USER MOD reduce.3.24.130724 H: found=0, std=0, add=799, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 799 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 Single : A 506 THR OG1 : rot 112:sc= 0.341 USER MOD Single : A 512 THR OG1 : rot 80:sc= 1.2 USER MOD Single : A 513 HIS : no HE2:sc= 0.955 K(o=0.95,f=-5.3!) USER MOD Single : A 515 SER OG : rot 180:sc= 0.0254 USER MOD Single : A 517 SER OG : rot -29:sc= 1.19 USER MOD Single : A 521 MET CE :methyl -117:sc= -0.287 (180deg=-5.3!) USER MOD Single : A 524 LYS NZ :NH3+ -146:sc= 1.13 (180deg=-0.194) USER MOD Single : A 528 THR OG1 : rot -127:sc= 0.743 USER MOD Single : A 529 SER OG : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= -3.41! K(o=-3.4!,f=-1.5) USER MOD Single : A 539 TYR OH : rot 180:sc= 0 USER MOD Single : A 540 LYS NZ :NH3+ -170:sc=-0.00282 (180deg=-0.135) USER MOD Single : A 541 THR OG1 : rot 89:sc= 0.585 USER MOD Single : A 545 THR OG1 : rot 79:sc= 1.09 USER MOD Single : A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 557 CYS SG : rot 180:sc= 0 USER MOD Single : A 563 GLN : amide:sc= -1.46! K(o=-1.5!,f=-0.086) USER MOD Single : A 564 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 569 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 570 THR OG1 : rot 143:sc= 1.2 USER MOD Single : A 572 SER OG : rot 180:sc= 0.0893 USER MOD Single : A 574 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0859) USER MOD Single : A 585 LYS NZ :NH3+ -122:sc= -0.733! (180deg=-1.25!) USER MOD Single : A 586 THR OG1 : rot 26:sc= 0.242 USER MOD Single : A 639 HIS : no HD1:sc= -0.338 X(o=-0.34,f=-0.011) USER MOD Single : A 640 THR OG1 : rot 53:sc= 0.00406 USER MOD Single : A 641 LYS NZ :NH3+ -170:sc=-0.00747 (180deg=-0.102) USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 502 3.507 -2.606 -1.253 1.00 62.32 N ATOM 19 CA ALA A 502 2.972 -3.914 -1.397 1.00 72.52 C ATOM 20 C ALA A 502 1.444 -3.907 -1.349 1.00 65.53 C ATOM 21 O ALA A 502 0.787 -3.700 -2.374 1.00 75.35 O ATOM 22 CB ALA A 502 3.555 -4.841 -0.355 1.00 12.52 C ATOM 0 HA ALA A 502 3.256 -4.288 -2.381 1.00 72.52 H new ATOM 0 HB1 ALA A 502 3.134 -5.839 -0.480 1.00 12.52 H new ATOM 0 HB2 ALA A 502 4.638 -4.886 -0.473 1.00 12.52 H new ATOM 0 HB3 ALA A 502 3.314 -4.467 0.640 1.00 12.52 H new ATOM 28 N GLY A 503 0.885 -4.064 -0.170 1.00 62.25 N ATOM 29 CA GLY A 503 -0.536 -4.192 -0.044 1.00 74.34 C ATOM 30 C GLY A 503 -0.913 -4.809 1.276 1.00 4.51 C ATOM 31 O GLY A 503 -0.111 -4.780 2.210 1.00 34.33 O ATOM 0 H GLY A 503 1.398 -4.105 0.710 1.00 62.25 H new ATOM 0 HA2 GLY A 503 -1.002 -3.211 -0.136 1.00 74.34 H new ATOM 0 HA3 GLY A 503 -0.922 -4.805 -0.858 1.00 74.34 H new ATOM 35 N ILE A 504 -2.062 -5.469 1.308 1.00 12.55 N ATOM 36 CA ILE A 504 -2.699 -5.902 2.547 1.00 2.02 C ATOM 37 C ILE A 504 -2.736 -7.421 2.671 1.00 40.20 C ATOM 38 O ILE A 504 -3.117 -8.118 1.736 1.00 24.23 O ATOM 39 CB ILE A 504 -4.202 -5.391 2.635 1.00 43.43 C ATOM 40 CG1 ILE A 504 -4.341 -3.863 2.618 1.00 1.31 C ATOM 41 CG2 ILE A 504 -4.952 -5.973 3.811 1.00 72.34 C ATOM 42 CD1 ILE A 504 -4.238 -3.248 1.248 1.00 2.11 C ATOM 0 H ILE A 504 -2.584 -5.722 0.469 1.00 12.55 H new ATOM 0 HA ILE A 504 -2.098 -5.476 3.350 1.00 2.02 H new ATOM 0 HB ILE A 504 -4.663 -5.763 1.720 1.00 43.43 H new ATOM 0 HG12 ILE A 504 -5.303 -3.592 3.054 1.00 1.31 H new ATOM 0 HG13 ILE A 504 -3.569 -3.432 3.256 1.00 1.31 H new ATOM 0 HG21 ILE A 504 -5.972 -5.588 3.819 1.00 72.34 H new ATOM 0 HG22 ILE A 504 -4.975 -7.059 3.726 1.00 72.34 H new ATOM 0 HG23 ILE A 504 -4.451 -5.692 4.737 1.00 72.34 H new ATOM 0 HD11 ILE A 504 -4.347 -2.166 1.326 1.00 2.11 H new ATOM 0 HD12 ILE A 504 -3.266 -3.485 0.815 1.00 2.11 H new ATOM 0 HD13 ILE A 504 -5.026 -3.647 0.610 1.00 2.11 H new ATOM 54 N PHE A 505 -2.318 -7.914 3.807 1.00 63.42 N ATOM 55 CA PHE A 505 -2.516 -9.303 4.160 1.00 22.53 C ATOM 56 C PHE A 505 -3.558 -9.398 5.248 1.00 32.53 C ATOM 57 O PHE A 505 -3.512 -8.635 6.226 1.00 52.44 O ATOM 58 CB PHE A 505 -1.229 -9.972 4.623 1.00 61.33 C ATOM 59 CG PHE A 505 -0.301 -10.311 3.514 1.00 62.33 C ATOM 60 CD1 PHE A 505 -0.522 -11.444 2.762 1.00 3.22 C ATOM 61 CD2 PHE A 505 0.785 -9.518 3.222 1.00 52.35 C ATOM 62 CE1 PHE A 505 0.319 -11.784 1.738 1.00 50.33 C ATOM 63 CE2 PHE A 505 1.639 -9.853 2.193 1.00 63.51 C ATOM 64 CZ PHE A 505 1.401 -10.996 1.449 1.00 1.00 C ATOM 0 H PHE A 505 -1.830 -7.367 4.517 1.00 63.42 H new ATOM 0 HA PHE A 505 -2.850 -9.828 3.265 1.00 22.53 H new ATOM 0 HB2 PHE A 505 -0.718 -9.312 5.324 1.00 61.33 H new ATOM 0 HB3 PHE A 505 -1.479 -10.883 5.168 1.00 61.33 H new ATOM 0 HD1 PHE A 505 -1.371 -12.073 2.984 1.00 3.22 H new ATOM 0 HD2 PHE A 505 0.970 -8.627 3.803 1.00 52.35 H new ATOM 0 HE1 PHE A 505 0.129 -12.675 1.157 1.00 50.33 H new ATOM 0 HE2 PHE A 505 2.490 -9.227 1.968 1.00 63.51 H new ATOM 0 HZ PHE A 505 2.067 -11.266 0.643 1.00 1.00 H new ATOM 74 N THR A 506 -4.505 -10.288 5.077 1.00 60.43 N ATOM 75 CA THR A 506 -5.539 -10.494 6.058 1.00 4.12 C ATOM 76 C THR A 506 -6.315 -11.764 5.718 1.00 63.41 C ATOM 77 O THR A 506 -6.089 -12.364 4.675 1.00 45.42 O ATOM 78 CB THR A 506 -6.504 -9.271 6.161 1.00 10.20 C ATOM 79 OG1 THR A 506 -7.428 -9.467 7.239 1.00 32.32 O ATOM 80 CG2 THR A 506 -7.280 -9.065 4.864 1.00 34.41 C ATOM 0 H THR A 506 -4.580 -10.888 4.255 1.00 60.43 H new ATOM 0 HA THR A 506 -5.064 -10.604 7.033 1.00 4.12 H new ATOM 0 HB THR A 506 -5.899 -8.384 6.347 1.00 10.20 H new ATOM 0 HG1 THR A 506 -7.241 -8.820 7.951 1.00 32.32 H new ATOM 0 HG21 THR A 506 -7.943 -8.206 4.969 1.00 34.41 H new ATOM 0 HG22 THR A 506 -6.581 -8.887 4.046 1.00 34.41 H new ATOM 0 HG23 THR A 506 -7.871 -9.955 4.648 1.00 34.41 H new ATOM 88 N PHE A 507 -7.210 -12.163 6.583 1.00 41.10 N ATOM 89 CA PHE A 507 -7.995 -13.343 6.358 1.00 21.14 C ATOM 90 C PHE A 507 -9.091 -13.072 5.369 1.00 3.03 C ATOM 91 O PHE A 507 -9.618 -11.958 5.295 1.00 35.12 O ATOM 92 CB PHE A 507 -8.576 -13.887 7.651 1.00 45.32 C ATOM 93 CG PHE A 507 -7.569 -14.542 8.530 1.00 21.43 C ATOM 94 CD1 PHE A 507 -7.236 -15.863 8.317 1.00 44.41 C ATOM 95 CD2 PHE A 507 -6.964 -13.855 9.564 1.00 73.20 C ATOM 96 CE1 PHE A 507 -6.321 -16.496 9.112 1.00 0.13 C ATOM 97 CE2 PHE A 507 -6.041 -14.480 10.373 1.00 43.04 C ATOM 98 CZ PHE A 507 -5.717 -15.804 10.147 1.00 54.33 C ATOM 0 H PHE A 507 -7.413 -11.680 7.458 1.00 41.10 H new ATOM 0 HA PHE A 507 -7.329 -14.102 5.947 1.00 21.14 H new ATOM 0 HB2 PHE A 507 -9.048 -13.071 8.199 1.00 45.32 H new ATOM 0 HB3 PHE A 507 -9.360 -14.606 7.413 1.00 45.32 H new ATOM 0 HD1 PHE A 507 -7.705 -16.406 7.510 1.00 44.41 H new ATOM 0 HD2 PHE A 507 -7.217 -12.820 9.740 1.00 73.20 H new ATOM 0 HE1 PHE A 507 -6.071 -17.531 8.933 1.00 0.13 H new ATOM 0 HE2 PHE A 507 -5.572 -13.937 11.181 1.00 43.04 H new ATOM 0 HZ PHE A 507 -4.993 -16.298 10.778 1.00 54.33 H new ATOM 108 N GLU A 508 -9.418 -14.077 4.604 1.00 50.44 N ATOM 109 CA GLU A 508 -10.450 -13.989 3.611 1.00 22.32 C ATOM 110 C GLU A 508 -11.810 -13.836 4.287 1.00 53.42 C ATOM 111 O GLU A 508 -12.675 -13.081 3.827 1.00 14.54 O ATOM 112 CB GLU A 508 -10.388 -15.236 2.757 1.00 14.40 C ATOM 113 CG GLU A 508 -11.316 -15.246 1.591 1.00 32.34 C ATOM 114 CD GLU A 508 -11.127 -16.471 0.759 1.00 25.43 C ATOM 115 OE1 GLU A 508 -11.665 -17.548 1.131 1.00 61.35 O ATOM 116 OE2 GLU A 508 -10.440 -16.389 -0.280 1.00 44.43 O ATOM 0 H GLU A 508 -8.969 -14.991 4.654 1.00 50.44 H new ATOM 0 HA GLU A 508 -10.304 -13.115 2.976 1.00 22.32 H new ATOM 0 HB2 GLU A 508 -9.368 -15.358 2.392 1.00 14.40 H new ATOM 0 HB3 GLU A 508 -10.608 -16.100 3.385 1.00 14.40 H new ATOM 0 HG2 GLU A 508 -12.346 -15.198 1.943 1.00 32.34 H new ATOM 0 HG3 GLU A 508 -11.146 -14.359 0.980 1.00 32.34 H new ATOM 123 N GLU A 509 -11.950 -14.490 5.401 1.00 3.41 N ATOM 124 CA GLU A 509 -13.152 -14.465 6.177 1.00 72.53 C ATOM 125 C GLU A 509 -12.785 -14.096 7.605 1.00 34.51 C ATOM 126 O GLU A 509 -11.702 -14.432 8.060 1.00 1.40 O ATOM 127 CB GLU A 509 -13.849 -15.834 6.088 1.00 74.01 C ATOM 128 CG GLU A 509 -12.964 -17.003 6.482 1.00 71.13 C ATOM 129 CD GLU A 509 -13.456 -18.323 5.948 1.00 41.21 C ATOM 130 OE1 GLU A 509 -14.402 -18.911 6.501 1.00 53.42 O ATOM 131 OE2 GLU A 509 -12.878 -18.823 4.970 1.00 13.01 O ATOM 0 H GLU A 509 -11.214 -15.069 5.804 1.00 3.41 H new ATOM 0 HA GLU A 509 -13.854 -13.723 5.798 1.00 72.53 H new ATOM 0 HB2 GLU A 509 -14.729 -15.825 6.731 1.00 74.01 H new ATOM 0 HB3 GLU A 509 -14.201 -15.986 5.068 1.00 74.01 H new ATOM 0 HG2 GLU A 509 -11.953 -16.824 6.117 1.00 71.13 H new ATOM 0 HG3 GLU A 509 -12.906 -17.057 7.569 1.00 71.13 H new ATOM 138 N PRO A 510 -13.633 -13.341 8.298 1.00 73.54 N ATOM 139 CA PRO A 510 -13.362 -12.930 9.684 1.00 24.22 C ATOM 140 C PRO A 510 -13.568 -14.078 10.672 1.00 32.40 C ATOM 141 O PRO A 510 -12.888 -14.181 11.704 1.00 33.32 O ATOM 142 CB PRO A 510 -14.399 -11.827 9.930 1.00 62.51 C ATOM 143 CG PRO A 510 -15.523 -12.148 9.002 1.00 71.22 C ATOM 144 CD PRO A 510 -14.904 -12.781 7.787 1.00 32.44 C ATOM 0 HA PRO A 510 -12.330 -12.607 9.825 1.00 24.22 H new ATOM 0 HB2 PRO A 510 -14.732 -11.821 10.968 1.00 62.51 H new ATOM 0 HB3 PRO A 510 -13.984 -10.841 9.723 1.00 62.51 H new ATOM 0 HG2 PRO A 510 -16.234 -12.826 9.474 1.00 71.22 H new ATOM 0 HG3 PRO A 510 -16.073 -11.247 8.732 1.00 71.22 H new ATOM 0 HD2 PRO A 510 -15.545 -13.557 7.368 1.00 32.44 H new ATOM 0 HD3 PRO A 510 -14.732 -12.050 6.997 1.00 32.44 H new ATOM 152 N VAL A 511 -14.486 -14.942 10.337 1.00 3.02 N ATOM 153 CA VAL A 511 -14.861 -16.047 11.165 1.00 72.13 C ATOM 154 C VAL A 511 -15.043 -17.222 10.251 1.00 41.25 C ATOM 155 O VAL A 511 -15.586 -17.069 9.157 1.00 44.40 O ATOM 156 CB VAL A 511 -16.208 -15.778 11.923 1.00 62.13 C ATOM 157 CG1 VAL A 511 -16.579 -16.947 12.817 1.00 1.04 C ATOM 158 CG2 VAL A 511 -16.158 -14.488 12.739 1.00 23.14 C ATOM 0 H VAL A 511 -15.004 -14.893 9.460 1.00 3.02 H new ATOM 0 HA VAL A 511 -14.093 -16.218 11.919 1.00 72.13 H new ATOM 0 HB VAL A 511 -16.978 -15.662 11.161 1.00 62.13 H new ATOM 0 HG11 VAL A 511 -17.517 -16.730 13.329 1.00 1.04 H new ATOM 0 HG12 VAL A 511 -16.695 -17.846 12.211 1.00 1.04 H new ATOM 0 HG13 VAL A 511 -15.792 -17.106 13.554 1.00 1.04 H new ATOM 0 HG21 VAL A 511 -17.111 -14.342 13.247 1.00 23.14 H new ATOM 0 HG22 VAL A 511 -15.360 -14.556 13.478 1.00 23.14 H new ATOM 0 HG23 VAL A 511 -15.967 -13.645 12.075 1.00 23.14 H new ATOM 168 N THR A 512 -14.578 -18.352 10.652 1.00 12.13 N ATOM 169 CA THR A 512 -14.713 -19.515 9.872 1.00 2.15 C ATOM 170 C THR A 512 -15.223 -20.626 10.769 1.00 32.45 C ATOM 171 O THR A 512 -14.876 -20.693 11.950 1.00 2.04 O ATOM 172 CB THR A 512 -13.366 -19.905 9.174 1.00 55.22 C ATOM 173 OG1 THR A 512 -13.602 -20.856 8.139 1.00 13.42 O ATOM 174 CG2 THR A 512 -12.355 -20.474 10.149 1.00 40.35 C ATOM 0 H THR A 512 -14.091 -18.489 11.538 1.00 12.13 H new ATOM 0 HA THR A 512 -15.425 -19.337 9.067 1.00 2.15 H new ATOM 0 HB THR A 512 -12.952 -18.988 8.755 1.00 55.22 H new ATOM 0 HG1 THR A 512 -13.934 -20.395 7.340 1.00 13.42 H new ATOM 0 HG21 THR A 512 -11.439 -20.729 9.616 1.00 40.35 H new ATOM 0 HG22 THR A 512 -12.134 -19.733 10.917 1.00 40.35 H new ATOM 0 HG23 THR A 512 -12.764 -21.370 10.616 1.00 40.35 H new ATOM 182 N HIS A 513 -16.090 -21.421 10.260 1.00 50.44 N ATOM 183 CA HIS A 513 -16.595 -22.523 11.004 1.00 60.13 C ATOM 184 C HIS A 513 -16.281 -23.797 10.276 1.00 72.41 C ATOM 185 O HIS A 513 -16.569 -23.939 9.080 1.00 22.23 O ATOM 186 CB HIS A 513 -18.088 -22.355 11.399 1.00 24.10 C ATOM 187 CG HIS A 513 -19.072 -22.109 10.281 1.00 73.40 C ATOM 188 ND1 HIS A 513 -20.229 -22.821 10.136 1.00 74.21 N ATOM 189 CD2 HIS A 513 -19.099 -21.151 9.318 1.00 20.32 C ATOM 190 CE1 HIS A 513 -20.921 -22.302 9.129 1.00 44.25 C ATOM 191 NE2 HIS A 513 -20.275 -21.274 8.587 1.00 24.21 N ATOM 0 H HIS A 513 -16.471 -21.330 9.318 