HA ILE A 471 8.188 8.313 -14.894 1.00 74.53 H new ATOM 0 HB ILE A 471 7.870 7.465 -11.967 1.00 63.43 H new ATOM 0 HG12 ILE A 471 8.259 5.624 -14.372 1.00 14.23 H new ATOM 0 HG13 ILE A 471 9.596 6.186 -13.388 1.00 14.23 H new ATOM 0 HG21 ILE A 471 5.871 6.170 -12.761 1.00 34.44 H new ATOM 0 HG22 ILE A 471 5.667 7.922 -12.998 1.00 34.44 H new ATOM 0 HG23 ILE A 471 6.077 6.879 -14.381 1.00 34.44 H new ATOM 0 HD11 ILE A 471 8.939 3.903 -12.753 1.00 24.42 H new ATOM 0 HD12 ILE A 471 8.641 5.027 -11.405 1.00 24.42 H new ATOM 0 HD13 ILE A 471 7.284 4.456 -12.404 1.00 24.42 H new ATOM 1195 N GLY A 472 7.316 10.847 -14.393 1.00 61.13 N ATOM 1196 CA GLY A 472 6.555 12.054 -14.036 1.00 43.32 C ATOM 1197 C GLY A 472 7.364 13.004 -13.164 1.00 52.21 C ATOM 1198 O GLY A 472 8.531 13.282 -13.453 1.00 32.21 O ATOM 0 H GLY A 472 7.671 10.824 -15.349 1.00 61.13 H new ATOM 0 HA2 GLY A 472 6.248 12.570 -14.945 1.00 43.32 H new ATOM 0 HA3 GLY A 472 5.645 11.766 -13.510 1.00 43.32 H new ATOM 1202 N MET A 473 6.742 13.483 -12.088 1.00 10.30 N ATOM 1203 CA MET A 473 7.432 14.363 -11.117 1.00 72.13 C ATOM 1204 C MET A 473 8.075 13.578 -9.937 1.00 14.02 C ATOM 1205 O MET A 473 8.510 14.195 -8.962 1.00 45.21 O ATOM 1206 CB MET A 473 6.487 15.481 -10.572 1.00 64.13 C ATOM 1207 CG MET A 473 5.143 14.985 -10.038 1.00 51.32 C ATOM 1208 SD MET A 473 4.627 15.810 -8.515 1.00 11.41 S ATOM 1209 CE MET A 473 4.452 17.514 -9.054 1.00 22.21 C ATOM 0 H MET A 473 5.768 13.284 -11.858 1.00 10.30 H new ATOM 0 HA MET A 473 8.242 14.835 -11.673 1.00 72.13 H new ATOM 0 HB2 MET A 473 7.003 16.016 -9.775 1.00 64.13 H new ATOM 0 HB3 MET A 473 6.301 16.200 -11.370 1.00 64.13 H new ATOM 0 HG2 MET A 473 4.379 15.136 -10.801 1.00 51.32 H new ATOM 0 HG3 MET A 473 5.206 13.912 -9.858 1.00 51.32 H new ATOM 0 HE1 MET A 473 4.138 18.131 -8.212 1.00 22.21 H new ATOM 0 HE2 MET A 473 5.408 17.876 -9.433 1.00 22.21 H new ATOM 0 HE3 MET A 473 3.704 17.571 -9.845 1.00 22.21 H new ATOM 1219 N LYS A 474 8.173 12.234 -10.034 1.00 54.44 N ATOM 1220 CA LYS A 474 8.785 11.418 -8.930 1.00 1.30 C ATOM 1221 C LYS A 474 9.760 10.371 -9.574 1.00 62.15 C ATOM 1222 O LYS A 474 9.684 10.157 -10.781 1.00 41.25 O ATOM 1223 CB LYS A 474 7.729 10.630 -8.034 1.00 4.21 C ATOM 1224 CG LYS A 474 6.350 11.263 -7.594 1.00 53.12 C ATOM 1225 CD LYS A 474 6.420 12.653 -6.873 1.00 63.23 C ATOM 1226 CE LYS A 474 5.295 12.857 -5.841 1.00 75.44 C ATOM 1227 NZ LYS A 474 3.942 12.795 -6.459 1.00 33.10 N ATOM 0 