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 118:sc= 1.2 USER MOD Single : A 512 THR OG1 : rot 180:sc= 0 USER MOD Single : A 513 HIS : no HE2:sc= 0.794 K(o=0.79,f=-5!) USER MOD Single : A 515 SER OG : rot 180:sc= 0.12 USER MOD Single : A 517 SER OG : rot -31:sc= 0.695 USER MOD Single : A 521 MET CE :methyl -117:sc= -0.434 (180deg=-4.2!) USER MOD Single : A 524 LYS NZ :NH3+ -157:sc= -0.71 (180deg=-1.36) USER MOD Single : A 528 THR OG1 : rot 118:sc= 2.34 USER MOD Single : A 529 SER OG : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= -4.91! C(o=-4.9!,f=-2.8!) USER MOD Single : A 539 TYR OH : rot 180:sc= 0 USER MOD Single : A 540 LYS NZ :NH3+ -107:sc= 1.17 (180deg=0.398) USER MOD Single : A 541 THR OG1 : rot 82:sc= 1.99 USER MOD Single : A 545 THR OG1 : rot -170:sc= 1.01 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= -1.38! K(o=-1.4!,f=-0.11) USER MOD Single : A 564 ASN : amide:sc= 0.0367 K(o=0.037,f=-3.2!) USER MOD Single : A 569 LYS NZ :NH3+ 146:sc= 1.19 (180deg=0.826) USER MOD Single : A 570 THR OG1 : rot 160:sc= 1.32 USER MOD Single : A 572 SER OG : rot 42:sc= 0.0474 USER MOD Single : A 574 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 585 LYS NZ :NH3+ 144:sc= 0.987 (180deg=-0.589!) USER MOD Single : A 586 THR OG1 : rot 19:sc= 0.273 USER MOD Single : A 639 HIS : no HD1:sc= -0.401 X(o=-0.4,f=-0.029) USER MOD Single : A 640 THR OG1 : rot 52:sc= 0.161 USER MOD Single : A 641 LYS NZ :NH3+ -169:sc=-0.00818 (180deg=-0.125) USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 502 2.094 -2.179 -0.410 1.00 75.02 N ATOM 19 CA ALA A 502 1.989 -3.545 -0.901 1.00 54.30 C ATOM 20 C ALA A 502 0.533 -3.957 -1.059 1.00 15.41 C ATOM 21 O ALA A 502 0.136 -4.533 -2.072 1.00 3.34 O ATOM 22 CB ALA A 502 2.699 -4.496 0.045 1.00 74.45 C ATOM 0 HA ALA A 502 2.466 -3.592 -1.880 1.00 54.30 H new ATOM 0 HB1 ALA A 502 2.614 -5.515 -0.332 1.00 74.45 H new ATOM 0 HB2 ALA A 502 3.752 -4.221 0.115 1.00 74.45 H new ATOM 0 HB3 ALA A 502 2.242 -4.435 1.033 1.00 74.45 H new ATOM 28 N GLY A 503 -0.257 -3.671 -0.066 1.00 72.05 N ATOM 29 CA GLY A 503 -1.634 -4.007 -0.127 1.00 43.21 C ATOM 30 C GLY A 503 -2.115 -4.510 1.186 1.00 3.14 C ATOM 31 O GLY A 503 -1.571 -4.148 2.215 1.00 71.15 O ATOM 0 H GLY A 503 0.036 -3.205 0.793 1.00 72.05 H new ATOM 0 HA2 GLY A 503 -2.214 -3.132 -0.420 1.00 43.21 H new ATOM 0 HA3 GLY A 503 -1.794 -4.766 -0.893 1.00 43.21 H new ATOM 35 N ILE A 504 -3.080 -5.382 1.148 1.00 0.23 N ATOM 36 CA ILE A 504 -3.724 -5.862 2.332 1.00 22.31 C ATOM 37 C ILE A 504 -3.511 -7.387 2.508 1.00 42.11 C ATOM 38 O ILE A 504 -3.963 -8.175 1.678 1.00 4.40 O ATOM 39 CB ILE A 504 -5.278 -5.559 2.269 1.00 51.10 C ATOM 40 CG1 ILE A 504 -5.616 -4.042 2.236 1.00 42.54 C ATOM 41 CG2 ILE A 504 -6.036 -6.234 3.371 1.00 3.23 C ATOM 42 CD1 ILE A 504 -5.406 -3.356 0.891 1.00 41.54 C ATOM 0 H ILE A 504 -3.445 -5.783 0.284 1.00 0.23 H new ATOM 0 HA ILE A 504 -3.280 -5.346 3.183 1.00 22.31 H new ATOM 0 HB ILE A 504 -5.603 -5.980 1.318 1.00 51.10 H new ATOM 0 HG12 ILE A 504 -6.657 -3.912 2.533 1.00 42.54 H new ATOM 0 HG13 ILE A 504 -5.006 -3.534 2.983 1.00 42.54 H new ATOM 0 HG21 ILE A 504 -7.096 -5.995 3.283 1.00 3.23 H new ATOM 0 HG22 ILE A 504 -5.900 -7.313 3.298 1.00 3.23 H new ATOM 0 HG23 ILE A 504 -5.664 -5.886 4.335 1.00 3.23 H new ATOM 0 HD11 ILE A 504 -5.670 -2.302 0.975 1.00 41.54 H new ATOM 0 HD12 ILE A 504 -4.361 -3.446 0.596 1.00 41.54 H new ATOM 0 HD13 ILE A 504 -6.037 -3.829 0.139 1.00 41.54 H new ATOM 54 N PHE A 505 -2.777 -7.781 3.542 1.00 70.52 N ATOM 55 CA PHE A 505 -2.708 -9.195 3.933 1.00 41.45 C ATOM 56 C PHE A 505 -3.776 -9.438 4.959 1.00 62.11 C ATOM 57 O PHE A 505 -3.818 -8.730 5.976 1.00 11.13 O ATOM 58 CB PHE A 505 -1.357 -9.589 4.551 1.00 71.11 C ATOM 59 CG PHE A 505 -0.280 -9.965 3.585 1.00 21.22 C ATOM 60 CD1 PHE A 505 -0.315 -11.196 2.953 1.00 31.44 C ATOM 61 CD2 PHE A 505 0.778 -9.122 3.333 1.00 51.40 C ATOM 62 CE1 PHE A 505 0.683 -11.569 2.084 1.00 1.33 C ATOM 63 CE2 PHE A 505 1.787 -9.494 2.464 1.00 14.10 C ATOM 64 CZ PHE A 505 1.736 -10.718 1.841 1.00 43.20 C ATOM 0 H PHE A 505 -2.224 -7.152 4.124 1.00 70.52 H new ATOM 0 HA PHE A 505 -2.840 -9.794 3.032 1.00 41.45 H new ATOM 0 HB2 PHE A 505 -1.000 -8.756 5.157 1.00 71.11 H new ATOM 0 HB3 PHE A 505 -1.520 -10.428 5.228 1.00 71.11 H new ATOM 0 HD1 PHE A 505 -1.136 -11.871 3.145 1.00 31.44 H new ATOM 0 HD2 PHE A 505 0.821 -8.159 3.820 1.00 51.40 H new ATOM 0 HE1 PHE A 505 0.640 -12.530 1.592 1.00 1.33 H new ATOM 0 HE2 PHE A 505 2.613 -8.824 2.275 1.00 14.10 H new ATOM 0 HZ PHE A 505 2.522 -11.011 1.161 1.00 43.20 H new ATOM 74 N THR A 506 -4.637 -10.392 4.720 1.00 53.40 N ATOM 75 CA THR A 506 -5.703 -10.661 5.643 1.00 62.44 C ATOM 76 C THR A 506 -6.386 -11.982 5.279 1.00 24.21 C ATOM 77 O THR A 506 -6.085 -12.583 4.243 1.00 21.31 O ATOM 78 CB THR A 506 -6.746 -9.482 5.650 1.00 43.11 C ATOM 79 OG1 THR A 506 -7.677 -9.633 6.732 1.00 12.24 O ATOM 80 CG2 THR A 506 -7.518 -9.414 4.328 1.00 2.11 C ATOM 0 H THR A 506 -4.620 -10.993 3.896 1.00 53.40 H new ATOM 0 HA THR A 506 -5.284 -10.745 6.646 1.00 62.44 H new ATOM 0 HB THR A 506 -6.186 -8.556 5.780 1.00 43.11 H new ATOM 0 HG1 THR A 506 -7.597 -8.869 7.341 1.00 12.24 H new ATOM 0 HG21 THR A 506 -8.230 -8.590 4.365 1.00 2.11 H new ATOM 0 HG22 THR A 506 -6.820 -9.254 3.507 1.00 2.11 H new ATOM 0 HG23 THR A 506 -8.054 -10.350 4.171 1.00 2.11 H new ATOM 88 N PHE A 507 -7.260 -12.433 6.138 1.00 53.44 N ATOM 89 CA PHE A 507 -8.057 -13.609 5.888 1.00 71.25 C ATOM 90 C PHE A 507 -9.225 -13.229 4.997 1.00 52.14 C ATOM 91 O PHE A 507 -9.605 -12.059 4.953 1.00 34.11 O ATOM 92 CB PHE A 507 -8.590 -14.162 7.201 1.00 12.32 C ATOM 93 CG PHE A 507 -7.564 -14.789 8.084 1.00 2.02 C ATOM 94 CD1 PHE A 507 -7.194 -16.096 7.878 1.00 63.31 C ATOM 95 CD2 PHE A 507 -6.990 -14.087 9.129 1.00 11.23 C ATOM 96 CE1 PHE A 507 -6.274 -16.707 8.689 1.00 65.25 C ATOM 97 CE2 PHE A 507 -6.066 -14.688 9.956 1.00 33.02 C ATOM 98 CZ PHE A 507 -5.707 -16.004 9.735 1.00 5.52 C ATOM 0 H PHE A 507 -7.442 -11.992 7.040 1.00 53.44 H new ATOM 0 HA PHE A 507 -7.444 -14.368 5.402 1.00 71.25 H new ATOM 0 HB2 PHE A 507 -9.074 -13.353 7.749 1.00 12.32 H new ATOM 0 HB3 PHE A 507 -9.359 -14.902 6.981 1.00 12.32 H new ATOM 0 HD1 PHE A 507 -7.636 -16.651 7.063 1.00 63.31 H new ATOM 0 HD2 PHE A 507 -7.269 -13.057 9.298 1.00 11.23 H new ATOM 0 HE1 PHE A 507 -5.993 -17.735 8.511 1.00 65.25 H new ATOM 0 HE2 PHE A 507 -5.625 -14.134 10.772 1.00 33.02 H new ATOM 0 HZ PHE A 507 -4.984 -16.483 10.379 1.00 5.52 H new ATOM 108 N GLU A 508 -9.798 -14.192 4.289 1.00 21.32 N ATOM 109 CA GLU A 508 -10.952 -13.901 3.433 1.00 64.24 C ATOM 110 C GLU A 508 -12.138 -13.437 4.280 1.00 53.34 C ATOM 111 O GLU A 508 -12.913 -12.562 3.881 1.00 14.03 O ATOM 112 CB GLU A 508 -11.397 -15.122 2.640 1.00 51.03 C ATOM 113 CG GLU A 508 -10.344 -15.777 1.787 1.00 14.32 C ATOM 114 CD GLU A 508 -10.952 -16.778 0.836 1.00 53.24 C ATOM 115 OE1 GLU A 508 -11.635 -17.745 1.291 1.00 63.02 O ATOM 116 OE2 GLU A 508 -10.787 -16.615 -0.388 1.00 41.21 O ATOM 0 H GLU A 508 -9.494 -15.166 4.285 1.00 21.32 H new ATOM 0 HA GLU A 508 -10.637 -13.119 2.741 1.00 64.24 H new ATOM 0 HB2 GLU A 508 -11.782 -15.864 3.340 1.00 51.03 H new ATOM 0 HB3 GLU A 508 -12.227 -14.830 1.997 1.00 51.03 H new ATOM 0 HG2 GLU A 508 -9.806 -15.016 1.222 1.00 14.32 H new ATOM 0 HG3 GLU A 508 -9.614 -16.275 2.425 1.00 14.32 H new ATOM 123 N GLU A 509 -12.249 -14.011 5.442 1.00 62.21 N ATOM 124 CA GLU A 509 -13.336 -13.763 6.335 1.00 50.13 C ATOM 125 C GLU A 509 -12.793 -13.698 7.745 1.00 32.35 C ATOM 126 O GLU A 509 -11.770 -14.303 8.019 1.00 65.00 O ATOM 127 CB GLU A 509 -14.377 -14.879 6.160 1.00 42.10 C ATOM 128 CG GLU A 509 -13.826 -16.288 6.334 1.00 75.42 C ATOM 129 CD GLU A 509 -14.731 -17.326 5.729 1.00 54.04 C ATOM 130 OE1 GLU A 509 -15.678 -17.769 6.371 1.00 11.45 O ATOM 131 OE2 GLU A 509 -14.506 -17.710 4.563 1.00 53.23 O ATOM 0 H GLU A 509 -11.568 -14.680 5.801 1.00 62.21 H new ATOM 0 HA GLU A 509 -13.826 -12.813 6.121 1.00 50.13 H new ATOM 0 HB2 GLU A 509 -15.181 -14.725 6.880 1.00 42.10 H new ATOM 0 HB3 GLU A 509 -14.818 -14.795 5.167 1.00 42.10 H new ATOM 0 HG2 GLU A 509 -12.841 -16.352 5.871 1.00 75.42 H new ATOM 0 HG3 GLU A 509 -13.694 -16.497 7.396 1.00 75.42 H new ATOM 138 N PRO A 510 -13.409 -12.912 8.631 1.00 61.35 N ATOM 139 CA PRO A 510 -12.956 -12.797 10.017 1.00 34.03 C ATOM 140 C PRO A 510 -13.328 -14.016 10.865 1.00 75.13 C ATOM 141 O PRO A 510 -12.682 -14.301 11.859 1.00 51.42 O ATOM 142 CB PRO A 510 -13.679 -11.548 10.526 1.00 3.20 C ATOM 143 CG PRO A 510 -14.917 -11.469 9.702 1.00 24.30 C ATOM 144 CD PRO A 510 -14.558 -12.023 8.350 1.00 41.30 C ATOM 0 HA PRO A 510 -11.870 -12.735 10.082 1.00 34.03 H new ATOM 0 HB2 PRO A 510 -13.914 -11.631 11.587 1.00 3.20 H new ATOM 0 HB3 PRO A 510 -13.064 -10.656 10.404 1.00 3.20 H new ATOM 0 HG2 PRO A 510 -15.724 -12.044 10.156 1.00 24.30 H new ATOM 0 HG3 PRO A 510 -15.265 -10.439 9.621 1.00 24.30 H new ATOM 0 HD2 PRO A 510 -15.390 -12.571 7.908 1.00 41.30 H new ATOM 0 HD3 PRO A 510 -14.290 -11.231 7.651 1.00 41.30 H new ATOM 152 N VAL A 511 -14.368 -14.726 10.476 1.00 74.23 N ATOM 153 CA VAL A 511 -14.824 -15.880 11.223 1.00 71.24 C ATOM 154 C VAL A 511 -15.034 -17.036 10.265 1.00 53.33 C ATOM 155 O VAL A 511 -15.609 -16.849 9.200 1.00 61.53 O ATOM 156 CB VAL A 511 -16.176 -15.598 11.951 1.00 53.41 C ATOM 157 CG1 VAL A 511 -16.595 -16.775 12.814 1.00 2.11 C ATOM 158 CG2 VAL A 511 -16.132 -14.313 12.770 1.00 2.00 C ATOM 0 H VAL A 511 -14.916 -14.522 9.641 1.00 74.23 H new ATOM 0 HA VAL A 511 -14.067 -16.116 11.971 1.00 71.24 H new ATOM 0 HB VAL A 511 -16.928 -15.461 11.174 1.00 53.41 H new ATOM 0 HG11 VAL A 511 -17.540 -16.547 13.307 1.00 2.11 H new ATOM 0 HG12 VAL A 511 -16.716 -17.660 12.189 1.00 2.11 H new ATOM 0 HG13 VAL A 511 -15.830 -16.965 13.567 1.00 2.11 H new ATOM 0 HG21 VAL A 511 -17.095 -14.159 13.258 1.00 2.00 H new ATOM 0 HG22 VAL A 511 -15.350 -14.390 13.526 1.00 2.00 H new ATOM 0 HG23 VAL A 511 -15.919 -13.470 12.113 1.00 2.00 H new ATOM 168 N THR A 512 -14.584 -18.206 10.637 1.00 64.24 N ATOM 169 CA THR A 512 -14.776 -19.370 9.841 1.00 63.22 C ATOM 170 C THR A 512 -15.224 -20.502 10.771 1.00 11.20 C ATOM 171 O THR A 512 -14.766 -20.600 11.919 1.00 24.45 O ATOM 172 CB THR A 512 -13.473 -19.760 9.048 1.00 41.32 C ATOM 173 OG1 THR A 512 -13.762 -20.738 8.039 1.00 64.14 O ATOM 174 CG2 THR A 512 -12.392 -20.321 9.967 1.00 33.51 C ATOM 0 H THR A 512 -14.074 -18.369 11.505 1.00 64.24 H new ATOM 0 HA THR A 512 -15.539 -19.178 9.087 1.00 63.22 H new ATOM 0 HB THR A 512 -13.106 -18.843 8.587 1.00 41.32 H new ATOM 0 HG1 THR A 512 -12.939 -20.964 7.558 1.00 64.14 H new ATOM 0 HG21 THR A 512 -11.511 -20.577 9.378 1.00 33.51 H new ATOM 0 HG22 THR A 512 -12.125 -19.573 10.714 1.00 33.51 H new ATOM 0 HG23 THR A 512 -12.767 -21.214 10.466 1.00 33.51 H new ATOM 182 N HIS A 513 -16.142 -21.297 10.336 1.00 20.31 N ATOM 183 CA HIS A 513 -16.576 -22.400 11.152 1.00 64.43 C ATOM 184 C HIS A 513 -16.069 -23.687 10.536 1.00 73.54 C ATOM 185 O HIS A 513 -16.050 -23.828 9.304 1.00 13.15 O ATOM 186 CB HIS A 513 -18.116 -22.412 11.351 1.00 43.42 C ATOM 187 CG HIS A 513 -18.936 -22.761 10.136 1.00 4.25 C ATOM 188 ND1 HIS A 513 -19.863 -23.765 10.123 1.00 23.21 N ATOM 189 CD2 HIS A 513 -18.963 -22.217 8.900 1.00 34.22 C ATOM 190 CE1 HIS A 513 -20.410 -23.819 8.917 1.00 34.24 C ATOM 191 NE2 HIS A 513 -19.901 -22.893 8.129 1.00 54.23 N ATOM 0 H HIS A 513 -16.607 -21.213 9.432 1.00 20.31 H new ATOM 0 HA HIS A 513 -16.156 -22.292 12.152 1.00 64.43 H new ATOM 0 HB2 HIS A 513 -18.355 -23.123 12.142 1.00 43.42 H new ATOM 0 HB3 HIS A 513 -18.425 -21.428 11.703 1.00 43.42 H new ATOM 0 HD1 HIS A 513 -20.095 -24.371 10.910 1.00 23.21 H new ATOM 0 HD2 HIS A 513 -18.354 -21.390 8.565 1.00 34.22 H new ATOM 0 HE1 HIS A 513 -21.170 -24.526 8.620 1.00 34.24 H new ATOM 199 N VAL A 514 -15.605 -24.577 11.351 1.00 14.34 N ATOM 200 CA VAL A 514 -15.095 -25.831 10.889 1.00 51.11 C ATOM 201 C VAL A 514 -15.759 -26.946 11.663 1.00 62.31 C ATOM 202 O VAL A 514 -16.262 -26.737 12.776 1.00 4.44 O ATOM 203 CB VAL A 514 -13.533 -25.941 11.010 1.00 24.15 C ATOM 204 CG1 VAL A 514 -12.840 -24.800 10.266 1.00 24.30 C ATOM 205 CG2 VAL A 514 -13.077 -25.993 12.467 1.00 42.51 C ATOM 0 H VAL A 514 -15.568 -24.456 12.363 1.00 14.34 H new ATOM 0 HA VAL A 514 -15.326 -25.911 9.827 1.00 51.11 H new ATOM 0 HB VAL A 514 -13.242 -26.881 10.542 1.00 24.15 H new ATOM 0 HG11 VAL A 514 -11.760 -24.903 10.368 1.00 24.30 H new ATOM 0 HG12 VAL A 514 -13.110 -24.837 9.211 1.00 24.30 H new ATOM 0 HG13 VAL A 514 -13.155 -23.846 10.688 1.00 24.30 H new ATOM 0 HG21 VAL A 514 -11.990 -26.069 12.506 1.00 42.51 H new ATOM 0 HG22 VAL A 514 -13.396 -25.086 12.981 1.00 42.51 H new ATOM 0 HG23 VAL A 514 -13.519 -26.861 12.956 1.00 42.51 H new ATOM 215 N SER A 515 -15.782 -28.093 11.083 1.00 2.13 N ATOM 216 CA SER A 515 -16.373 -29.239 11.691 1.00 35.44 C ATOM 217 C SER A 515 -15.372 -29.880 12.632 1.00 40.41 C ATOM 218 O SER A 515 -14.172 -29.761 12.438 1.00 13.44 O ATOM 219 CB SER A 515 -16.720 -30.234 10.593 1.00 51.11 C ATOM 220 OG SER A 515 -17.392 -31.374 11.082 1.00 75.02 O ATOM 0 H SER A 515 -15.386 -28.268 10.159 1.00 2.13 H new ATOM 0 HA SER A 515 -17.266 -28.952 12.247 1.00 35.44 H new ATOM 0 HB2 SER A 515 -17.344 -29.742 9.847 1.00 51.11 H new ATOM 0 HB3 SER A 515 -15.805 -30.545 10.088 1.00 51.11 H new ATOM 0 HG SER A 515 -17.593 -31.979 10.338 1.00 75.02 H new ATOM 226 N GLU A 516 -15.861 -30.515 13.652 1.00 35.42 N ATOM 227 CA GLU A 516 -15.040 -31.334 14.495 1.00 3.14 C ATOM 228 C GLU A 516 -14.545 -32.555 13.700 1.00 64.53 C ATOM 229 O GLU A 516 -13.414 -32.992 13.855 1.00 2.05 O ATOM 230 CB GLU A 516 -15.861 -31.696 15.747 1.00 22.20 C ATOM 231 CG GLU A 516 -15.448 -32.913 16.547 1.00 12.54 C ATOM 232 CD GLU A 516 -16.157 -34.128 16.021 1.00 21.13 C ATOM 233 OE1 GLU A 516 -17.399 -34.120 16.009 1.00 10.12 O ATOM 234 OE2 GLU A 516 -15.502 -35.063 15.534 1.00 54.14 O ATOM 0 H GLU A 516 -16.843 -30.481 13.926 1.00 35.42 H new ATOM 0 HA GLU A 516 -14.144 -30.811 14.829 1.00 3.14 H new ATOM 0 HB2 GLU A 516 -15.844 -30.836 16.417 1.00 22.20 H new ATOM 0 HB3 GLU A 516 -16.896 -31.837 15.437 1.00 22.20 H new ATOM 0 HG2 GLU A 516 -14.369 -33.053 16.483 1.00 12.54 H new ATOM 0 HG3 GLU A 516 -15.689 -32.767 17.600 1.00 12.54 H new ATOM 241 N SER A 517 -15.367 -33.021 12.778 1.00 0.34 N ATOM 242 CA SER A 517 -15.076 -34.210 12.014 1.00 3.30 C ATOM 243 C SER A 517 -14.506 -33.877 10.609 1.00 65.41 C ATOM 244 O SER A 517 -14.538 -34.715 9.722 1.00 53.23 O ATOM 245 CB SER A 517 -16.369 -35.012 11.875 1.00 24.13 C ATOM 246 OG SER A 517 -16.981 -35.222 13.146 1.00 14.42 O ATOM 0 H SER A 517 -16.256 -32.581 12.541 1.00 0.34 H new ATOM 0 HA SER A 517 -14.313 -34.786 12.537 1.00 3.30 H new ATOM 0 HB2 SER A 517 -17.060 -34.483 11.218 1.00 24.13 H new ATOM 0 HB3 SER A 517 -16.156 -35.973 11.407 1.00 24.13 H new ATOM 0 HG SER A 517 -16.289 -35.270 13.838 1.00 14.42 H new ATOM 252 N ILE A 518 -13.968 -32.673 10.412 1.00 51.35 N ATOM 253 CA ILE A 518 -13.430 -32.308 9.085 1.00 53.15 C ATOM 254 C ILE A 518 -12.029 -32.913 8.856 1.00 53.25 C ATOM 255 O ILE A 518 -11.625 -33.189 7.716 1.00 1.23 O ATOM 256 CB ILE A 518 -13.394 -30.755 8.860 1.00 55.34 C ATOM 257 CG1 ILE A 518 -12.855 -30.396 7.473 1.00 74.21 C ATOM 258 CG2 ILE A 518 -12.587 -30.056 9.932 1.00 41.02 C ATOM 259 CD1 ILE A 518 -12.794 -28.912 7.212 1.00 51.52 C ATOM 0 H ILE A 518 -13.890 -31.948 11.125 1.00 51.35 H new ATOM 0 HA ILE A 518 -14.116 -32.732 8.351 1.00 53.15 H new ATOM 0 HB ILE A 518 -14.424 -30.405 8.925 1.00 55.34 H new ATOM 0 HG12 ILE A 518 -11.856 -30.817 7.361 1.00 74.21 H new ATOM 0 HG13 ILE A 518 -13.485 -30.864 6.716 1.00 74.21 H new ATOM 0 HG21 ILE A 518 -12.584 -28.982 9.743 1.00 41.02 H new ATOM 0 HG22 ILE A 518 -13.031 -30.252 10.908 1.00 41.02 H new ATOM 0 HG23 ILE A 518 -11.563 -30.429 9.918 1.00 41.02 H new ATOM 0 HD11 ILE A 518 -12.402 -28.735 6.210 1.00 51.52 H new ATOM 0 HD12 ILE A 518 -13.795 -28.487 7.291 1.00 51.52 H new ATOM 0 HD13 ILE A 518 -12.141 -28.440 7.946 1.00 51.52 H new ATOM 271 N GLY A 519 -11.310 -33.134 9.928 1.00 40.43 N ATOM 272 CA GLY A 519 -9.975 -33.647 9.811 1.00 51.23 C ATOM 273 C GLY A 519 -8.970 -32.541 9.759 1.00 40.10 C ATOM 274 O GLY A 519 -8.336 -32.214 10.762 1.00 32.54 O ATOM 0 H GLY A 519 -11.627 -32.967 10.883 1.00 40.43 H new ATOM 0 HA2 GLY A 519 -9.758 -34.299 10.657 1.00 51.23 H new ATOM 0 HA3 GLY A 519 -9.895 -34.256 8.911 1.00 51.23 H new ATOM 278 N ILE A 520 -8.870 -31.920 8.622 1.00 72.32 N ATOM 279 CA ILE A 520 -7.926 -30.859 8.410 1.00 34.43 C ATOM 280 C ILE A 520 -8.687 -29.720 7.800 1.00 33.25 C ATOM 281 O ILE A 520 -9.339 -29.898 6.768 1.00 25.32 O ATOM 282 CB ILE A 520 -6.804 -31.258 7.404 1.00 71.35 C ATOM 283 CG1 ILE A 520 -6.024 -32.521 7.831 1.00 10.21 C ATOM 284 CG2 ILE A 520 -5.843 -30.088 7.162 1.00 72.23 C ATOM 285 CD1 ILE A 520 -5.231 -32.382 9.109 1.00 10.52 C ATOM 0 H ILE A 520 -9.445 -32.136 7.808 1.00 72.32 H new ATOM 0 HA ILE A 520 -7.457 -30.611 9.362 1.00 34.43 H new ATOM 0 HB ILE A 520 -7.308 -31.504 6.469 1.00 71.35 H new ATOM 0 HG12 ILE A 520 -6.730 -33.343 7.947 1.00 10.21 H new ATOM 0 HG13 ILE A 520 -5.342 -32.797 7.027 1.00 10.21 H new ATOM 0 HG21 ILE A 520 -5.070 -30.392 6.457 1.00 72.23 H new ATOM 0 HG22 ILE A 520 -6.395 -29.242 6.752 1.00 72.23 H new ATOM 0 HG23 ILE A 520 -5.380 -29.797 8.105 1.00 72.23 H new ATOM 0 HD11 ILE A 520 -4.720 -33.320 9.324 1.00 10.52 H new ATOM 0 HD12 ILE A 520 -4.496 -31.585 8.996 1.00 10.52 H new ATOM 0 HD13 ILE A 520 -5.905 -32.140 9.931 1.00 10.52 H new ATOM 297 N MET A 521 -8.642 -28.589 8.411 1.00 22.44 N ATOM 298 CA MET A 521 -9.311 -27.445 7.861 1.00 74.22 C ATOM 299 C MET A 521 -8.293 -26.566 7.186 1.00 64.43 C ATOM 300 O MET A 521 -7.119 -26.591 7.568 1.00 21.51 O ATOM 301 CB MET A 521 -10.112 -26.689 8.945 1.00 61.34 C ATOM 302 CG MET A 521 -9.316 -25.930 10.020 1.00 70.35 C ATOM 303 SD MET A 521 -8.660 -24.349 9.433 1.00 22.30 S ATOM 304 CE MET A 521 -8.263 -23.529 10.969 1.00 64.12 C ATOM 0 H MET A 521 -8.152 -28.423 9.290 1.00 22.44 H new ATOM 0 HA MET A 521 -10.040 -27.767 7.118 1.00 74.22 H new ATOM 0 HB2 MET A 521 -10.764 -25.974 8.443 1.00 61.34 H new ATOM 0 HB3 MET A 521 -10.756 -27.409 9.450 1.00 61.34 H new ATOM 0 HG2 MET A 521 -9.959 -25.752 10.882 1.00 70.35 H new ATOM 0 HG3 MET A 521 -8.491 -26.555 10.361 1.00 70.35 H new ATOM 0 HE1 MET A 521 -8.873 -22.631 11.070 1.00 64.12 H new ATOM 0 HE2 MET A 521 -8.465 -24.201 11.803 1.00 64.12 H new ATOM 0 HE3 MET A 521 -7.208 -23.254 10.972 1.00 64.12 H new ATOM 314 N GLU A 522 -8.713 -25.850 6.169 1.00 52.43 N ATOM 315 CA GLU A 522 -7.863 -24.927 5.469 1.00 45.31 C ATOM 316 C GLU A 522 -8.538 -23.608 5.289 1.00 41.45 C ATOM 317 O GLU A 522 -9.685 -23.541 4.848 1.00 42.40 O ATOM 318 CB GLU A 522 -7.402 -25.471 4.130 1.00 1.32 C ATOM 319 CG GLU A 522 -6.233 -26.411 4.231 1.00 73.23 C ATOM 320 CD GLU A 522 -5.860 -26.999 2.918 1.00 73.11 C ATOM 321 OE1 GLU A 522 -5.030 -26.401 2.210 1.00 31.31 O ATOM 322 OE2 GLU A 522 -6.387 -28.084 2.566 1.00 62.52 O ATOM 0 H GLU A 522 -9.664 -25.895 5.804 1.00 52.43 H new ATOM 0 HA GLU A 522 -6.976 -24.786 6.087 1.00 45.31 H new ATOM 0 HB2 GLU A 522 -8.234 -25.989 3.652 1.00 1.32 H new ATOM 0 HB3 GLU A 522 -7.132 -24.637 3.482 1.00 1.32 H new ATOM 0 HG2 GLU A 522 -5.376 -25.877 4.643 1.00 73.23 H new ATOM 0 HG3 GLU A 522 -6.475 -27.213 4.929 1.00 73.23 H new ATOM 329 N VAL A 523 -7.846 -22.576 5.662 1.00 2.43 N ATOM 330 CA VAL A 523 -8.328 -21.225 5.524 1.00 40.24 C ATOM 331 C VAL A 523 -7.425 -20.475 4.565 1.00 54.20 C ATOM 332 O VAL A 523 -6.197 -20.535 4.691 1.00 40.54 O ATOM 333 CB VAL A 523 -8.360 -20.511 6.887 1.00 41.32 C ATOM 334 CG1 VAL A 523 -8.873 -19.085 6.741 1.00 22.12 C ATOM 335 CG2 VAL A 523 -9.231 -21.294 7.855 1.00 4.31 C ATOM 0 H VAL A 523 -6.917 -22.643 6.077 1.00 2.43 H new ATOM 0 HA VAL A 523 -9.346 -21.249 5.134 1.00 40.24 H new ATOM 0 HB VAL A 523 -7.345 -20.462 7.280 1.00 41.32 H new ATOM 0 HG11 VAL A 523 -8.886 -18.601 7.718 1.00 22.12 H new ATOM 0 HG12 VAL A 523 -8.218 -18.530 6.070 1.00 22.12 H new ATOM 0 HG13 VAL A 523 -9.883 -19.102 6.331 1.00 22.12 H new ATOM 0 HG21 VAL A 523 -9.251 -20.786 8.819 1.00 4.31 H new ATOM 0 HG22 VAL A 523 -10.244 -21.362 7.459 1.00 4.31 H new ATOM 0 HG23 VAL A 523 -8.823 -22.297 7.982 1.00 4.31 H new ATOM 345 N LYS A 524 -8.033 -19.795 3.628 1.00 1.11 N ATOM 346 CA LYS A 524 -7.350 -19.071 2.576 1.00 30.42 C ATOM 347 C LYS A 524 -6.965 -17.667 3.061 1.00 21.55 C ATOM 348 O LYS A 524 -7.804 -16.921 3.597 1.00 71.34 O ATOM 349 CB LYS A 524 -8.298 -18.968 1.378 1.00 52.45 C ATOM 350 CG LYS A 524 -8.792 -20.318 0.857 1.00 33.35 C ATOM 351 CD LYS A 524 -7.936 -20.883 -0.269 1.00 64.15 C ATOM 352 CE LYS A 524 -8.308 -20.269 -1.608 1.00 64.32 C ATOM 353 NZ LYS A 524 -7.607 -20.930 -2.727 1.00 64.03 N ATOM 0 H LYS A 524 -9.049 -19.725 3.570 1.00 1.11 H new ATOM 0 HA LYS A 524 -6.437 -19.595 2.293 1.00 30.42 H new ATOM 0 HB2 LYS A 524 -9.159 -18.362 1.660 1.00 52.45 H new ATOM 0 HB3 LYS A 524 -7.790 -18.442 0.570 1.00 52.45 H new ATOM 0 HG2 LYS A 524 -8.812 -21.031 1.681 1.00 33.35 H new ATOM 0 HG3 LYS A 524 -9.818 -20.209 0.504 1.00 33.35 H new ATOM 0 HD2 LYS A 524 -6.884 -20.692 -0.059 1.00 64.15 H new ATOM 0 HD3 LYS A 524 -8.061 -21.965 -0.316 1.00 64.15 H new ATOM 0 HE2 LYS A 524 -9.385 -20.347 -1.757 1.00 64.32 H new ATOM 0 HE3 LYS A 524 -8.063 -19.207 -1.602 1.00 64.32 H new ATOM 0 HZ1 LYS A 524 -7.562 -20.282 -3.539 1.00 64.03 H new ATOM 0 HZ2 LYS A 524 -6.642 -21.182 -2.432 1.00 64.03 H new ATOM 0 HZ3 LYS A 524 -8.122 -21.791 -2.999 1.00 64.03 H new ATOM 367 N VAL A 525 -5.711 -17.332 2.902 1.00 0.45 N ATOM 368 CA VAL A 525 -5.193 -16.025 3.283 1.00 51.40 C ATOM 369 C VAL A 525 -4.839 -15.237 2.042 1.00 10.40 C ATOM 370 O VAL A 525 -4.093 -15.714 1.181 1.00 13.41 O ATOM 371 CB VAL A 525 -3.958 -16.137 4.200 1.00 72.22 C ATOM 372 CG1 VAL A 525 -3.437 -14.762 4.618 1.00 51.32 C ATOM 373 CG2 VAL A 525 -4.303 -16.944 5.415 1.00 3.45 C ATOM 0 H VAL A 525 -5.009 -17.955 2.503 1.00 0.45 H new ATOM 0 HA VAL A 525 -5.973 -15.510 3.843 1.00 51.40 H new ATOM 0 HB VAL A 525 -3.167 -16.634 3.639 1.00 72.22 H new ATOM 0 HG11 VAL A 525 -2.567 -14.883 5.263 1.00 51.32 H new ATOM 0 HG12 VAL A 525 -3.155 -14.195 3.731 1.00 51.32 H new ATOM 0 HG13 VAL A 525 -4.217 -14.226 5.158 1.00 51.32 H new ATOM 0 HG21 VAL A 525 -3.428 -17.021 6.061 1.00 3.45 H new