1.00 50.44 H new ATOM 0 HA HIS A 513 -16.088 -22.566 11.968 1.00 60.13 H new ATOM 0 HB2 HIS A 513 -18.400 -23.253 11.932 1.00 24.10 H new ATOM 0 HB3 HIS A 513 -18.161 -21.525 12.102 1.00 24.10 H new ATOM 0 HD1 HIS A 513 -20.513 -23.618 10.706 1.00 74.21 H new ATOM 0 HD2 HIS A 513 -18.330 -20.412 9.148 1.00 20.32 H new ATOM 0 HE1 HIS A 513 -21.881 -22.666 8.794 1.00 44.25 H new ATOM 199 N VAL A 514 -15.618 -24.674 10.966 1.00 75.24 N ATOM 200 CA VAL A 514 -15.124 -25.889 10.400 1.00 21.33 C ATOM 201 C VAL A 514 -15.815 -27.070 11.059 1.00 13.05 C ATOM 202 O VAL A 514 -16.461 -26.919 12.097 1.00 51.53 O ATOM 203 CB VAL A 514 -13.568 -25.999 10.565 1.00 34.02 C ATOM 204 CG1 VAL A 514 -12.876 -24.764 9.976 1.00 65.22 C ATOM 205 CG2 VAL A 514 -13.165 -26.183 12.030 1.00 74.13 C ATOM 0 H VAL A 514 -15.402 -24.562 11.957 1.00 75.24 H new ATOM 0 HA VAL A 514 -15.342 -25.892 9.332 1.00 21.33 H new ATOM 0 HB VAL A 514 -13.243 -26.884 10.017 1.00 34.02 H new ATOM 0 HG11 VAL A 514 -11.797 -24.858 10.100 1.00 65.22 H new ATOM 0 HG12 VAL A 514 -13.114 -24.685 8.915 1.00 65.22 H new ATOM 0 HG13 VAL A 514 -13.224 -23.870 10.494 1.00 65.22 H new ATOM 0 HG21 VAL A 514 -12.080 -26.255 12.103 1.00 74.13 H new ATOM 0 HG22 VAL A 514 -13.512 -25.330 12.613 1.00 74.13 H new ATOM 0 HG23 VAL A 514 -13.616 -27.096 12.420 1.00 74.13 H new ATOM 215 N SER A 515 -15.662 -28.220 10.482 1.00 1.34 N ATOM 216 CA SER A 515 -16.318 -29.395 10.964 1.00 11.21 C ATOM 217 C SER A 515 -15.378 -30.195 11.853 1.00 21.10 C ATOM 218 O SER A 515 -14.167 -30.095 11.737 1.00 44.11 O ATOM 219 CB SER A 515 -16.734 -30.255 9.766 1.00 64.41 C ATOM 220 OG SER A 515 -17.542 -31.366 10.143 1.00 64.40 O ATOM 0 H SER A 515 -15.077 -28.371 9.660 1.00 1.34 H new ATOM 0 HA SER A 515 -17.194 -29.107 11.545 1.00 11.21 H new ATOM 0 HB2 SER A 515 -17.281 -29.638 9.053 1.00 64.41 H new ATOM 0 HB3 SER A 515 -15.841 -30.616 9.256 1.00 64.41 H new ATOM 0 HG SER A 515 -17.782 -31.882 9.345 1.00 64.40 H new ATOM 226 N GLU A 516 -15.945 -30.952 12.751 1.00 61.24 N ATOM 227 CA GLU A 516 -15.210 -31.926 13.515 1.00 3.31 C ATOM 228 C GLU A 516 -14.720 -32.992 12.534 1.00 74.13 C ATOM 229 O GLU A 516 -13.552 -33.398 12.540 1.00 40.42 O ATOM 230 CB GLU A 516 -16.148 -32.525 14.624 1.00 11.13 C ATOM 231 CG GLU A 516 -15.593 -33.692 15.470 1.00 31.20 C ATOM 232 CD GLU A 516 -15.458 -34.996 14.696 1.00 12.55 C ATOM 233 OE1 GLU A 516 -16.443 -35.445 14.095 1.00 12.40 O ATOM 234 OE2 GLU A 516 -14.363 -35.584 14.667 1.00 72.24 O ATOM 0 H GLU A 516 -16.939 -30.911 12.976 1.00 61.24 H new ATOM 0 HA GLU A 516 -14.351 -31.488 14.024 1.00 3.31 H new ATOM 0 HB2 GLU A 516 -16.424 -31.718 15.303 1.00 11.13 H new ATOM 0 HB3 GLU A 516 -17.065 -32.864 14.142 1.00 11.13 H new ATOM 0 HG2 GLU A 516 -14.617 -33.411 15.865 1.00 31.20 H new ATOM 0 HG3 GLU A 516 -16.249 -33.853 16.326 1.00 31.20 H new ATOM 241 N SER A 517 -15.598 -33.360 11.631 1.00 64.42 N ATOM 242 CA SER A 517 -15.352 -34.434 10.717 1.00 21.02 C ATOM 243 C SER A 517 -14.694 -33.951 9.401 1.00 33.24 C ATOM 244 O SER A 517 -14.797 -34.617 8.373 1.00 30.31 O ATOM 245 CB SER A 517 -16.676 -35.123 10.427 1.00 31.54 C ATOM 246 OG SER A 517 -17.367 -35.453 11.637 1.00 24.51 O ATOM 0 H SER A 517 -16.508 -32.915 11.515 1.00 64.42 H new ATOM 0 HA SER A 517 -14.648 -35.128 11.175 1.00 21.02 H new ATOM 0 HB2 SER A 517 -17.301 -34.472 9.815 1.00 31.54 H new ATOM 0 HB3 SER A 517 -16.498 -36.030 9.849 1.00 31.54 H new ATOM 0 HG SER A 517 -16.716 -35.607 12.353 1.00 24.51 H new ATOM 252 N ILE A 518 -14.009 -32.814 9.427 1.00 44.11 N ATOM 253 CA ILE A 518 -13.335 -32.337 8.225 1.00 75.43 C ATOM 254 C ILE A 518 -11.897 -32.873 8.187 1.00 72.32 C ATOM 255 O ILE A 518 -11.275 -32.970 7.125 1.00 20.11 O ATOM 256 CB ILE A 518 -13.322 -30.775 8.136 1.00 2.31 C ATOM 257 CG1 ILE A 518 -12.759 -30.303 6.794 1.00 44.31 C ATOM 258 CG2 ILE A 518 -12.539 -30.154 9.284 1.00 10.15 C ATOM 259 CD1 ILE A 518 -12.661 -28.802 6.676 1.00 63.23 C ATOM 0 H ILE A 518 -13.906 -32.216 10.247 1.00 44.11 H new ATOM 0 HA ILE A 518 -13.893 -32.709 7.366 1.00 75.43 H new ATOM 0 HB ILE A 518 -14.357 -30.441 8.214 1.00 2.31 H new ATOM 0 HG12 ILE A 518 -11.769 -30.736 6.652 1.00 44.31 H new ATOM 0 HG13 ILE A 518 -13.391 -30.682 5.991 1.00 44.31 H new ATOM 0 HG21 ILE A 518 -12.552 -29.068 9.188 1.00 10.15 H new ATOM 0 HG22 ILE A 518 -12.995 -30.440 10.232 1.00 10.15 H new ATOM 0 HG23 ILE A 518 -11.509 -30.508 9.255 1.00 10.15 H new ATOM 0 HD11 ILE A 518 -12.254 -28.540 5.699 1.00 63.23 H new ATOM 0 HD12 ILE A 518 -13.653 -28.363 6.786 1.00 63.23 H new ATOM 0 HD13 ILE A 518 -12.005 -28.418 7.457 1.00 63.23 H new ATOM 271 N GLY A 519 -11.379 -33.236 9.343 1.00 51.42 N ATOM 272 CA GLY A 519 -10.020 -33.684 9.427 1.00 71.31 C ATOM 273 C GLY A 519 -9.071 -32.525 9.538 1.00 1.03 C ATOM 274 O GLY A 519 -8.598 -32.188 10.631 1.00 11.34 O ATOM 0 H GLY A 519 -11.883 -33.227 10.230 1.00 51.42 H new ATOM 0 HA2 GLY A 519 -9.903 -34.337 10.292 1.00 71.31 H new ATOM 0 HA3 GLY A 519 -9.774 -34.275 8.545 1.00 71.31 H new ATOM 278 N ILE A 520 -8.862 -31.869 8.431 1.00 0.44 N ATOM 279 CA ILE A 520 -7.933 -30.782 8.335 1.00 5.12 C ATOM 280 C ILE A 520 -8.661 -29.638 7.683 1.00 23.13 C ATOM 281 O ILE A 520 -9.326 -29.825 6.657 1.00 32.10 O ATOM 282 CB ILE A 520 -6.696 -31.154 7.449 1.00 34.21 C ATOM 283 CG1 ILE A 520 -5.929 -32.383 7.988 1.00 40.42 C ATOM 284 CG2 ILE A 520 -5.749 -29.964 7.276 1.00 44.10 C ATOM 285 CD1 ILE A 520 -5.294 -32.192 9.351 1.00 62.51 C ATOM 0 H ILE A 520 -9.342 -32.080 7.556 1.00 0.44 H new ATOM 0 HA ILE A 520 -7.567 -30.530 9.330 1.00 5.12 H new ATOM 0 HB ILE A 520 -7.093 -31.423 6.470 1.00 34.21 H new ATOM 0 HG12 ILE A 520 -6.616 -33.228 8.038 1.00 40.42 H new ATOM 0 HG13 ILE A 520 -5.149 -32.648 7.274 1.00 40.42 H new ATOM 0 HG21 ILE A 520 -4.903 -30.260 6.656 1.00 44.10 H new ATOM 0 HG22 ILE A 520 -6.281 -29.142 6.796 1.00 44.10 H new ATOM 0 HG23 ILE A 520 -5.388 -29.641 8.253 1.00 44.10 H new ATOM 0 HD11 ILE A 520 -4.779 -33.107 9.644 1.00 62.51 H new ATOM 0 HD12 ILE A 520 -4.578 -31.371 9.307 1.00 62.51 H new ATOM 0 HD13 ILE A 520 -6.067 -31.960 10.083 1.00 62.51 H new ATOM 297 N MET A 521 -8.586 -28.494 8.264 1.00 3.34 N ATOM 298 CA MET A 521 -9.225 -27.344 7.695 1.00 74.50 C ATOM 299 C MET A 521 -8.174 -26.438 7.099 1.00 34.21 C ATOM 300 O MET A 521 -7.044 -26.427 7.578 1.00 10.03 O ATOM 301 CB MET A 521 -10.099 -26.633 8.752 1.00 42.14 C ATOM 302 CG MET A 521 -9.373 -25.920 9.901 1.00 63.43 C ATOM 303 SD MET A 521 -8.818 -24.269 9.436 1.00 24.43 S ATOM 304 CE MET A 521 -8.425 -23.572 11.027 1.00 41.40 C ATOM 0 H MET A 521 -8.088 -28.321 9.137 1.00 3.34 H new ATOM 0 HA MET A 521 -9.898 -27.645 6.893 1.00 74.50 H new ATOM 0 HB2 MET A 521 -10.720 -25.899 8.238 1.00 42.14 H new ATOM 0 HB3 MET A 521 -10.772 -27.372 9.186 1.00 42.14 H new ATOM 0 HG2 MET A 521 -10.039 -25.849 10.761 1.00 63.43 H new ATOM 0 HG3 MET A 521 -8.515 -26.516 10.211 1.00 63.43 H new ATOM 0 HE1 MET A 521 -9.077 -22.721 11.222 1.00 41.40 H new ATOM 0 HE2 MET A 521 -8.571 -24.326 11.801 1.00 41.40 H new ATOM 0 HE3 MET A 521 -7.386 -23.242 11.033 1.00 41.40 H new ATOM 314 N GLU A 522 -8.525 -25.752 6.028 1.00 43.54 N ATOM 315 CA GLU A 522 -7.639 -24.816 5.358 1.00 1.13 C ATOM 316 C GLU A 522 -8.305 -23.478 5.180 1.00 15.43 C ATOM 317 O GLU A 522 -9.295 -23.361 4.471 1.00 34.33 O ATOM 318 CB GLU A 522 -7.164 -25.337 3.996 1.00 53.45 C ATOM 319 CG GLU A 522 -5.980 -26.275 4.059 1.00 31.42 C ATOM 320 CD GLU A 522 -5.527 -26.741 2.701 1.00 54.44 C ATOM 321 OE1 GLU A 522 -6.067 -27.739 2.181 1.00 20.25 O ATOM 322 OE2 GLU A 522 -4.612 -26.128 2.125 1.00 51.33 O ATOM 0 H GLU A 522 -9.444 -25.829 5.593 1.00 43.54 H new ATOM 0 HA GLU A 522 -6.765 -24.704 6.000 1.00 1.13 H new ATOM 0 HB2 GLU A 522 -7.993 -25.851 3.509 1.00 53.45 H new ATOM 0 HB3 GLU A 522 -6.903 -24.486 3.367 1.00 53.45 H new ATOM 0 HG2 GLU A 522 -5.152 -25.773 4.560 1.00 31.42 H new ATOM 0 HG3 GLU A 522 -6.242 -27.142 4.666 1.00 31.42 H new ATOM 329 N VAL A 523 -7.773 -22.486 5.833 1.00 22.42 N ATOM 330 CA VAL A 523 -8.280 -21.133 5.722 1.00 34.34 C ATOM 331 C VAL A 523 -7.370 -20.347 4.814 1.00 60.14 C ATOM 332 O VAL A 523 -6.150 -20.343 5.021 1.00 41.10 O ATOM 333 CB VAL A 523 -8.341 -20.454 7.102 1.00 73.10 C ATOM 334 CG1 VAL A 523 -8.806 -19.005 6.982 1.00 23.34 C ATOM 335 CG2 VAL A 523 -9.269 -21.233 8.004 1.00 63.13 C ATOM 0 H VAL A 523 -6.975 -22.584 6.460 1.00 22.42 H new ATOM 0 HA VAL A 523 -9.290 -21.165 5.313 1.00 34.34 H new ATOM 0 HB VAL A 523 -7.340 -20.445 7.532 1.00 73.10 H new ATOM 0 HG11 VAL A 523 -8.840 -18.550 7.972 1.00 23.34 H new ATOM 0 HG12 VAL A 523 -8.111 -18.451 6.352 1.00 23.34 H new ATOM 0 HG13 VAL A 523 -9.800 -18.978 6.536 1.00 23.34 H new ATOM 0 HG21 VAL A 523 -9.313 -20.753 8.982 1.00 63.13 H new ATOM 0 HG22 VAL A 523 -10.267 -21.257 7.566 1.00 63.13 H new ATOM 0 HG23 VAL A 523 -8.897 -22.252 8.116 1.00 63.13 H new ATOM 345 N LYS A 524 -7.939 -19.707 3.819 1.00 51.14 N ATOM 346 CA LYS A 524 -7.173 -18.965 2.867 1.00 3.22 C ATOM 347 C LYS A 524 -6.951 -17.545 3.349 1.00 12.54 C ATOM 348 O LYS A 524 -7.850 -16.907 3.921 1.00 14.14 O ATOM 349 CB LYS A 524 -7.857 -18.945 1.513 1.00 53.24 C ATOM 350 CG LYS A 524 -8.311 -20.312 1.017 1.00 33.32 C ATOM 351 CD LYS A 524 -8.401 -20.361 -0.488 1.00 5.24 C ATOM 352 CE LYS A 524 -9.298 -19.286 -1.023 1.00 43.02 C ATOM 353 NZ LYS A 524 -10.713 -19.453 -0.650 1.00 31.24 N ATOM 0 H LYS A 524 -8.945 -19.691 3.654 1.00 51.14 H new ATOM 0 HA LYS A 524 -6.208 -19.460 2.762 1.00 3.22 H new ATOM 0 HB2 LYS A 524 -8.723 -18.285 1.567 1.00 53.24 H new ATOM 0 HB3 LYS A 524 -7.174 -18.515 0.781 1.00 53.24 H new ATOM 0 HG2 LYS A 524 -7.614 -21.074 1.364 1.00 33.32 H new ATOM 0 HG3 LYS A 524 -9.284 -20.550 1.447 1.00 33.32 H new ATOM 0 HD2 LYS A 524 -7.405 -20.251 -0.916 1.00 5.24 H new ATOM 0 HD3 LYS A 524 -8.776 -21.336 -0.799 1.00 5.24 H new ATOM 0 HE2 LYS A 524 -8.948 -18.320 -0.660 1.00 43.02 H new ATOM 0 HE3 LYS A 524 -9.218 -19.267 -2.110 1.00 43.02 H new ATOM 0 HZ1 LYS A 524 -11.319 -19.111 -1.423 1.00 31.24 H new ATOM 0 HZ2 LYS A 524 -10.910 -20.459 -0.475 1.00 31.24 H new ATOM 0 HZ3 LYS A 524 -10.911 -18.907 0.212 1.00 31.24 H new ATOM 367 N VAL A 525 -5.767 -17.067 3.143 1.00 2.25 N ATOM 368 CA VAL A 525 -5.393 -15.733 3.539 1.00 12.24 C ATOM 369 C VAL A 525 -5.256 -14.875 2.299 1.00 63.30 C ATOM 370 O VAL A 525 -4.584 -15.272 1.343 1.00 22.15 O ATOM 371 CB VAL A 525 -4.061 -15.757 4.328 1.00 54.25 C ATOM 372 CG1 VAL A 525 -3.645 -14.374 4.801 1.00 31.31 C ATOM 373 CG2 VAL A 525 -4.176 -16.699 5.496 1.00 45.51 C ATOM 0 H VAL A 525 -5.018 -17.591 2.691 1.00 2.25 H new ATOM 0 HA VAL A 525 -6.162 -15.316 4.189 1.00 12.24 H new ATOM 0 HB VAL A 525 -3.283 -16.109 3.650 1.00 54.25 H new ATOM 0 HG11 VAL A 525 -2.705 -14.444 5.349 1.00 31.31 H new ATOM 0 HG12 VAL A 525 -3.515 -13.719 3.940 1.00 31.31 H new ATOM 0 HG13 VAL A 525 -4.416 -13.966 5.454 1.00 31.31 H new ATOM 0 HG21 VAL A 525 -3.236 -16.712 6.047 1.00 45.51 H new ATOM 0 HG22 VAL A 525 -4.978 -16.366 6.154 1.00 45.51 H new ATOM 0 HG23 VAL A 525 -4.397 -17.703 5.133 1.00 45.51 H new ATOM 383 N LEU A 526 -5.896 -13.722 2.319 1.00 74.11 N ATOM 384 CA LEU A 526 -5.892 -12.806 1.203 1.00 12.33 C ATOM 385 C LEU A 526 -4.509 -12.260 0.996 1.00 23.12 C ATOM 386 O LEU A 526 -3.852 -11.802 1.945 1.00 3.20 O ATOM 387 CB LEU A 526 -6.882 -11.656 1.424 1.00 63.22 C ATOM 388 CG LEU A 526 -8.367 -12.027 1.458 1.00 1.35 C ATOM 389 CD1 LEU A 526 -9.209 -10.813 1.813 1.00 64.12 C ATOM 390 CD2 LEU A 526 -8.808 -12.586 0.115 1.00 72.31 C ATOM 0 H LEU A 526 -6.437 -13.395 3.119 1.00 74.11 H new ATOM 0 HA LEU A 526 -6.204 -13.353 0.313 1.00 12.33 H new ATOM 0 HB2 LEU A 526 -6.631 -11.167 2.365 1.00 