H LYS A 474 7.850 11.692 -10.835 1.00 54.44 H new ATOM 0 HA LYS A 474 9.294 12.120 -8.269 1.00 1.30 H new ATOM 0 HB2 LYS A 474 7.493 9.709 -8.567 1.00 4.21 H new ATOM 0 HB3 LYS A 474 8.248 10.345 -7.119 1.00 4.21 H new ATOM 0 HG2 LYS A 474 5.724 11.369 -8.480 1.00 53.12 H new ATOM 0 HG3 LYS A 474 5.847 10.559 -6.931 1.00 53.12 H new ATOM 0 HD2 LYS A 474 7.384 12.748 -6.374 1.00 63.23 H new ATOM 0 HD3 LYS A 474 6.368 13.446 -7.619 1.00 63.23 H new ATOM 0 HE2 LYS A 474 5.373 12.094 -5.066 1.00 75.44 H new ATOM 0 HE3 LYS A 474 5.425 13.822 -5.352 1.00 75.44 H new ATOM 0 HZ1 LYS A 474 3.219 12.938 -5.726 1.00 33.10 H new ATOM 0 HZ2 LYS A 474 3.855 13.539 -7.180 1.00 33.10 H new ATOM 0 HZ3 LYS A 474 3.806 11.865 -6.903 1.00 33.10 H new ATOM 1241 N ARG A 475 10.692 9.727 -8.801 1.00 51.32 N ATOM 1242 CA ARG A 475 11.521 8.640 -9.386 1.00 14.02 C ATOM 1243 C ARG A 475 11.423 7.352 -8.553 1.00 20.55 C ATOM 1244 O ARG A 475 11.473 7.409 -7.317 1.00 23.54 O ATOM 1245 CB ARG A 475 13.023 9.072 -9.588 1.00 63.03 C ATOM 1246 CG ARG A 475 13.905 9.400 -8.330 1.00 55.54 C ATOM 1247 CD ARG A 475 13.744 10.821 -7.733 1.00 35.15 C ATOM 1248 NE ARG A 475 15.045 11.472 -7.573 1.00 72.52 N ATOM 1249 CZ ARG A 475 15.206 12.773 -7.339 1.00 40.31 C ATOM 1250 NH1 ARG A 475 14.152 13.582 -7.227 1.00 52.33 N ATOM 1251 NH2 ARG A 475 16.429 13.279 -7.229 1.00 54.04 N ATOM 0 H ARG A 475 10.877 9.934 -7.819 1.00 51.32 H new ATOM 0 HA ARG A 475 11.114 8.435 -10.376 1.00 14.02 H new ATOM 0 HB2 ARG A 475 13.522 8.275 -10.139 1.00 63.03 H new ATOM 0 HB3 ARG A 475 13.027 9.953 -10.229 1.00 63.03 H new ATOM 0 HG2 ARG A 475 13.675 8.673 -7.551 1.00 55.54 H new ATOM 0 HG3 ARG A 475 14.952 9.258 -8.599 1.00 55.54 H new ATOM 0 HD2 ARG A 475 13.109 11.423 -8.383 1.00 35.15 H new ATOM 0 HD3 ARG A 475 13.243 10.759 -6.767 1.00 35.15 H new ATOM 0 HE ARG A 475 15.881 10.893 -7.645 1.00 72.52 H new ATOM 0 HH11 ARG A 475 13.208 13.206 -7.321 1.00 52.33 H new ATOM 0 HH12 ARG A 475 14.289 14.577 -7.048 1.00 52.33 H new ATOM 0 HH21 ARG A 475 17.243 12.671 -7.324 1.00 54.04 H new ATOM 0 HH22 ARG A 475 16.555 14.275 -7.050 1.00 54.04 H new ATOM 1265 N LEU A 476 11.285 6.188 -9.232 1.00 75.34 N ATOM 1266 CA LEU A 476 11.041 4.914 -8.505 1.00 11.25 C ATOM 1267 C LEU A 476 12.398 4.320 -8.046 1.00 5.34 C ATOM 1268 O LEU A 476 13.201 3.942 -8.897 1.00 51.33 O ATOM 1269 CB LEU A 476 10.276 3.890 -9.437 1.00 12.11 C ATOM 1270 CG LEU A 476 9.095 3.045 -8.831 1.00 32.42 C ATOM 