ATOM 0 HG22 VAL A 525 -5.113 -16.456 5.958 1.00 3.45 H new ATOM 0 HG23 VAL A 525 -4.619 -17.942 5.111 1.00 3.45 H new ATOM 383 N LEU A 526 -5.347 -14.044 1.986 1.00 0.23 N ATOM 384 CA LEU A 526 -5.239 -13.180 0.843 1.00 1.13 C ATOM 385 C LEU A 526 -3.895 -12.445 0.803 1.00 13.24 C ATOM 386 O LEU A 526 -3.477 -11.827 1.799 1.00 3.33 O ATOM 387 CB LEU A 526 -6.386 -12.160 0.903 1.00 62.42 C ATOM 388 CG LEU A 526 -7.813 -12.740 0.934 1.00 41.44 C ATOM 389 CD1 LEU A 526 -8.834 -11.635 1.135 1.00 0.21 C ATOM 390 CD2 LEU A 526 -8.105 -13.505 -0.345 1.00 34.12 C ATOM 0 H LEU A 526 -5.866 -13.628 2.759 1.00 0.23 H new ATOM 0 HA LEU A 526 -5.301 -13.786 -0.061 1.00 1.13 H new ATOM 0 HB2 LEU A 526 -6.248 -11.542 1.790 1.00 62.42 H new ATOM 0 HB3 LEU A 526 -6.303 -11.501 0.039 1.00 62.42 H new ATOM 0 HG LEU A 526 -7.884 -13.431 1.774 1.00 41.44 H new ATOM 0 HD11 LEU A 526 -9.836 -12.064 1.154 1.00 0.21 H new ATOM 0 HD12 LEU A 526 -8.639 -11.127 2.079 1.00 0.21 H new ATOM 0 HD13 LEU A 526 -8.762 -10.919 0.316 1.00 0.21 H new ATOM 0 HD21 LEU A 526 -9.117 -13.907 -0.305 1.00 34.12 H new ATOM 0 HD22 LEU A 526 -8.015 -12.834 -1.199 1.00 34.12 H new ATOM 0 HD23 LEU A 526 -7.393 -14.324 -0.450 1.00 34.12 H new ATOM 402 N ARG A 527 -3.215 -12.541 -0.339 1.00 43.41 N ATOM 403 CA ARG A 527 -1.997 -11.775 -0.611 1.00 12.42 C ATOM 404 C ARG A 527 -2.389 -10.305 -0.839 1.00 43.25 C ATOM 405 O ARG A 527 -3.561 -10.002 -1.095 1.00 33.03 O ATOM 406 CB ARG A 527 -1.283 -12.338 -1.892 1.00 41.31 C ATOM 407 CG ARG A 527 -0.072 -11.532 -2.414 1.00 52.33 C ATOM 408 CD ARG A 527 1.158 -11.635 -1.518 1.00 54.12 C ATOM 409 NE ARG A 527 2.013 -10.418 -1.601 1.00 24.33 N ATOM 410 CZ ARG A 527 3.360 -10.374 -1.655 1.00 74.31 C ATOM 411 NH1 ARG A 527 4.063 -11.465 -1.899 1.00 63.25 N ATOM 412 NH2 ARG A 527 3.991 -9.206 -1.521 1.00 35.20 N ATOM 0 H ARG A 527 -3.494 -13.154 -1.105 1.00 43.41 H new ATOM 0 HA ARG A 527 -1.312 -11.855 0.233 1.00 12.42 H new ATOM 0 HB2 ARG A 527 -0.951 -13.354 -1.679 1.00 41.31 H new ATOM 0 HB3 ARG A 527 -2.020 -12.404 -2.692 1.00 41.31 H new ATOM 0 HG2 ARG A 527 0.185 -11.884 -3.413 1.00 52.33 H new ATOM 0 HG3 ARG A 527 -0.356 -10.484 -2.509 1.00 52.33 H new ATOM 0 HD2 ARG A 527 0.843 -11.787 -0.486 1.00 54.12 H new ATOM 0 HD3 ARG A 527 1.743 -12.509 -1.804 1.00 54.12 H new ATOM 0 HE ARG A 527 1.527 -9.521 -1.619 1.00 24.33 H new ATOM 0 HH11 ARG A 527 3.588 -12.355 -2.049 1.00 63.25 H new ATOM 0 HH12 ARG A 527 5.081 -11.418 -1.937 1.00 63.25 H new ATOM 0 HH21 ARG A 527 3.455 -8.350 -1.378 1.00 35.20 H new ATOM 0 HH22 ARG A 527 5.010 -9.169 -1.561 1.00 35.20 H new ATOM 426 N THR A 528 -1.422 -9.423 -0.737 1.00 41.43 N ATOM 427 CA THR A 528 -1.592 -8.031 -1.011 1.00 3.51 C ATOM 428 C THR A 528 -2.074 -7.773 -2.447 1.00 24.22 C ATOM 429 O THR A 528 -1.869 -8.604 -3.352 1.00 31.22 O ATOM 430 CB THR A 528 -0.263 -7.301 -0.767 1.00 71.30 C ATOM 431 OG1 THR A 528 0.817 -8.000 -1.409 1.00 24.52 O ATOM 432 CG2 THR A 528 0.024 -7.181 0.706 1.00 1.53 C ATOM 0 H THR A 528 -0.474 -9.669 -0.453 1.00 41.43 H new ATOM 0 HA THR A 528 -2.362 -7.651 -0.340 1.00 3.51 H new ATOM 0 HB THR A 528 -0.350 -6.300 -1.190 1.00 71.30 H new ATOM 0 HG1 THR A 528 1.228 -7.419 -2.083 1.00 24.52 H new ATOM 0 HG21 THR A 528 0.971 -6.660 0.851 1.00 1.53 H new ATOM 0 HG22 THR A 528 -0.776 -6.620 1.188 1.00 1.53 H new ATOM 0 HG23 THR A 528 0.086 -8.176 1.147 1.00 1.53 H new ATOM 440 N SER A 529 -2.740 -6.639 -2.616 1.00 2.33 N ATOM 441 CA SER A 529 -3.219 -6.145 -3.888 1.00 24.51 C ATOM 442 C SER A 529 -2.050 -6.088 -4.891 1.00 61.04 C ATOM 443 O SER A 529 -2.210 -6.357 -6.090 1.00 43.34 O ATOM 444 CB SER A 529 -3.845 -4.748 -3.644 1.00 62.32 C ATOM 445 OG SER A 529 -4.380 -4.175 -4.830 1.00 1.43 O ATOM 0 H SER A 529 -2.967 -6.019 -1.839 1.00 2.33 H new ATOM 0 HA SER A 529 -3.976 -6.803 -4.314 1.00 24.51 H new ATOM 0 HB2 SER A 529 -4.635 -4.833 -2.897 1.00 62.32 H new ATOM 0 HB3 SER A 529 -3.087 -4.081 -3.232 1.00 62.32 H new ATOM 0 HG SER A 529 -4.764 -3.297 -4.625 1.00 1.43 H new ATOM 451 N GLY A 530 -0.887 -5.766 -4.377 1.00 21.12 N ATOM 452 CA GLY A 530 0.300 -5.783 -5.156 1.00 54.51 C ATOM 453 C GLY A 530 1.215 -6.843 -4.621 1.00 1.22 C ATOM 454 O GLY A 530 1.799 -6.683 -3.541 1.00 33.04 O ATOM 0 H GLY A 530 -0.751 -5.487 -3.406 1.00 21.12 H new ATOM 0 HA2 GLY A 530 0.063 -5.982 -6.201 1.00 54.51 H new ATOM 0 HA3 GLY A 530 0.789 -4.809 -5.120 1.00 54.51 H new ATOM 458 N ALA A 531 1.291 -7.949 -5.300 1.00 70.33 N ATOM 459 CA ALA A 531 2.149 -9.022 -4.877 1.00 45.11 C ATOM 460 C ALA A 531 3.530 -8.790 -5.414 1.00 20.03 C ATOM 461 O ALA A 531 3.784 -8.975 -6.605 1.00 64.44 O ATOM 462 CB ALA A 531 1.618 -10.369 -5.332 1.00 33.01 C ATOM 0 H ALA A 531 0.767 -8.135 -6.155 1.00 70.33 H new ATOM 0 HA ALA A 531 2.179 -9.038 -3.788 1.00 45.11 H new ATOM 0 HB1 ALA A 531 2.291 -11.158 -4.995 1.00 33.01 H new ATOM 0 HB2 ALA A 531 0.627 -10.532 -4.908 1.00 33.01 H new ATOM 0 HB3 ALA A 531 1.554 -10.386 -6.420 1.00 33.01 H new ATOM 468 N ARG A 532 4.400 -8.312 -4.563 1.00 15.13 N ATOM 469 CA ARG A 532 5.755 -8.032 -4.941 1.00 10.24 C ATOM 470 C ARG A 532 6.683 -8.733 -3.979 1.00 5.33 C ATOM 471 O ARG A 532 6.620 -8.498 -2.761 1.00 64.44 O ATOM 472 CB ARG A 532 6.040 -6.512 -4.909 1.00 42.40 C ATOM 473 CG ARG A 532 5.053 -5.653 -5.693 1.00 43.11 C ATOM 474 CD ARG A 532 5.022 -5.998 -7.172 1.00 21.03 C ATOM 475 NE ARG A 532 3.934 -5.296 -7.858 1.00 54.41 N ATOM 476 CZ ARG A 532 3.223 -5.788 -8.882 1.00 3.32 C ATOM 477 NH1 ARG A 532 3.566 -6.947 -9.444 1.00 33.54 N ATOM 478 NH2 ARG A 532 2.190 -5.099 -9.357 1.00 14.25 N ATOM 0 H ARG A 532 4.186 -8.107 -3.587 1.00 15.13 H new ATOM 0 HA ARG A 532 5.916 -8.389 -5.958 1.00 10.24 H new ATOM 0 HB2 ARG A 532 6.042 -6.180 -3.871 1.00 42.40 H new ATOM 0 HB3 ARG A 532 7.042 -6.337 -5.302 1.00 42.40 H new ATOM 0 HG2 ARG A 532 4.055 -5.779 -5.274 1.00 43.11 H new ATOM 0 HG3 ARG A 532 5.318 -4.602 -5.575 1.00 43.11 H new ATOM 0 HD2 ARG A 532 5.975 -5.733 -7.630 1.00 21.03 H new ATOM 0 HD3 ARG A 532 4.898 -7.074 -7.294 1.00 21.03 H new ATOM 0 HE ARG A 532 3.699 -4.359 -7.530 1.00 54.41 H new ATOM 0 HH11 ARG A 532 4.373 -7.464 -9.095 1.00 33.54 H new ATOM 0 HH12 ARG A 532 3.021 -7.317 -10.223 1.00 33.54 H new ATOM 0 HH21 ARG A 532 1.942 -4.201 -8.942 1.00 14.25 H new ATOM 0 HH22 ARG A 532 1.645 -5.469 -10.136 1.00 14.25 H new ATOM 492 N GLY A 533 7.464 -9.628 -4.502 1.00 33.44 N ATOM 493 CA GLY A 533 8.498 -10.282 -3.740 1.00 63.01 C ATOM 494 C GLY A 533 8.015 -11.368 -2.809 1.00 4.51 C ATOM 495 O GLY A 533 6.793 -11.569 -2.609 1.00 43.33 O ATOM 0 H GLY A 533 7.406 -9.931 -5.474 1.00 33.44 H new ATOM 0 HA2 GLY A 533 9.221 -10.713 -4.432 1.00 63.01 H new ATOM 0 HA3 GLY A 533 9.027 -9.530 -3.154 1.00 63.01 H new ATOM 499 N ASN A 534 8.967 -12.063 -2.247 1.00 1.52 N ATOM 500 CA ASN A 534 8.722 -13.136 -1.330 1.00 34.42 C ATOM 501 C ASN A 534 8.571 -12.573 0.060 1.00 25.14 C ATOM 502 O ASN A 534 9.443 -11.853 0.569 1.00 51.32 O ATOM 503 CB ASN A 534 9.849 -14.171 -1.387 1.00 1.22 C ATOM 504 CG ASN A 534 9.631 -15.373 -0.474 1.00 72.52 C ATOM 505 OD1 ASN A 534 10.574 -15.967 0.014 1.00 15.13 O ATOM 506 ND2 ASN A 534 8.400 -15.757 -0.253 1.00 44.04 N ATOM 0 H ASN A 534 9.958 -11.892 -2.420 1.00 1.52 H new ATOM 0 HA ASN A 534 7.800 -13.646 -1.610 1.00 34.42 H new ATOM 0 HB2 ASN A 534 9.956 -14.522 -2.414 1.00 1.22 H new ATOM 0 HB3 ASN A 534 10.787 -13.687 -1.116 1.00 1.22 H new ATOM 0 HD21 ASN A 534 8.217 -16.568 0.338 1.00 44.04 H new ATOM 0 HD22 ASN A 534 7.623 -15.245 -0.672 1.00 44.04 H new ATOM 513 N VAL A 535 7.458 -12.866 0.645 1.00 33.11 N ATOM 514 CA VAL A 535 7.088 -12.364 1.923 1.00 72.13 C ATOM 515 C VAL A 535 6.604 -13.520 2.761 1.00 62.42 C ATOM 516 O VAL A 535 5.823 -14.352 2.291 1.00 32.14 O ATOM 517 CB VAL A 535 5.942 -11.319 1.775 1.00 14.43 C ATOM 518 CG1 VAL A 535 5.510 -10.731 3.105 1.00 25.41 C ATOM 519 CG2 VAL A 535 6.343 -10.228 0.815 1.00 64.31 C ATOM 0 H VAL A 535 6.758 -13.482 0.231 1.00 33.11 H new ATOM 0 HA VAL A 535 7.944 -11.881 2.394 1.00 72.13 H new ATOM 0 HB VAL A 535 5.079 -11.849 1.372 1.00 14.43 H new ATOM 0 HG11 VAL A 535 4.710 -10.010 2.941 1.00 25.41 H new ATOM 0 HG12 VAL A 535 5.152 -11.528 3.756 1.00 25.41 H new ATOM 0 HG13 VAL A 535 6.358 -10.232 3.575 1.00 25.41 H new ATOM 0 HG21 VAL A 535 5.531 -9.507 0.724 1.00 64.31 H new ATOM 0 HG22 VAL A 535 7.235 -9.725 1.188 1.00 64.31 H new ATOM 0 HG23 VAL A 535 6.554 -10.663 -0.162 1.00 64.31 H new ATOM 529 N ILE A 536 7.077 -13.594 3.955 1.00 25.22 N ATOM 530 CA ILE A 536 6.655 -14.618 4.848 1.00 2.12 C ATOM 531 C ILE A 536 5.674 -14.043 5.842 1.00 24.04 C ATOM 532 O ILE A 536 5.895 -12.954 6.396 1.00 60.45 O ATOM 533 CB ILE A 536 7.839 -15.281 5.596 1.00 71.21 C ATOM 534 CG1 ILE A 536 8.794 -15.988 4.617 1.00 32.22 C ATOM 535 CG2 ILE A 536 7.327 -16.254 6.636 1.00 70.35 C ATOM 536 CD1 ILE A 536 8.145 -17.058 3.764 1.00 0.22 C ATOM 0 H ILE A 536 7.766 -12.949 4.341 1.00 25.22 H new ATOM 0 HA ILE A 536 6.179 -15.397 4.253 1.00 2.12 H new ATOM 0 HB ILE A 536 8.401 -14.495 6.099 1.00 71.21 H new ATOM 0 HG12 ILE A 536 9.240 -15.240 3.961 1.00 32.22 H new ATOM 0 HG13 ILE A 536 9.607 -16.439 5.185 1.00 32.22 H new ATOM 0 HG21 ILE A 536 8.171 -16.711 7.153 1.00 70.35 H new ATOM 0 HG22 ILE A 536 6.705 -15.723 7.356 1.00 70.35 H new ATOM 0 HG23 ILE A 536 6.736 -17.030 6.149 1.00 70.35 H new ATOM 0 HD11 ILE A 536 8.892 -17.501 3.106 1.00 0.22 H new ATOM 0 HD12 ILE A 536 7.724 -17.831 4.407 1.00 0.22 H new ATOM 0 HD13 ILE A 536 7.351 -16.613 3.164 1.00 0.22 H new ATOM 548 N VAL A 537 4.584 -14.730 6.022 1.00 21.53 N ATOM 549 CA VAL A 537 3.593 -14.340 6.972 1.00 41.34 C ATOM 550 C VAL A 537 3.435 -15.455 8.001 1.00 44.40 C ATOM 551 O VAL A 537 2.910 -16.527 7.685 1.00 75.14 O ATOM 552 CB VAL A 537 2.230 -14.040 6.299 1.00 31.42 C ATOM 553 CG1 VAL A 537 1.219 -13.529 7.315 1.00 64.22 C ATOM 554 CG2 VAL A 537 2.409 -13.038 5.177 1.00 44.42 C ATOM 0 H VAL A 537 4.359 -15.582 5.508 1.00 21.53 H new ATOM 0 HA VAL A 537 3.921 -13.420 7.455 1.00 41.34 H new ATOM 0 HB VAL A 537 1.844 -14.970 5.881 1.00 31.42 H new ATOM 0 HG11 VAL A 537 0.272 -13.327 6.815 1.00 64.22 H new ATOM 0 HG12 VAL A 537 1.068 -14.282 8.088 1.00 64.22 H new ATOM 0 HG13 VAL A 537 1.592 -12.612 7.770 1.00 64.22 H new ATOM 0 HG21 VAL A 537 1.444 -12.836 4.712 1.00 44.42 H new ATOM 0 HG22 VAL A 537 2.820 -12.112 5.579 1.00 44.42 H new ATOM 0 HG23 VAL A 537 3.092 -13.445 4.432 1.00 44.42 H new ATOM 564 N PRO A 538 3.952 -15.256 9.214 1.00 53.43 N ATOM 565 CA PRO A 538 3.841 -16.246 10.276 1.00 3.54 C ATOM 566 C PRO A 538 2.426 -16.323 10.826 1.00 61.12 C ATOM 567 O PRO A 538 1.679 -15.354 10.775 1.00 41.24 O ATOM 568 CB PRO A 538 4.790 -15.740 11.359 1.00 11.43 C ATOM 569 CG PRO A 538 4.949 -14.277 11.107 1.00 2.04 C ATOM 570 CD PRO A 538 4.687 -14.049 9.646 1.00 71.12 C ATOM 0 HA PRO A 538 4.084 -17.247 9.920 1.00 3.54 H new ATOM 0 HB2 PRO A 538 4.383 -15.924 12.353 1.00 11.43 H new ATOM 0 HB3 PRO A 538 5.751 -16.253 11.308 1.00 11.43 H new ATOM 0 HG2 PRO A 538 4.252 -13.703 11.717 1.00 2.04 H new ATOM 0 HG3 PRO A 538 5.953 -13.947 11.374 1.00 2.04 H new ATOM 0 HD2 PRO A 538 4.099 -13.146 9.484 1.00 71.12 H new ATOM 0 HD3 PRO A 538 5.616 -13.929 9.089 1.00 71.12 H new ATOM 