63.22 H new ATOM 0 HB3 LEU A 526 -6.732 -10.921 0.633 1.00 63.22 H new ATOM 0 HG LEU A 526 -8.510 -12.792 2.221 1.00 1.35 H new ATOM 0 HD11 LEU A 526 -10.262 -11.094 1.833 1.00 64.12 H new ATOM 0 HD12 LEU A 526 -8.914 -10.440 2.794 1.00 64.12 H new ATOM 0 HD13 LEU A 526 -9.056 -10.033 1.067 1.00 64.12 H new ATOM 0 HD21 LEU A 526 -9.866 -12.844 0.158 1.00 72.31 H new ATOM 0 HD22 LEU A 526 -8.648 -11.837 -0.661 1.00 72.31 H new ATOM 0 HD23 LEU A 526 -8.226 -13.478 -0.117 1.00 72.31 H new ATOM 402 N ARG A 527 -4.065 -12.330 -0.221 1.00 25.43 N ATOM 403 CA ARG A 527 -2.764 -11.876 -0.571 1.00 51.23 C ATOM 404 C ARG A 527 -2.779 -10.371 -0.790 1.00 14.10 C ATOM 405 O ARG A 527 -3.820 -9.776 -1.112 1.00 32.34 O ATOM 406 CB ARG A 527 -2.273 -12.594 -1.840 1.00 71.23 C ATOM 407 CG ARG A 527 -0.841 -12.254 -2.255 1.00 70.10 C ATOM 408 CD ARG A 527 -0.470 -12.892 -3.573 1.00 30.23 C ATOM 409 NE ARG A 527 -1.336 -12.430 -4.670 1.00 35.43 N ATOM 410 CZ ARG A 527 -1.258 -12.823 -5.948 1.00 24.25 C ATOM 411 NH1 ARG A 527 -0.359 -13.727 -6.330 1.00 74.24 N ATOM 412 NH2 ARG A 527 -2.092 -12.321 -6.835 1.00 25.31 N ATOM 0 H ARG A 527 -4.603 -12.707 -1.001 1.00 25.43 H new ATOM 0 HA ARG A 527 -2.079 -12.106 0.245 1.00 51.23 H new ATOM 0 HB2 ARG A 527 -2.345 -13.670 -1.683 1.00 71.23 H new ATOM 0 HB3 ARG A 527 -2.943 -12.347 -2.663 1.00 71.23 H new ATOM 0 HG2 ARG A 527 -0.733 -11.172 -2.332 1.00 70.10 H new ATOM 0 HG3 ARG A 527 -0.150 -12.589 -1.482 1.00 70.10 H new ATOM 0 HD2 ARG A 527 0.569 -12.661 -3.809 1.00 30.23 H new ATOM 0 HD3 ARG A 527 -0.543 -13.976 -3.485 1.00 30.23 H new ATOM 0 HE ARG A 527 -2.060 -11.750 -4.436 1.00 35.43 H new ATOM 0 HH11 ARG A 527 0.282 -14.130 -5.646 1.00 74.24 H new ATOM 0 HH12 ARG A 527 -0.311 -14.017 -7.307 1.00 74.24 H new ATOM 0 HH21 ARG A 527 -2.792 -11.637 -6.547 1.00 25.31 H new ATOM 0 HH22 ARG A 527 -2.038 -12.616 -7.810 1.00 25.31 H new ATOM 426 N THR A 528 -1.632 -9.789 -0.611 1.00 54.54 N ATOM 427 CA THR A 528 -1.382 -8.407 -0.828 1.00 51.53 C ATOM 428 C THR A 528 -1.752 -7.984 -2.261 1.00 34.41 C ATOM 429 O THR A 528 -1.626 -8.768 -3.221 1.00 45.43 O ATOM 430 CB THR A 528 0.121 -8.127 -0.561 1.00 64.20 C ATOM 431 OG1 THR A 528 0.481 -6.831 -0.962 1.00 42.33 O ATOM 432 CG2 THR A 528 0.988 -9.111 -1.288 1.00 20.01 C ATOM 0 H THR A 528 -0.806 -10.297 -0.293 1.00 54.54 H new ATOM 0 HA THR A 528 -2.003 -7.825 -0.146 1.00 51.53 H new ATOM 0 HB THR A 528 0.273 -8.226 0.514 1.00 64.20 H new ATOM 0 HG1 THR A 528 1.258 -6.877 -1.557 1.00 42.33 H new ATOM 0 HG21 THR A 528 2.036 -8.893 -1.084 1.00 20.01 H new ATOM 0 HG22 THR A 528 0.755 -10.121 -0.950 1.00 20.01 H new ATOM 0 HG23 THR A 528 0.804 -9.036 -2.360 1.00 20.01 H new ATOM 440 N SER A 529 -2.235 -6.761 -2.371 1.00 70.42 N ATOM 441 CA SER A 529 -2.595 -6.142 -3.612 1.00 11.21 C ATOM 442 C SER A 529 -1.352 -6.063 -4.512 1.00 13.01 C ATOM 443 O SER A 529 -1.434 -6.164 -5.730 1.00 21.00 O ATOM 444 CB SER A 529 -3.180 -4.741 -3.313 1.00 33.10 C ATOM 445 OG SER A 529 -3.733 -4.125 -4.469 1.00 22.21 O ATOM 0 H SER A 529 -2.389 -6.158 -1.563 1.00 70.42 H new ATOM 0 HA SER A 529 -3.352 -6.724 -4.138 1.00 11.21 H new ATOM 0 HB2 SER A 529 -3.951 -4.828 -2.548 1.00 33.10 H new ATOM 0 HB3 SER A 529 -2.396 -4.103 -2.905 1.00 33.10 H new ATOM 0 HG SER A 529 -4.091 -3.244 -4.231 1.00 22.21 H new ATOM 451 N GLY A 530 -0.211 -5.917 -3.879 1.00 22.10 N ATOM 452 CA GLY A 530 1.045 -5.900 -4.558 1.00 32.44 C ATOM 453 C GLY A 530 1.925 -6.982 -4.018 1.00 53.44 C ATOM 454 O GLY A 530 2.507 -6.835 -2.932 1.00 1.05 O ATOM 0 H GLY A 530 -0.138 -5.806 -2.868 1.00 22.10 H new ATOM 0 HA2 GLY A 530 0.893 -6.042 -5.628 1.00 32.44 H new ATOM 0 HA3 GLY A 530 1.525 -4.930 -4.430 1.00 32.44 H new ATOM 458 N ALA A 531 1.989 -8.073 -4.715 1.00 2.25 N ATOM 459 CA ALA A 531 2.804 -9.185 -4.323 1.00 15.11 C ATOM 460 C ALA A 531 4.191 -8.949 -4.846 1.00 63.50 C ATOM 461 O ALA A 531 4.468 -9.109 -6.025 1.00 11.42 O ATOM 462 CB ALA A 531 2.217 -10.479 -4.854 1.00 21.21 C ATOM 0 H ALA A 531 1.472 -8.220 -5.582 1.00 2.25 H new ATOM 0 HA ALA A 531 2.839 -9.274 -3.237 1.00 15.11 H new ATOM 0 HB1 ALA A 531 2.846 -11.316 -4.549 1.00 21.21 H new ATOM 0 HB2 ALA A 531 1.213 -10.615 -4.453 1.00 21.21 H new ATOM 0 HB3 ALA A 531 2.170 -10.438 -5.942 1.00 21.21 H new ATOM 468 N ARG A 532 5.047 -8.522 -3.971 1.00 52.03 N ATOM 469 CA ARG A 532 6.355 -8.097 -4.358 1.00 30.14 C ATOM 470 C ARG A 532 7.384 -9.106 -3.924 1.00 11.43 C ATOM 471 O ARG A 532 7.713 -9.182 -2.742 1.00 44.14 O ATOM 472 CB ARG A 532 6.677 -6.741 -3.716 1.00 22.32 C ATOM 473 CG ARG A 532 5.572 -5.687 -3.849 1.00 43.30 C ATOM 474 CD ARG A 532 5.225 -5.390 -5.289 1.00 51.00 C ATOM 475 NE ARG A 532 4.204 -4.343 -5.392 1.00 34.20 N ATOM 476 CZ ARG A 532 3.433 -4.131 -6.455 1.00 21.35 C ATOM 477 NH1 ARG A 532 3.536 -4.904 -7.528 1.00 21.34 N ATOM 478 NH2 ARG A 532 2.554 -3.147 -6.434 1.00 14.11 N ATOM 0 H ARG A 532 4.859 -8.458 -2.970 1.00 52.03 H new ATOM 0 HA ARG A 532 6.379 -8.004 -5.444 1.00 30.14 H new ATOM 0 HB2 ARG A 532 6.885 -6.897 -2.657 1.00 22.32 H new ATOM 0 HB3 ARG A 532 7.589 -6.349 -4.166 1.00 22.32 H new ATOM 0 HG2 ARG A 532 4.680 -6.033 -3.328 1.00 43.30 H new ATOM 0 HG3 ARG A 532 5.891 -4.767 -3.359 1.00 43.30 H new ATOM 0 HD2 ARG A 532 6.122 -5.078 -5.823 1.00 51.00 H new ATOM 0 HD3 ARG A 532 4.866 -6.299 -5.772 1.00 51.00 H new ATOM 0 HE ARG A 532 4.075 -3.730 -4.587 1.00 34.20 H new ATOM 0 HH11 ARG A 532 4.211 -5.669 -7.543 1.00 21.34 H new ATOM 0 HH12 ARG A 532 2.940 -4.734 -8.338 1.00 21.34 H new ATOM 0 HH21 ARG A 532 2.470 -2.556 -5.607 1.00 14.11 H new ATOM 0 HH22 ARG A 532 1.959 -2.977 -7.245 1.00 14.11 H new ATOM 492 N GLY A 533 7.822 -9.924 -4.849 1.00 54.04 N ATOM 493 CA GLY A 533 8.898 -10.826 -4.568 1.00 60.41 C ATOM 494 C GLY A 533 8.463 -11.988 -3.732 1.00 5.32 C ATOM 495 O GLY A 533 7.667 -12.815 -4.176 1.00 62.44 O ATOM 0 H GLY A 533 7.449 -9.980 -5.797 1.00 54.04 H new ATOM 0 HA2 GLY A 533 9.316 -11.192 -5.506 1.00 60.41 H new ATOM 0 HA3 GLY A 533 9.694 -10.289 -4.053 1.00 60.41 H new ATOM 499 N ASN A 534 8.986 -12.052 -2.543 1.00 72.11 N ATOM 500 CA ASN A 534 8.663 -13.088 -1.595 1.00 23.54 C ATOM 501 C ASN A 534 8.402 -12.461 -0.224 1.00 1.41 C ATOM 502 O ASN A 534 9.198 -11.649 0.264 1.00 12.12 O ATOM 503 CB ASN A 534 9.797 -14.132 -1.532 1.00 15.34 C ATOM 504 CG ASN A 534 9.518 -15.307 -0.594 1.00 11.23 C ATOM 505 OD1 ASN A 534 10.438 -15.883 -0.017 1.00 42.31 O ATOM 506 ND2 ASN A 534 8.278 -15.699 -0.458 1.00 54.41 N ATOM 0 H ASN A 534 9.663 -11.374 -2.194 1.00 72.11 H new ATOM 0 HA ASN A 534 7.759 -13.606 -1.915 1.00 23.54 H new ATOM 0 HB2 ASN A 534 9.976 -14.518 -2.536 1.00 15.34 H new ATOM 0 HB3 ASN A 534 10.714 -13.637 -1.212 1.00 15.34 H new ATOM 0 HD21 ASN A 534 8.058 -16.498 0.137 1.00 54.41 H new ATOM 0 HD22 ASN A 534 7.531 -15.206 -0.947 1.00 54.41 H new ATOM 513 N VAL A 535 7.286 -12.813 0.371 1.00 51.34 N ATOM 514 CA VAL A 535 6.865 -12.293 1.656 1.00 12.42 C ATOM 515 C VAL A 535 6.481 -13.448 2.557 1.00 4.32 C ATOM 516 O VAL A 535 5.803 -14.378 2.122 1.00 51.21 O ATOM 517 CB VAL A 535 5.627 -11.363 1.498 1.00 43.43 C ATOM 518 CG1 VAL A 535 5.152 -10.832 2.848 1.00 13.25 C ATOM 519 CG2 VAL A 535 5.935 -10.226 0.544 1.00 24.52 C ATOM 0 H VAL A 535 6.630 -13.483 -0.031 1.00 51.34 H new ATOM 0 HA VAL A 535 7.690 -11.723 2.084 1.00 12.42 H new ATOM 0 HB VAL A 535 4.814 -11.955 1.076 1.00 43.43 H new ATOM 0 HG11 VAL A 535 4.286 -10.186 2.701 1.00 13.25 H new ATOM 0 HG12 VAL A 535 4.876 -11.668 3.491 1.00 13.25 H new ATOM 0 HG13 VAL A 535 5.954 -10.262 3.318 1.00 13.25 H new ATOM 0 HG21 VAL A 535 5.058 -9.586 0.446 1.00 24.52 H new ATOM 0 HG22 VAL A 535 6.769 -9.641 0.932 1.00 24.52 H new ATOM 0 HG23 VAL A 535 6.199 -10.632 -0.432 1.00 24.52 H new ATOM 529 N ILE A 536 6.913 -13.407 3.781 1.00 22.33 N ATOM 530 CA ILE A 536 6.545 -14.425 4.723 1.00 63.40 C ATOM 531 C ILE A 536 5.577 -13.858 5.743 1.00 22.41 C ATOM 532 O ILE A 536 5.799 -12.762 6.290 1.00 62.13 O ATOM 533 CB ILE A 536 7.768 -15.061 5.438 1.00 52.54 C ATOM 534 CG1 ILE A 536 8.669 -15.805 4.442 1.00 1.42 C ATOM 535 CG2 ILE A 536 7.309 -16.002 6.526 1.00 24.15 C ATOM 536 CD1 ILE A 536 7.965 -16.887 3.646 1.00 41.23 C ATOM 0 H ILE A 536 7.522 -12.679 4.153 1.00 22.33 H new ATOM 0 HA ILE A 536 6.064 -15.224 4.158 1.00 63.40 H new ATOM 0 HB ILE A 536 8.350 -14.256 5.886 1.00 52.54 H new ATOM 0 HG12 ILE A 536 9.098 -15.082 3.748 1.00 1.42 H new ATOM 0 HG13 ILE A 536 9.499 -16.254 4.987 1.00 1.42 H new ATOM 0 HG21 ILE A 536 8.177 -16.440 7.018 1.00 24.15 H new ATOM 0 HG22 ILE A 536 6.717 -15.452 7.257 1.00 24.15 H new ATOM 0 HG23 ILE A 536 6.701 -16.794 6.089 1.00 24.15 H new ATOM 0 HD11 ILE A 536 8.675 -17.360 2.968 1.00 41.23 H new ATOM 0 HD12 ILE A 536 7.560 -17.635 4.328 1.00 41.23 H new ATOM 0 HD13 ILE A 536 7.153 -16.444 3.069 1.00 41.23 H new ATOM 548 N VAL A 537 4.496 -14.570 5.964 1.00 0.02 N ATOM 549 CA VAL A 537 3.501 -14.168 6.924 1.00 22.25 C ATOM 550 C VAL A 537 3.380 -15.245 8.005 1.00 51.11 C ATOM 551 O VAL A 537 2.867 -16.331 7.740 1.00 75.11 O ATOM 552 CB VAL A 537 2.115 -13.951 6.257 1.00 53.32 C ATOM 553 CG1 VAL A 537 1.109 -13.374 7.247 1.00 44.10 C ATOM 554 CG2 VAL A 537 2.242 -13.067 5.032 1.00 2.34 C ATOM 0 H VAL A 537 4.284 -15.444 5.482 1.00 0.02 H new ATOM 0 HA VAL A 537 3.816 -13.221 7.362 1.00 22.25 H new ATOM 0 HB VAL A 537 1.741 -14.923 5.937 1.00 53.32 H new ATOM 0 HG11 VAL A 537 0.149 -13.234 6.750 1.00 44.10 H new ATOM 0 HG12 VAL A 537 0.987 -14.061 8.084 1.00 44.10 H new ATOM 0 HG13 VAL A 537 1.471 -12.414 7.615 1.00 44.10 H new ATOM 0 HG21 VAL A 537 1.260 -12.928 4.580 1.00 2.34 H new ATOM 0 HG22 VAL A 537 2.648 -12.098 5.323 1.00 2.34 H new ATOM 0 HG23 VAL A 537 2.910 -13.538 4.311 1.00 2.34 H new ATOM 564 N PRO A 538 3.903 -14.989 9.207 1.00 41.44 N ATOM 565 CA PRO A 538 3.824 -15.945 10.316 1.00 33.43 C ATOM 566 C PRO A 538 2.407 -16.052 10.882 1.00 72.44 C ATOM 567 O PRO A 538 1.623 -15.107 10.796 1.00 12.13 O ATOM 568 CB PRO A 538 4.771 -15.364 11.361 1.00 53.30 C ATOM 569 CG PRO A 538 4.837 -13.904 11.068 1.00 34.34 C ATOM 570 CD PRO A 538 4.616 -13.752 9.588 1.00 31.02 C ATOM 0 HA PRO A 538 4.088 -16.955 10.003 1.00 33.43 H new ATOM 0 HB2 PRO A 538 4.401 -15.546 12.370 1.00 53.30 H new ATOM 0 HB3 PRO A 538 5.758 -15.823 11.295 1.00 53.30 H new ATOM 0 HG2 PRO A 538 4.078 -13.361 11.631 1.00 34.34 H new ATOM 0 HG3 PRO A 538 5.804 -13.494 11.359 1.00 34.34 H new ATOM 0 HD2 PRO A 538 4.025 -12.864 9.361 1.00 31.02 H new ATOM 0 HD3 PRO A 538 5.559 -13.653 9.051 1.00 31.02 H new ATOM 578 N TYR A 539 2.082 -17.183 11.454 1.00 43.35 N ATOM 579 CA TYR A 539 0.765 -17.396 12.011 1.00 71.40 C ATOM 580 C TYR A 539 0.821 -18.369 13.157 1.00 70.25 C ATOM 581 O TYR A 539 1.770 -19.160 13.269 1.00 32.24 O ATOM 582 CB TYR A 539 -0.228 -17.899 10.945 1.00 65.21 C ATOM 583 CG TYR A 539 0.083 -19.262 10.362 1.00 64.12 C ATOM 584 CD1 TYR A 539 -0.383 -20.427 10.964 1.00 45.21 C ATOM 585 CD2 TYR A 539 0.823 -19.379 9.207 1.00 33.21 C ATOM 586 CE1 TYR A 539 -0.112 -21.661 10.426 1.00 20.31 C ATOM 587 CE2 TYR A 539 1.098 -20.610 8.663 1.00 72.14 C ATOM 588 CZ TYR A 539 0.632 -21.746 9.272 1.00 22.12 C ATOM 589 OH TYR A 539 0.907 -22.975 8.720 1.00 11.34 O ATOM 0 H TYR A 539 2.714 -17.978 11.548 1.00 43.35 H new ATOM 0 HA TYR A 539 0.411 -16.433 12.379 1.00 71.40 H new ATOM 0 HB2 TYR A 539 -1.224 -17.930 11.386 1.00 65.21 H new ATOM 0 HB3 TYR A 539 -0.261 -17.173 10.132 1.00 65.21 H new ATOM 0 HD1 TYR A 539 -0.968 -20.359 11.870 1.00 45.21 H new ATOM 0 HD2 TYR A 539 1.193 -18.489 8.721 1.00 33.21 H new ATOM 0 HE1 TYR A 539 -0.480 -22.557 10.905 1.00 20.31 H new ATOM 0 HE2 TYR A 539 1.681 -20.683 7.757 1.00 72.14 H new ATOM 0 HH TYR A 539 1.442 -22.856 7.907 