1271 CD1 LEU A 476 9.433 2.470 -7.467 1.00 42.34 C ATOM 1272 CD2 LEU A 476 7.801 3.848 -8.784 1.00 55.41 C ATOM 0 H LEU A 476 11.336 6.101 -10.247 1.00 75.34 H new ATOM 0 HA LEU A 476 10.420 5.108 -7.631 1.00 11.25 H new ATOM 0 HB2 LEU A 476 9.880 4.449 -10.285 1.00 12.11 H new ATOM 0 HB3 LEU A 476 11.013 3.190 -9.832 1.00 12.11 H new ATOM 0 HG LEU A 476 8.942 2.200 -9.502 1.00 32.42 H new ATOM 0 HD11 LEU A 476 8.585 1.896 -7.094 1.00 42.34 H new ATOM 0 HD12 LEU A 476 10.303 1.818 -7.552 1.00 42.34 H new ATOM 0 HD13 LEU A 476 9.654 3.282 -6.775 1.00 42.34 H new ATOM 0 HD21 LEU A 476 7.007 3.234 -8.360 1.00 55.41 H new ATOM 0 HD22 LEU A 476 7.945 4.733 -8.165 1.00 55.41 H new ATOM 0 HD23 LEU A 476 7.525 4.152 -9.794 1.00 55.41 H new ATOM 1284 N LYS A 477 12.699 4.296 -6.718 1.00 24.31 N ATOM 1285 CA LYS A 477 13.885 3.532 -6.244 1.00 22.42 C ATOM 1286 C LYS A 477 13.454 2.301 -5.400 1.00 62.44 C ATOM 1287 O LYS A 477 12.601 2.452 -4.524 1.00 31.52 O ATOM 1288 CB LYS A 477 14.824 4.456 -5.427 1.00 11.25 C ATOM 1289 CG LYS A 477 16.081 3.740 -4.875 1.00 31.24 C ATOM 1290 CD LYS A 477 17.395 4.459 -5.203 1.00 5.42 C ATOM 1291 CE LYS A 477 18.606 3.691 -4.654 1.00 23.43 C ATOM 1292 NZ LYS A 477 18.629 2.260 -5.094 1.00 2.00 N ATOM 0 H LYS A 477 12.166 4.771 -5.989 1.00 24.31 H new ATOM 0 HA LYS A 477 14.428 3.165 -7.115 1.00 22.42 H new ATOM 0 HB2 LYS A 477 15.139 5.288 -6.058 1.00 11.25 H new ATOM 0 HB3 LYS A 477 14.265 4.882 -4.594 1.00 11.25 H new ATOM 0 HG2 LYS A 477 15.989 3.646 -3.793 1.00 31.24 H new ATOM 0 HG3 LYS A 477 16.120 2.729 -5.280 1.00 31.24 H new ATOM 0 HD2 LYS A 477 17.491 4.569 -6.283 1.00 5.42 H new ATOM 0 HD3 LYS A 477 17.377 5.464 -4.780 1.00 5.42 H new ATOM 0 HE2 LYS A 477 19.522 4.183 -4.982 1.00 23.43 H new ATOM 0 HE3 LYS A 477 18.594 3.732 -3.565 1.00 23.43 H new ATOM 0 HZ1 LYS A 477 19.614 1.953 -5.225 1.00 2.00 H new ATOM 0 HZ2 LYS A 477 18.174 1.667 -4.371 1.00 2.00 H new ATOM 0 HZ3 LYS A 477 18.115 2.165 -5.993 1.00 2.00 H new ATOM 1306 N VAL A 478 14.015 1.076 -5.656 1.00 43.02 N ATOM 1307 CA VAL A 478 13.543 -0.118 -4.934 1.00 10.25 C ATOM 1308 C VAL A 478 14.729 -1.058 -4.591 1.00 42.34 C ATOM 1309 O VAL A 478 15.708 -1.076 -5.339 1.00 1.01 O ATOM 1310 CB VAL A 478 12.380 -0.838 -5.727 1.00 40.42 C ATOM 1311 CG1 VAL A 478 12.695 -2.292 -6.112 1.00 20.15 C ATOM 1312 CG2 VAL A 478 11.087 -0.789 -4.933 1.00 60.04 C ATOM 0 H VAL A 478 14.762 0.908 -6.330 1.00 43.02 H new ATOM 0 HA VAL A 478 