578 N TYR A 539 2.050 -17.461 11.326 1.00 72.31 N ATOM 579 CA TYR A 539 0.745 -17.604 11.912 1.00 32.52 C ATOM 580 C TYR A 539 0.815 -18.498 13.115 1.00 11.51 C ATOM 581 O TYR A 539 1.799 -19.241 13.292 1.00 72.12 O ATOM 582 CB TYR A 539 -0.294 -18.134 10.902 1.00 64.40 C ATOM 583 CG TYR A 539 -0.173 -19.600 10.497 1.00 41.45 C ATOM 584 CD1 TYR A 539 -0.764 -20.603 11.264 1.00 13.43 C ATOM 585 CD2 TYR A 539 0.486 -19.973 9.339 1.00 71.04 C ATOM 586 CE1 TYR A 539 -0.702 -21.921 10.888 1.00 41.24 C ATOM 587 CE2 TYR A 539 0.557 -21.301 8.958 1.00 63.45 C ATOM 588 CZ TYR A 539 -0.043 -22.270 9.740 1.00 42.12 C ATOM 589 OH TYR A 539 -0.008 -23.586 9.358 1.00 41.20 O ATOM 0 H TYR A 539 2.624 -18.304 11.342 1.00 72.31 H new ATOM 0 HA TYR A 539 0.413 -16.612 12.220 1.00 32.52 H new ATOM 0 HB2 TYR A 539 -1.287 -17.979 11.323 1.00 64.40 H new ATOM 0 HB3 TYR A 539 -0.232 -17.526 10.000 1.00 64.40 H new ATOM 0 HD1 TYR A 539 -1.282 -20.337 12.174 1.00 13.43 H new ATOM 0 HD2 TYR A 539 0.951 -19.217 8.724 1.00 71.04 H new ATOM 0 HE1 TYR A 539 -1.171 -22.681 11.496 1.00 41.24 H new ATOM 0 HE2 TYR A 539 1.079 -21.579 8.054 1.00 63.45 H new ATOM 0 HH TYR A 539 0.496 -23.671 8.522 1.00 41.20 H new ATOM 599 N LYS A 540 -0.209 -18.439 13.924 1.00 64.13 N ATOM 600 CA LYS A 540 -0.308 -19.265 15.112 1.00 31.20 C ATOM 601 C LYS A 540 -1.763 -19.480 15.474 1.00 11.11 C ATOM 602 O LYS A 540 -2.626 -18.637 15.142 1.00 44.13 O ATOM 603 CB LYS A 540 0.411 -18.614 16.302 1.00 24.43 C ATOM 604 CG LYS A 540 -0.174 -17.276 16.708 1.00 75.24 C ATOM 605 CD LYS A 540 0.392 -16.793 18.018 1.00 10.10 C ATOM 606 CE LYS A 540 -0.274 -15.500 18.442 1.00 13.21 C ATOM 607 NZ LYS A 540 0.118 -14.358 17.590 1.00 13.45 N ATOM 0 H LYS A 540 -1.004 -17.816 13.783 1.00 64.13 H new ATOM 0 HA LYS A 540 0.168 -20.221 14.893 1.00 31.20 H new ATOM 0 HB2 LYS A 540 0.371 -19.292 17.155 1.00 24.43 H new ATOM 0 HB3 LYS A 540 1.463 -18.480 16.050 1.00 24.43 H new ATOM 0 HG2 LYS A 540 0.029 -16.539 15.931 1.00 75.24 H new ATOM 0 HG3 LYS A 540 -1.257 -17.363 16.790 1.00 75.24 H new ATOM 0 HD2 LYS A 540 0.246 -17.553 18.786 1.00 10.10 H new ATOM 0 HD3 LYS A 540 1.467 -16.640 17.922 1.00 10.10 H new ATOM 0 HE2 LYS A 540 -1.356 -15.623 18.405 1.00 13.21 H new ATOM 0 HE3 LYS A 540 -0.013 -15.283 19.478 1.00 13.21 H new ATOM 0 HZ1 LYS A 540 0.761 -13.735 18.119 1.00 13.45 H new ATOM 0 HZ2 LYS A 540 0.600 -14.710 16.738 1.00 13.45 H new ATOM 0 HZ3 LYS A 540 -0.731 -13.825 17.312 1.00 13.45 H new ATOM 621 N THR A 541 -2.043 -20.595 16.099 1.00 23.52 N ATOM 622 CA THR A 541 -3.343 -20.853 16.631 1.00 74.23 C ATOM 623 C THR A 541 -3.446 -20.254 18.021 1.00 52.35 C ATOM 624 O THR A 541 -2.525 -20.383 18.840 1.00 75.32 O ATOM 625 CB THR A 541 -3.628 -22.363 16.688 1.00 11.11 C ATOM 626 OG1 THR A 541 -2.490 -23.048 17.208 1.00 14.32 O ATOM 627 CG2 THR A 541 -3.947 -22.911 15.320 1.00 72.53 C ATOM 0 H THR A 541 -1.370 -21.347 16.250 1.00 23.52 H new ATOM 0 HA THR A 541 -4.084 -20.395 15.976 1.00 74.23 H new ATOM 0 HB THR A 541 -4.491 -22.518 17.336 1.00 11.11 H new ATOM 0 HG1 THR A 541 -2.498 -23.000 18.187 1.00 14.32 H new ATOM 0 HG21 THR A 541 -4.144 -23.981 15.393 1.00 72.53 H new ATOM 0 HG22 THR A 541 -4.828 -22.406 14.922 1.00 72.53 H new ATOM 0 HG23 THR A 541 -3.101 -22.743 14.654 1.00 72.53 H new ATOM 635 N ILE A 542 -4.512 -19.567 18.262 1.00 13.21 N ATOM 636 CA ILE A 542 -4.758 -18.950 19.526 1.00 32.24 C ATOM 637 C ILE A 542 -5.856 -19.717 20.218 1.00 14.44 C ATOM 638 O ILE A 542 -6.938 -19.887 19.657 1.00 44.20 O ATOM 639 CB ILE A 542 -5.240 -17.505 19.341 1.00 71.33 C ATOM 640 CG1 ILE A 542 -4.247 -16.696 18.510 1.00 34.31 C ATOM 641 CG2 ILE A 542 -5.482 -16.834 20.699 1.00 13.41 C ATOM 642 CD1 ILE A 542 -4.765 -15.334 18.127 1.00 73.21 C ATOM 0 H ILE A 542 -5.251 -19.415 17.575 1.00 13.21 H new ATOM 0 HA ILE A 542 -3.835 -18.951 20.106 1.00 32.24 H new ATOM 0 HB ILE A 542 -6.186 -17.535 18.800 1.00 71.33 H new ATOM 0 HG12 ILE A 542 -3.321 -16.580 19.073 1.00 34.31 H new ATOM 0 HG13 ILE A 542 -4.002 -17.252 17.605 1.00 34.31 H new ATOM 0 HG21 ILE A 542 -5.823 -15.810 20.543 1.00 13.41 H new ATOM 0 HG22 ILE A 542 -6.241 -17.390 21.249 1.00 13.41 H new ATOM 0 HG23 ILE A 542 -4.554 -16.824 21.271 1.00 13.41 H new ATOM 0 HD11 ILE A 542 -4.012 -14.811 17.538 1.00 73.21 H new ATOM 0 HD12 ILE A 542 -5.675 -15.443 17.537 1.00 73.21 H new ATOM 0 HD13 ILE A 542 -4.983 -14.761 19.028 1.00 73.21 H new ATOM 654 N GLU A 543 -5.592 -20.180 21.399 1.00 31.30 N ATOM 655 CA GLU A 543 -6.579 -20.894 22.167 1.00 74.50 C ATOM 656 C GLU A 543 -7.629 -19.937 22.694 1.00 72.33 C ATOM 657 O GLU A 543 -7.310 -18.833 23.156 1.00 2.02 O ATOM 658 CB GLU A 543 -5.912 -21.659 23.300 1.00 71.23 C ATOM 659 CG GLU A 543 -5.063 -22.810 22.809 1.00 32.00 C ATOM 660 CD GLU A 543 -4.171 -23.378 23.862 1.00 1.44 C ATOM 661 OE1 GLU A 543 -4.641 -24.128 24.731 1.00 63.54 O ATOM 662 OE2 GLU A 543 -2.948 -23.093 23.820 1.00 14.34 O ATOM 0 H GLU A 543 -4.689 -20.077 21.863 1.00 31.30 H new ATOM 0 HA GLU A 543 -7.077 -21.616 21.520 1.00 74.50 H new ATOM 0 HB2 GLU A 543 -5.290 -20.975 23.877 1.00 71.23 H new ATOM 0 HB3 GLU A 543 -6.678 -22.040 23.975 1.00 71.23 H new ATOM 0 HG2 GLU A 543 -5.715 -23.598 22.431 1.00 32.00 H new ATOM 0 HG3 GLU A 543 -4.454 -22.471 21.971 1.00 32.00 H new ATOM 669 N GLY A 544 -8.863 -20.335 22.589 1.00 2.40 N ATOM 670 CA GLY A 544 -9.945 -19.531 23.069 1.00 21.22 C ATOM 671 C GLY A 544 -10.787 -20.338 23.992 1.00 54.22 C ATOM 672 O GLY A 544 -10.388 -20.610 25.122 1.00 44.20 O ATOM 0 H GLY A 544 -9.145 -21.221 22.170 1.00 2.40 H new ATOM 0 HA2 GLY A 544 -9.559 -18.652 23.586 1.00 21.22 H new ATOM 0 HA3 GLY A 544 -10.544 -19.171 22.233 1.00 21.22 H new ATOM 676 N THR A 545 -11.918 -20.755 23.521 1.00 64.42 N ATOM 677 CA THR A 545 -12.770 -21.612 24.282 1.00 35.32 C ATOM 678 C THR A 545 -12.496 -23.068 23.911 1.00 2.32 C ATOM 679 O THR A 545 -12.790 -23.988 24.667 1.00 33.03 O ATOM 680 CB THR A 545 -14.241 -21.235 24.067 1.00 52.23 C ATOM 681 OG1 THR A 545 -14.474 -20.984 22.665 1.00 12.52 O ATOM 682 CG2 THR A 545 -14.593 -19.992 24.860 1.00 0.11 C ATOM 0 H THR A 545 -12.278 -20.511 22.598 1.00 64.42 H new ATOM 0 HA THR A 545 -12.558 -21.487 25.344 1.00 35.32 H new ATOM 0 HB THR A 545 -14.865 -22.061 24.407 1.00 52.23 H new ATOM 0 HG1 THR A 545 -15.365 -20.593 22.546 1.00 12.52 H new ATOM 0 HG21 THR A 545 -15.640 -19.740 24.695 1.00 0.11 H new ATOM 0 HG22 THR A 545 -14.427 -20.178 25.921 1.00 0.11 H new ATOM 0 HG23 THR A 545 -13.965 -19.163 24.535 1.00 0.11 H new ATOM 690 N ALA A 546 -11.919 -23.262 22.735 1.00 72.21 N ATOM 691 CA ALA A 546 -11.521 -24.578 22.291 1.00 51.12 C ATOM 692 C ALA A 546 -10.152 -24.888 22.873 1.00 51.20 C ATOM 693 O ALA A 546 -9.295 -23.989 22.972 1.00 1.55 O ATOM 694 CB ALA A 546 -11.504 -24.650 20.773 1.00 65.22 C ATOM 0 H ALA A 546 -11.717 -22.515 22.070 1.00 72.21 H new ATOM 0 HA ALA A 546 -12.239 -25.321 22.639 1.00 51.12 H new ATOM 0 HB1 ALA A 546 -11.202 -25.649 20.460 1.00 65.22 H new ATOM 0 HB2 ALA A 546 -12.500 -24.435 20.387 1.00 65.22 H new ATOM 0 HB3 ALA A 546 -10.798 -23.918 20.382 1.00 65.22 H new ATOM 700 N ARG A 547 -9.947 -26.122 23.255 1.00 23.30 N ATOM 701 CA ARG A 547 -8.729 -26.524 23.942 1.00 62.34 C ATOM 702 C ARG A 547 -7.583 -26.916 23.012 1.00 53.02 C ATOM 703 O ARG A 547 -7.694 -27.818 22.163 1.00 4.14 O ATOM 704 CB ARG A 547 -9.037 -27.591 24.988 1.00 32.32 C ATOM 705 CG ARG A 547 -9.881 -27.019 26.104 1.00 33.55 C ATOM 706 CD ARG A 547 -10.276 -28.030 27.160 1.00 3.42 C ATOM 707 NE ARG A 547 -10.943 -27.348 28.282 1.00 54.41 N ATOM 708 CZ ARG A 547 -11.481 -27.923 29.365 1.00 54.41 C ATOM 709 NH1 ARG A 547 -11.691 -29.237 29.414 1.00 23.35 N ATOM 710 NH2 ARG A 547 -11.875 -27.163 30.375 1.00 73.23 N ATOM 0 H ARG A 547 -10.612 -26.880 23.103 1.00 23.30 H new ATOM 0 HA ARG A 547 -8.354 -25.640 24.457 1.00 62.34 H new ATOM 0 HB2 ARG A 547 -9.561 -28.425 24.520 1.00 32.32 H new ATOM 0 HB3 ARG A 547 -8.107 -27.987 25.395 1.00 32.32 H new ATOM 0 HG2 ARG A 547 -9.332 -26.207 26.581 1.00 33.55 H new ATOM 0 HG3 ARG A 547 -10.784 -26.585 25.676 1.00 33.55 H new ATOM 0 HD2 ARG A 547 -10.942 -28.777 26.729 1.00 3.42 H new ATOM 0 HD3 ARG A 547 -9.393 -28.559 27.518 1.00 3.42 H new ATOM 0 HE ARG A 547 -11.001 -26.331 28.229 1.00 54.41 H new ATOM 0 HH11 ARG A 547 -11.441 -29.823 28.618 1.00 23.35 H new ATOM 0 HH12 ARG A 547 -12.102 -29.657 30.248 1.00 23.35 H new ATOM 0 HH21 ARG A 547 -11.767 -26.150 30.323 1.00 73.23 H new ATOM 0 HH22 ARG A 547 -12.286 -27.590 31.205 1.00 73.23 H new ATOM 724 N GLY A 548 -6.473 -26.239 23.183 1.00 4.23 N ATOM 725 CA GLY A 548 -5.317 -26.484 22.367 1.00 21.23 C ATOM 726 C GLY A 548 -4.522 -27.665 22.852 1.00 53.11 C ATOM 727 O GLY A 548 -5.039 -28.525 23.573 1.00 24.01 O ATOM 0 H GLY A 548 -6.350 -25.510 23.886 1.00 4.23 H new ATOM 0 HA2 GLY A 548 -5.631 -26.657 21.337 1.00 21.23 H new ATOM 0 HA3 GLY A 548 -4.683 -25.598 22.362 1.00 21.23 H new ATOM 731 N GLY A 549 -3.273 -27.715 22.473 1.00 0.21 N ATOM 732 CA GLY A 549 -2.417 -28.815 22.852 1.00 5.41 C ATOM 733 C GLY A 549 -2.781 -30.113 22.153 1.00 52.44 C ATOM 734 O GLY A 549 -2.338 -31.184 22.561 1.00 30.24 O ATOM 0 H GLY A 549 -2.820 -27.004 21.899 1.00 0.21 H new ATOM 0 HA2 GLY A 549 -1.383 -28.561 22.620 1.00 5.41 H new ATOM 0 HA3 GLY A 549 -2.476 -28.960 23.931 1.00 5.41 H new ATOM 738 N GLY A 550 -3.592 -30.025 21.112 1.00 32.24 N ATOM 739 CA GLY A 550 -3.994 -31.203 20.385 1.00 13.23 C ATOM 740 C GLY A 550 -5.066 -31.968 21.109 1.00 32.22 C ATOM 741 O GLY A 550 -5.046 -33.188 21.123 1.00 33.41 O ATOM 0 H GLY A 550 -3.980 -29.151 20.757 1.00 32.24 H new ATOM 0 HA2 GLY A 550 -4.357 -30.915 19.398 1.00 13.23 H new ATOM 0 HA3 GLY A 550 -3.129 -31.848 20.231 1.00 13.23 H new ATOM 745 N GLU A 551 -5.992 -31.254 21.714 1.00 34.32 N ATOM 746 CA GLU A 551 -7.065 -31.895 22.452 1.00 11.23 C ATOM 747 C GLU A 551 -8.393 -31.673 21.737 1.00 31.12 C ATOM 748 O GLU A 551 -9.163 -32.602 21.514 1.00 1.20 O ATOM 749 CB GLU A 551 -7.157 -31.312 23.845 1.00 52.13 C ATOM 750 CG GLU A 551 -8.049 -32.112 24.769 1.00 55.15 C ATOM 751 CD GLU A 551 -7.451 -33.454 25.133 1.00 2.20 C ATOM 752 OE1 GLU A 551 -7.411 -34.365 24.289 1.00 12.15 O ATOM 753 OE2 GLU A 551 -6.985 -33.618 26.282 1.00 62.41 O ATOM 0 H GLU A 551 -6.026 -30.235 21.711 1.00 34.32 H new ATOM 0 HA GLU A 551 -6.854 -32.962 22.514 1.00 11.23 H new ATOM 0 HB2 GLU A 551 -6.157 -31.256 24.275 1.00 52.13 H new ATOM 0 HB3 GLU A 551 -7.534 -30.291 23.780 1.00 52.13 H new ATOM 0 HG2 GLU A 551 -8.231 -31.540 25.679 1.00 55.15 H new ATOM 0 HG3 GLU A 551 -9.016 -32.266 24.291 1.00 55.15 H new ATOM 760 N ASP A 552 -8.660 -30.429 21.426 1.00 33.43 N ATOM 761 CA ASP A 552 -9.868 -30.039 20.693 1.00 42.41 C ATOM 762 C ASP A 552 -9.417 -29.748 19.281 1.00 60.52 C ATOM 763 O ASP A 552 -9.961 -30.239 18.299 1.00 54.34 O ATOM 764 CB ASP A 552 -10.410 -28.762 21.321 1.00 63.01 C ATOM 765 CG ASP A 552 -11.836 -28.412 21.013 1.00 11.32 C ATOM 766 OD1 ASP A 552 -12.301 -28.536 19.873 1.00 20.21 O ATOM 767 OD2 ASP A 552 -12.520 -27.988 21.950 1.00 30.54 O ATOM 0 H ASP A 552 -8.053 -29.646 21.669 1.00 33.43 H new ATOM 0 HA ASP A 552 -10.639 -30.809 20.715 1.00 42.41 H new ATOM 0 HB2 ASP A 552 -10.306 -28.844 