1.00 11.34 H new ATOM 599 N LYS A 540 -0.195 -18.324 13.985 1.00 65.14 N ATOM 600 CA LYS A 540 -0.308 -19.212 15.121 1.00 2.05 C ATOM 601 C LYS A 540 -1.753 -19.370 15.584 1.00 24.24 C ATOM 602 O LYS A 540 -2.613 -18.514 15.289 1.00 52.20 O ATOM 603 CB LYS A 540 0.637 -18.771 16.278 1.00 24.45 C ATOM 604 CG LYS A 540 0.597 -17.284 16.685 1.00 75.34 C ATOM 605 CD LYS A 540 -0.726 -16.841 17.278 1.00 21.55 C ATOM 606 CE LYS A 540 -0.706 -15.367 17.636 1.00 72.42 C ATOM 607 NZ LYS A 540 0.271 -15.047 18.699 1.00 31.51 N ATOM 0 H LYS A 540 -0.971 -17.668 13.891 1.00 65.14 H new ATOM 0 HA LYS A 540 0.019 -20.200 14.796 1.00 2.05 H new ATOM 0 HB2 LYS A 540 0.399 -19.370 17.157 1.00 24.45 H new ATOM 0 HB3 LYS A 540 1.660 -19.017 15.993 1.00 24.45 H new ATOM 0 HG2 LYS A 540 1.389 -17.095 17.409 1.00 75.34 H new ATOM 0 HG3 LYS A 540 0.813 -16.672 15.809 1.00 75.34 H new ATOM 0 HD2 LYS A 540 -1.528 -17.033 16.566 1.00 21.55 H new ATOM 0 HD3 LYS A 540 -0.943 -17.430 18.169 1.00 21.55 H new ATOM 0 HE2 LYS A 540 -0.470 -14.785 16.745 1.00 72.42 H new ATOM 0 HE3 LYS A 540 -1.701 -15.063 17.961 1.00 72.42 H new ATOM 0 HZ1 LYS A 540 0.125 -14.069 19.021 1.00 31.51 H new ATOM 0 HZ2 LYS A 540 0.139 -15.698 19.499 1.00 31.51 H new ATOM 0 HZ3 LYS A 540 1.236 -15.148 18.325 1.00 31.51 H new ATOM 621 N THR A 541 -2.021 -20.461 16.260 1.00 14.50 N ATOM 622 CA THR A 541 -3.301 -20.708 16.853 1.00 71.12 C ATOM 623 C THR A 541 -3.372 -20.045 18.227 1.00 61.42 C ATOM 624 O THR A 541 -2.387 -20.038 18.982 1.00 45.23 O ATOM 625 CB THR A 541 -3.565 -22.228 16.971 1.00 75.12 C ATOM 626 OG1 THR A 541 -2.378 -22.898 17.425 1.00 21.20 O ATOM 627 CG2 THR A 541 -3.992 -22.817 15.640 1.00 11.35 C ATOM 0 H THR A 541 -1.344 -21.208 16.412 1.00 14.50 H new ATOM 0 HA THR A 541 -4.072 -20.280 16.213 1.00 71.12 H new ATOM 0 HB THR A 541 -4.371 -22.372 17.690 1.00 75.12 H new ATOM 0 HG1 THR A 541 -2.373 -22.927 18.405 1.00 21.20 H new ATOM 0 HG21 THR A 541 -4.170 -23.886 15.756 1.00 11.35 H new ATOM 0 HG22 THR A 541 -4.908 -22.331 15.304 1.00 11.35 H new ATOM 0 HG23 THR A 541 -3.205 -22.658 14.903 1.00 11.35 H new ATOM 635 N ILE A 542 -4.492 -19.469 18.532 1.00 50.20 N ATOM 636 CA ILE A 542 -4.689 -18.786 19.779 1.00 42.10 C ATOM 637 C ILE A 542 -5.603 -19.610 20.656 1.00 31.54 C ATOM 638 O ILE A 542 -6.629 -20.118 20.189 1.00 71.44 O ATOM 639 CB ILE A 542 -5.320 -17.393 19.551 1.00 14.41 C ATOM 640 CG1 ILE A 542 -4.436 -16.550 18.637 1.00 70.53 C ATOM 641 CG2 ILE A 542 -5.549 -16.672 20.877 1.00 71.34 C ATOM 642 CD1 ILE A 542 -5.016 -15.196 18.302 1.00 12.43 C ATOM 0 H ILE A 542 -5.306 -19.458 17.918 1.00 50.20 H new ATOM 0 HA ILE A 542 -3.720 -18.653 20.261 1.00 42.10 H new ATOM 0 HB ILE A 542 -6.287 -17.536 19.069 1.00 14.41 H new ATOM 0 HG12 ILE A 542 -3.466 -16.411 19.114 1.00 70.53 H new ATOM 0 HG13 ILE A 542 -4.260 -17.098 17.711 1.00 70.53 H new ATOM 0 HG21 ILE A 542 -5.994 -15.695 20.688 1.00 71.34 H new ATOM 0 HG22 ILE A 542 -6.221 -17.262 21.501 1.00 71.34 H new ATOM 0 HG23 ILE A 542 -4.596 -16.544 21.391 1.00 71.34 H new ATOM 0 HD11 ILE A 542 -4.329 -14.657 17.649 1.00 12.43 H new ATOM 0 HD12 ILE A 542 -5.972 -15.325 17.795 1.00 12.43 H new ATOM 0 HD13 ILE A 542 -5.165 -14.627 19.220 1.00 12.43 H new ATOM 654 N GLU A 543 -5.230 -19.748 21.896 1.00 40.23 N ATOM 655 CA GLU A 543 -5.998 -20.499 22.841 1.00 52.13 C ATOM 656 C GLU A 543 -7.077 -19.623 23.461 1.00 42.34 C ATOM 657 O GLU A 543 -6.877 -18.412 23.685 1.00 43.20 O ATOM 658 CB GLU A 543 -5.095 -21.072 23.920 1.00 62.31 C ATOM 659 CG GLU A 543 -3.992 -21.959 23.377 1.00 51.35 C ATOM 660 CD GLU A 543 -3.137 -22.538 24.470 1.00 33.21 C ATOM 661 OE1 GLU A 543 -2.347 -21.799 25.094 1.00 53.05 O ATOM 662 OE2 GLU A 543 -3.256 -23.740 24.746 1.00 2.34 O ATOM 0 H GLU A 543 -4.378 -19.339 22.280 1.00 40.23 H new ATOM 0 HA GLU A 543 -6.480 -21.325 22.319 1.00 52.13 H new ATOM 0 HB2 GLU A 543 -4.648 -20.252 24.482 1.00 62.31 H new ATOM 0 HB3 GLU A 543 -5.700 -21.646 24.622 1.00 62.31 H new ATOM 0 HG2 GLU A 543 -4.433 -22.769 22.796 1.00 51.35 H new ATOM 0 HG3 GLU A 543 -3.366 -21.382 22.696 1.00 51.35 H new ATOM 669 N GLY A 544 -8.203 -20.217 23.690 1.00 41.25 N ATOM 670 CA GLY A 544 -9.328 -19.555 24.281 1.00 55.10 C ATOM 671 C GLY A 544 -10.549 -20.217 23.796 1.00 3.15 C ATOM 672 O GLY A 544 -10.590 -20.603 22.632 1.00 61.31 O ATOM 0 H GLY A 544 -8.373 -21.198 23.468 1.00 41.25 H new ATOM 0 HA2 GLY A 544 -9.273 -19.606 25.368 1.00 55.10 H new ATOM 0 HA3 GLY A 544 -9.334 -18.499 24.011 1.00 55.10 H new ATOM 676 N THR A 545 -11.523 -20.363 24.660 1.00 32.22 N ATOM 677 CA THR A 545 -12.768 -21.102 24.414 1.00 61.14 C ATOM 678 C THR A 545 -12.594 -22.611 24.096 1.00 64.41 C ATOM 679 O THR A 545 -13.288 -23.456 24.656 1.00 63.15 O ATOM 680 CB THR A 545 -13.807 -20.386 23.493 1.00 52.40 C ATOM 681 OG1 THR A 545 -13.169 -19.586 22.475 1.00 45.42 O ATOM 682 CG2 THR A 545 -14.745 -19.532 24.315 1.00 34.23 C ATOM 0 H THR A 545 -11.483 -19.960 25.596 1.00 32.22 H new ATOM 0 HA THR A 545 -13.232 -21.085 25.400 1.00 61.14 H new ATOM 0 HB THR A 545 -14.380 -21.164 22.989 1.00 52.40 H new ATOM 0 HG1 THR A 545 -12.861 -20.167 21.748 1.00 45.42 H new ATOM 0 HG21 THR A 545 -15.462 -19.041 23.656 1.00 34.23 H new ATOM 0 HG22 THR A 545 -15.279 -20.160 25.028 1.00 34.23 H new ATOM 0 HG23 THR A 545 -14.172 -18.778 24.854 1.00 34.23 H new ATOM 690 N ALA A 546 -11.686 -22.926 23.212 1.00 2.54 N ATOM 691 CA ALA A 546 -11.334 -24.272 22.895 1.00 60.03 C ATOM 692 C ALA A 546 -9.963 -24.551 23.474 1.00 15.42 C ATOM 693 O ALA A 546 -9.154 -23.623 23.644 1.00 25.33 O ATOM 694 CB ALA A 546 -11.334 -24.478 21.393 1.00 75.32 C ATOM 0 H ALA A 546 -11.160 -22.231 22.682 1.00 2.54 H new ATOM 0 HA ALA A 546 -12.063 -24.961 23.322 1.00 60.03 H new ATOM 0 HB1 ALA A 546 -11.064 -25.510 21.167 1.00 75.32 H new ATOM 0 HB2 ALA A 546 -12.328 -24.268 20.997 1.00 75.32 H new ATOM 0 HB3 ALA A 546 -10.611 -23.804 20.933 1.00 75.32 H new ATOM 700 N ARG A 547 -9.719 -25.776 23.821 1.00 33.23 N ATOM 701 CA ARG A 547 -8.467 -26.193 24.390 1.00 73.04 C ATOM 702 C ARG A 547 -7.507 -26.675 23.319 1.00 75.21 C ATOM 703 O ARG A 547 -7.845 -27.517 22.468 1.00 45.45 O ATOM 704 CB ARG A 547 -8.718 -27.233 25.468 1.00 2.50 C ATOM 705 CG ARG A 547 -9.310 -26.597 26.710 1.00 72.41 C ATOM 706 CD ARG A 547 -10.051 -27.579 27.588 1.00 74.54 C ATOM 707 NE ARG A 547 -9.234 -28.700 28.067 1.00 20.32 N ATOM 708 CZ ARG A 547 -9.572 -29.512 29.084 1.00 63.51 C ATOM 709 NH1 ARG A 547 -10.648 -29.260 29.828 1.00 23.31 N ATOM 710 NH2 ARG A 547 -8.825 -30.569 29.350 1.00 21.21 N ATOM 0 H ARG A 547 -10.395 -26.532 23.716 1.00 33.23 H new ATOM 0 HA ARG A 547 -7.982 -25.338 24.861 1.00 73.04 H new ATOM 0 HB2 ARG A 547 -9.395 -27.998 25.089 1.00 2.50 H new ATOM 0 HB3 ARG A 547 -7.783 -27.732 25.721 1.00 2.50 H new ATOM 0 HG2 ARG A 547 -8.511 -26.134 27.289 1.00 72.41 H new ATOM 0 HG3 ARG A 547 -9.991 -25.800 26.412 1.00 72.41 H new ATOM 0 HD2 ARG A 547 -10.455 -27.046 28.449 1.00 74.54 H new ATOM 0 HD3 ARG A 547 -10.900 -27.976 27.032 1.00 74.54 H new ATOM 0 HE ARG A 547 -8.347 -28.876 27.595 1.00 20.32 H new ATOM 0 HH11 ARG A 547 -11.226 -28.443 29.629 1.00 23.31 H new ATOM 0 HH12 ARG A 547 -10.894 -29.884 30.597 1.00 23.31 H new ATOM 0 HH21 ARG A 547 -7.998 -30.764 28.785 1.00 21.21 H new ATOM 0 HH22 ARG A 547 -9.075 -31.190 30.120 1.00 21.21 H new ATOM 724 N GLY A 548 -6.325 -26.134 23.355 1.00 45.44 N ATOM 725 CA GLY A 548 -5.333 -26.414 22.346 1.00 10.51 C ATOM 726 C GLY A 548 -4.534 -27.649 22.638 1.00 52.21 C ATOM 727 O GLY A 548 -5.015 -28.547 23.313 1.00 34.01 O ATOM 0 H GLY A 548 -6.017 -25.487 24.081 1.00 45.44 H new ATOM 0 HA2 GLY A 548 -5.826 -26.527 21.381 1.00 10.51 H new ATOM 0 HA3 GLY A 548 -4.658 -25.562 22.262 1.00 10.51 H new ATOM 731 N GLY A 549 -3.321 -27.693 22.126 1.00 32.43 N ATOM 732 CA GLY A 549 -2.423 -28.826 22.323 1.00 65.23 C ATOM 733 C GLY A 549 -2.999 -30.152 21.856 1.00 24.23 C ATOM 734 O GLY A 549 -2.699 -31.193 22.430 1.00 32.13 O ATOM 0 H GLY A 549 -2.923 -26.944 21.559 1.00 32.43 H new ATOM 0 HA2 GLY A 549 -1.492 -28.637 21.789 1.00 65.23 H new ATOM 0 HA3 GLY A 549 -2.174 -28.901 23.382 1.00 65.23 H new ATOM 738 N GLY A 550 -3.841 -30.111 20.835 1.00 43.33 N ATOM 739 CA GLY A 550 -4.439 -31.322 20.322 1.00 70.15 C ATOM 740 C GLY A 550 -5.504 -31.867 21.252 1.00 45.54 C ATOM 741 O GLY A 550 -5.604 -33.077 21.463 1.00 25.21 O ATOM 0 H GLY A 550 -4.121 -29.257 20.352 1.00 43.33 H new ATOM 0 HA2 GLY A 550 -4.878 -31.123 19.344 1.00 70.15 H new ATOM 0 HA3 GLY A 550 -3.665 -32.075 20.176 1.00 70.15 H new ATOM 745 N GLU A 551 -6.287 -30.989 21.825 1.00 24.03 N ATOM 746 CA GLU A 551 -7.329 -31.410 22.729 1.00 74.34 C ATOM 747 C GLU A 551 -8.705 -31.130 22.139 1.00 1.44 C ATOM 748 O GLU A 551 -9.553 -32.010 22.103 1.00 41.03 O ATOM 749 CB GLU A 551 -7.107 -30.786 24.089 1.00 33.11 C ATOM 750 CG GLU A 551 -8.063 -31.223 25.156 1.00 72.11 C ATOM 751 CD GLU A 551 -7.499 -30.994 26.523 1.00 13.15 C ATOM 752 OE1 GLU A 551 -7.097 -29.853 26.845 1.00 13.43 O ATOM 753 OE2 GLU A 551 -7.409 -31.958 27.298 1.00 3.43 O ATOM 0 H GLU A 551 -6.224 -29.981 21.683 1.00 24.03 H new ATOM 0 HA GLU A 551 -7.287 -32.490 22.869 1.00 74.34 H new ATOM 0 HB2 GLU A 551 -6.093 -31.017 24.416 1.00 33.11 H new ATOM 0 HB3 GLU A 551 -7.171 -29.703 23.988 1.00 33.11 H new ATOM 0 HG2 GLU A 551 -9.001 -30.677 25.052 1.00 72.11 H new ATOM 0 HG3 GLU A 551 -8.294 -32.281 25.029 1.00 72.11 H new ATOM 760 N ASP A 552 -8.927 -29.915 21.708 1.00 24.24 N ATOM 761 CA ASP A 552 -10.120 -29.595 20.915 1.00 50.55 C ATOM 762 C ASP A 552 -9.660 -29.279 19.519 1.00 5.33 C ATOM 763 O ASP A 552 -10.303 -29.602 18.531 1.00 22.50 O ATOM 764 CB ASP A 552 -10.916 -28.399 21.457 1.00 74.52 C ATOM 765 CG ASP A 552 -11.545 -28.616 22.811 1.00 72.45 C ATOM 766 OD1 ASP A 552 -12.127 -29.675 23.075 1.00 41.44 O ATOM 767 OD2 ASP A 552 -11.509 -27.697 23.639 1.00 21.14 O ATOM 0 H ASP A 552 -8.309 -29.123 21.884 1.00 24.24 H new ATOM 0 HA ASP A 552 -10.789 -30.454 20.954 1.00 50.55 H new ATOM 0 HB2 ASP A 552 -10.253 -27.536 21.515 1.00 74.52 H new ATOM 0 HB3 ASP A 552 -11.701 -28.150 20.743 1.00 74.52 H new ATOM 772 N PHE A 553 -8.513 -28.661 19.445 1.00 73.43 N ATOM 773 CA PHE A 553 -7.895 -28.345 18.197 1.00 74.42 C ATOM 774 C PHE A 553 -6.426 -28.602 18.336 1.00 61.33 C ATOM 775 O PHE A 553 -5.876 -28.515 19.457 1.00 12.40 O ATOM 776 CB PHE A 553 -8.153 -26.878 17.777 1.00 34.14 C ATOM 777 CG PHE A 553 -7.532 -25.811 18.666 1.00 14.33 C ATOM 778 CD1 PHE A 553 -8.203 -25.328 19.774 1.00 43.41 C ATOM 779 CD2 PHE A 553 -6.279 -25.286 18.372 1.00 30.15 C ATOM 780 CE1 PHE A 553 -7.640 -24.348 20.571 1.00 63.12 C ATOM 781 CE2 PHE A 553 -5.715 -24.309 19.165 1.00 12.41 C ATOM 782 CZ PHE A 553 -6.396 -23.838 20.265 1.00 72.51 C ATOM 0 H PHE A 553 -7.980 -28.362 20.261 1.00 73.43 H new ATOM 0 HA PHE A 553 -8.324 -28.970 17.414 1.00 74.42 H new ATOM 0 HB2 PHE A 553 -7.779 -26.740 16.762 1.00 34.14 H new ATOM 0 HB3 PHE A 553 -9.230 -26.714 17.745 1.00 34.14 H new ATOM 0 HD1 PHE A 553 -9.179 -25.721 20.020 1.00 43.41 H new ATOM 0 HD2 PHE A 553 -5.739 -25.649 17.510 1.00 30.15 H new ATOM 0 HE1 PHE A 553 -8.175 -23.982 21.434 1.00 63.12 H new ATOM 0 HE2 PHE A 553 -4.740 -23.913 18.923 1.00 12.41 H new ATOM 0 HZ PHE A 553 -5.957 -23.071 20.886 1.00 72.51 H new ATOM 792 N GLU A 554 -5.802 -28.980 17.263 1.00 72.23 N ATOM 793 CA GLU A 554 -4.386 -29.165 17.261 1.00 4.34 C ATOM 794 C GLU A 554 -3.746 -27.781 17.156 1.00 72.20 C ATOM 795 O GLU A 554 -4.196 -26.937 16.375 1.00 61.42 O ATOM 796 CB GLU A 554 -3.984 -30.055 16.094 1.00 10.43 C ATOM 797 CG GLU A 554 -2.906 -31.078 16.424 1.00 33.11 C ATOM 798 CD GLU A 554 -1.636 -30.469 16.953 1.00 43.31 C ATOM 799 OE1 