13.112 0.192 -3.982 1.00 10.25 H new ATOM 0 HB VAL A 478 12.273 -0.285 -6.660 1.00 40.42 H new ATOM 0 HG11 VAL A 478 11.849 -2.717 -6.653 1.00 20.15 H new ATOM 0 HG12 VAL A 478 13.581 -2.317 -6.747 1.00 20.15 H new ATOM 0 HG13 VAL A 478 12.879 -2.876 -5.210 1.00 20.15 H new ATOM 0 HG21 VAL A 478 10.297 -1.289 -5.493 1.00 60.04 H new ATOM 0 HG22 VAL A 478 11.228 -1.292 -3.977 1.00 60.04 H new ATOM 0 HG23 VAL A 478 10.806 0.250 -4.758 1.00 60.04 H new ATOM 1322 N GLN A 479 14.663 -1.811 -3.465 1.00 11.31 N ATOM 1323 CA GLN A 479 15.803 -2.668 -3.033 1.00 24.13 C ATOM 1324 C GLN A 479 15.354 -3.877 -2.174 1.00 34.50 C ATOM 1325 O GLN A 479 14.164 -3.974 -1.850 1.00 52.41 O ATOM 1326 CB GLN A 479 16.876 -1.857 -2.295 1.00 25.24 C ATOM 1327 CG GLN A 479 18.080 -1.516 -3.181 1.00 22.41 C ATOM 1328 CD GLN A 479 19.230 -0.833 -2.457 1.00 44.24 C ATOM 1329 OE1 GLN A 479 19.457 -1.164 -1.193 1.00 73.45 O flip ATOM 1330 NE2 GLN A 479 19.927 -0.017 -3.055 1.00 44.35 N flip ATOM 0 H GLN A 479 13.851 -1.845 -2.848 1.00 11.31 H new ATOM 0 HA GLN A 479 16.240 -3.066 -3.949 1.00 24.13 H new ATOM 0 HB2 GLN A 479 16.433 -0.934 -1.921 1.00 25.24 H new ATOM 0 HB3 GLN A 479 17.218 -2.421 -1.427 1.00 25.24 H new ATOM 0 HG2 GLN A 479 18.450 -2.434 -3.637 1.00 22.41 H new ATOM 0 HG3 GLN A 479 17.745 -0.870 -3.993 1.00 22.41 H new ATOM 0 HE21 GLN A 479 19.722 0.213 -4.027 1.00 44.35 H new ATOM 0 HE22 GLN A 479 20.710 0.430 -2.579 1.00 44.35 H new ATOM 1339 N LEU A 480 16.307 -4.827 -1.846 1.00 20.43 N ATOM 1340 CA LEU A 480 16.015 -5.876 -0.783 1.00 62.34 C ATOM 1341 C LEU A 480 15.833 -5.098 0.540 1.00 52.12 C ATOM 1342 O LEU A 480 16.381 -3.986 0.634 1.00 61.10 O ATOM 1343 CB LEU A 480 17.172 -6.953 -0.577 1.00 44.52 C ATOM 1344 CG LEU A 480 16.905 -8.487 -0.860 1.00 50.45 C ATOM 1345 CD1 LEU A 480 16.518 -8.705 -2.322 1.00 53.33 C ATOM 1346 CD2 LEU A 480 18.178 -9.279 -0.550 1.00 62.43 C ATOM 0 H LEU A 480 17.231 -4.891 -2.272 1.00 20.43 H new ATOM 0 HA LEU A 480 15.138 -6.443 -1.097 1.00 62.34 H new ATOM 0 HB2 LEU A 480 18.008 -6.651 -1.208 1.00 44.52 H new ATOM 0 HB3 LEU A 480 17.507 -6.871 0.457 1.00 44.52 H new ATOM 0 HG LEU A 480 16.085 -8.827 -0.228 1.00 50.45 H new ATOM 0 HD11 LEU A 480 16.339 -9.766 -2.497 1.00 53.33 H new ATOM 0 HD12 LEU A 480 15.612 -8.142 -2.546 1.00 53.33 H new ATOM 0 HD13 LEU A 480 17.327 -8.363 -2.967 1.00 53.33 H new ATOM 0 HD21 LEU A 480 18.004 -10.338 -0.742 1.00 62.43 H new ATOM 0 HD22 LEU A 480 18.991 -8.924 -1.184 1.00 62.43 H new ATOM 0 HD23 LEU A 480 18.447 -9.140 0.497 1.00 62.43 H new ATOM 1358 N LYS A 481 15.062 -5.635 1.530 1.00 42.02 N ATOM 1359 CA LYS A 481 14.808 -4.901 2.816 1.00 12.04 C ATOM 1360 C LYS A 481 16.118 -4.553 3.494 1.00 51.43 C ATOM 1361 O LYS A 481 16.850 -5.406 3.990 1.00 51.21 O ATOM 1362 CB LYS A 481 13.858 -5.691 3.791 1.00 73.12 C ATOM 1363 CG LYS A 481 13.687 -5.188 5.290 1.00 2.33 C ATOM 1364 CD LYS A 481 14.719 -5.782 6.275 1.00 14.03 C ATOM 1365 CE LYS A 481 14.092 -6.539 7.458 1.00 11.12 C ATOM 1366 NZ LYS A 481 15.135 -7.263 8.234 1.00 71.35 N ATOM 0 H LYS A 481 14.614 -6.549 1.471 1.00 42.02 H new ATOM 0 HA LYS A 481 14.287 -3.978 2.560 1.00 12.04 H new ATOM 0 HB2 LYS A 481 12.867 -5.711 3.337 1.00 73.12 H new ATOM 0 HB3 LYS A 481 14.212 -6.721 3.830 1.00 73.12 H new ATOM 0 HG2 LYS A 481 13.766 -4.101 5.309 1.00 2.33 H new ATOM 0 HG3 LYS A 481 12.684 -5.440 5.635 1.00 2.33 H new ATOM 0 HD2 LYS A 481 15.377 -6.460 5.731 1.00 14.03 H new ATOM 0 HD3 LYS A 481 15.342 -4.976 6.662 1.00 14.03 H new ATOM 0 HE2 LYS A 481 13.569 -5.838 8.109 1.00 11.12 H new ATOM 0 HE3 LYS A 481 13.349 -7.247 7.090 1.00 11.12 H new ATOM 0 HZ1 LYS A 481 14.690 -7.767 9.028 1.00 71.35 H new ATOM 0 HZ2 LYS A 481 15.616 -7.947 7.615 1.00 71.35 H new ATOM 0 HZ3 LYS A 481 15.829 -6.582 8.602 1.00 71.35 H new ATOM 1380 N ARG A 482 16.433 -3.287 3.389 1.00 62.41 N ATOM 1381 CA ARG A 482 17.568 -2.715 4.053 1.00 10.31 C ATOM 1382 C ARG A 482 17.082 -1.818 5.217 1.00 13.20 C ATOM 1383 O ARG A 482 16.410 -0.806 4.972 1.00 30.51 O ATOM 1384 CB ARG A 482 18.486 -2.021 2.958 1.00 53.42 C ATOM 1385 CG ARG A 482 18.048 -0.683 2.280 1.00 74.14 C ATOM 1386 CD ARG A 482 16.624 -0.623 1.680 1.00 14.25 C ATOM 1387 NE ARG A 482 16.379 0.629 0.957 1.00 62.34 N ATOM 1388 CZ ARG A 482 15.920 1.762 1.524 1.00 41.24 C ATOM 1389 NH1 ARG A 482 15.648 1.817 2.831 1.00 63.03 N ATOM 1390 NH2 ARG A 482 15.713 2.826 0.760 1.00 3.42 N ATOM 0 H ARG A 482 15.899 -2.619 2.832 1.00 62.41 H new ATOM 0 HA ARG A 482 18.203 -3.458 4.535 1.00 10.31 H new ATOM 0 HB2 ARG A 482 19.457 -1.843 3.420 1.00 53.42 H new ATOM 0 HB3 ARG A 482 18.640 -2.749 2.161 1.00 53.42 H new ATOM 0 HG2 ARG A 482 18.136 0.114 3.019 1.00 74.14 H new ATOM 0 HG3 ARG A 482 18.759 -0.460 1.484 1.00 74.14 H new ATOM 0 HD2 ARG A 482 16.481 -1.465 1.003 1.00 14.25 H new ATOM 0 HD3 ARG A 482 15.890 -0.728 2.479 1.00 14.25 H new ATOM 0 HE ARG A 482 16.569 0.643 -0.045 1.00 62.34 