22.403 1.00 63.01 H new ATOM 0 HB3 ASP A 552 -9.779 -27.932 21.002 1.00 63.01 H new ATOM 772 N PHE A 553 -8.352 -28.987 19.200 1.00 40.11 N ATOM 773 CA PHE A 553 -7.735 -28.677 17.943 1.00 50.50 C ATOM 774 C PHE A 553 -6.249 -28.858 18.093 1.00 44.41 C ATOM 775 O PHE A 553 -5.714 -28.785 19.227 1.00 63.22 O ATOM 776 CB PHE A 553 -8.057 -27.242 17.469 1.00 75.03 C ATOM 777 CG PHE A 553 -7.471 -26.132 18.310 1.00 23.12 C ATOM 778 CD1 PHE A 553 -8.143 -25.645 19.413 1.00 53.12 C ATOM 779 CD2 PHE A 553 -6.244 -25.571 17.977 1.00 52.52 C ATOM 780 CE1 PHE A 553 -7.605 -24.625 20.167 1.00 12.31 C ATOM 781 CE2 PHE A 553 -5.705 -24.557 18.730 1.00 23.54 C ATOM 782 CZ PHE A 553 -6.384 -24.082 19.824 1.00 32.23 C ATOM 0 H PHE A 553 -7.892 -28.567 20.008 1.00 40.11 H new ATOM 0 HA PHE A 553 -8.132 -29.350 17.183 1.00 50.50 H new ATOM 0 HB2 PHE A 553 -7.699 -27.127 16.446 1.00 75.03 H new ATOM 0 HB3 PHE A 553 -9.140 -27.121 17.443 1.00 75.03 H new ATOM 0 HD1 PHE A 553 -9.099 -26.067 19.687 1.00 53.12 H new ATOM 0 HD2 PHE A 553 -5.707 -25.937 17.114 1.00 52.52 H new ATOM 0 HE1 PHE A 553 -8.140 -24.250 21.027 1.00 12.31 H new ATOM 0 HE2 PHE A 553 -4.748 -24.134 18.462 1.00 23.54 H new ATOM 0 HZ PHE A 553 -5.963 -23.283 20.416 1.00 32.23 H new ATOM 792 N GLU A 554 -5.589 -29.132 17.007 1.00 55.11 N ATOM 793 CA GLU A 554 -4.175 -29.284 17.016 1.00 42.43 C ATOM 794 C GLU A 554 -3.573 -27.893 16.976 1.00 50.42 C ATOM 795 O GLU A 554 -3.839 -27.123 16.046 1.00 34.02 O ATOM 796 CB GLU A 554 -3.732 -30.085 15.801 1.00 3.12 C ATOM 797 CG GLU A 554 -2.392 -30.746 15.963 1.00 70.42 C ATOM 798 CD GLU A 554 -1.842 -31.314 14.680 1.00 12.12 C ATOM 799 OE1 GLU A 554 -1.156 -30.572 13.925 1.00 64.52 O ATOM 800 OE2 GLU A 554 -2.042 -32.505 14.409 1.00 54.43 O ATOM 0 H GLU A 554 -6.022 -29.255 16.092 1.00 55.11 H new ATOM 0 HA GLU A 554 -3.847 -29.818 17.908 1.00 42.43 H new ATOM 0 HB2 GLU A 554 -4.480 -30.849 15.589 1.00 3.12 H new ATOM 0 HB3 GLU A 554 -3.698 -29.424 14.935 1.00 3.12 H new ATOM 0 HG2 GLU A 554 -1.684 -30.020 16.363 1.00 70.42 H new ATOM 0 HG3 GLU A 554 -2.477 -31.546 16.698 1.00 70.42 H new ATOM 807 N ASP A 555 -2.815 -27.554 17.992 1.00 64.20 N ATOM 808 CA ASP A 555 -2.207 -26.240 18.068 1.00 43.02 C ATOM 809 C ASP A 555 -1.064 -26.200 17.102 1.00 51.44 C ATOM 810 O ASP A 555 -0.168 -27.053 17.164 1.00 74.35 O ATOM 811 CB ASP A 555 -1.724 -25.932 19.483 1.00 43.01 C ATOM 812 CG ASP A 555 -1.127 -24.545 19.600 1.00 70.31 C ATOM 813 OD1 ASP A 555 -1.882 -23.573 19.712 1.00 22.15 O ATOM 814 OD2 ASP A 555 0.116 -24.401 19.591 1.00 30.53 O ATOM 0 H ASP A 555 -2.603 -28.167 18.779 1.00 64.20 H new ATOM 0 HA ASP A 555 -2.946 -25.481 17.811 1.00 43.02 H new ATOM 0 HB2 ASP A 555 -2.559 -26.025 20.177 1.00 43.01 H new ATOM 0 HB3 ASP A 555 -0.980 -26.671 19.779 1.00 43.01 H new ATOM 819 N THR A 556 -1.073 -25.250 16.228 1.00 21.32 N ATOM 820 CA THR A 556 -0.128 -25.237 15.178 1.00 45.01 C ATOM 821 C THR A 556 0.369 -23.817 14.920 1.00 15.33 C ATOM 822 O THR A 556 -0.265 -22.821 15.317 1.00 40.34 O ATOM 823 CB THR A 556 -0.747 -25.873 13.874 1.00 10.34 C ATOM 824 OG1 THR A 556 0.261 -26.117 12.876 1.00 42.44 O ATOM 825 CG2 THR A 556 -1.835 -24.985 13.271 1.00 1.23 C ATOM 0 H THR A 556 -1.731 -24.471 16.226 1.00 21.32 H new ATOM 0 HA THR A 556 0.730 -25.841 15.472 1.00 45.01 H new ATOM 0 HB THR A 556 -1.190 -26.821 14.178 1.00 10.34 H new ATOM 0 HG1 THR A 556 -0.154 -26.513 12.081 1.00 42.44 H new ATOM 0 HG21 THR A 556 -2.236 -25.458 12.375 1.00 1.23 H new ATOM 0 HG22 THR A 556 -2.636 -24.847 13.997 1.00 1.23 H new ATOM 0 HG23 THR A 556 -1.410 -24.016 13.010 1.00 1.23 H new ATOM 833 N CYS A 557 1.495 -23.732 14.302 1.00 51.43 N ATOM 834 CA CYS A 557 2.073 -22.501 13.915 1.00 75.42 C ATOM 835 C CYS A 557 2.822 -22.741 12.637 1.00 74.02 C ATOM 836 O CYS A 557 3.038 -23.903 12.256 1.00 74.11 O ATOM 837 CB CYS A 557 2.988 -21.958 15.016 1.00 71.55 C ATOM 838 SG CYS A 557 4.306 -23.076 15.543 1.00 10.51 S ATOM 0 H CYS A 557 2.054 -24.546 14.046 1.00 51.43 H new ATOM 0 HA CYS A 557 1.304 -21.745 13.757 1.00 75.42 H new ATOM 0 HB2 CYS A 557 3.439 -21.030 14.666 1.00 71.55 H new ATOM 0 HB3 CYS A 557 2.377 -21.708 15.883 1.00 71.55 H new ATOM 0 HG CYS A 557 5.012 -22.506 16.474 1.00 10.51 H new ATOM 844 N GLY A 558 3.189 -21.704 11.960 1.00 22.04 N ATOM 845 CA GLY A 558 3.895 -21.865 10.745 1.00 42.23 C ATOM 846 C GLY A 558 4.132 -20.556 10.097 1.00 23.40 C ATOM 847 O GLY A 558 3.794 -19.507 10.668 1.00 13.30 O ATOM 0 H GLY A 558 3.009 -20.738 12.232 1.00 22.04 H new ATOM 0 HA2 GLY A 558 4.848 -22.359 10.936 1.00 42.23 H new ATOM 0 HA3 GLY A 558 3.329 -22.511 10.074 1.00 42.23 H new ATOM 851 N GLU A 559 4.671 -20.601 8.921 1.00 23.41 N ATOM 852 CA GLU A 559 5.000 -19.434 8.164 1.00 75.42 C ATOM 853 C GLU A 559 4.533 -19.616 6.733 1.00 74.05 C ATOM 854 O GLU A 559 4.949 -20.553 6.046 1.00 74.20 O ATOM 855 CB GLU A 559 6.507 -19.179 8.213 1.00 53.25 C ATOM 856 CG GLU A 559 7.039 -18.783 9.585 1.00 34.43 C ATOM 857 CD GLU A 559 8.537 -18.627 9.598 1.00 24.32 C ATOM 858 OE1 GLU A 559 9.246 -19.653 9.488 1.00 71.43 O ATOM 859 OE2 GLU A 559 9.044 -17.489 9.702 1.00 53.52 O ATOM 0 H GLU A 559 4.901 -21.474 8.447 1.00 23.41 H new ATOM 0 HA GLU A 559 4.497 -18.568 8.594 1.00 75.42 H new ATOM 0 HB2 GLU A 559 7.025 -20.079 7.883 1.00 53.25 H new ATOM 0 HB3 GLU A 559 6.752 -18.391 7.501 1.00 53.25 H new ATOM 0 HG2 GLU A 559 6.576 -17.846 9.894 1.00 34.43 H new ATOM 0 HG3 GLU A 559 6.749 -19.538 10.316 1.00 34.43 H new ATOM 866 N LEU A 560 3.660 -18.750 6.303 1.00 0.34 N ATOM 867 CA LEU A 560 3.129 -18.804 4.970 1.00 12.25 C ATOM 868 C LEU A 560 4.029 -18.066 4.037 1.00 22.33 C ATOM 869 O LEU A 560 4.444 -16.938 4.320 1.00 32.04 O ATOM 870 CB LEU A 560 1.731 -18.218 4.912 1.00 12.11 C ATOM 871 CG LEU A 560 0.667 -18.947 5.710 1.00 55.41 C ATOM 872 CD1 LEU A 560 -0.664 -18.248 5.562 1.00 62.11 C ATOM 873 CD2 LEU A 560 0.570 -20.406 5.275 1.00 41.54 C ATOM 0 H LEU A 560 3.295 -17.984 6.869 1.00 0.34 H new ATOM 0 HA LEU A 560 3.070 -19.850 4.669 1.00 12.25 H new ATOM 0 HB2 LEU A 560 1.777 -17.187 5.263 1.00 12.11 H new ATOM 0 HB3 LEU A 560 1.416 -18.186 3.869 1.00 12.11 H new ATOM 0 HG LEU A 560 0.949 -18.932 6.763 1.00 55.41 H new ATOM 0 HD11 LEU A 560 -1.420 -18.780 6.139 1.00 62.11 H new ATOM 0 HD12 LEU A 560 -0.581 -17.225 5.929 1.00 62.11 H new ATOM 0 HD13 LEU A 560 -0.953 -18.234 4.511 1.00 62.11 H new ATOM 0 HD21 LEU A 560 -0.199 -20.910 5.860 1.00 41.54 H new ATOM 0 HD22 LEU A 560 0.311 -20.454 4.217 1.00 41.54 H new ATOM 0 HD23 LEU A 560 1.529 -20.898 5.436 1.00 41.54 H new ATOM 885 N GLU A 561 4.328 -18.681 2.943 1.00 71.20 N ATOM 886 CA GLU A 561 5.220 -18.122 2.003 1.00 45.22 C ATOM 887 C GLU A 561 4.443 -17.518 0.843 1.00 73.41 C ATOM 888 O GLU A 561 3.862 -18.229 0.034 1.00 13.02 O ATOM 889 CB GLU A 561 6.180 -19.196 1.519 1.00 31.40 C ATOM 890 CG GLU A 561 7.353 -18.663 0.739 1.00 33.45 C ATOM 891 CD GLU A 561 8.237 -19.755 0.200 1.00 61.25 C ATOM 892 OE1 GLU A 561 7.846 -20.444 -0.750 1.00 33.02 O ATOM 893 OE2 GLU A 561 9.352 -19.935 0.736 1.00 14.52 O ATOM 0 H GLU A 561 3.954 -19.593 2.680 1.00 71.20 H new ATOM 0 HA GLU A 561 5.797 -17.325 2.472 1.00 45.22 H new ATOM 0 HB2 GLU A 561 6.552 -19.751 2.380 1.00 31.40 H new ATOM 0 HB3 GLU A 561 5.633 -19.903 0.895 1.00 31.40 H new ATOM 0 HG2 GLU A 561 6.988 -18.055 -0.089 1.00 33.45 H new ATOM 0 HG3 GLU A 561 7.942 -18.007 1.380 1.00 33.45 H new ATOM 900 N PHE A 562 4.390 -16.224 0.807 1.00 34.32 N ATOM 901 CA PHE A 562 3.746 -15.520 -0.267 1.00 24.43 C ATOM 902 C PHE A 562 4.802 -14.924 -1.156 1.00 1.44 C ATOM 903 O PHE A 562 5.882 -14.584 -0.696 1.00 54.24 O ATOM 904 CB PHE A 562 2.837 -14.413 0.256 1.00 22.44 C ATOM 905 CG PHE A 562 1.601 -14.887 0.958 1.00 41.02 C ATOM 906 CD1 PHE A 562 0.431 -15.107 0.248 1.00 52.33 C ATOM 907 CD2 PHE A 562 1.595 -15.087 2.324 1.00 72.25 C ATOM 908 CE1 PHE A 562 -0.713 -15.516 0.889 1.00 11.11 C ATOM 909 CE2 PHE A 562 0.451 -15.501 2.968 1.00 21.42 C ATOM 910 CZ PHE A 562 -0.701 -15.714 2.249 1.00 52.12 C ATOM 0 H PHE A 562 4.793 -15.619 1.523 1.00 34.32 H new ATOM 0 HA PHE A 562 3.128 -16.225 -0.823 1.00 24.43 H new ATOM 0 HB2 PHE A 562 3.409 -13.788 0.942 1.00 22.44 H new ATOM 0 HB3 PHE A 562 2.541 -13.781 -0.581 1.00 22.44 H new ATOM 0 HD1 PHE A 562 0.419 -14.955 -0.821 1.00 52.33 H new ATOM 0 HD2 PHE A 562 2.497 -14.917 2.893 1.00 72.25 H new ATOM 0 HE1 PHE A 562 -1.620 -15.682 0.326 1.00 11.11 H new ATOM 0 HE2 PHE A 562 0.459 -15.658 4.036 1.00 21.42 H new ATOM 0 HZ PHE A 562 -1.599 -16.038 2.754 1.00 52.12 H new ATOM 920 N GLN A 563 4.519 -14.791 -2.416 1.00 42.20 N ATOM 921 CA GLN A 563 5.474 -14.246 -3.352 1.00 64.01 C ATOM 922 C GLN A 563 4.709 -13.439 -4.342 1.00 25.41 C ATOM 923 O GLN A 563 3.538 -13.176 -4.123 1.00 41.32 O ATOM 924 CB GLN A 563 6.265 -15.350 -4.087 1.00 30.43 C ATOM 925 CG GLN A 563 6.921 -16.375 -3.178 1.00 33.02 C ATOM 926 CD GLN A 563 8.074 -17.108 -3.813 1.00 40.15 C ATOM 927 OE1 GLN A 563 8.310 -18.267 -3.525 1.00 43.14 O ATOM 928 NE2 GLN A 563 8.852 -16.425 -4.595 1.00 23.20 N ATOM 0 H GLN A 563 3.625 -15.054 -2.830 1.00 42.20 H new ATOM 0 HA GLN A 563 6.202 -13.642 -2.811 1.00 64.01 H new ATOM 0 HB2 GLN A 563 5.591 -15.868 -4.769 1.00 30.43 H new ATOM 0 HB3 GLN A 563 7.036 -14.880 -4.697 1.00 30.43 H new ATOM 0 HG2 GLN A 563 7.275 -15.873 -2.277 1.00 33.02 H new ATOM 0 HG3 GLN A 563 6.171 -17.101 -2.865 1.00 33.02 H new ATOM 0 HE21 GLN A 563 8.627 -15.455 -4.818 1.00 23.20 H new ATOM 0 HE22 GLN A 563 9.688 -16.858 -4.987 1.00 23.20 H new ATOM 937 N ASN A 564 5.345 -13.032 -5.403 1.00 31.40 N ATOM 938 CA ASN A 564 4.638 -12.347 -6.477 1.00 35.15 C ATOM 939 C ASN A 564 3.854 -13.383 -7.283 1.00 23.15 C ATOM 940 O ASN A 564 2.906 -13.067 -8.003 1.00 43.13 O ATOM 941 CB ASN A 564 5.608 -11.558 -7.386 1.00 13.42 C ATOM 942 CG ASN A 564 6.611 -12.423 -8.138 1.00 12.01 C ATOM 943 OD1 ASN A 564 7.054 -13.478 -7.653 1.00 50.20 O ATOM 944 ND2 ASN A 564 6.975 -11.990 -9.313 1.00 71.22 N ATOM 0 H ASN A 564 6.345 -13.156 -5.559 1.00 31.40 H new ATOM 0 HA ASN A 564 3.952 -11.618 -6.045 1.00 35.15 H new ATOM 0 HB2 ASN A 564 5.025 -10.987 -8.109 1.00 13.42 H new ATOM 0 HB3 ASN A 564 6.153 -10.838 -6.776 1.00 13.42 H new ATOM 0 HD21 ASN A 564 7.645 -12.522 -9.867 1.00 71.22 H new ATOM 0 HD22 ASN A 564 6.589 -11.119 -9.678 1.00 71.22 H new ATOM 951 N ASP A 565 4.276 -14.622 -7.130 1.00 33.34 N ATOM 952 CA ASP A 565 3.648 -15.775 -7.749 1.00 61.33 C ATOM 953 C ASP A 565 2.534 -16.331 -6.847 1.00 34.34 C ATOM 954 O ASP A 565 1.449 -16.631 -7.316 1.00 43.42 O ATOM 955 CB ASP A 565 4.711 -16.845 -8.027 1.00 21.22 C ATOM 956 CG ASP A 565 4.152 -18.135 -8.585 1.00 23.23 C ATOM 957 OD1 ASP A 565 3.827 -18.198 -9.783 1.00 33.30 O ATOM 958 OD2 ASP A 565 4.088 -19.134 -7.840 1.00 62.25 O ATOM 0 H ASP A 565 5.085 -14.862 -6.558 1.00 33.34 H new ATOM 0 HA ASP A 565 3.193 -15.474 -8.693 1.00 61.33 H new ATOM 0 HB2 ASP A 565 5.441 -16.443 -8.729 1.00 21.22 H new ATOM 0 HB3 ASP A 565 5.244 -17.062 -7.102 1.00 21.22 H new ATOM 963 N GLU A 566 2.814 -16.457 -5.552 1.00 31.25 N ATOM 964 CA GLU A 566 1.831 -16.934 -4.590 1.00 74.41 C ATOM 965 C GLU A 566 0.794 -15.877 -4.274 1.00 62.41 C ATOM 966 O GLU A 566 1.123 -14.789 -3.789 1.00 42.30 O ATOM 967 CB GLU A 566 2.494 -17.356 -3.305 1.00 1.10 C ATOM 968 CG GLU A 566 3.257 -18.650 -3.368 1.00 5.12 C ATOM 969 CD GLU A 566 2.348 -19.845 -3.408 1.00 62.55 C ATOM 970 OE1 GLU A 566 1.669 -20.064 -4.427 1.00 35.43 O ATOM 971 OE2 GLU A 566 2.314 -20.602 -2.425 1.00 34.13 O ATOM 0 H GLU A 566 3.722 -16.233 -5.145 1.00 31.25 H new ATOM 0 HA GLU A 566 1.337 -17.790 -5.050 1.00 74.41 H new ATOM 0 HB2 GLU A 566 3.177 -16.566 -2.992 1.00 1.10 H new ATOM 0 HB3 GLU A 566 1.730 -17.442 -2.533 1.00 1.10 H new ATOM 0 HG2 GLU A 566 3.894 -18.651 -4.252 1.00 5.12 H new ATOM 0 HG3 GLU A 566 3.914 -18.725 -2.501 1.00 5.12 H new ATOM 978 N ILE A 567 -0.430 -16.223 -4.504 1.00 51.22 N ATOM 979 CA ILE A 567 -1.547 -15.336 -4.293 1.00 1.22 C ATOM 980 C ILE A 567 -2.381 -15.702 -3.069 1.00 40.24 C ATOM 981 O ILE A 567 -2.954 -14.832 -2.413 1.00 54.12 O ATOM 982 CB ILE A 567 -2.414 -15.224 -5.564 1.00 54.25 C ATOM 983 CG1 ILE A 567 -2.545 -16.578 -6.298 1.00 32.23 C ATOM 984 CG2 ILE A 567 -1.887 -14.143 -6.498 1.00 25.12 C ATOM 985 CD1 ILE A 567 -3.594 -17.513 -5.754 1.00 21.21 C ATOM 0 H ILE A 567 -0.696 -17.145 -4.850 1.00 51.22 H new ATOM 0 HA ILE A 567 -1.127 -14.352 -4.082 1.00 1.22 H new ATOM 0 HB ILE A 567 -3.414 -14.934 -5.243 1.00 54.25 H new ATOM 0 HG12 ILE A 567 -2.767 -16.383 -7.347 1.00 32.23 H new ATOM 0 HG13 ILE A 567 -1.580 -17.084 -6.265 1.00 32.23 H new ATOM 0 HG21 ILE A 567 -2.519 -14.088 -7.384 1.00 25.12 H new ATOM 0 HG22 ILE A 567 -1.898 -13.182 -5.985 1.00 25.12 H new ATOM 0 HG23 ILE A 567 -0.866 -14.384 -6.794 1.00 25.12 H new ATOM 0 HD11 ILE A 567 -3.602 -18.432 -6.341 1.00 21.21 H new ATOM 0 HD12 ILE A 567 -3.367 -17.748 -4.714 1.00 21.21 H new ATOM 0 HD13 ILE A 567 -4.572 -17.036 -5.813 1.00 21.21 H new ATOM 997 N VAL A 568 -2.465 -16.963 -2.772 1.00 44.32 N ATOM 998 CA VAL A 568 -3.181 -17.387 -1.591 1.00 21.10 C ATOM 999 C VAL A 568 -2.485 -18.575 -0.944 1.00 71.13 C ATOM 1000 O VAL A 568 -1.859 -19.400 -1.622 1.00 54.51 O ATOM 1001 CB VAL A 568 -4.681 -17.735 -1.894 1.00 62.14 C ATOM 1002 CG1 VAL A 568 -4.833 -19.007 -2.682 1.00 43.13 C ATOM 1003 CG2 VAL A 568 -5.514 -17.794 -0.637 1.00 13.42 C ATOM 0 H VAL A 568 -2.053 -17.717 -3.321 1.00 44.32 H new ATOM 0 HA VAL A 568 -3.178 -16.546 -0.897 1.00 21.10 H new ATOM 0 HB VAL A 568 -5.054 -16.918 -2.512 1.00 62.14 H new ATOM 0 HG11 VAL A 568 -5.891 -19.199 -2.863 1.00 43.13 H new ATOM 0 HG12 VAL A 568 -4.314 -18.909 -3.635 1.00 43.13 H new ATOM 0 HG13 VAL A 568 -4.405 -19.837 -2.120 1.00 43.13 H new ATOM 0 HG21 VAL A 568 -6.545 -18.038 -0.895 1.00 13.42 H new ATOM 0 HG22 VAL A 568 -5.115 -18.560 0.028 1.00 13.42 H new ATOM 0 HG23 VAL A 568 -5.484 -16.827 -0.135 1.00 13.42 H new ATOM 1013 N LYS A 569 -2.542 -18.626 0.344 1.00 52.24 N ATOM 1014 CA LYS A 569 -2.043 -19.748 1.099 1.00 50.51 C ATOM 1015 C LYS A 569 -3.110 -20.242 2.032 1.00 64.42 C ATOM 1016 O LYS A 569 -4.072 -19.527 2.297 1.00 34.32 O ATOM 1017 CB LYS A 569 -0.801 -19.388 1.889 1.00 44.32 C ATOM 1018 CG LYS A 569 0.443 -19.146 1.054 1.00 13.44 C ATOM 1019 CD LYS A 569 1.533 -20.158 1.367 1.00 34.15 C ATOM 1020 CE LYS A 569 1.167 -21.583 0.954 1.00 55.40 C ATOM 1021 NZ LYS A 569 0.921 -21.729 -0.506 1.00 53.22 N ATOM 0 H LYS A 569 -2.940 -17.884 0.919 1.00 52.24 H new ATOM 0 HA LYS A 569 -1.772 -20.532 0.392 1.00 50.51 H new ATOM 0 HB2 LYS A 569 -1.008 -18.492 2.474 1.00 44.32 H new ATOM 0 HB3 LYS A 569 -0.594 -20.190 2.598 1.00 44.32 H new ATOM 0 HG2 LYS A 569 0.188 -19.201 -0.004 1.00 13.44 H new ATOM 0 HG3 LYS A 569 0.816 -18.139 1.240 1.00 13.44 H new ATOM 0 HD2 LYS A 569 2.451 -19.863 0.858 1.00 34.15 H new ATOM 0 HD3 LYS A 569 1.742 -20.139 2.437 1.00 34.15 H new ATOM 0 HE2 LYS A 569 1.971 -22.257 1.249 1.00 55.40 H new ATOM 0 HE3 LYS A 569 0.275 -21.894 1.498 1.00 55.40 H new ATOM 0 HZ1 LYS A 569 1.240 -22.668 -0.820 1.00 53.22 H new ATOM 0 HZ2 LYS A 569 -0.096 -21.627 -0.699 1.00 53.22 H new ATOM 0 HZ3 LYS A 569 1.447 -20.995 -1.022 1.00 53.22 H new ATOM 1035 N THR A 570 -2.953 -21.442 2.512 1.00 50.30 N ATOM 1036 CA THR A 570 -3.898 -22.013 3.438 1.00 45.12 C ATOM 1037 C THR A 570 -3.255 -22.427 4.743 1.00 5.24 C ATOM 1038 O THR A 570 -2.093 -22.860 4.779 1.00 53.01 O ATOM 1039 CB THR A 570 -4.663 -23.223 2.837 1.00 50.11 C ATOM 1040 OG1 THR A 570 -3.802 -24.018 2.001 1.00 2.32 O ATOM 1041 CG2 THR A 570 -5.896 -22.797 2.069 1.00 50.45 C ATOM 0 H THR A 570 -2.171 -22.053 2.276 1.00 50.30 H new ATOM 0 HA THR A 570 -4.612 -21.215 3.641 1.00 45.12 H new ATOM 0 HB THR A 570 -4.994 -23.833 3.678 1.00 50.11 H new ATOM 0 HG1 THR A 570 -4.181 -24.916 1.901 1.00 2.32 H new ATOM 0 HG21 THR A 570 -6.397 -23.678 1.668 1.00 50.45 H new ATOM 0 HG22 THR A 570 -6.575 -22.266 2.736 1.00 50.45 H new ATOM 0 HG23 THR A 570 -5.605 -22.140 1.249 1.00 50.45 H new ATOM 1049 N ILE A 571 -3.983 -22.238 5.807 1.00 51.51 N ATOM 1050 CA ILE A 571 -3.599 -22.752 7.097 1.00 13.04 C ATOM 1051 C ILE A 571 -4.294 -24.075 7.256 1.00 42.52 C ATOM 1052 O ILE A 571 -5.515 -24.132 7.203 1.00 24.31 O ATOM 1053 CB ILE A 571 -4.012 -21.821 8.299 1.00 55.43 C ATOM 1054 CG1 ILE A 571 -3.199 -20.539 8.373 1.00 42.44 C ATOM 1055 CG2 ILE A 571 -3.940 -22.543 9.623 1.00 21.15 C ATOM 1056 CD1 ILE A 571 -3.511 -19.541 7.320 1.00 63.21 C ATOM 0 H ILE A 571 -4.863 -21.722 5.807 1.00 51.51 H new ATOM 0 HA ILE A 571 -2.512 -22.826 7.126 1.00 13.04 H new ATOM 0 HB ILE A 571 -5.047 -21.544 8.100 1.00 55.43 H new ATOM 0 HG12 ILE A 571 -3.360 -20.079 9.348 1.00 42.44 H new ATOM 0 HG13 ILE A 571 -2.141 -20.793 8.311 1.00 42.44 H new ATOM 0 HG21 ILE A 571 -4.233 -21.864 10.424 1.00 21.15 H new ATOM 0 HG22 ILE A 571 -4.615 -23.399 9.608 1.00 21.15 H new ATOM 0 HG23 ILE A 571 -2.920 -22.888 9.794 1.00 21.15 H new ATOM 0 HD11 ILE A 571 -2.882 -18.661 7.455 1.00 63.21 H new ATOM 0 HD12 ILE A 571 -3.321 -19.976 6.339 1.00 63.21 H new ATOM 0 HD13 ILE A 571 -4.559 -19.252 7.392 1.00 63.21 H new ATOM 1068 N SER A 572 -3.532 -25.112 7.378 1.00 52.21 N ATOM 1069 CA SER A 572 -4.062 -26.425 7.578 1.00 22.12 C ATOM 1070 C SER A 572 -4.015 -26.772 9.061 1.00 65.31 C ATOM 1071 O SER A 572 -2.935 -26.833 9.665 1.00 31.14 O ATOM 1072 CB SER A 572 -3.268 -27.418 6.719 1.00 42.10 C ATOM 1073 OG SER A 572 -1.863 -27.182 6.830 1.00 14.14 O ATOM 0 H SER A 572 -2.513 -25.073 7.342 1.00 52.21 H new ATOM 0 HA SER A 572 -5.106 -26.474 7.267 1.00 22.12 H new ATOM 0 HB2 SER A 572 -3.495 -28.437 7.032 1.00 42.10 H new ATOM 0 HB3 SER A 572 -3.574 -27.329 5.677 1.00 42.10 H new ATOM 0 HG SER A 572 -1.636 -26.993 7.764 1.00 14.14 H new ATOM 1079 N VAL A 573 -5.172 -26.946 9.654 1.00 23.43 N ATOM 1080 CA VAL A 573 -5.269 -27.271 11.063 1.00 74.43 C ATOM 1081 C VAL A 573 -5.997 -28.567 11.258 1.00 22.25 C ATOM 1082 O VAL A 573 -7.112 -28.753 10.747 1.00 33.11 O ATOM 1083 CB VAL A 573 -5.966 -26.138 11.890 1.00 31.24 C ATOM 1084 CG1 VAL A 573 -6.269 -26.560 13.328 1.00 4.44 C ATOM 1085 CG2 VAL A 573 -5.096 -24.918 11.927 1.00 34.34 C ATOM 0 H VAL A 573 -6.071 -26.867 9.179 1.00 23.43 H new ATOM 0 HA VAL A 573 -4.249 -27.369 11.434 1.00 74.43 H new ATOM 0 HB VAL A 573 -6.911 -25.926 11.390 1.00 31.24 H new ATOM 0 HG11 VAL A 573 -6.752 -25.737 13.855 1.00 4.44 H new ATOM 0 HG12 VAL A 573 -6.932 -27.425 13.321 1.00 4.44 H new ATOM 0 HG13 VAL A 573 -5.339 -26.820 13.835 1.00 4.44 H new ATOM 0 HG21 VAL A 573 -5.590 -24.136 12.504 1.00 34.34 H new ATOM 0 HG22 VAL A 573 -4.142 -25.165 12.393 1.00 34.34 H new ATOM 0 HG23 VAL A 573 -4.923 -24.564 10.911 1.00 34.34 H new ATOM 1095 N LYS A 574 -5.350 -29.461 11.938 1.00 64.42 N ATOM 1096 CA LYS A 574 -5.932 -30.700 12.344 1.00 72.04 C ATOM 1097 C LYS A 574 -6.934 -30.427 13.447 1.00 71.11 C ATOM 1098 O LYS A 574 -6.594 -29.841 14.481 1.00 12.23 O ATOM 1099 CB LYS A 574 -4.829 -31.633 12.862 1.00 60.31 C ATOM 1100 CG LYS A 574 -5.314 -32.867 13.640 1.00 20.13 C ATOM 1101 CD LYS A 574 -5.851 -33.987 12.764 1.00 22.02 C ATOM 1102 CE LYS A 574 -4.718 -34.651 12.003 1.00 12.25 C ATOM 1103 NZ LYS A 574 -5.128 -35.876 11.285 1.00 62.52 N ATOM 0 H LYS A 574 -4.380 -29.346 12.233 1.00 64.42 H new ATOM 0 HA LYS A 574 -6.434 -31.175 11.501 1.00 72.04 H new ATOM 0 HB2 LYS A 574 -4.236 -31.971 12.013 1.00 60.31 H new ATOM 0 HB3 LYS A 574 -4.164 -31.058 13.506 1.00 60.31 H new ATOM 0 HG2 LYS A 574 -4.488 -33.253 14.238 1.00 20.13 H new ATOM 0 HG3 LYS A 574 -6.095 -32.560 14.336 1.00 20.13 H new ATOM 0 HD2 LYS A 574 -6.366 -34.725 13.380 1.00 22.02 H new ATOM 0 HD3 LYS A 574 -6.585 -33.589 12.063 1.00 22.02 H new ATOM 0 HE2 LYS A 574 -4.307 -33.940 11.287 1.00 12.25 H new ATOM 0 HE3 LYS A 574 -3.918 -34.899 12.701 1.00 12.25 H new ATOM 0 HZ1 LYS A 574 -4.308 -36.278 10.788 1.00 62.52 H new ATOM 0 HZ2 LYS A 574 -5.495 -36.571 11.966 1.00 62.52 H new ATOM 0 HZ3 LYS A 574 -5.871 -35.642 10.595 1.00 62.52 H new ATOM 1117 N VAL A 575 -8.147 -30.786 13.222 1.00 13.51 N ATOM 1118 CA VAL A 575 -9.120 -30.693 14.250 1.00 31.40 C ATOM 1119 C VAL A 575 -9.103 -32.042 14.916 1.00 22.15 C ATOM 1120 O VAL A 575 -9.107 -33.073 14.231 1.00 21.03 O ATOM 1121 CB VAL A 575 -10.532 -30.343 13.708 1.00 53.14 C ATOM 1122 CG1 VAL A 575 -11.505 -30.101 14.858 1.00 51.32 C ATOM 1123 CG2 VAL A 575 -10.467 -29.115 12.807 1.00 43.11 C ATOM 0 H VAL A 575 -8.490 -31.148 12.332 1.00 13.51 H new ATOM 0 HA VAL A 575 -8.887 -29.884 14.943 1.00 31.40 H new ATOM 0 HB VAL A 575 -10.892 -31.189 13.122 1.00 53.14 H new ATOM 0 HG11 VAL A 575 -12.489 -29.857 14.457 1.00 51.32 H new ATOM 0 HG12 VAL A 575 -11.575 -31.000 15.470 1.00 51.32 H new ATOM 0 HG13 VAL A 575 -11.147 -29.273 15.469 1.00 51.32 H new ATOM 0 HG21 VAL A 575 -11.465 -28.883 12.435 1.00 43.11 H new ATOM 0 HG22 VAL A 575 -10.085 -28.267 13.375 1.00 43.11 H new ATOM 0 HG23 VAL A 575 -9.804 -29.316 11.965 1.00 43.11 H new ATOM 1133 N ILE A 576 -9.011 -32.046 16.202 1.00 55.14 N ATOM 1134 CA ILE A 576 -8.845 -33.265 16.946 1.00 42.40 C ATOM 1135 C ILE A 576 -10.209 -33.898 17.157 1.00 23.12 C ATOM 1136 O ILE A 576 -11.229 -33.202 17.133 1.00 73.02 O ATOM 1137 CB ILE A 576 -8.160 -32.954 18.322 1.00 42.12 C ATOM 1138 CG1 ILE A 576 -6.833 -32.210 18.113 1.00 43.25 C ATOM 1139 CG2 ILE A 576 -7.927 -34.203 19.172 1.00 53.02 C ATOM 1140 CD1 ILE A 576 -5.772 -32.979 17.356 1.00 12.13 C ATOM 0 H ILE A 576 -9.048 -31.204 16.777 1.00 55.14 H new ATOM 0 HA ILE A 576 -8.209 -33.959 16.396 1.00 42.40 H new ATOM 0 HB ILE A 576 -8.855 -32.318 18.870 1.00 42.12 H new ATOM 0 HG12 ILE A 576 -7.036 -31.282 17.579 1.00 43.25 H new ATOM 0 HG13 ILE A 576 -6.432 -31.935 19.089 1.00 43.25 H new ATOM 0 HG21 ILE A 576 -7.450 -33.921 20.111 1.00 53.02 H new ATOM 0 HG22 ILE A 576 -8.882 -34.685 19.381 1.00 53.02 H new ATOM 0 HG23 ILE A 576 -7.282 -34.896 18.632 1.00 53.02 H new ATOM 0 HD11 ILE A 576 -4.876 -32.366 17.262 1.00 12.13 H new ATOM 0 HD12 ILE A 576 -5.531 -33.894 17.896 1.00 12.13 H new ATOM 0 HD13 ILE A 576 -6.144 -33.231 16.363 1.00 12.13 H new ATOM 1278 N LYS A 585 -17.415 -23.966 20.985 1.00 21.34 N ATOM 1279 CA LYS A 585 -16.102 -23.456 21.247 1.00 51.35 C ATOM 1280 C LYS A 585 -15.303 -23.131 20.003 1.00 1.30 C ATOM 1281 O LYS A 585 -15.453 -23.758 18.952 1.00 20.14 O ATOM 1282 CB LYS A 585 -15.339 -24.260 22.312 1.00 14.24 C ATOM 1283 CG LYS A 585 -15.648 -25.746 22.397 1.00 60.43 