GLU A 554 -1.551 -30.223 18.178 1.00 13.13 O ATOM 800 OE2 GLU A 554 -0.708 -30.245 16.171 1.00 35.33 O ATOM 0 H GLU A 554 -6.258 -29.168 16.370 1.00 72.23 H new ATOM 0 HA GLU A 554 -4.049 -29.657 18.173 1.00 4.34 H new ATOM 0 HB2 GLU A 554 -4.868 -30.581 15.733 1.00 10.43 H new ATOM 0 HB3 GLU A 554 -3.632 -29.425 15.277 1.00 10.43 H new ATOM 0 HG2 GLU A 554 -3.297 -31.779 17.161 1.00 33.11 H new ATOM 0 HG3 GLU A 554 -2.677 -31.653 15.527 1.00 33.11 H new ATOM 807 N ASP A 555 -2.733 -27.550 17.941 1.00 2.42 N ATOM 808 CA ASP A 555 -2.116 -26.232 18.023 1.00 5.11 C ATOM 809 C ASP A 555 -0.996 -26.133 17.013 1.00 43.33 C ATOM 810 O ASP A 555 -0.032 -26.899 17.075 1.00 63.33 O ATOM 811 CB ASP A 555 -1.591 -25.980 19.439 1.00 41.53 C ATOM 812 CG ASP A 555 -1.046 -24.586 19.641 1.00 53.21 C ATOM 813 OD1 ASP A 555 0.162 -24.352 19.398 1.00 22.53 O ATOM 814 OD2 ASP A 555 -1.809 -23.695 20.075 1.00 42.30 O ATOM 0 H ASP A 555 -2.305 -28.254 18.542 1.00 2.42 H new ATOM 0 HA ASP A 555 -2.862 -25.470 17.797 1.00 5.11 H new ATOM 0 HB2 ASP A 555 -2.396 -26.153 20.153 1.00 41.53 H new ATOM 0 HB3 ASP A 555 -0.807 -26.704 19.661 1.00 41.53 H new ATOM 819 N THR A 556 -1.106 -25.202 16.105 1.00 21.44 N ATOM 820 CA THR A 556 -0.164 -25.096 15.025 1.00 44.12 C ATOM 821 C THR A 556 0.399 -23.670 14.922 1.00 34.11 C ATOM 822 O THR A 556 -0.217 -22.695 15.397 1.00 53.14 O ATOM 823 CB THR A 556 -0.816 -25.542 13.657 1.00 12.41 C ATOM 824 OG1 THR A 556 0.144 -25.533 12.583 1.00 64.12 O ATOM 825 CG2 THR A 556 -1.983 -24.646 13.271 1.00 40.11 C ATOM 0 H THR A 556 -1.846 -24.500 16.092 1.00 21.44 H new ATOM 0 HA THR A 556 0.664 -25.771 15.239 1.00 44.12 H new ATOM 0 HB THR A 556 -1.177 -26.559 13.811 1.00 12.41 H new ATOM 0 HG1 THR A 556 -0.292 -25.816 11.752 1.00 64.12 H new ATOM 0 HG21 THR A 556 -2.405 -24.985 12.325 1.00 40.11 H new ATOM 0 HG22 THR A 556 -2.748 -24.691 14.046 1.00 40.11 H new ATOM 0 HG23 THR A 556 -1.634 -23.619 13.165 1.00 40.11 H new ATOM 833 N CYS A 557 1.568 -23.572 14.364 1.00 61.42 N ATOM 834 CA CYS A 557 2.213 -22.328 14.085 1.00 3.33 C ATOM 835 C CYS A 557 3.072 -22.542 12.862 1.00 3.11 C ATOM 836 O CYS A 557 3.403 -23.696 12.529 1.00 52.12 O ATOM 837 CB CYS A 557 3.064 -21.858 15.278 1.00 12.20 C ATOM 838 SG CYS A 557 4.362 -23.010 15.788 1.00 73.11 S ATOM 0 H CYS A 557 2.116 -24.385 14.082 1.00 61.42 H new ATOM 0 HA CYS A 557 1.473 -21.548 13.908 1.00 3.33 H new ATOM 0 HB2 CYS A 557 3.525 -20.904 15.023 1.00 12.20 H new ATOM 0 HB3 CYS A 557 2.405 -21.677 16.127 1.00 12.20 H new ATOM 0 HG CYS A 557 5.014 -22.511 16.796 1.00 73.11 H new ATOM 844 N GLY A 558 3.403 -21.496 12.181 1.00 52.15 N ATOM 845 CA GLY A 558 4.207 -21.624 11.019 1.00 32.14 C ATOM 846 C GLY A 558 4.223 -20.348 10.276 1.00 74.40 C ATOM 847 O GLY A 558 3.766 -19.322 10.798 1.00 55.23 O ATOM 0 H GLY A 558 3.127 -20.542 12.412 1.00 52.15 H new ATOM 0 HA2 GLY A 558 5.222 -21.905 11.298 1.00 32.14 H new ATOM 0 HA3 GLY A 558 3.819 -22.420 10.384 1.00 32.14 H new ATOM 851 N GLU A 559 4.708 -20.382 9.079 1.00 3.15 N ATOM 852 CA GLU A 559 4.814 -19.208 8.276 1.00 13.43 C ATOM 853 C GLU A 559 4.275 -19.485 6.889 1.00 3.53 C ATOM 854 O GLU A 559 4.497 -20.559 6.338 1.00 70.04 O ATOM 855 CB GLU A 559 6.267 -18.789 8.205 1.00 42.41 C ATOM 856 CG GLU A 559 6.875 -18.402 9.541 1.00 21.43 C ATOM 857 CD GLU A 559 8.354 -18.195 9.454 1.00 11.43 C ATOM 858 OE1 GLU A 559 9.102 -19.199 9.455 1.00 22.31 O ATOM 859 OE2 GLU A 559 8.804 -17.049 9.363 1.00 51.51 O ATOM 0 H GLU A 559 5.045 -21.232 8.627 1.00 3.15 H new ATOM 0 HA GLU A 559 4.229 -18.402 8.718 1.00 13.43 H new ATOM 0 HB2 GLU A 559 6.848 -19.607 7.779 1.00 42.41 H new ATOM 0 HB3 GLU A 559 6.356 -17.945 7.521 1.00 42.41 H new ATOM 0 HG2 GLU A 559 6.403 -17.488 9.901 1.00 21.43 H new ATOM 0 HG3 GLU A 559 6.662 -19.180 10.274 1.00 21.43 H new ATOM 866 N LEU A 560 3.544 -18.550 6.353 1.00 21.30 N ATOM 867 CA LEU A 560 3.011 -18.658 5.019 1.00 44.34 C ATOM 868 C LEU A 560 3.915 -17.963 4.058 1.00 11.23 C ATOM 869 O LEU A 560 4.356 -16.838 4.312 1.00 4.20 O ATOM 870 CB LEU A 560 1.618 -18.059 4.920 1.00 30.23 C ATOM 871 CG LEU A 560 0.520 -18.776 5.681 1.00 22.42 C ATOM 872 CD1 LEU A 560 -0.799 -18.077 5.476 1.00 13.11 C ATOM 873 CD2 LEU A 560 0.440 -20.236 5.256 1.00 23.15 C ATOM 0 H LEU A 560 3.297 -17.683 6.831 1.00 21.30 H new ATOM 0 HA LEU A 560 2.944 -19.718 4.774 1.00 44.34 H new ATOM 0 HB2 LEU A 560 1.663 -17.029 5.275 1.00 30.23 H new ATOM 0 HB3 LEU A 560 1.336 -18.022 3.868 1.00 30.23 H new ATOM 0 HG LEU A 560 0.756 -18.750 6.745 1.00 22.42 H new ATOM 0 HD11 LEU A 560 -1.579 -18.602 6.028 1.00 13.11 H new ATOM 0 HD12 LEU A 560 -0.727 -17.051 5.837 1.00 13.11 H new ATOM 0 HD13 LEU A 560 -1.047 -18.071 4.415 1.00 13.11 H new ATOM 0 HD21 LEU A 560 -0.354 -20.734 5.813 1.00 23.15 H new ATOM 0 HD22 LEU A 560 0.225 -20.293 4.189 1.00 23.15 H new ATOM 0 HD23 LEU A 560 1.391 -20.727 5.462 1.00 23.15 H new ATOM 885 N GLU A 561 4.191 -18.611 2.975 1.00 72.22 N ATOM 886 CA GLU A 561 5.070 -18.074 1.994 1.00 12.23 C ATOM 887 C GLU A 561 4.272 -17.493 0.830 1.00 34.52 C ATOM 888 O GLU A 561 3.688 -18.220 0.036 1.00 4.13 O ATOM 889 CB GLU A 561 6.010 -19.161 1.501 1.00 0.34 C ATOM 890 CG GLU A 561 7.099 -18.665 0.584 1.00 61.23 C ATOM 891 CD GLU A 561 7.746 -19.787 -0.172 1.00 10.15 C ATOM 892 OE1 GLU A 561 7.050 -20.473 -0.943 1.00 12.52 O ATOM 893 OE2 GLU A 561 8.973 -19.996 -0.025 1.00 21.13 O ATOM 0 H GLU A 561 3.812 -19.530 2.746 1.00 72.22 H new ATOM 0 HA GLU A 561 5.658 -17.272 2.441 1.00 12.23 H new ATOM 0 HB2 GLU A 561 6.469 -19.647 2.362 1.00 0.34 H new ATOM 0 HB3 GLU A 561 5.428 -19.920 0.979 1.00 0.34 H new ATOM 0 HG2 GLU A 561 6.681 -17.946 -0.120 1.00 61.23 H new ATOM 0 HG3 GLU A 561 7.853 -18.138 1.168 1.00 61.23 H new ATOM 900 N PHE A 562 4.223 -16.200 0.759 1.00 65.14 N ATOM 901 CA PHE A 562 3.561 -15.530 -0.327 1.00 50.43 C ATOM 902 C PHE A 562 4.588 -14.975 -1.253 1.00 44.00 C ATOM 903 O PHE A 562 5.686 -14.620 -0.833 1.00 25.34 O ATOM 904 CB PHE A 562 2.652 -14.410 0.161 1.00 73.34 C ATOM 905 CG PHE A 562 1.371 -14.872 0.778 1.00 63.34 C ATOM 906 CD1 PHE A 562 1.279 -15.124 2.134 1.00 62.12 C ATOM 907 CD2 PHE A 562 0.241 -15.025 -0.007 1.00 55.11 C ATOM 908 CE1 PHE A 562 0.084 -15.526 2.691 1.00 31.45 C ATOM 909 CE2 PHE A 562 -0.951 -15.421 0.542 1.00 24.13 C ATOM 910 CZ PHE A 562 -1.033 -15.670 1.891 1.00 31.21 C ATOM 0 H PHE A 562 4.639 -15.575 1.449 1.00 65.14 H new ATOM 0 HA PHE A 562 2.934 -16.258 -0.842 1.00 50.43 H new ATOM 0 HB2 PHE A 562 3.196 -13.810 0.891 1.00 73.34 H new ATOM 0 HB3 PHE A 562 2.420 -13.756 -0.680 1.00 73.34 H new ATOM 0 HD1 PHE A 562 2.150 -15.005 2.762 1.00 62.12 H new ATOM 0 HD2 PHE A 562 0.299 -14.829 -1.068 1.00 55.11 H new ATOM 0 HE1 PHE A 562 0.021 -15.728 3.750 1.00 31.45 H new ATOM 0 HE2 PHE A 562 -1.823 -15.537 -0.084 1.00 24.13 H new ATOM 0 HZ PHE A 562 -1.972 -15.979 2.326 1.00 31.21 H new ATOM 920 N GLN A 563 4.280 -14.917 -2.501 1.00 24.25 N ATOM 921 CA GLN A 563 5.208 -14.419 -3.464 1.00 11.14 C ATOM 922 C GLN A 563 4.438 -13.691 -4.509 1.00 63.44 C ATOM 923 O GLN A 563 3.216 -13.587 -4.406 1.00 34.24 O ATOM 924 CB GLN A 563 5.999 -15.552 -4.147 1.00 72.11 C ATOM 925 CG GLN A 563 6.629 -16.565 -3.218 1.00 3.24 C ATOM 926 CD GLN A 563 7.659 -17.432 -3.887 1.00 45.31 C ATOM 927 OE1 GLN A 563 7.818 -18.582 -3.548 1.00 70.12 O ATOM 928 NE2 GLN A 563 8.406 -16.886 -4.787 1.00 54.14 N ATOM 0 H GLN A 563 3.382 -15.211 -2.886 1.00 24.25 H new ATOM 0 HA GLN A 563 5.920 -13.772 -2.952 1.00 11.14 H new ATOM 0 HB2 GLN A 563 5.330 -16.078 -4.828 1.00 72.11 H new ATOM 0 HB3 GLN A 563 6.786 -15.105 -4.755 1.00 72.11 H new ATOM 0 HG2 GLN A 563 7.094 -16.041 -2.383 1.00 3.24 H new ATOM 0 HG3 GLN A 563 5.847 -17.199 -2.801 1.00 3.24 H new ATOM 0 HE21 GLN A 563 8.253 -15.914 -5.056 1.00 54.14 H new ATOM 0 HE22 GLN A 563 9.150 -17.426 -5.229 1.00 54.14 H new ATOM 937 N ASN A 564 5.141 -13.199 -5.501 1.00 72.10 N ATOM 938 CA ASN A 564 4.518 -12.581 -6.656 1.00 12.33 C ATOM 939 C ASN A 564 3.804 -13.671 -7.450 1.00 34.31 C ATOM 940 O ASN A 564 2.771 -13.447 -8.079 1.00 43.32 O ATOM 941 CB ASN A 564 5.583 -11.898 -7.528 1.00 61.10 C ATOM 942 CG ASN A 564 5.011 -11.170 -8.744 1.00 30.24 C ATOM 943 OD1 ASN A 564 3.887 -10.661 -8.732 1.00 44.12 O ATOM 944 ND2 ASN A 564 5.780 -11.112 -9.793 1.00 1.41 N ATOM 0 H ASN A 564 6.160 -13.214 -5.534 1.00 72.10 H new ATOM 0 HA ASN A 564 3.804 -11.822 -6.338 1.00 12.33 H new ATOM 0 HB2 ASN A 564 6.137 -11.185 -6.917 1.00 61.10 H new ATOM 0 HB3 ASN A 564 6.297 -12.649 -7.868 1.00 61.10 H new ATOM 0 HD21 ASN A 564 5.458 -10.636 -10.636 1.00 1.41 H new ATOM 0 HD22 ASN A 564 6.704 -11.543 -9.772 1.00 1.41 H new ATOM 951 N ASP A 565 4.374 -14.870 -7.400 1.00 34.54 N ATOM 952 CA ASP A 565 3.787 -16.039 -8.064 1.00 61.44 C ATOM 953 C ASP A 565 2.660 -16.652 -7.240 1.00 71.41 C ATOM 954 O ASP A 565 1.559 -16.867 -7.758 1.00 12.03 O ATOM 955 CB ASP A 565 4.829 -17.117 -8.337 1.00 50.41 C ATOM 956 CG ASP A 565 4.231 -18.283 -9.099 1.00 44.11 C ATOM 957 OD1 ASP A 565 4.086 -18.180 -10.331 1.00 61.43 O ATOM 958 OD2 ASP A 565 3.878 -19.309 -8.490 1.00 40.41 O ATOM 0 H ASP A 565 5.245 -15.063 -6.906 1.00 34.54 H new ATOM 0 HA ASP A 565 3.386 -15.676 -9.010 1.00 61.44 H new ATOM 0 HB2 ASP A 565 5.654 -16.692 -8.908 1.00 50.41 H new ATOM 0 HB3 ASP A 565 5.244 -17.471 -7.393 1.00 50.41 H new ATOM 963 N GLU A 566 2.952 -16.942 -5.962 1.00 55.32 N ATOM 964 CA GLU A 566 2.003 -17.545 -5.040 1.00 14.13 C ATOM 965 C GLU A 566 0.739 -16.747 -4.944 1.00 35.22 C ATOM 966 O GLU A 566 0.771 -15.550 -4.656 1.00 5.13 O ATOM 967 CB GLU A 566 2.623 -17.710 -3.668 1.00 13.22 C ATOM 968 CG GLU A 566 3.604 -18.861 -3.554 1.00 63.02 C ATOM 969 CD GLU A 566 2.914 -20.201 -3.683 1.00 32.22 C ATOM 970 OE1 GLU A 566 2.484 -20.760 -2.657 1.00 42.23 O ATOM 971 OE2 GLU A 566 2.768 -20.711 -4.810 1.00 70.24 O ATOM 0 H GLU A 566 3.865 -16.759 -5.545 1.00 55.32 H new ATOM 0 HA GLU A 566 1.747 -18.529 -5.434 1.00 14.13 H new ATOM 0 HB2 GLU A 566 3.135 -16.785 -3.401 1.00 13.22 H new ATOM 0 HB3 GLU A 566 1.826 -17.855 -2.938 1.00 13.22 H new ATOM 0 HG2 GLU A 566 4.365 -18.768 -4.328 1.00 63.02 H new ATOM 0 HG3 GLU A 566 4.118 -18.807 -2.594 1.00 63.02 H new ATOM 978 N ILE A 567 -0.358 -17.412 -5.177 1.00 24.44 N ATOM 979 CA ILE A 567 -1.659 -16.784 -5.211 1.00 2.11 C ATOM 980 C ILE A 567 -2.282 -16.647 -3.824 1.00 12.31 C ATOM 981 O ILE A 567 -2.537 -15.536 -3.363 1.00 51.52 O ATOM 982 CB ILE A 567 -2.646 -17.499 -6.174 1.00 30.52 C ATOM 983 CG1 ILE A 567 -2.569 -19.031 -6.024 1.00 1.03 C ATOM 984 CG2 ILE A 567 -2.369 -17.089 -7.615 1.00 73.21 C ATOM 985 CD1 ILE A 567 -3.832 -19.734 -6.409 1.00 30.15 C ATOM 0 H ILE A 567 -0.379 -18.417 -5.351 1.00 24.44 H new ATOM 0 HA ILE A 567 -1.481 -15.781 -5.600 1.00 2.11 H new ATOM 0 HB ILE A 567 -3.657 -17.191 -5.908 1.00 30.52 H new ATOM 0 HG12 ILE A 567 -1.751 -19.407 -6.639 1.00 1.03 H new ATOM 0 HG13 ILE A 567 -2.328 -19.275 -4.989 1.00 1.03 H new ATOM 0 HG21 ILE A 567 -3.068 -17.598 -8.279 1.00 73.21 H new ATOM 0 HG22 ILE A 567 -2.492 -16.011 -7.716 1.00 73.21 H new ATOM 0 HG23 ILE A 567 -1.349 -17.365 -7.882 1.00 73.21 H new ATOM 0 HD11 ILE A 567 -3.705 -20.809 -6.278 1.00 30.15 H new ATOM 0 HD12 ILE A 567 -4.649 -19.386 -5.777 1.00 30.15 H new ATOM 0 HD13 ILE A 567 -4.064 -19.520 -7.452 1.00 30.15 H new ATOM 997 N VAL A 568 -2.546 -17.759 -3.178 1.00 41.44 N ATOM 998 CA VAL A 568 -3.138 -17.752 -1.872 1.00 2.23 C ATOM 999 C VAL A 568 -2.541 -18.889 -1.043 1.00 30.22 C ATOM 1000 O VAL A 568 -2.089 -19.907 -1.593 1.00 21.35 O ATOM 1001 CB VAL A 568 -4.697 -17.875 -1.962 1.00 3.54 C ATOM 1002 CG1 VAL A 568 -5.153 -19.233 -2.473 1.00 24.45 C ATOM 1003 CG2 VAL A 568 -5.370 -17.543 -0.650 1.00 