H new ATOM 0 HH11 ARG A 482 15.787 0.993 3.416 1.00 63.03 H new ATOM 0 HH12 ARG A 482 15.301 2.683 3.244 1.00 63.03 H new ATOM 0 HH21 ARG A 482 15.901 2.779 -0.241 1.00 3.42 H new ATOM 0 HH22 ARG A 482 15.366 3.691 1.174 1.00 3.42 H new ATOM 1404 N SER A 483 17.353 -2.248 6.486 1.00 15.54 N ATOM 1405 CA SER A 483 17.135 -1.456 7.713 1.00 22.34 C ATOM 1406 C SER A 483 15.658 -1.440 8.220 1.00 51.43 C ATOM 1407 O SER A 483 15.470 -1.653 9.416 1.00 30.33 O ATOM 1408 CB SER A 483 17.756 -0.029 7.628 1.00 11.35 C ATOM 1409 OG SER A 483 19.149 -0.105 7.357 1.00 33.51 O ATOM 0 H SER A 483 17.736 -3.174 6.676 1.00 15.54 H new ATOM 0 HA SER A 483 17.686 -1.993 8.486 1.00 22.34 H new ATOM 0 HB2 SER A 483 17.259 0.544 6.845 1.00 11.35 H new ATOM 0 HB3 SER A 483 17.591 0.502 8.566 1.00 11.35 H new ATOM 0 HG SER A 483 19.522 0.800 7.305 1.00 33.51 H new ATOM 1415 N LYS A 484 14.641 -1.222 7.318 1.00 5.05 N ATOM 1416 CA LYS A 484 13.166 -1.183 7.677 1.00 25.22 C ATOM 1417 C LYS A 484 12.844 0.102 8.504 1.00 13.54 C ATOM 1418 O LYS A 484 13.348 0.270 9.616 1.00 23.42 O ATOM 1419 CB LYS A 484 12.715 -2.465 8.457 1.00 43.21 C ATOM 1420 CG LYS A 484 11.183 -2.633 8.681 1.00 74.22 C ATOM 1421 CD LYS A 484 10.431 -2.919 7.369 1.00 43.01 C ATOM 1422 CE LYS A 484 8.905 -3.090 7.539 1.00 71.10 C ATOM 1423 NZ LYS A 484 8.554 -4.203 8.465 1.00 23.33 N ATOM 0 H LYS A 484 14.814 -1.068 6.325 1.00 5.05 H new ATOM 0 HA LYS A 484 12.603 -1.158 6.744 1.00 25.22 H new ATOM 0 HB2 LYS A 484 13.080 -3.339 7.918 1.00 43.21 H new ATOM 0 HB3 LYS A 484 13.205 -2.463 9.431 1.00 43.21 H new ATOM 0 HG2 LYS A 484 11.008 -3.448 9.383 1.00 74.22 H new ATOM 0 HG3 LYS A 484 10.783 -1.727 9.137 1.00 74.22 H new ATOM 0 HD2 LYS A 484 10.618 -2.103 6.671 1.00 43.01 H new ATOM 0 HD3 LYS A 484 10.839 -3.824 6.919 1.00 43.01 H new ATOM 0 HE2 LYS A 484 8.478 -2.160 7.916 1.00 71.10 H new ATOM 0 HE3 LYS A 484 8.453 -3.276 6.565 1.00 71.10 H new ATOM 0 HZ1 LYS A 484 7.812 -4.792 8.035 1.00 23.33 H new ATOM 0 HZ2 LYS A 484 9.397 -4.785 8.644 1.00 23.33 H new ATOM 0 HZ3 LYS A 484 8.207 -3.811 9.364 1.00 23.33 H new ATOM 1437 N ASN A 485 12.002 1.007 7.970 1.00 62.44 N ATOM 1438 CA ASN A 485 11.788 2.346 8.586 1.00 1.21 C ATOM 1439 C ASN A 485 10.350 2.832 8.310 1.00 72.04 C ATOM 1440 O ASN A 485 9.959 2.904 7.143 1.00 44.05 O ATOM 1441 CB ASN A 485 12.814 3.355 7.979 1.00 64.31 C ATOM 1442 CG ASN A 485 13.132 4.517 8.929 1.00 3.21 C ATOM 1443 OD1 ASN A 485 13.333 4.213 10.220 