C ATOM 1284 CD LYS A 585 -15.204 -26.540 21.201 1.00 35.23 C ATOM 1285 CE LYS A 585 -15.515 -28.006 21.439 1.00 31.32 C ATOM 1286 NZ LYS A 585 -14.902 -28.874 20.424 1.00 23.44 N ATOM 0 HA LYS A 585 -16.260 -22.480 21.705 1.00 51.35 H new ATOM 0 HB2 LYS A 585 -14.271 -24.145 22.125 1.00 14.24 H new ATOM 0 HB3 LYS A 585 -15.542 -23.814 23.286 1.00 14.24 H new ATOM 0 HG2 LYS A 585 -15.170 -26.154 23.287 1.00 60.43 H new ATOM 0 HG3 LYS A 585 -16.723 -25.875 22.525 1.00 60.43 H new ATOM 0 HD2 LYS A 585 -15.714 -26.188 20.304 1.00 35.23 H new ATOM 0 HD3 LYS A 585 -14.135 -26.404 21.034 1.00 35.23 H new ATOM 0 HE2 LYS A 585 -15.157 -28.296 22.427 1.00 31.32 H new ATOM 0 HE3 LYS A 585 -16.595 -28.152 21.435 1.00 31.32 H new ATOM 0 HZ1 LYS A 585 -14.595 -29.763 20.867 1.00 23.44 H new ATOM 0 HZ2 LYS A 585 -15.597 -29.081 19.679 1.00 23.44 H new ATOM 0 HZ3 LYS A 585 -14.080 -28.393 20.007 1.00 23.44 H new ATOM 1300 N THR A 586 -14.477 -22.136 20.131 1.00 12.25 N ATOM 1301 CA THR A 586 -13.750 -21.585 19.031 1.00 35.40 C ATOM 1302 C THR A 586 -12.334 -21.203 19.467 1.00 51.50 C ATOM 1303 O THR A 586 -12.052 -21.059 20.673 1.00 31.14 O ATOM 1304 CB THR A 586 -14.526 -20.327 18.487 1.00 22.35 C ATOM 1305 OG1 THR A 586 -13.831 -19.688 17.431 1.00 61.13 O ATOM 1306 CG2 THR A 586 -14.786 -19.317 19.585 1.00 51.44 C ATOM 0 H THR A 586 -14.287 -21.677 21.022 1.00 12.25 H new ATOM 0 HA THR A 586 -13.665 -22.327 18.237 1.00 35.40 H new ATOM 0 HB THR A 586 -15.476 -20.701 18.106 1.00 22.35 H new ATOM 0 HG1 THR A 586 -13.172 -20.306 17.052 1.00 61.13 H new ATOM 0 HG21 THR A 586 -15.323 -18.462 19.174 1.00 51.44 H new ATOM 0 HG22 THR A 586 -15.385 -19.779 20.370 1.00 51.44 H new ATOM 0 HG23 THR A 586 -13.837 -18.982 20.003 1.00 51.44 H new ATOM 1314 N PHE A 587 -11.456 -21.097 18.507 1.00 61.31 N ATOM 1315 CA PHE A 587 -10.122 -20.653 18.716 1.00 52.23 C ATOM 1316 C PHE A 587 -9.836 -19.621 17.650 1.00 11.30 C ATOM 1317 O PHE A 587 -10.603 -19.498 16.701 1.00 71.43 O ATOM 1318 CB PHE A 587 -9.123 -21.824 18.651 1.00 25.24 C ATOM 1319 CG PHE A 587 -8.956 -22.485 17.307 1.00 20.35 C ATOM 1320 CD1 PHE A 587 -9.847 -23.439 16.859 1.00 72.43 C ATOM 1321 CD2 PHE A 587 -7.873 -22.165 16.512 1.00 42.34 C ATOM 1322 CE1 PHE A 587 -9.652 -24.060 15.637 1.00 12.24 C ATOM 1323 CE2 PHE A 587 -7.681 -22.775 15.295 1.00 51.42 C ATOM 1324 CZ PHE A 587 -8.568 -23.724 14.857 1.00 75.20 C ATOM 0 H PHE A 587 -11.663 -21.325 17.535 1.00 61.31 H new ATOM 0 HA PHE A 587 -10.010 -20.220 19.710 1.00 52.23 H new ATOM 0 HB2 PHE A 587 -8.148 -21.461 18.977 1.00 25.24 H new ATOM 0 HB3 PHE A 587 -9.437 -22.582 19.368 1.00 25.24 H new ATOM 0 HD1 PHE A 587 -10.701 -23.703 17.465 1.00 72.43 H new ATOM 0 HD2 PHE A 587 -7.165 -21.423 16.852 1.00 42.34 H new ATOM 0 HE1 PHE A 587 -10.351 -24.809 15.295 1.00 12.24 H new ATOM 0 HE2 PHE A 587 -6.832 -22.507 14.684 1.00 51.42 H new ATOM 0 HZ PHE A 587 -8.417 -24.207 13.903 1.00 75.20 H new ATOM 1334 N PHE A 588 -8.770 -18.916 17.768 1.00 53.35 N ATOM 1335 CA PHE A 588 -8.493 -17.861 16.838 1.00 4.24 C ATOM 1336 C PHE A 588 -7.254 -18.168 16.057 1.00 64.43 C ATOM 1337 O PHE A 588 -6.417 -18.955 16.483 1.00 25.42 O ATOM 1338 CB PHE A 588 -8.375 -16.492 17.542 1.00 33.41 C ATOM 1339 CG PHE A 588 -9.642 -16.016 18.186 1.00 1.14 C ATOM 1340 CD1 PHE A 588 -10.055 -16.527 19.407 1.00 31.41 C ATOM 1341 CD2 PHE A 588 -10.426 -15.067 17.566 1.00 12.23 C ATOM 1342 CE1 PHE A 588 -11.224 -16.098 19.995 1.00 61.05 C ATOM 1343 CE2 PHE A 588 -11.596 -14.636 18.148 1.00 75.40 C ATOM 1344 CZ PHE A 588 -11.997 -15.150 19.364 1.00 53.01 C ATOM 0 H PHE A 588 -8.069 -19.044 18.497 1.00 53.35 H new ATOM 0 HA PHE A 588 -9.335 -17.797 16.148 1.00 4.24 H new ATOM 0 HB2 PHE A 588 -7.596 -16.554 18.302 1.00 33.41 H new ATOM 0 HB3 PHE A 588 -8.051 -15.749 16.813 1.00 33.41 H new ATOM 0 HD1 PHE A 588 -9.451 -17.272 19.904 1.00 31.41 H new ATOM 0 HD2 PHE A 588 -10.119 -14.658 16.615 1.00 12.23 H new ATOM 0 HE1 PHE A 588 -11.533 -16.504 20.947 1.00 61.05 H new ATOM 0 HE2 PHE A 588 -12.202 -13.893 17.651 1.00 75.40 H new ATOM 0 HZ PHE A 588 -12.915 -14.809 19.820 1.00 53.01 H new ATOM 1354 N LEU A 589 -7.162 -17.598 14.917 1.00 14.13 N ATOM 1355 CA LEU A 589 -6.018 -17.742 14.089 1.00 62.04 C ATOM 1356 C LEU A 589 -5.523 -16.346 13.832 1.00 51.33 C ATOM 1357 O LEU A 589 -6.303 -15.472 13.427 1.00 30.33 O ATOM 1358 CB LEU A 589 -6.403 -18.417 12.760 1.00 4.13 C ATOM 1359 CG LEU A 589 -5.406 -19.424 12.159 1.00 45.32 C ATOM 1360 CD1 LEU A 589 -4.031 -18.819 11.937 1.00 13.04 C ATOM 1361 CD2 LEU A 589 -5.325 -20.655 13.029 1.00 34.11 C ATOM 0 H LEU A 589 -7.892 -17.005 14.521 1.00 14.13 H new ATOM 0 HA LEU A 589 -5.256 -18.362 14.562 1.00 62.04 H new ATOM 0 HB2 LEU A 589 -7.353 -18.931 12.907 1.00 4.13 H new ATOM 0 HB3 LEU A 589 -6.575 -17.633 12.022 1.00 4.13 H new ATOM 0 HG LEU A 589 -5.779 -19.708 11.175 1.00 45.32 H new ATOM 0 HD11 LEU A 589 -3.367 -19.571 11.512 1.00 13.04 H new ATOM 0 HD12 LEU A 589 -4.111 -17.976 11.251 1.00 13.04 H new ATOM 0 HD13 LEU A 589 -3.627 -18.475 12.889 1.00 13.04 H new ATOM 0 HD21 LEU A 589 -4.617 -21.361 12.595 1.00 34.11 H new ATOM 0 HD22 LEU A 589 -4.991 -20.373 14.028 1.00 34.11 H new ATOM 0 HD23 LEU A 589 -6.309 -21.120 13.093 1.00 34.11 H new ATOM 1373 N GLU A 590 -4.286 -16.108 14.108 1.00 51.11 N ATOM 1374 CA GLU A 590 -3.730 -14.813 13.886 1.00 74.23 C ATOM 1375 C GLU A 590 -2.493 -14.927 13.058 1.00 71.31 C ATOM 1376 O GLU A 590 -1.605 -15.749 13.343 1.00 62.43 O ATOM 1377 CB GLU A 590 -3.420 -14.110 15.204 1.00 71.51 C ATOM 1378 CG GLU A 590 -2.838 -12.714 15.048 1.00 42.52 C ATOM 1379 CD GLU A 590 -2.523 -12.072 16.369 1.00 75.34 C ATOM 1380 OE1 GLU A 590 -1.420 -12.295 16.898 1.00 31.32 O ATOM 1381 OE2 GLU A 590 -3.358 -11.330 16.900 1.00 32.45 O ATOM 0 H GLU A 590 -3.636 -16.795 14.490 1.00 51.11 H new ATOM 0 HA GLU A 590 -4.467 -14.213 13.352 1.00 74.23 H new ATOM 0 HB2 GLU A 590 -4.336 -14.045 15.792 1.00 71.51 H new ATOM 0 HB3 GLU A 590 -2.719 -14.722 15.772 1.00 71.51 H new ATOM 0 HG2 GLU A 590 -1.930 -12.767 14.448 1.00 42.52 H new ATOM 0 HG3 GLU A 590 -3.544 -12.088 14.503 1.00 42.52 H new ATOM 1388 N ILE A 591 -2.443 -14.146 12.035 1.00 53.02 N ATOM 1389 CA ILE A 591 -1.299 -14.063 11.203 1.00 21.41 C ATOM 1390 C ILE A 591 -0.508 -12.850 11.617 1.00 44.11 C ATOM 1391 O ILE A 591 -1.084 -11.796 11.924 1.00 32.15 O ATOM 1392 CB ILE A 591 -1.661 -14.031 9.693 1.00 54.55 C ATOM 1393 CG1 ILE A 591 -2.685 -12.914 9.382 1.00 64.41 C ATOM 1394 CG2 ILE A 591 -2.187 -15.396 9.269 1.00 32.12 C ATOM 1395 CD1 ILE A 591 -3.074 -12.805 7.916 1.00 21.23 C ATOM 0 H ILE A 591 -3.211 -13.538 11.750 1.00 53.02 H new ATOM 0 HA ILE A 591 -0.696 -14.962 11.332 1.00 21.41 H new ATOM 0 HB ILE A 591 -0.761 -13.805 9.120 1.00 54.55 H new ATOM 0 HG12 ILE A 591 -3.585 -13.089 9.971 1.00 64.41 H new ATOM 0 HG13 ILE A 591 -2.272 -11.959 9.707 1.00 64.41 H new ATOM 0 HG21 ILE A 591 -2.441 -15.375 8.209 1.00 32.12 H new ATOM 0 HG22 ILE A 591 -1.421 -16.151 9.443 1.00 32.12 H new ATOM 0 HG23 ILE A 591 -3.076 -15.640 9.851 1.00 32.12 H new ATOM 0 HD11 ILE A 591 -3.795 -11.997 7.790 1.00 21.23 H new ATOM 0 HD12 ILE A 591 -2.187 -12.596 7.319 1.00 21.23 H new ATOM 0 HD13 ILE A 591 -3.520 -13.744 7.587 1.00 21.23 H new ATOM 1407 N GLY A 592 0.775 -13.022 11.701 1.00 62.22 N ATOM 1408 CA GLY A 592 1.635 -11.978 12.135 1.00 61.23 C ATOM 1409 C GLY A 592 1.973 -11.053 11.017 1.00 4.22 C ATOM 1410 O GLY A 592 1.493 -11.225 9.887 1.00 10.22 O ATOM 0 H GLY A 592 1.251 -13.894 11.469 1.00 62.22 H new ATOM 0 HA2 GLY A 592 1.155 -11.420 12.939 1.00 61.23 H new ATOM 0 HA3 GLY A 592 2.550 -12.405 12.545 1.00 61.23 H new ATOM 1414 N GLU A 593 2.795 -10.085 11.312 1.00 15.23 N ATOM 1415 CA GLU A 593 3.176 -9.110 10.338 1.00 31.22 C ATOM 1416 C GLU A 593 3.964 -9.735 9.206 1.00 32.44 C ATOM 1417 O GLU A 593 4.877 -10.544 9.439 1.00 54.20 O ATOM 1418 CB GLU A 593 3.949 -7.977 10.972 1.00 11.32 C ATOM 1419 CG GLU A 593 3.145 -7.225 11.992 1.00 73.34 C ATOM 1420 CD GLU A 593 3.853 -6.009 12.476 1.00 54.02 C ATOM 1421 OE1 GLU A 593 4.659 -6.092 13.434 1.00 74.34 O ATOM 1422 OE2 GLU A 593 3.624 -4.932 11.909 1.00 34.34 O ATOM 0 H GLU A 593 3.216 -9.953 12.231 1.00 15.23 H new ATOM 0 HA GLU A 593 2.260 -8.697 9.915 1.00 31.22 H new ATOM 0 HB2 GLU A 593 4.847 -8.375 11.445 1.00 11.32 H new ATOM 0 HB3 GLU A 593 4.278 -7.287 10.194 1.00 11.32 H new ATOM 0 HG2 GLU A 593 2.187 -6.938 11.558 1.00 73.34 H new ATOM 0 HG3 GLU A 593 2.929 -7.879 12.837 1.00 73.34 H new ATOM 1429 N PRO A 594 3.608 -9.387 7.978 1.00 71.45 N ATOM 1430 CA PRO A 594 4.265 -9.902 6.800 1.00 71.42 C ATOM 1431 C PRO A 594 5.670 -9.360 6.697 1.00 22.04 C ATOM 1432 O PRO A 594 5.887 -8.146 6.690 1.00 44.12 O ATOM 1433 CB PRO A 594 3.418 -9.379 5.646 1.00 4.21 C ATOM 1434 CG PRO A 594 2.706 -8.199 6.188 1.00 20.15 C ATOM 1435 CD PRO A 594 2.534 -8.438 7.650 1.00 42.41 C ATOM 0 HA PRO A 594 4.347 -10.989 6.810 1.00 71.42 H new ATOM 0 HB2 PRO A 594 4.040 -9.106 4.794 1.00 4.21 H new ATOM 0 HB3 PRO A 594 2.716 -10.137 5.298 1.00 4.21 H new ATOM 0 HG2 PRO A 594 3.276 -7.287 6.009 1.00 20.15 H new ATOM 0 HG3 PRO A 594 1.740 -8.072 5.700 1.00 20.15 H new ATOM 0 HD2 PRO A 594 2.628 -7.514 8.220 1.00 42.41 H new ATOM 0 HD3 PRO A 594 1.551 -8.852 7.875 1.00 42.41 H new ATOM 1443 N ARG A 595 6.610 -10.232 6.617 1.00 51.31 N ATOM 1444 CA ARG A 595 7.973 -9.836 6.563 1.00 13.52 C ATOM 1445 C ARG A 595 8.535 -10.142 5.202 1.00 13.12 C ATOM 1446 O ARG A 595 8.394 -11.265 4.701 1.00 70.04 O ATOM 1447 CB ARG A 595 8.794 -10.509 7.688 1.00 44.10 C ATOM 1448 CG ARG A 595 8.818 -12.037 7.649 1.00 21.04 C ATOM 1449 CD ARG A 595 9.570 -12.622 8.832 1.00 22.55 C ATOM 1450 NE ARG A 595 10.956 -12.143 8.907 1.00 61.10 N ATOM 1451 CZ ARG A 595 11.870 -12.565 9.784 1.00 13.32 C ATOM 1452 NH1 ARG A 595 11.580 -13.541 10.646 1.00 44.54 N ATOM 1453 NH2 ARG A 595 13.086 -12.021 9.781 1.00 32.01 N ATOM 0 H ARG A 595 6.457 -11.240 6.587 1.00 51.31 H new ATOM 0 HA ARG A 595 8.038 -8.760 6.727 1.00 13.52 H new ATOM 0 HB2 ARG A 595 9.820 -10.144 7.636 1.00 44.10 H new ATOM 0 HB3 ARG A 595 8.391 -10.192 8.650 1.00 44.10 H new ATOM 0 HG2 ARG A 595 7.796 -12.416 7.645 1.00 21.04 H new ATOM 0 HG3 ARG A 595 9.285 -12.369 6.722 1.00 21.04 H new ATOM 0 HD2 ARG A 595 9.049 -12.364 9.754 1.00 22.55 H new ATOM 0 HD3 ARG A 595 9.568 -13.710 8.759 1.00 22.55 H new ATOM 0 HE ARG A 595 11.243 -11.431 8.236 1.00 61.10 H new ATOM 0 HH11 ARG A 595 10.655 -13.970 10.638 1.00 44.54 H new ATOM 0 HH12 ARG A 595 12.284 -13.858 11.313 1.00 44.54 H new ATOM 0 HH21 ARG A 595 13.314 -11.286 9.111 1.00 32.01 H new ATOM 0 HH22 ARG A 595 13.789 -12.339 10.448 1.00 32.01 H new ATOM 1467 N LEU A 596 9.085 -9.136 4.563 1.00 20.24 N ATOM 1468 CA LEU A 596 9.751 -9.322 3.310 1.00 70.41 C ATOM 1469 C LEU A 596 10.959 -10.162 3.626 1.00 32.04 C ATOM 1470 O LEU A 596 11.640 -9.900 4.628 1.00 41.31 O ATOM 1471 CB LEU A 596 10.168 -7.947 2.753 1.00 35.52 C ATOM 1472 CG LEU A 596 10.477 -7.814 1.241 1.00 71.44 C ATOM 1473 CD1 LEU A 596 11.696 -8.598 0.817 1.00 73.34 C ATOM 1474 CD2 LEU A 596 9.281 -8.229 0.426 1.00 74.23 C ATOM 0 H LEU A 596 9.080 -8.174 4.901 1.00 20.24 H new ATOM 0 HA LEU A 596 9.122 -9.802 2.561 1.00 70.41 H new ATOM 