3.11 C ATOM 0 H VAL A 568 -2.354 -18.690 -3.548 1.00 41.44 H new ATOM 0 HA VAL A 568 -2.918 -16.803 -1.383 1.00 2.23 H new ATOM 0 HB VAL A 568 -5.009 -17.133 -2.697 1.00 3.54 H new ATOM 0 HG11 VAL A 568 -6.242 -19.259 -2.514 1.00 24.45 H new ATOM 0 HG12 VAL A 568 -4.748 -19.401 -3.471 1.00 24.45 H new ATOM 0 HG13 VAL A 568 -4.796 -20.013 -1.801 1.00 24.45 H new ATOM 0 HG21 VAL A 568 -6.450 -17.642 -0.760 1.00 3.11 H new ATOM 0 HG22 VAL A 568 -5.020 -18.228 0.122 1.00 3.11 H new ATOM 0 HG23 VAL A 568 -5.126 -16.520 -0.365 1.00 3.11 H new ATOM 1013 N LYS A 569 -2.484 -18.702 0.238 1.00 65.22 N ATOM 1014 CA LYS A 569 -1.994 -19.707 1.141 1.00 23.21 C ATOM 1015 C LYS A 569 -3.084 -20.110 2.090 1.00 13.14 C ATOM 1016 O LYS A 569 -4.091 -19.407 2.218 1.00 31.42 O ATOM 1017 CB LYS A 569 -0.812 -19.188 1.920 1.00 71.01 C ATOM 1018 CG LYS A 569 0.455 -18.985 1.115 1.00 53.02 C ATOM 1019 CD LYS A 569 1.440 -20.151 1.240 1.00 41.23 C ATOM 1020 CE LYS A 569 0.972 -21.413 0.535 1.00 31.22 C ATOM 1021 NZ LYS A 569 1.946 -22.519 0.679 1.00 10.53 N ATOM 0 H LYS A 569 -2.778 -17.839 0.696 1.00 65.22 H new ATOM 0 HA LYS A 569 -1.677 -20.573 0.559 1.00 23.21 H new ATOM 0 HB2 LYS A 569 -1.088 -18.238 2.378 1.00 71.01 H new ATOM 0 HB3 LYS A 569 -0.599 -19.883 2.732 1.00 71.01 H new ATOM 0 HG2 LYS A 569 0.194 -18.849 0.066 1.00 53.02 H new ATOM 0 HG3 LYS A 569 0.944 -18.068 1.443 1.00 53.02 H new ATOM 0 HD2 LYS A 569 2.403 -19.849 0.828 1.00 41.23 H new ATOM 0 HD3 LYS A 569 1.599 -20.371 2.296 1.00 41.23 H new ATOM 0 HE2 LYS A 569 0.010 -21.721 0.943 1.00 31.22 H new ATOM 0 HE3 LYS A 569 0.816 -21.202 -0.523 1.00 31.22 H new ATOM 0 HZ1 LYS A 569 1.590 -23.362 0.184 1.00 10.53 H new ATOM 0 HZ2 LYS A 569 2.858 -22.235 0.267 1.00 10.53 H new ATOM 0 HZ3 LYS A 569 2.076 -22.738 1.687 1.00 10.53 H new ATOM 1035 N THR A 570 -2.872 -21.201 2.759 1.00 42.03 N ATOM 1036 CA THR A 570 -3.845 -21.756 3.668 1.00 0.34 C ATOM 1037 C THR A 570 -3.219 -22.200 4.990 1.00 2.42 C ATOM 1038 O THR A 570 -2.048 -22.604 5.039 1.00 45.33 O ATOM 1039 CB THR A 570 -4.543 -22.965 3.018 1.00 21.14 C ATOM 1040 OG1 THR A 570 -3.583 -23.744 2.263 1.00 24.03 O ATOM 1041 CG2 THR A 570 -5.701 -22.547 2.128 1.00 4.24 C ATOM 0 H THR A 570 -2.010 -21.743 2.693 1.00 42.03 H new ATOM 0 HA THR A 570 -4.566 -20.967 3.882 1.00 0.34 H new ATOM 0 HB THR A 570 -4.957 -23.577 3.820 1.00 21.14 H new ATOM 0 HG1 THR A 570 -3.787 -24.698 2.360 1.00 24.03 H new ATOM 0 HG21 THR A 570 -6.163 -23.433 1.691 1.00 4.24 H new ATOM 0 HG22 THR A 570 -6.440 -22.008 2.721 1.00 4.24 H new ATOM 0 HG23 THR A 570 -5.333 -21.900 1.332 1.00 4.24 H new ATOM 1049 N ILE A 571 -3.976 -22.085 6.053 1.00 24.24 N ATOM 1050 CA ILE A 571 -3.568 -22.614 7.336 1.00 31.44 C ATOM 1051 C ILE A 571 -4.290 -23.921 7.521 1.00 35.41 C ATOM 1052 O ILE A 571 -5.516 -23.948 7.507 1.00 4.43 O ATOM 1053 CB ILE A 571 -3.883 -21.678 8.565 1.00 52.41 C ATOM 1054 CG1 ILE A 571 -3.066 -20.390 8.550 1.00 62.55 C ATOM 1055 CG2 ILE A 571 -3.644 -22.400 9.881 1.00 22.44 C ATOM 1056 CD1 ILE A 571 -3.471 -19.384 7.527 1.00 1.04 C ATOM 0 H ILE A 571 -4.887 -21.626 6.057 1.00 24.24 H new ATOM 0 HA ILE A 571 -2.483 -22.716 7.319 1.00 31.44 H new ATOM 0 HB ILE A 571 -4.937 -21.413 8.475 1.00 52.41 H new ATOM 0 HG12 ILE A 571 -3.132 -19.927 9.535 1.00 62.55 H new ATOM 0 HG13 ILE A 571 -2.019 -20.646 8.387 1.00 62.55 H new ATOM 0 HG21 ILE A 571 -3.870 -21.729 10.710 1.00 22.44 H new ATOM 0 HG22 ILE A 571 -4.289 -23.277 9.937 1.00 22.44 H new ATOM 0 HG23 ILE A 571 -2.601 -22.712 9.940 1.00 22.44 H new ATOM 0 HD11 ILE A 571 -2.827 -18.508 7.603 1.00 1.04 H new ATOM 0 HD12 ILE A 571 -3.377 -19.819 6.532 1.00 1.04 H new ATOM 0 HD13 ILE A 571 -4.506 -19.089 7.697 1.00 1.04 H new ATOM 1068 N SER A 572 -3.543 -24.971 7.627 1.00 55.41 N ATOM 1069 CA SER A 572 -4.065 -26.293 7.811 1.00 33.44 C ATOM 1070 C SER A 572 -4.072 -26.663 9.301 1.00 13.15 C ATOM 1071 O SER A 572 -3.027 -26.679 9.954 1.00 13.01 O ATOM 1072 CB SER A 572 -3.209 -27.242 6.982 1.00 4.44 C ATOM 1073 OG SER A 572 -1.837 -26.874 7.079 1.00 2.25 O ATOM 0 H SER A 572 -2.524 -24.936 7.587 1.00 55.41 H new ATOM 0 HA SER A 572 -5.100 -26.359 7.476 1.00 33.44 H new ATOM 0 HB2 SER A 572 -3.345 -28.266 7.331 1.00 4.44 H new ATOM 0 HB3 SER A 572 -3.528 -27.216 5.940 1.00 4.44 H new ATOM 0 HG SER A 572 -1.294 -27.491 6.544 1.00 2.25 H new ATOM 1079 N VAL A 573 -5.242 -26.888 9.848 1.00 3.03 N ATOM 1080 CA VAL A 573 -5.371 -27.240 11.264 1.00 2.12 C ATOM 1081 C VAL A 573 -6.132 -28.541 11.428 1.00 53.12 C ATOM 1082 O VAL A 573 -7.185 -28.741 10.795 1.00 62.44 O ATOM 1083 CB VAL A 573 -6.097 -26.116 12.086 1.00 22.34 C ATOM 1084 CG1 VAL A 573 -6.297 -26.503 13.546 1.00 43.12 C ATOM 1085 CG2 VAL A 573 -5.338 -24.814 12.007 1.00 34.44 C ATOM 0 H VAL A 573 -6.127 -26.837 9.343 1.00 3.03 H new ATOM 0 HA VAL A 573 -4.358 -27.353 11.651 1.00 2.12 H new ATOM 0 HB VAL A 573 -7.081 -25.990 11.635 1.00 22.34 H new ATOM 0 HG11 VAL A 573 -6.803 -25.693 14.071 1.00 43.12 H new ATOM 0 HG12 VAL A 573 -6.904 -27.407 13.603 1.00 43.12 H new ATOM 0 HG13 VAL A 573 -5.328 -26.687 14.010 1.00 43.12 H new ATOM 0 HG21 VAL A 573 -5.862 -24.052 12.584 1.00 34.44 H new ATOM 0 HG22 VAL A 573 -4.336 -24.952 12.413 1.00 34.44 H new ATOM 0 HG23 VAL A 573 -5.268 -24.496 10.967 1.00 34.44 H new ATOM 1095 N LYS A 574 -5.585 -29.422 12.238 1.00 32.11 N ATOM 1096 CA LYS A 574 -6.234 -30.654 12.602 1.00 33.32 C ATOM 1097 C LYS A 574 -7.269 -30.388 13.689 1.00 73.01 C ATOM 1098 O LYS A 574 -6.957 -29.837 14.758 1.00 23.15 O ATOM 1099 CB LYS A 574 -5.197 -31.707 13.068 1.00 43.12 C ATOM 1100 CG LYS A 574 -5.794 -32.992 13.656 1.00 72.54 C ATOM 1101 CD LYS A 574 -6.699 -33.700 12.667 1.00 70.43 C ATOM 1102 CE LYS A 574 -7.329 -34.946 13.264 1.00 54.22 C ATOM 1103 NZ LYS A 574 -8.245 -35.598 12.307 1.00 62.01 N ATOM 0 H LYS A 574 -4.667 -29.297 12.665 1.00 32.11 H new ATOM 0 HA LYS A 574 -6.742 -31.058 11.726 1.00 33.32 H new ATOM 0 HB2 LYS A 574 -4.566 -31.973 12.220 1.00 43.12 H new ATOM 0 HB3 LYS A 574 -4.549 -31.250 13.816 1.00 43.12 H new ATOM 0 HG2 LYS A 574 -4.988 -33.663 13.955 1.00 72.54 H new ATOM 0 HG3 LYS A 574 -6.359 -32.751 14.556 1.00 72.54 H new ATOM 0 HD2 LYS A 574 -7.484 -33.018 12.341 1.00 70.43 H new ATOM 0 HD3 LYS A 574 -6.125 -33.973 11.781 1.00 70.43 H new ATOM 0 HE2 LYS A 574 -6.547 -35.647 13.556 1.00 54.22 H new ATOM 0 HE3 LYS A 574 -7.875 -34.681 14.170 1.00 54.22 H new ATOM 0 HZ1 LYS A 574 -8.513 -36.536 12.667 1.00 62.01 H new ATOM 0 HZ2 LYS A 574 -9.098 -35.015 12.190 1.00 62.01 H new ATOM 0 HZ3 LYS A 574 -7.770 -35.703 11.388 1.00 62.01 H new ATOM 1117 N VAL A 575 -8.484 -30.755 13.406 1.00 34.30 N ATOM 1118 CA VAL A 575 -9.565 -30.588 14.340 1.00 53.35 C ATOM 1119 C VAL A 575 -9.664 -31.847 15.199 1.00 3.31 C ATOM 1120 O VAL A 575 -9.695 -32.965 14.670 1.00 65.54 O ATOM 1121 CB VAL A 575 -10.908 -30.319 13.601 1.00 23.43 C ATOM 1122 CG1 VAL A 575 -12.033 -30.082 14.590 1.00 34.31 C ATOM 1123 CG2 VAL A 575 -10.766 -29.122 12.668 1.00 14.53 C ATOM 0 H VAL A 575 -8.757 -31.180 12.520 1.00 34.30 H new ATOM 0 HA VAL A 575 -9.366 -29.723 14.973 1.00 53.35 H new ATOM 0 HB VAL A 575 -11.154 -31.201 13.010 1.00 23.43 H new ATOM 0 HG11 VAL A 575 -12.961 -29.896 14.048 1.00 34.31 H new ATOM 0 HG12 VAL A 575 -12.152 -30.961 15.223 1.00 34.31 H new ATOM 0 HG13 VAL A 575 -11.796 -29.218 15.210 1.00 34.31 H new ATOM 0 HG21 VAL A 575 -11.712 -28.945 12.157 1.00 14.53 H new ATOM 0 HG22 VAL A 575 -10.495 -28.239 13.247 1.00 14.53 H new ATOM 0 HG23 VAL A 575 -9.989 -29.325 11.931 1.00 14.53 H new ATOM 1133 N ILE A 576 -9.652 -31.673 16.502 1.00 43.13 N ATOM 1134 CA ILE A 576 -9.690 -32.788 17.437 1.00 12.12 C ATOM 1135 C ILE A 576 -11.132 -33.027 17.907 1.00 35.00 C ATOM 1136 O ILE A 576 -11.968 -32.132 17.846 1.00 71.41 O ATOM 1137 CB ILE A 576 -8.779 -32.504 18.667 1.00 55.04 C ATOM 1138 CG1 ILE A 576 -7.402 -32.014 18.208 1.00 53.43 C ATOM 1139 CG2 ILE A 576 -8.621 -33.744 19.550 1.00 33.13 C ATOM 1140 CD1 ILE A 576 -6.613 -33.005 17.388 1.00 11.21 C ATOM 0 H ILE A 576 -9.616 -30.757 16.949 1.00 43.13 H new ATOM 0 HA ILE A 576 -9.322 -33.678 16.927 1.00 12.12 H new ATOM 0 HB ILE A 576 -9.261 -31.726 19.260 1.00 55.04 H new ATOM 0 HG12 ILE A 576 -7.533 -31.104 17.623 1.00 53.43 H new ATOM 0 HG13 ILE A 576 -6.817 -31.746 19.088 1.00 53.43 H new ATOM 0 HG21 ILE A 576 -7.979 -33.507 20.398 1.00 33.13 H new ATOM 0 HG22 ILE A 576 -9.599 -34.060 19.913 1.00 33.13 H new ATOM 0 HG23 ILE A 576 -8.172 -34.550 18.969 1.00 33.13 H new ATOM 0 HD11 ILE A 576 -5.654 -32.567 17.111 1.00 11.21 H new ATOM 0 HD12 ILE A 576 -6.443 -33.908 17.974 1.00 11.21 H new ATOM 0 HD13 ILE A 576 -7.171 -33.257 16.486 1.00 11.21 H new ATOM 1278 N LYS A 585 -16.860 -24.854 20.722 1.00 75.03 N ATOM 1279 CA LYS A 585 -15.440 -24.791 20.673 1.00 74.43 C ATOM 1280 C LYS A 585 -15.006 -23.970 19.516 1.00 24.40 C ATOM 1281 O LYS A 585 -15.370 -24.227 18.382 1.00 10.21 O ATOM 1282 CB LYS A 585 -14.821 -26.204 20.644 1.00 21.24 C ATOM 1283 CG LYS A 585 -15.061 -27.024 21.926 1.00 52.45 C ATOM 1284 CD LYS A 585 -14.410 -26.355 23.134 1.00 2.22 C ATOM 1285 CE LYS A 585 -14.661 -27.096 24.446 1.00 72.22 C ATOM 1286 NZ LYS A 585 -14.134 -28.472 24.445 1.00 74.44 N ATOM 0 HA LYS A 585 -15.078 -24.308 21.581 1.00 74.43 H new ATOM 0 HB2 LYS A 585 -15.230 -26.751 19.794 1.00 21.24 H new ATOM 0 HB3 LYS A 585 -13.747 -26.115 20.478 1.00 21.24 H new ATOM 0 HG2 LYS A 585 -16.132 -27.131 22.098 1.00 52.45 H new ATOM 0 HG3 LYS A 585 -14.657 -28.028 21.800 1.00 52.45 H new ATOM 0 HD2 LYS A 585 -13.335 -26.284 22.965 1.00 2.22 H new ATOM 0 HD3 LYS A 585 -14.787 -25.336 23.223 1.00 2.22 H new ATOM 0 HE2 LYS A 585 -14.203 -26.539 25.264 1.00 72.22 H new ATOM 0 HE3 LYS A 585 -15.733 -27.124 24.640 1.00 72.22 H new ATOM 0 HZ1 LYS A 585 -14.908 -29.140 24.635 1.00 74.44 H new ATOM 0 HZ2 LYS A 585 -13.714 -28.682 23.517 1.00 74.44 H new ATOM 0 HZ3 LYS A 585 -13.407 -28.566 25.183 1.00 74.44 H new ATOM 1300 N THR A 586 -14.290 -22.950 19.821 1.00 44.14 N ATOM 1301 CA THR A 586 -13.817 -22.045 18.861 1.00 21.23 C ATOM 1302 C THR A 586 -12.505 -21.477 19.362 1.00 41.23 C ATOM 1303 O THR A 586 -12.296 -21.385 20.570 1.00 13.34 O ATOM 1304 CB THR A 586 -14.877 -20.921 18.579 1.00 20.21 C ATOM 1305 OG1 THR A 586 -14.399 -19.999 17.608 1.00 40.13 O ATOM 1306 CG2 THR A 586 -15.276 -20.173 19.841 1.00 15.42 C ATOM 0 H THR A 586 -14.013 -22.723 20.776 1.00 44.14 H new ATOM 0 HA THR A 586 -13.651 -22.551 17.910 1.00 21.23 H new ATOM 0 HB THR A 586 -15.763 -21.424 18.192 1.00 20.21 H new ATOM 0 HG1 THR A 586 -13.737 -20.440 17.036 1.00 40.13 H new ATOM 0 HG21 THR A 586 -16.010 -19.407 19.593 1.00 15.42 H new ATOM 0 HG22 THR A 586 -15.709 -20.872 20.557 1.00 15.42 H new ATOM 0 HG23 THR A 586 -14.395 -19.703 20.279 1.00 15.42 H new ATOM 1314 N PHE A 587 -11.618 -21.188 18.459 1.00 23.43 N ATOM 1315 CA PHE A 587 -10.331 -20.635 18.780 1.00 33.43 C ATOM 1316 C PHE A 587 -10.030 -19.554 17.773 1.00 31.24 C ATOM 1317 O PHE A 587 -10.821 -19.336 16.860 1.00 60.11 O ATOM 1318 CB PHE A 587 -9.238 -21.725 18.774 1.00 4.03 C ATOM 1319 CG PHE A 587 -8.996 -22.412 17.444 1.00 33.41 C ATOM 1320 CD1 PHE A 587 -9.798 -23.465 17.024 1.00 34.42 C ATOM 1321 CD2 PHE A 587 -7.949 -22.014 16.628 1.00 5.25 C ATOM 1322 CE1 PHE A 587 -9.554 -24.100 15.822 1.00 74.03 C ATOM 1323 CE2 PHE A 587 -7.708 -22.645 15.427 1.00 72.40 C ATOM 1324 CZ PHE A 587 -8.510 -23.687 15.025 1.00 24.52 C ATOM 0 H PHE A 587 -11.768 -21.331 17.460 1.00 23.43 H new ATOM 0 HA PHE A 587 -10.345 -20.215 19.786 1.00 33.43 H new ATOM 0 HB2 PHE A 587 -8.302 -21.275 19.105 1.00 4.03 H new ATOM 0 HB3 PHE A 587 -9.504 -22.484 19.510 1.00 4.03 H new ATOM 0 HD1 PHE A 587 -10.621 -23.791 17.643 