1.00 64.14 O flip ATOM 1444 ND2 ASN A 485 13.259 5.661 8.497 1.00 54.32 N flip ATOM 0 H ASN A 485 11.460 0.845 7.121 1.00 62.44 H new ATOM 0 HA ASN A 485 11.932 2.278 9.664 1.00 1.21 H new ATOM 0 HB2 ASN A 485 13.736 2.827 7.735 1.00 64.31 H new ATOM 0 HB3 ASN A 485 12.418 3.753 7.045 1.00 64.31 H new ATOM 0 HD21 ASN A 485 13.098 5.854 7.508 1.00 54.32 H new ATOM 0 HD22 ASN A 485 13.526 6.417 9.127 1.00 54.32 H new ATOM 1451 N ASP A 486 9.542 3.134 9.365 1.00 55.00 N ATOM 1452 CA ASP A 486 8.186 3.685 9.143 1.00 63.12 C ATOM 1453 C ASP A 486 8.205 5.221 9.189 1.00 3.53 C ATOM 1454 O ASP A 486 9.095 5.832 9.786 1.00 2.12 O ATOM 1455 CB ASP A 486 7.159 3.144 10.190 1.00 1.44 C ATOM 1456 CG ASP A 486 5.820 2.733 9.583 1.00 65.32 C ATOM 1457 OD1 ASP A 486 5.170 3.575 8.915 1.00 62.41 O ATOM 1458 OD2 ASP A 486 5.409 1.568 9.784 1.00 32.14 O ATOM 0 H ASP A 486 9.800 3.009 10.344 1.00 55.00 H new ATOM 0 HA ASP A 486 7.870 3.357 8.153 1.00 63.12 H new ATOM 0 HB2 ASP A 486 7.594 2.286 10.702 1.00 1.44 H new ATOM 0 HB3 ASP A 486 6.985 3.911 10.945 1.00 1.44 H new ATOM 1463 N SER A 487 7.205 5.808 8.543 1.00 62.54 N ATOM 1464 CA SER A 487 6.982 7.255 8.479 1.00 72.40 C ATOM 1465 C SER A 487 5.489 7.460 8.174 1.00 33.51 C ATOM 1466 O SER A 487 4.842 6.501 7.776 1.00 71.11 O ATOM 1467 CB SER A 487 7.850 7.873 7.362 1.00 40.54 C ATOM 1468 OG SER A 487 7.822 9.292 7.399 1.00 74.10 O ATOM 0 H SER A 487 6.501 5.276 8.031 1.00 62.54 H new ATOM 0 HA SER A 487 7.256 7.739 9.416 1.00 72.40 H new ATOM 0 HB2 SER A 487 8.878 7.527 7.467 1.00 40.54 H new ATOM 0 HB3 SER A 487 7.494 7.527 6.391 1.00 40.54 H new ATOM 0 HG SER A 487 8.383 9.649 6.679 1.00 74.10 H new ATOM 1474 N LYS A 488 4.951 8.667 8.440 1.00 14.02 N ATOM 1475 CA LYS A 488 3.597 9.120 8.013 1.00 45.35 C ATOM 1476 C LYS A 488 3.359 10.551 8.531 1.00 41.22 C ATOM 1477 O LYS A 488 2.977 10.752 9.691 1.00 51.04 O ATOM 1478 CB LYS A 488 2.421 8.179 8.439 1.00 1.23 C ATOM 1479 CG LYS A 488 2.439 7.662 9.882 1.00 4.44 C ATOM 1480 CD LYS A 488 1.325 6.647 10.106 1.00 4.21 C ATOM 1481 CE LYS A 488 -0.040 7.311 10.232 1.00 53.24 C ATOM 1482 NZ LYS A 488 -1.142 6.326 10.081 1.00 63.41 N ATOM 0 H LYS A 488 5.453 9.378 8.971 1.00 14.02 H new ATOM 0 HA LYS A 488 3.594 9.091 6.923 1.00 45.35 H new ATOM 0 HB2 LYS A 488 1.484 8.713 8.281 1.00 1.23 H new ATOM 0 HB3 LYS A 488 2.414 7.319 7.770 1.00 1.23 H new ATOM 0 HG2 LYS A 488 3.404 7.203 10.097 1.00 4.44 H new ATOM 0 HG3 LYS A 488 2.322 8.496 10.574 1.00 4.44 H new ATOM 0 HD2 LYS A 488 1.308 5.939 9.277 1.00 4.21 H new ATOM 0 HD3 LYS A 488 1.534 6.074 11.010 1.00 4.21 H new ATOM 0 HE2 LYS A 488 -0.119 7.801 11.203 1.00 53.24 H new ATOM 0 HE3 LYS A 488 -0.139 8.088 9.474 1.00 53.24 H new ATOM 0 HZ1 LYS A 488 -2.057 6.812 10.172 1.00 63.41 H new ATOM 0 HZ2 LYS A 488 -1.080 5.877 9.145 1.00 63.41 H new ATOM 0 HZ3 LYS A 488 -1.061 5.599 10.820 1.00 63.41 H new ATOM 1496 N PRO A 489 3.676 11.584 7.709 1.00 21.03 N ATOM 1497 CA PRO A 489 3.351 12.965 8.048 1.00 4.14 C ATOM 1498 C PRO A 489 1.890 13.315 7.708 1.00 5.33 C ATOM 1499 O PRO A 489 1.428 13.017 6.599 1.00 35.32 O ATOM 1500 CB PRO A 489 4.347 13.791 7.222 1.00 30.44 C ATOM 1501 CG PRO A 489 4.843 12.901 6.119 1.00 43.13 C ATOM 1502 CD PRO A 489 4.392 11.489 6.416 1.00 5.13 C ATOM 0 HA PRO A 489 3.434 13.161 9.117 1.00 4.14 H new ATOM 0 HB2 PRO A 489 3.866 14.680 6.814 1.00 30.44 H new ATOM 0 HB3 PRO A 489 5.174 14.133 7.844 1.00 30.44 H new ATOM 0 HG2 PRO A 489 4.450 13.232 5.157 1.00 43.13 H new ATOM 0 HG3 PRO A 489 5.930 12.947 6.052 1.00 43.13 H new ATOM 0 HD2 PRO A 489 3.740 11.109 5.630 1.00 5.13 H new ATOM 0 HD3 PRO A 489 5.241 10.809 6.483 1.00 5.13 H new ATOM 1510 N TYR A 490 1.190 13.915 8.704 1.00 51.31 N ATOM 1511 CA TYR A 490 -0.241 14.325 8.614 1.00 52.24 C ATOM 1512 C TYR A 490 -1.180 13.121 8.658 1.00 24.14 C ATOM 1513 O TYR A 490 -1.662 12.795 9.768 1.00 35.43 O ATOM 1514 CB TYR A 490 -0.568 15.217 7.383 1.00 43.11 C ATOM 1515 CG TYR A 490 -0.259 16.691 7.572 1.00 33.44 C ATOM 1516 CD1 TYR A 490 1.011 17.127 7.933 1.00 30.22 C ATOM 1517 CD2 TYR A 490 -1.248 17.650 7.380 1.00 32.13 C ATOM 1518 CE1 TYR A 490 1.285 18.465 8.103 1.00 52.01 C ATOM 1519 CE2 TYR A 490 -0.982 18.996 7.548 1.00 14.12 C ATOM 1520 CZ TYR A 490 0.287 19.399 7.908 1.00 35.24 C ATOM 1521 OH TYR A 490 0.561 20.737 8.079 1.00 25.25 O ATOM 1522 OXT TYR A 490 -1.429 12.517 7.600 1.00 36.85 O ATOM 0 H TYR A 490 1.608 14.133 9.609 1.00 51.31 H new ATOM 0 HA TYR A 490 -0.410 14.941 9.497 1.00 52.24 H new ATOM 0 HB2 TYR A 490 -0.007 14.849 6.524 1.00 43.11 H new ATOM 0 HB3 TYR A 490 -1.626 15.109 7.143 1.00 43.11 H new ATOM 0 HD1 TYR A 490 1.797 16.402 8.083 1.00 30.22 H new ATOM 0 HD2 TYR A 490 -2.242 17.337 7.095 1.00 32.13 H new ATOM 0 HE1 TYR A 490 2.277 18.783 8.388 1.00 52.01 H new ATOM 0 HE2 TYR A 490 -1.763 19.727 7.398 1.00 14.12 H new ATOM 0 HH TYR A 490 -0.248 21.262 7.903 1.00 25.25 H new TER 1532 TYR A 490