1.00 34.42 H new ATOM 0 HD2 PHE A 587 -7.313 -21.198 16.938 1.00 5.25 H new ATOM 0 HE1 PHE A 587 -10.182 -24.920 15.507 1.00 74.03 H new ATOM 0 HE2 PHE A 587 -6.889 -22.321 14.802 1.00 72.40 H new ATOM 0 HZ PHE A 587 -8.321 -24.182 14.084 1.00 24.52 H new ATOM 1334 N PHE A 588 -8.915 -18.902 17.896 1.00 51.34 N ATOM 1335 CA PHE A 588 -8.608 -17.826 17.003 1.00 24.40 C ATOM 1336 C PHE A 588 -7.334 -18.113 16.278 1.00 71.03 C ATOM 1337 O PHE A 588 -6.485 -18.854 16.769 1.00 23.41 O ATOM 1338 CB PHE A 588 -8.522 -16.476 17.741 1.00 53.44 C ATOM 1339 CG PHE A 588 -9.810 -16.022 18.361 1.00 50.03 C ATOM 1340 CD1 PHE A 588 -10.212 -16.504 19.598 1.00 15.24 C ATOM 1341 CD2 PHE A 588 -10.618 -15.111 17.707 1.00 11.10 C ATOM 1342 CE1 PHE A 588 -11.396 -16.091 20.165 1.00 63.01 C ATOM 1343 CE2 PHE A 588 -11.802 -14.692 18.268 1.00 10.23 C ATOM 1344 CZ PHE A 588 -12.193 -15.183 19.500 1.00 4.25 C ATOM 0 H PHE A 588 -8.205 -19.094 18.602 1.00 51.34 H new ATOM 0 HA PHE A 588 -9.420 -17.747 16.281 1.00 24.40 H new ATOM 0 HB2 PHE A 588 -7.765 -16.551 18.521 1.00 53.44 H new ATOM 0 HB3 PHE A 588 -8.183 -15.714 17.039 1.00 53.44 H new ATOM 0 HD1 PHE A 588 -9.588 -17.212 20.123 1.00 15.24 H new ATOM 0 HD2 PHE A 588 -10.316 -14.724 16.745 1.00 11.10 H new ATOM 0 HE1 PHE A 588 -11.700 -16.476 21.127 1.00 63.01 H new ATOM 0 HE2 PHE A 588 -12.425 -13.980 17.747 1.00 10.23 H new ATOM 0 HZ PHE A 588 -13.123 -14.855 19.942 1.00 4.25 H new ATOM 1354 N LEU A 589 -7.219 -17.580 15.115 1.00 30.31 N ATOM 1355 CA LEU A 589 -6.032 -17.715 14.336 1.00 42.13 C ATOM 1356 C LEU A 589 -5.529 -16.312 14.096 1.00 12.13 C ATOM 1357 O LEU A 589 -6.318 -15.424 13.729 1.00 11.40 O ATOM 1358 CB LEU A 589 -6.361 -18.391 12.990 1.00 61.22 C ATOM 1359 CG LEU A 589 -5.315 -19.359 12.390 1.00 11.40 C ATOM 1360 CD1 LEU A 589 -3.953 -18.718 12.202 1.00 14.43 C ATOM 1361 CD2 LEU A 589 -5.207 -20.610 13.226 1.00 71.21 C ATOM 0 H LEU A 589 -7.953 -17.030 14.668 1.00 30.31 H new ATOM 0 HA LEU A 589 -5.287 -18.327 14.844 1.00 42.13 H new ATOM 0 HB2 LEU A 589 -7.294 -18.941 13.112 1.00 61.22 H new ATOM 0 HB3 LEU A 589 -6.547 -17.605 12.258 1.00 61.22 H new ATOM 0 HG LEU A 589 -5.671 -19.626 11.395 1.00 11.40 H new ATOM 0 HD11 LEU A 589 -3.263 -19.447 11.778 1.00 14.43 H new ATOM 0 HD12 LEU A 589 -4.042 -17.867 11.527 1.00 14.43 H new ATOM 0 HD13 LEU A 589 -3.574 -18.378 13.166 1.00 14.43 H new ATOM 0 HD21 LEU A 589 -4.466 -21.278 12.787 1.00 71.21 H new ATOM 0 HD22 LEU A 589 -4.903 -20.346 14.239 1.00 71.21 H new ATOM 0 HD23 LEU A 589 -6.174 -21.111 13.257 1.00 71.21 H new ATOM 1373 N GLU A 590 -4.275 -16.086 14.336 1.00 53.12 N ATOM 1374 CA GLU A 590 -3.712 -14.791 14.106 1.00 54.01 C ATOM 1375 C GLU A 590 -2.494 -14.900 13.250 1.00 32.23 C ATOM 1376 O GLU A 590 -1.662 -15.805 13.431 1.00 54.13 O ATOM 1377 CB GLU A 590 -3.385 -14.070 15.415 1.00 42.54 C ATOM 1378 CG GLU A 590 -2.748 -12.695 15.231 1.00 24.20 C ATOM 1379 CD GLU A 590 -2.497 -11.981 16.528 1.00 53.31 C ATOM 1380 OE1 GLU A 590 -3.435 -11.323 17.042 1.00 33.44 O ATOM 1381 OE2 GLU A 590 -1.367 -12.050 17.059 1.00 75.31 O ATOM 0 H GLU A 590 -3.620 -16.782 14.692 1.00 53.12 H new ATOM 0 HA GLU A 590 -4.461 -14.195 13.585 1.00 54.01 H new ATOM 0 HB2 GLU A 590 -4.302 -13.959 15.994 1.00 42.54 H new ATOM 0 HB3 GLU A 590 -2.711 -14.694 16.002 1.00 42.54 H new ATOM 0 HG2 GLU A 590 -1.804 -12.807 14.697 1.00 24.20 H new ATOM 0 HG3 GLU A 590 -3.397 -12.082 14.606 1.00 24.20 H new ATOM 1388 N ILE A 591 -2.410 -14.016 12.310 1.00 32.31 N ATOM 1389 CA ILE A 591 -1.279 -13.907 11.464 1.00 53.10 C ATOM 1390 C ILE A 591 -0.504 -12.688 11.896 1.00 21.31 C ATOM 1391 O ILE A 591 -1.097 -11.678 12.319 1.00 70.53 O ATOM 1392 CB ILE A 591 -1.670 -13.824 9.965 1.00 3.32 C ATOM 1393 CG1 ILE A 591 -2.652 -12.663 9.707 1.00 4.50 C ATOM 1394 CG2 ILE A 591 -2.261 -15.151 9.508 1.00 41.13 C ATOM 1395 CD1 ILE A 591 -3.078 -12.520 8.263 1.00 74.34 C ATOM 0 H ILE A 591 -3.145 -13.337 12.109 1.00 32.31 H new ATOM 0 HA ILE A 591 -0.666 -14.804 11.558 1.00 53.10 H new ATOM 0 HB ILE A 591 -0.770 -13.623 9.384 1.00 3.32 H new ATOM 0 HG12 ILE A 591 -3.539 -12.809 10.323 1.00 4.50 H new ATOM 0 HG13 ILE A 591 -2.189 -11.731 10.031 1.00 4.50 H new ATOM 0 HG21 ILE A 591 -2.533 -15.085 8.455 1.00 41.13 H new ATOM 0 HG22 ILE A 591 -1.525 -15.943 9.643 1.00 41.13 H new ATOM 0 HG23 ILE A 591 -3.149 -15.376 10.098 1.00 41.13 H new ATOM 0 HD11 ILE A 591 -3.768 -11.681 8.168 1.00 74.34 H new ATOM 0 HD12 ILE A 591 -2.201 -12.341 7.641 1.00 74.34 H new ATOM 0 HD13 ILE A 591 -3.573 -13.435 7.937 1.00 74.34 H new ATOM 1407 N GLY A 592 0.779 -12.789 11.848 1.00 60.11 N ATOM 1408 CA GLY A 592 1.614 -11.719 12.277 1.00 30.40 C ATOM 1409 C GLY A 592 1.879 -10.777 11.155 1.00 14.34 C ATOM 1410 O GLY A 592 1.338 -10.945 10.055 1.00 45.41 O ATOM 0 H GLY A 592 1.279 -13.612 11.512 1.00 60.11 H new ATOM 0 HA2 GLY A 592 1.138 -11.187 13.101 1.00 30.40 H new ATOM 0 HA3 GLY A 592 2.556 -12.115 12.656 1.00 30.40 H new ATOM 1414 N GLU A 593 2.699 -9.800 11.409 1.00 22.42 N ATOM 1415 CA GLU A 593 3.027 -8.826 10.412 1.00 73.31 C ATOM 1416 C GLU A 593 3.897 -9.437 9.319 1.00 12.02 C ATOM 1417 O GLU A 593 4.893 -10.123 9.607 1.00 5.35 O ATOM 1418 CB GLU A 593 3.665 -7.603 11.048 1.00 23.41 C ATOM 1419 CG GLU A 593 2.710 -6.892 11.988 1.00 1.53 C ATOM 1420 CD GLU A 593 3.312 -5.682 12.642 1.00 13.31 C ATOM 1421 OE1 GLU A 593 3.996 -5.834 13.682 1.00 23.34 O ATOM 1422 OE2 GLU A 593 3.113 -4.559 12.131 1.00 14.03 O ATOM 0 H GLU A 593 3.157 -9.657 12.309 1.00 22.42 H new ATOM 0 HA GLU A 593 2.107 -8.493 9.931 1.00 73.31 H new ATOM 0 HB2 GLU A 593 4.558 -7.903 11.596 1.00 23.41 H new ATOM 0 HB3 GLU A 593 3.987 -6.914 10.267 1.00 23.41 H new ATOM 0 HG2 GLU A 593 1.821 -6.592 11.433 1.00 1.53 H new ATOM 0 HG3 GLU A 593 2.384 -7.589 12.760 1.00 1.53 H new ATOM 1429 N PRO A 594 3.513 -9.222 8.058 1.00 22.32 N ATOM 1430 CA PRO A 594 4.206 -9.787 6.908 1.00 64.31 C ATOM 1431 C PRO A 594 5.592 -9.199 6.757 1.00 43.21 C ATOM 1432 O PRO A 594 5.772 -7.976 6.795 1.00 52.11 O ATOM 1433 CB PRO A 594 3.336 -9.381 5.716 1.00 42.45 C ATOM 1434 CG PRO A 594 2.565 -8.204 6.187 1.00 42.22 C ATOM 1435 CD PRO A 594 2.375 -8.377 7.660 1.00 1.51 C ATOM 0 HA PRO A 594 4.339 -10.865 7.000 1.00 64.31 H new ATOM 0 HB2 PRO A 594 3.947 -9.131 4.848 1.00 42.45 H new ATOM 0 HB3 PRO A 594 2.673 -10.193 5.416 1.00 42.45 H new ATOM 0 HG2 PRO A 594 3.100 -7.279 5.972 1.00 42.22 H new ATOM 0 HG3 PRO A 594 1.604 -8.142 5.677 1.00 42.22 H new ATOM 0 HD2 PRO A 594 2.385 -7.420 8.181 1.00 1.51 H new ATOM 0 HD3 PRO A 594 1.422 -8.854 7.888 1.00 1.51 H new ATOM 1443 N ARG A 595 6.557 -10.040 6.595 1.00 62.01 N ATOM 1444 CA ARG A 595 7.908 -9.591 6.450 1.00 50.21 C ATOM 1445 C ARG A 595 8.395 -9.866 5.044 1.00 41.23 C ATOM 1446 O ARG A 595 8.135 -10.943 4.481 1.00 5.30 O ATOM 1447 CB ARG A 595 8.833 -10.230 7.500 1.00 21.51 C ATOM 1448 CG ARG A 595 8.931 -11.749 7.433 1.00 5.35 C ATOM 1449 CD ARG A 595 9.852 -12.295 8.508 1.00 21.30 C ATOM 1450 NE ARG A 595 11.209 -11.732 8.425 1.00 44.13 N ATOM 1451 CZ ARG A 595 12.343 -12.432 8.541 1.00 20.12 C ATOM 1452 NH1 ARG A 595 12.313 -13.744 8.693 1.00 35.32 N ATOM 1453 NH2 ARG A 595 13.507 -11.805 8.499 1.00 74.13 N ATOM 0 H ARG A 595 6.437 -11.052 6.559 1.00 62.01 H new ATOM 0 HA ARG A 595 7.933 -8.515 6.622 1.00 50.21 H new ATOM 0 HB2 ARG A 595 9.833 -9.811 7.385 1.00 21.51 H new ATOM 0 HB3 ARG A 595 8.481 -9.947 8.492 1.00 21.51 H new ATOM 0 HG2 ARG A 595 7.938 -12.184 7.548 1.00 5.35 H new ATOM 0 HG3 ARG A 595 9.299 -12.048 6.451 1.00 5.35 H new ATOM 0 HD2 ARG A 595 9.430 -12.076 9.489 1.00 21.30 H new ATOM 0 HD3 ARG A 595 9.906 -13.380 8.419 1.00 21.30 H new ATOM 0 HE ARG A 595 11.292 -10.728 8.266 1.00 44.13 H new ATOM 0 HH11 ARG A 595 11.419 -14.234 8.723 1.00 35.32 H new ATOM 0 HH12 ARG A 595 13.184 -14.267 8.780 1.00 35.32 H new ATOM 0 HH21 ARG A 595 13.537 -10.793 8.379 1.00 74.13 H new ATOM 0 HH22 ARG A 595 14.375 -12.334 8.587 1.00 74.13 H new ATOM 1467 N LEU A 596 9.029 -8.883 4.465 1.00 5.14 N ATOM 1468 CA LEU A 596 9.600 -9.002 3.161 1.00 41.21 C ATOM 1469 C LEU A 596 10.829 -9.886 3.280 1.00 34.31 C ATOM 1470 O LEU A 596 11.647 -9.706 4.193 1.00 31.32 O ATOM 1471 CB LEU A 596 9.977 -7.592 2.648 1.00 54.13 C ATOM 1472 CG LEU A 596 10.149 -7.389 1.124 1.00 12.13 C ATOM 1473 CD1 LEU A 596 11.418 -8.039 0.586 1.00 14.51 C ATOM 1474 CD2 LEU A 596 8.932 -7.940 0.410 1.00 23.53 C ATOM 0 H LEU A 596 9.163 -7.968 4.895 1.00 5.14 H new ATOM 0 HA LEU A 596 8.899 -9.445 2.453 1.00 41.21 H new ATOM 0 HB2 LEU A 596 9.211 -6.897 2.992 1.00 54.13 H new ATOM 0 HB3 LEU A 596 10.910 -7.301 3.130 1.00 54.13 H new ATOM 0 HG LEU A 596 10.244 -6.319 0.937 1.00 12.13 H new ATOM 0 HD11 LEU A 596 11.488 -7.866 -0.488 1.00 14.51 H new ATOM 0 HD12 LEU A 596 12.287 -7.606 1.081 1.00 14.51 H new ATOM 0 HD13 LEU A 596 11.388 -9.111 0.779 1.00 14.51 H new ATOM 0 HD21 LEU A 596 9.046 -7.800 -0.665 1.00 23.53 H new ATOM 0 HD22 LEU A 596 8.832 -9.003 0.629 1.00 23.53 H new ATOM 0 HD23 LEU A 596 8.041 -7.414 0.751 1.00 23.53 H new ATOM 1486 N VAL A 597 10.940 -10.847 2.409 1.00 34.01 N ATOM 1487 CA VAL A 597 12.076 -11.724 2.428 1.00 2.33 C ATOM 1488 C VAL A 597 13.224 -11.065 1.695 1.00 40.40 C ATOM 1489 O VAL A 597 13.327 -11.132 0.459 1.00 4.50 O ATOM 1490 CB VAL A 597 11.758 -13.103 1.820 1.00 20.12 C ATOM 1491 CG1 VAL A 597 12.950 -14.037 1.918 1.00 12.32 C ATOM 1492 CG2 VAL A 597 10.565 -13.707 2.519 1.00 2.54 C ATOM 0 H VAL A 597 10.258 -11.044 1.676 1.00 34.01 H new ATOM 0 HA VAL A 597 12.355 -11.900 3.467 1.00 2.33 H new ATOM 0 HB VAL A 597 11.528 -12.965 0.764 1.00 20.12 H new ATOM 0 HG11 VAL A 597 12.693 -15.002 1.480 1.00 12.32 H new ATOM 0 HG12 VAL A 597 13.794 -13.607 1.379 1.00 12.32 H new ATOM 0 HG13 VAL A 597 13.220 -14.174 2.965 1.00 12.32 H new ATOM 0 HG21 VAL A 597 10.344 -14.682 2.085 1.00 2.54 H new ATOM 0 HG22 VAL A 597 10.785 -13.823 3.580 1.00 2.54 H new ATOM 0 HG23 VAL A 597 9.702 -13.052 2.397 1.00 2.54 H new ATOM 2079 N PRO A 634 5.595 -5.094 2.927 1.00 31.20 N ATOM 2080 CA PRO A 634 4.244 -5.619 2.987 1.00 21.24 C ATOM 2081 C PRO A 634 3.645 -5.363 4.358 1.00 2.52 C ATOM 2082 O PRO A 634 4.346 -5.455 5.385 1.00 44.12 O ATOM 2083 CB PRO A 634 4.430 -7.119 2.736 1.00 52.45 C ATOM 2084 CG PRO A 634 5.850 -7.386 3.110 1.00 54.25 C ATOM 2085 CD PRO A 634 6.592 -6.155 2.748 1.00 21.01 C ATOM 0 HA PRO A 634 3.567 -5.157 2.268 1.00 21.24 H new ATOM 0 HB2 PRO A 634 3.742 -7.711 3.340 1.00 52.45 H new ATOM 0 HB3 PRO A 634 4.239 -7.374 1.694 1.00 52.45 H new ATOM 0 HG2 PRO A 634 5.942 -7.601 4.175 1.00 54.25 H new ATOM 0 HG3 PRO A 634 6.241 -8.252 2.575 1.00 54.25 H new ATOM 0 HD2 PRO A 634 7.459 -6.004 3.391 1.00 21.01 H new ATOM 0 HD3 PRO A 634 6.959 -6.193 1.722 1.00 21.01 H new ATOM 2093 N ILE A 635 2.377 -5.024 4.383 1.00 51.54 N ATOM 2094 CA ILE A 635 1.707 -4.702 5.608 1.00 1.30 C ATOM 2095 C ILE A 635 0.422 -5.501 5.744 1.00 53.05 C ATOM 2096 O ILE A 635 0.045 -6.247 4.826 1.00 24.43 O ATOM 2097 CB ILE A 635 1.473 -3.151 5.763 1.00 51.32 C ATOM 2098 CG1 ILE A 635 0.716 -2.500 4.569 1.00 14.41 C ATOM 2099 CG2 ILE A 635 2.798 -2.436 5.974 1.00 3.33 C ATOM 2100 CD1 ILE A 635 -0.776 -2.766 4.509 1.00 41.03 C ATOM 0 H ILE A 635 1.787 -4.966 3.553 1.00 51.54 H new ATOM 0 HA ILE A 635 2.358 -4.991 6.433 1.00 1.30 H new ATOM 0 HB ILE A 635 0.831 -3.036 6.637 1.00 51.32 H new ATOM 0 HG12 ILE A 635 0.872 -1.422 4.609 1.00 14.41 H new ATOM 0 HG13 ILE A 635 1.167 -2.854 3.642 1.00 14.41 H new ATOM 0 HG21 ILE A 635 2.621 -1.366 6.079 1.00 3.33 H new ATOM 0 HG22 ILE A 635 3.276 -2.815 6.877 1.00 3.33 H new ATOM 0 HG23 ILE A 635 3.448 -2.614 5.117 1.00 3.33 H new ATOM 0 HD11 ILE A 635 -1.200 -2.265 3.639 1.00 41.03 H new ATOM 0 HD12 ILE A 635 -0.951 -3.839 4.432 1.00 41.03 H new ATOM 0 HD13 ILE A 635 -1.250 -2.385 5.414 1.00 41.03 H new ATOM 2112 N LEU A 636 -0.235 -5.388 6.862 1.00 3.13 N ATOM 2113 CA LEU A 636 -1.452 -6.108 7.055 1.00 3.40 C ATOM 2114 C LEU A 636 -2.656 -5.202 7.111 1.00 62.35 C ATOM 2115 O LEU A 636 -2.522 -3.976 7.122 1.00 72.54 O ATOM 2116 CB LEU A 636 -1.380 -7.121 8.216 1.00 54.34 C ATOM 2117 CG LEU A 636 -0.801 -6.671 9.568 1.00 12.53 C ATOM 2118 CD1 LEU A 636 -1.598 -5.536 10.191 1.00 51.52 C ATOM 2119 CD2 LEU A 636 -0.773 -7.856 10.497 1.00 34.33 C ATOM 0 H LEU A 636 0.053 -4.806 7.649 1.00 3.13 H new ATOM 0 HA LEU A 636 -1.590 -6.719 6.163 1.00 3.40 H new ATOM 0 HB2 LEU A 636 -2.391 -7.486 8.397 1.00 54.34 H new ATOM 0 HB3 LEU A 636 -0.791 -7.972 7.873 1.00 54.34 H new ATOM 0 HG LEU A 636 0.207 -6.291 9.399 1.00 12.53 H new ATOM 0 HD11 LEU A 636 -1.148 -5.256 11.143 1.00 51.52 H new ATOM 0 HD12 LEU A 636 -1.593 -4.677 9.520 1.00 51.52 H new ATOM 0 HD13 LEU A 636 -2.625 -5.861 10.357 1.00 51.52 H new ATOM 0 HD21 LEU A 636 -0.365 -7.553 11.461 1.00 34.33 H new ATOM 0 HD22 LEU A 636 -1.786 -8.234 10.635 1.00 34.33 H new ATOM 0 HD23 LEU A 636 -0.148 -8.640 10.068 1.00 34.33 H new ATOM 2131 N GLY A 637 -3.808 -5.805 7.134 1.00 51.01 N ATOM 2132 CA GLY A 637 -5.037 -5.073 7.079 1.00 60.34 C ATOM 2133 C GLY A 637 -5.513 -4.517 8.400 1.00 51.22 C ATOM 2134 O GLY A 637 -4.766 -4.464 9.394 1.00 64.50 O ATOM 0 H GLY A 637 -3.921 -6.817 7.191 1.00 51.01 H new ATOM 0 HA2 GLY A 637 -4.919 -4.248 6.377 1.00 60.34 H new ATOM 0 HA3 GLY A 637 -5.812 -5.725 6.677 1.00 60.34 H new ATOM 2138 N GLU A 638 -6.771 -4.130 8.395 1.00 20.42 N ATOM 2139 CA GLU A 638 -7.442 -3.517 9.520 1.00 53.31 C ATOM 2140 C GLU A 638 -7.609 -4.529 10.664 1.00 64.22 C ATOM 2141 O GLU A 638 -7.263 -4.253 11.815 1.00 62.13 O ATOM 2142 CB GLU A 638 -8.814 -3.017 9.050 1.00 12.32 C ATOM 2143 CG GLU A 638 -9.569 -2.176 10.058 1.00 12.21 C ATOM 2144 CD GLU A 638 -8.865 -0.890 10.372 1.00 51.52 C ATOM 2145 OE1 GLU A 638 -8.986 0.070 9.583 1.00 41.11 O ATOM 2146 OE2 GLU A 638 -8.180 -0.804 11.416 1.00 75.12 O ATOM 0 H GLU A 638 -7.374 -4.237 7.580 1.00 20.42 H new ATOM 0 HA GLU A 638 -6.848 -2.683 9.894 1.00 53.31 H new ATOM 0 HB2 GLU A 638 -8.679 -2.432 8.140 1.00 12.32 H new ATOM 0 HB3 GLU A 638 -9.427 -3.879 8.787 1.00 12.32 H new ATOM 0 HG2 GLU A 638 -10.564 -1.957 9.671 1.00 12.21 H new ATOM 0 HG3 GLU A 638 -9.702 -2.748 10.977 1.00 12.21 H new ATOM 2153 N HIS A 639 -8.129 -5.690 10.339 1.00 61.14 N ATOM 2154 CA HIS A 639 -8.341 -6.737 11.318 1.00 14.32 C ATOM 2155 C HIS A 639 -7.737 -8.018 10.803 1.00 55.03 C ATOM 2156 O HIS A 639 -8.131 -8.511 9.745 1.00 34.12 O ATOM 2157 CB HIS A 639 -9.849 -6.979 11.589 1.00 20.40 C ATOM 2158 CG HIS A 639 -10.610 -5.821 12.176 1.00 1.10 C ATOM 2159 ND1 HIS A 639 -10.763 -5.611 13.522 1.00 15.40 N ATOM 2160 CD2 HIS A 639 -11.293 -4.829 11.570 1.00 73.44 C ATOM 2161 CE1 HIS A 639 -11.515 -4.530 13.698 1.00 32.33 C ATOM 2162 NE2 HIS A 639 -11.870 -4.009 12.538 1.00 42.51 N ATOM 0 H HIS A 639 -8.417 -5.937 9.392 1.00 61.14 H new ATOM 0 HA HIS A 639 -7.871 -6.423 12.250 1.00 14.32 H new ATOM 0 HB2 HIS A 639 -10.325 -7.262 10.650 1.00 20.40 H new ATOM 0 HB3 HIS A 639 -9.944 -7.830 12.264 1.00 20.40 H new ATOM 0 HD2 HIS A 639 -11.379 -4.691 10.502 1.00 73.44 H new ATOM 0 HE1 HIS A 639 -11.798 -4.131 14.661 1.00 32.33 H new ATOM 0 HE2 HIS A 639 -12.445 -3.181 12.383 1.00 42.51 H new ATOM 2170 N THR A 640 -6.811 -8.558 11.532 1.00 42.04 N ATOM 2171 CA THR A 640 -6.189 -9.791 11.177 1.00 15.45 C ATOM 2172 C THR A 640 -6.439 -10.830 12.244 1.00 13.04 C ATOM 2173 O THR A 640 -5.614 -11.083 13.137 1.00 52.54 O ATOM 2174 CB THR A 640 -4.694 -9.636 10.870 1.00 3.32 C ATOM 2175 OG1 THR A 640 -4.052 -8.822 11.880 1.00 41.40 O ATOM 2176 CG2 THR A 640 -4.488 -9.013 9.507 1.00 2.31 C ATOM 0 H THR A 640 -6.463 -8.149 12.399 1.00 42.04 H new ATOM 0 HA THR A 640 -6.647 -10.132 10.249 1.00 15.45 H new ATOM 0 HB THR A 640 -4.245 -10.629 10.874 1.00 3.32 H new ATOM 0 HG1 THR A 640 -4.249 -9.187 12.768 1.00 41.40 H new ATOM 0 HG21 THR A 640 -3.421 -8.913 9.310 1.00 2.31 H new ATOM 0 HG22 THR A 640 -4.939 -9.648 8.745 1.00 2.31 H new ATOM 0 HG23 THR A 640 -4.956 -8.029 9.482 1.00 2.31 H new ATOM 2184 N LYS A 641 -7.590 -11.394 12.166 1.00 14.25 N ATOM 2185 CA LYS A 641 -8.065 -12.322 13.151 1.00 21.22 C ATOM 2186 C LYS A 641 -9.063 -13.230 12.517 1.00 41.23 C ATOM 2187 O LYS A 641 -9.840 -12.803 11.659 1.00 2.03 O ATOM 2188 CB LYS A 641 -8.729 -11.572 14.318 1.00 61.50 C ATOM 2189 CG LYS A 641 -9.286 -12.481 15.415 1.00 52.21 C ATOM 2190 CD LYS A 641 -9.958 -11.689 16.525 1.00 11.00 C ATOM 2191 CE LYS A 641 -8.965 -10.854 17.326 1.00 41.23 C ATOM 2192 NZ LYS A 641 -7.994 -11.681 18.085 1.00 4.23 N ATOM 0 H LYS A 641 -8.248 -11.226 11.405 1.00 14.25 H new ATOM 0 HA LYS A 641 -7.223 -12.897 13.537 1.00 21.22 H new ATOM 0 HB2 LYS A 641 -8.000 -10.893 14.760 1.00 61.50 H new ATOM 0 HB3 LYS A 641 -9.539 -10.957 13.926 1.00 61.50 H new ATOM 0 HG2 LYS A 641 -10.004 -13.176 14.980 1.00 52.21 H new ATOM 0 HG3 LYS A 641 -8.478 -13.079 15.835 1.00 52.21 H new ATOM 0 HD2 LYS A 641 -10.715 -11.034 16.093 1.00 11.00 H new ATOM 0 HD3 LYS A 641 -10.476 -12.375 17.195 1.00 11.00 H new ATOM 0 HE2 LYS A 641 -8.422 -10.196 16.648 1.00 41.23 H new ATOM 0 HE3 LYS A 641 -9.512 -10.216 18.020 1.00 41.23 H new ATOM 0 HZ1 LYS A 641 -7.457 -11.075 18.738 1.00 4.23 H new ATOM 0 HZ2 LYS A 641 -8.505 -12.406 18.627 1.00 4.23 H new ATOM 0 HZ3 LYS A 641 -7.338 -12.142 17.422 1.00 4.23 H new ATOM 2206 N LEU A 642 -9.023 -14.453 12.895 1.00 20.11 N ATOM 2207 CA LEU A 642 -9.945 -15.412 12.421 1.00 2.54 C ATOM 2208 C LEU A 642 -10.526 -16.148 13.597 1.00 12.22 C ATOM 2209 O LEU A 642 -9.777 -16.696 14.403 1.00 51.11 O ATOM 2210 CB LEU A 642 -9.211 -16.392 11.556 1.00 11.54 C ATOM 2211 CG LEU A 642 -10.037 -17.484 10.927 1.00 64.03 C ATOM 2212 CD1 LEU A 642 -10.923 -16.940 9.829 1.00 1.13 C ATOM 2213 CD2 LEU A 642 -9.134 -18.560 10.424 1.00 72.14 C ATOM 0 H LEU A 642 -8.337 -14.821 13.554 1.00 20.11 H new ATOM 0 HA LEU A 642 -10.738 -14.925 11.854 1.00 2.54 H new ATOM 0 HB2 LEU A 642 -8.714 -15.838 10.759 1.00 11.54 H new ATOM 0 HB3 LEU A 642 -8.429 -16.858 12.156 1.00 11.54 H new ATOM 0 HG LEU A 642 -10.700 -17.908 11.681 1.00 64.03 H new ATOM 0 HD11 LEU A 642 -11.506 -17.753 9.396 1.00 1.13 H new ATOM 0 HD12 LEU A 642 -11.597 -16.191 10.243 1.00 1.13 H new ATOM 0 HD13 LEU A 642 -10.305 -16.484 9.055 1.00 1.13 H new ATOM 0 HD21 LEU A 642 -9.729 -19.351 9.968 1.00 72.14 H new ATOM 0 HD22 LEU A 642 -8.452 -18.145 9.681 1.00 72.14 H new ATOM 0 HD23 LEU A 642 -8.560 -18.971 11.254 1.00 72.14 H new ATOM 2225 N GLU A 643 -11.816 -16.127 13.726 1.00 34.31 N ATOM 2226 CA GLU A 643 -12.473 -16.904 14.743 1.00 60.24 C ATOM 2227 C GLU A 643 -12.846 -18.242 14.115 1.00 73.31 C ATOM 2228 O GLU A 643 -13.641 -18.290 13.189 1.00 44.34 O ATOM 2229 CB GLU A 643 -13.713 -16.161 15.274 1.00 53.22 C ATOM 2230 CG GLU A 643 -14.455 -16.884 16.393 1.00 43.22 C ATOM 2231 CD GLU A 643 -15.619 -16.085 16.946 1.00 2.14 C ATOM 2232 OE1 GLU A 643 -16.718 -16.103 16.356 1.00 14.43 O ATOM 2233 OE2 GLU A 643 -15.468 -15.427 18.002 1.00 44.32 O ATOM 0 H GLU A 643 -12.443 -15.578 13.138 1.00 34.31 H new ATOM 0 HA GLU A 643 -11.817 -17.064 15.599 1.00 60.24 H new ATOM 0 HB2 GLU A 643 -13.405 -15.179 15.635 1.00 53.22 H new ATOM 0 HB3 GLU A 643 -14.403 -15.995 14.447 1.00 53.22 H new ATOM 0 HG2 GLU A 643 -14.823 -17.840 16.019 1.00 43.22 H new ATOM 0 HG3 GLU A 643 -13.757 -17.105 17.201 1.00 43.22 H new ATOM 2240 N VAL A 644 -12.219 -19.299 14.557 1.00 0.52 N ATOM 2241 CA VAL A 644 -12.450 -20.617 14.000 1.00 54.11 C ATOM 2242 C VAL A 644 -13.350 -21.397 14.914 1.00 23.24 C ATOM 2243 O VAL A 644 -12.953 -21.753 16.018 1.00 12.03 O ATOM 2244 CB VAL A 644 -11.144 -21.417 13.825 1.00 14.35 C ATOM 2245 CG1 VAL A 644 -11.433 -22.761 13.174 1.00 43.44 C ATOM 2246 CG2 VAL A 644 -10.133 -20.645 13.011 1.00 2.11 C ATOM 0 H VAL A 644 -11.533 -19.277 15.312 1.00 0.52 H new ATOM 0 HA VAL A 644 -12.904 -20.473 13.019 1.00 54.11 H new ATOM 0 HB VAL A 644 -10.718 -21.587 14.814 1.00 14.35 H new ATOM 0 HG11 VAL A 644 -10.502 -23.316 13.056 1.00 43.44 H new ATOM 0 HG12 VAL A 644 -12.118 -23.330 13.803 1.00 43.44 H new ATOM 0 HG13 VAL A 644 -11.887 -22.601 12.196 1.00 43.44 H new ATOM 0 HG21 VAL A 644 -9.223 -21.236 12.906 1.00 2.11 H new ATOM 0 HG22 VAL A 644 -10.545 -20.434 12.024 1.00 2.11 H new ATOM 0 HG23 VAL A 644 -9.900 -19.707 13.515 1.00 2.11 H new ATOM 2256 N ILE A 645 -14.542 -21.633 14.484 1.00 30.10 N ATOM 2257 CA ILE A 645 -15.510 -22.371 15.252 1.00 63.21 C ATOM 2258 C ILE A 645 -15.502 -23.822 14.809 1.00 3.41 C ATOM 2259 O ILE A 645 -15.446 -24.110 13.619 1.00 32.12 O ATOM 2260 CB ILE A 645 -16.919 -21.773 15.056 1.00 44.42 C ATOM 2261 CG1 ILE A 645 -16.887 -20.265 15.332 1.00 62.22 C ATOM 2262 CG2 ILE A 645 -17.929 -22.464 15.974 1.00 72.23 C ATOM 2263 CD1 ILE A 645 -18.145 -19.546 14.931 1.00 2.43 C ATOM 0 H ILE A 645 -14.886 -21.318 13.577 1.00 30.10 H new ATOM 0 HA ILE A 645 -15.249 -22.309 16.308 1.00 63.21 H new ATOM 0 HB ILE A 645 -17.230 -21.937 14.024 1.00 44.42 H new ATOM 0 HG12 ILE A 645 -16.711 -20.104 16.396 1.00 62.22 H new ATOM 0 HG13 ILE A 645 -16.044 -19.826 14.799 1.00 62.22 H new ATOM 0 HG21 ILE A 645 -18.917 -22.029 15.821 1.00 72.23 H new ATOM 0 HG22 ILE A 645 -17.962 -23.529 15.743 1.00 72.23 H new ATOM 0 HG23 ILE A 645 -17.629 -22.328 17.013 1.00 72.23 H new ATOM 0 HD11 ILE A 645 -18.045 -18.484 15.158 1.00 2.43 H new ATOM 0 HD12 ILE A 645 -18.312 -19.675 13.862 1.00 2.43 H new ATOM 0 HD13 ILE A 645 -18.991 -19.957 15.483 1.00 2.43 H new ATOM 2275 N ILE A 646 -15.519 -24.709 15.757 1.00 0.51 N ATOM 2276 CA ILE A 646 -15.535 -26.119 15.509 1.00 12.33 C ATOM 2277 C ILE A 646 -16.943 -26.646 15.734 1.00 73.25 C ATOM 2278 O ILE A 646 -17.459 -26.650 16.869 1.00 53.44 O ATOM 2279 CB ILE A 646 -14.540 -26.864 16.441 1.00 41.44 C ATOM 2280 CG1 ILE A 646 -13.110 -26.347 16.211 1.00 32.33 C ATOM 2281 CG2 ILE A 646 -14.621 -28.376 16.224 1.00 21.30 C ATOM 2282 CD1 ILE A 646 -12.085 -26.897 17.179 1.00 33.32 C ATOM 0 H ILE A 646 -15.522 -24.467 16.748 1.00 0.51 H new ATOM 0 HA ILE A 646 -15.228 -26.296 14.478 1.00 12.33 H new ATOM 0 HB ILE A 646 -14.815 -26.663 17.477 1.00 41.44 H new ATOM 0 HG12 ILE A 646 -12.805 -26.598 15.195 1.00 32.33 H new ATOM 0 HG13 ILE A 646 -13.114 -25.259 16.283 1.00 32.33 H new ATOM 0 HG21 ILE A 646 -13.916 -28.877 16.887 1.00 21.30 H new ATOM 0 HG22 ILE A 646 -15.632 -28.721 16.442 1.00 21.30 H new ATOM 0 HG23 ILE A 646 -14.373 -28.609 15.188 1.00 21.30 H new ATOM 0 HD11 ILE A 646 -11.105 -26.481 16.946 1.00 33.32 H new ATOM 0 HD12 ILE A 646 -12.362 -26.623 18.197 1.00 33.32 H new ATOM 0 HD13 ILE A 646 -12.049 -27.983 17.092 1.00 33.32 H new ATOM 2294 N GLU A 647 -17.572 -27.018 14.672 1.00 52.13 N ATOM 2295 CA GLU A 647 -18.879 -27.597 14.729 1.00 24.44 C ATOM 2296 C GLU A 647 -18.754 -29.083 14.428 1.00 63.31 C ATOM 2297 O GLU A 647 -18.060 -29.470 13.497 1.00 13.23 O ATOM 2298 CB GLU A 647 -19.813 -26.911 13.735 1.00 3.42 C ATOM 2299 CG GLU A 647 -19.898 -25.405 13.919 1.00 32.30 C ATOM 2300 CD GLU A 647 -20.870 -24.759 12.972 1.00 53.14 C ATOM 2301 OE1 GLU A 647 -20.699 -24.872 11.749 1.00 74.52 O ATOM 2302 OE2 GLU A 647 -21.817 -24.077 13.432 1.00 42.33 O ATOM 0 H GLU A 647 -17.194 -26.930 13.729 1.00 52.13 H new ATOM 0 HA GLU A 647 -19.308 -27.460 15.722 1.00 24.44 H new ATOM 0 HB2 GLU A 647 -19.473 -27.126 12.722 1.00 3.42 H new ATOM 0 HB3 GLU A 647 -20.811 -27.337 13.834 1.00 3.42 H new ATOM 0 HG2 GLU A 647 -20.195 -25.185 14.944 1.00 32.30 H new ATOM 0 HG3 GLU A 647 -18.910 -24.969 13.773 1.00 32.30 H new