0 HB2 LEU A 596 9.373 -7.240 2.990 1.00 35.52 H new ATOM 0 HB3 LEU A 596 11.054 -7.625 3.300 1.00 35.52 H new ATOM 0 HG LEU A 596 10.700 -6.763 1.057 1.00 71.44 H new ATOM 0 HD11 LEU A 596 11.860 -8.465 -0.252 1.00 73.34 H new ATOM 0 HD12 LEU A 596 12.567 -8.240 1.366 1.00 73.34 H new ATOM 0 HD13 LEU A 596 11.541 -9.655 1.031 1.00 73.34 H new ATOM 0 HD21 LEU A 596 9.512 -8.131 -0.635 1.00 74.23 H new ATOM 0 HD22 LEU A 596 9.031 -9.266 0.648 1.00 74.23 H new ATOM 0 HD23 LEU A 596 8.433 -7.591 0.673 1.00 74.23 H new ATOM 1486 N VAL A 597 11.182 -11.177 2.845 1.00 13.31 N ATOM 1487 CA VAL A 597 12.286 -12.080 3.083 1.00 75.11 C ATOM 1488 C VAL A 597 13.620 -11.365 2.905 1.00 63.11 C ATOM 1489 O VAL A 597 14.081 -11.114 1.782 1.00 71.31 O ATOM 1490 CB VAL A 597 12.171 -13.347 2.218 1.00 42.53 C ATOM 1491 CG1 VAL A 597 13.341 -14.299 2.471 1.00 43.11 C ATOM 1492 CG2 VAL A 597 10.861 -14.029 2.550 1.00 54.35 C ATOM 0 H VAL A 597 10.614 -11.408 2.030 1.00 13.31 H new ATOM 0 HA VAL A 597 12.240 -12.412 4.120 1.00 75.11 H new ATOM 0 HB VAL A 597 12.200 -13.069 1.164 1.00 42.53 H new ATOM 0 HG11 VAL A 597 13.231 -15.185 1.845 1.00 43.11 H new ATOM 0 HG12 VAL A 597 14.278 -13.797 2.228 1.00 43.11 H new ATOM 0 HG13 VAL A 597 13.349 -14.595 3.520 1.00 43.11 H new ATOM 0 HG21 VAL A 597 10.758 -14.931 1.948 1.00 54.35 H new ATOM 0 HG22 VAL A 597 10.847 -14.295 3.607 1.00 54.35 H new ATOM 0 HG23 VAL A 597 10.034 -13.353 2.335 1.00 54.35 H new ATOM 2079 N PRO A 634 6.087 -4.973 2.902 1.00 35.33 N ATOM 2080 CA PRO A 634 4.698 -5.427 2.966 1.00 23.25 C ATOM 2081 C PRO A 634 4.089 -5.242 4.354 1.00 35.13 C ATOM 2082 O PRO A 634 4.744 -5.473 5.385 1.00 44.21 O ATOM 2083 CB PRO A 634 4.778 -6.913 2.615 1.00 20.01 C ATOM 2084 CG PRO A 634 6.176 -7.297 2.931 1.00 25.05 C ATOM 2085 CD PRO A 634 7.001 -6.096 2.609 1.00 75.43 C ATOM 0 HA PRO A 634 4.059 -4.855 2.293 1.00 23.25 H new ATOM 0 HB2 PRO A 634 4.065 -7.497 3.197 1.00 20.01 H new ATOM 0 HB3 PRO A 634 4.548 -7.085 1.564 1.00 20.01 H new ATOM 0 HG2 PRO A 634 6.279 -7.574 3.980 1.00 25.05 H new ATOM 0 HG3 PRO A 634 6.489 -8.158 2.341 1.00 25.05 H new ATOM 0 HD2 PRO A 634 7.903 -6.051 3.219 1.00 75.43 H new ATOM 0 HD3 PRO A 634 7.321 -6.094 1.567 1.00 75.43 H new ATOM 2093 N ILE A 635 2.849 -4.831 4.376 1.00 71.05 N ATOM 2094 CA ILE A 635 2.134 -4.610 5.599 1.00 35.24 C ATOM 2095 C ILE A 635 0.829 -5.381 5.580 1.00 72.14 C ATOM 2096 O ILE A 635 0.400 -5.859 4.516 1.00 53.55 O ATOM 2097 CB ILE A 635 1.934 -3.075 5.904 1.00 12.25 C ATOM 2098 CG1 ILE A 635 1.238 -2.289 4.753 1.00 10.44 C ATOM 2099 CG2 ILE A 635 3.272 -2.429 6.220 1.00 11.23 C ATOM 2100 CD1 ILE A 635 -0.261 -2.471 4.635 1.00 35.52 C ATOM 0 H ILE A 635 2.304 -4.639 3.536 1.00 71.05 H new ATOM 0 HA ILE A 635 2.735 -4.991 6.425 1.00 35.24 H new ATOM 0 HB ILE A 635 1.267 -3.024 6.765 1.00 12.25 H new ATOM 0 HG12 ILE A 635 1.445 -1.227 4.888 1.00 10.44 H new ATOM 0 HG13 ILE A 635 1.695 -2.586 3.809 1.00 10.44 H new ATOM 0 HG21 ILE A 635 3.124 -1.370 6.429 1.00 11.23 H new ATOM 0 HG22 ILE A 635 3.713 -2.913 7.092 1.00 11.23 H new ATOM 0 HG23 ILE A 635 3.940 -2.540 5.366 1.00 11.23 H new ATOM 0 HD11 ILE A 635 -0.635 -1.877 3.801 1.00 35.52 H new ATOM 0 HD12 ILE A 635 -0.487 -3.523 4.462 1.00 35.52 H new ATOM 0 HD13 ILE A 635 -0.741 -2.144 5.557 1.00 35.52 H new ATOM 2112 N LEU A 636 0.225 -5.542 6.723 1.00 61.33 N ATOM 2113 CA LEU A 636 -1.010 -6.282 6.806 1.00 22.23 C ATOM 2114 C LEU A 636 -2.234 -5.394 6.735 1.00 13.34 C ATOM 2115 O LEU A 636 -2.124 -4.163 6.732 1.00 52.32 O ATOM 2116 CB LEU A 636 -1.041 -7.262 8.001 1.00 70.41 C ATOM 2117 CG LEU A 636 -0.545 -6.768 9.386 1.00 52.22 C ATOM 2118 CD1 LEU A 636 -1.344 -5.586 9.905 1.00 30.33 C ATOM 2119 CD2 LEU A 636 -0.596 -7.907 10.386 1.00 53.33 C ATOM 0 H LEU A 636 0.564 -5.173 7.611 1.00 61.33 H new ATOM 0 HA LEU A 636 -1.047 -6.905 5.912 1.00 22.23 H new ATOM 0 HB2 LEU A 636 -2.069 -7.603 8.121 1.00 70.41 H new ATOM 0 HB3 LEU A 636 -0.445 -8.133 7.729 1.00 70.41 H new ATOM 0 HG LEU A 636 0.483 -6.428 9.259 1.00 52.22 H new ATOM 0 HD11 LEU A 636 -0.954 -5.282 10.876 1.00 30.33 H new ATOM 0 HD12 LEU A 636 -1.261 -4.755 9.204 1.00 30.33 H new ATOM 0 HD13 LEU A 636 -2.391 -5.871 10.007 1.00 30.33 H new ATOM 0 HD21 LEU A 636 -0.247 -7.555 11.357 1.00 53.33 H new ATOM 0 HD22 LEU A 636 -1.621 -8.265 10.477 1.00 53.33 H new ATOM 0 HD23 LEU A 636 0.043 -8.721 10.044 1.00 53.33 H new ATOM 2131 N GLY A 637 -3.385 -6.020 6.673 1.00 11.04 N ATOM 2132 CA GLY A 637 -4.622 -5.315 6.536 1.00 74.33 C ATOM 2133 C GLY A 637 -5.090 -4.630 7.795 1.00 44.43 C ATOM 2134 O GLY A 637 -4.386 -4.590 8.806 1.00 21.55 O ATOM 0 H GLY A 637 -3.483 -7.034 6.717 1.00 11.04 H new ATOM 0 HA2 GLY A 637 -4.516 -4.569 5.749 1.00 74.33 H new ATOM 0 HA3 GLY A 637 -5.391 -6.015 6.210 1.00 74.33 H new ATOM 2138 N GLU A 638 -6.296 -4.125 7.727 1.00 61.33 N ATOM 2139 CA GLU A 638 -6.940 -3.415 8.807 1.00 74.25 C ATOM 2140 C GLU A 638 -7.211 -4.373 9.965 1.00 44.32 C ATOM 2141 O GLU A 638 -7.029 -4.025 11.136 1.00 34.54 O ATOM 2142 CB GLU A 638 -8.238 -2.794 8.284 1.00 24.10 C ATOM 2143 CG GLU A 638 -9.011 -1.980 9.296 1.00 41.30 C ATOM 2144 CD GLU A 638 -10.244 -1.359 8.702 1.00 51.22 C ATOM 2145 OE1 GLU A 638 -10.149 -0.260 8.137 1.00 42.13 O ATOM 2146 OE2 GLU A 638 -11.335 -1.965 8.783 1.00 52.32 O ATOM 0 H GLU A 638 -6.877 -4.198 6.892 1.00 61.33 H new ATOM 0 HA GLU A 638 -6.294 -2.619 9.177 1.00 74.25 H new ATOM 0 HB2 GLU A 638 -8.000 -2.156 7.433 1.00 24.10 H new ATOM 0 HB3 GLU A 638 -8.882 -3.592 7.915 1.00 24.10 H new ATOM 0 HG2 GLU A 638 -9.295 -2.618 10.133 1.00 41.30 H new ATOM 0 HG3 GLU A 638 -8.368 -1.196 9.697 1.00 41.30 H new ATOM 2153 N HIS A 639 -7.632 -5.574 9.631 1.00 70.33 N ATOM 2154 CA HIS A 639 -7.861 -6.610 10.612 1.00 12.52 C ATOM 2155 C HIS A 639 -7.231 -7.882 10.131 1.00 54.30 C ATOM 2156 O HIS A 639 -7.284 -8.191 8.932 1.00 40.11 O ATOM 2157 CB HIS A 639 -9.362 -6.857 10.880 1.00 31.02 C ATOM 2158 CG HIS A 639 -10.111 -5.687 11.437 1.00 22.34 C ATOM 2159 ND1 HIS A 639 -10.235 -5.414 12.783 1.00 5.34 N ATOM 2160 CD2 HIS A 639 -10.800 -4.718 10.799 1.00 1.25 C ATOM 2161 CE1 HIS A 639 -10.978 -4.322 12.914 1.00 51.04 C ATOM 2162 NE2 HIS A 639 -11.350 -3.852 11.734 1.00 51.43 N ATOM 0 H HIS A 639 -7.825 -5.859 8.671 1.00 70.33 H new ATOM 0 HA HIS A 639 -7.415 -6.279 11.550 1.00 12.52 H new ATOM 0 HB2 HIS A 639 -9.836 -7.161 9.947 1.00 31.02 H new ATOM 0 HB3 HIS A 639 -9.458 -7.693 11.573 1.00 31.02 H new ATOM 0 HD2 HIS A 639 -10.907 -4.630 9.728 1.00 1.25 H new ATOM 0 HE1 HIS A 639 -11.244 -3.875 13.860 1.00 51.04 H new ATOM 0 HE2 HIS A 639 -11.921 -3.027 11.550 1.00 51.43 H new ATOM 2170 N THR A 640 -6.604 -8.585 11.025 1.00 1.25 N ATOM 2171 CA THR A 640 -6.017 -9.855 10.745 1.00 23.34 C ATOM 2172 C THR A 640 -6.335 -10.809 11.872 1.00 63.20 C ATOM 2173 O THR A 640 -5.595 -10.916 12.869 1.00 63.21 O ATOM 2174 CB THR A 640 -4.499 -9.774 10.517 1.00 20.24 C ATOM 2175 OG1 THR A 640 -3.876 -8.996 11.560 1.00 40.21 O ATOM 2176 CG2 THR A 640 -4.181 -9.172 9.168 1.00 2.30 C ATOM 0 H THR A 640 -6.485 -8.282 11.992 1.00 1.25 H new ATOM 0 HA THR A 640 -6.446 -10.221 9.812 1.00 23.34 H new ATOM 0 HB THR A 640 -4.103 -10.789 10.542 1.00 20.24 H new ATOM 0 HG1 THR A 640 -4.153 -9.341 12.435 1.00 40.21 H new ATOM 0 HG21 THR A 640 -3.100 -9.128 9.035 1.00 2.30 H new ATOM 0 HG22 THR A 640 -4.618 -9.788 8.382 1.00 2.30 H new ATOM 0 HG23 THR A 640 -4.595 -8.165 9.112 1.00 2.30 H new ATOM 2184 N LYS A 641 -7.445 -11.456 11.743 1.00 74.41 N ATOM 2185 CA LYS A 641 -7.939 -12.347 12.763 1.00 4.43 C ATOM 2186 C LYS A 641 -8.925 -13.286 12.146 1.00 71.21 C ATOM 2187 O LYS A 641 -9.638 -12.917 11.207 1.00 32.03 O ATOM 2188 CB LYS A 641 -8.626 -11.563 13.910 1.00 3.42 C ATOM 2189 CG LYS A 641 -9.159 -12.451 15.051 1.00 70.31 C ATOM 2190 CD LYS A 641 -9.939 -11.656 16.100 1.00 72.35 C ATOM 2191 CE LYS A 641 -9.060 -10.675 16.862 1.00 74.02 C ATOM 2192 NZ LYS A 641 -8.014 -11.354 17.660 1.00 21.03 N ATOM 0 H LYS A 641 -8.047 -11.387 10.923 1.00 74.41 H new ATOM 0 HA LYS A 641 -7.097 -12.896 13.184 1.00 4.43 H new ATOM 0 HB2 LYS A 641 -7.915 -10.848 14.323 1.00 3.42 H new ATOM 0 HB3 LYS A 641 -9.454 -10.987 13.496 1.00 3.42 H new ATOM 0 HG2 LYS A 641 -9.803 -13.225 14.634 1.00 70.31 H new ATOM 0 HG3 LYS A 641 -8.323 -12.958 15.533 1.00 70.31 H new ATOM 0 HD2 LYS A 641 -10.747 -11.111 15.611 1.00 72.35 H new ATOM 0 HD3 LYS A 641 -10.402 -12.347 16.805 1.00 72.35 H new ATOM 0 HE2 LYS A 641 -8.588 -9.991 16.157 1.00 74.02 H new ATOM 0 HE3 LYS A 641 -9.682 -10.072 17.523 1.00 74.02 H new ATOM 0 HZ1 LYS A 641 -7.565 -10.668 18.300 1.00 21.03 H new ATOM 0 HZ2 LYS A 641 -8.445 -12.118 18.219 1.00 21.03 H new ATOM 0 HZ3 LYS A 641 -7.296 -11.754 17.023 1.00 21.03 H new ATOM 2206 N LEU A 642 -8.934 -14.479 12.627 1.00 34.12 N ATOM 2207 CA LEU A 642 -9.855 -15.452 12.191 1.00 72.10 C ATOM 2208 C LEU A 642 -10.397 -16.182 13.398 1.00 34.45 C ATOM 2209 O LEU A 642 -9.637 -16.740 14.179 1.00 64.23 O ATOM 2210 CB LEU A 642 -9.155 -16.425 11.297 1.00 3.43 C ATOM 2211 CG LEU A 642 -10.014 -17.477 10.651 1.00 70.40 C ATOM 2212 CD1 LEU A 642 -10.882 -16.896 9.544 1.00 40.53 C ATOM 2213 CD2 LEU A 642 -9.145 -18.579 10.151 1.00 24.13 C ATOM 0 H LEU A 642 -8.288 -14.805 13.346 1.00 34.12 H new ATOM 0 HA LEU A 642 -10.671 -14.978 11.645 1.00 72.10 H new ATOM 0 HB2 LEU A 642 -8.651 -15.864 10.510 1.00 3.43 H new ATOM 0 HB3 LEU A 642 -8.380 -16.926 11.877 1.00 3.43 H new ATOM 0 HG LEU A 642 -10.701 -17.879 11.396 1.00 70.40 H new ATOM 0 HD11 LEU A 642 -11.487 -17.688 9.103 1.00 40.53 H new ATOM 0 HD12 LEU A 642 -11.535 -16.128 9.959 1.00 40.53 H new ATOM 0 HD13 LEU A 642 -10.246 -16.455 8.776 1.00 40.53 H new ATOM 0 HD21 LEU A 642 -9.762 -19.345 9.682 1.00 24.13 H new ATOM 0 HD22 LEU A 642 -8.440 -18.183 9.420 1.00 24.13 H new ATOM 0 HD23 LEU A 642 -8.596 -19.016 10.985 1.00 24.13 H new ATOM 2225 N GLU A 643 -11.665 -16.122 13.569 1.00 72.31 N ATOM 2226 CA GLU A 643 -12.346 -16.818 14.619 1.00 15.05 C ATOM 2227 C GLU A 643 -12.768 -18.176 14.050 1.00 54.22 C ATOM 2228 O GLU A 643 -13.646 -18.245 13.200 1.00 51.24 O ATOM 2229 CB GLU A 643 -13.565 -15.981 15.038 1.00 12.24 C ATOM 2230 CG GLU A 643 -14.316 -16.458 16.269 1.00 72.40 C ATOM 2231 CD GLU A 643 -15.502 -15.563 16.596 1.00 63.55 C ATOM 2232 OE1 GLU A 643 -15.334 -14.318 16.671 1.00 12.11 O ATOM 2233 OE2 GLU A 643 -16.632 -16.080 16.777 1.00 51.15 O ATOM 0 H GLU A 643 -12.284 -15.575 12.971 1.00 72.31 H new ATOM 0 HA GLU A 643 -11.720 -16.970 15.498 1.00 15.05 H new ATOM 0 HB2 GLU A 643 -13.233 -14.958 15.214 1.00 12.24 H new ATOM 0 HB3 GLU A 643 -14.263 -15.950 14.201 1.00 12.24 H new ATOM 0 HG2 GLU A 643 -14.665 -17.478 16.108 1.00 72.40 H new ATOM 0 HG3 GLU A 643 -13.636 -16.485 17.121 1.00 72.40 H new ATOM 2240 N VAL A 644 -12.083 -19.224 14.438 1.00 33.30 N ATOM 2241 CA VAL A 644 -12.369 -20.550 13.931 1.00 72.12 C ATOM 2242 C VAL A 644 -13.220 -21.296 14.927 1.00 63.11 C ATOM 2243 O VAL A 644 -12.746 -21.695 15.999 1.00 24.35 O ATOM 2244 CB VAL A 644 -11.095 -21.378 13.668 1.00 61.01 C ATOM 2245 CG1 VAL A 644 -11.454 -22.699 13.011 1.00 21.01 C ATOM 2246 CG2 VAL A 644 -10.105 -20.614 12.817 1.00 62.52 C ATOM 0 H VAL A 644 -11.316 -19.186 15.109 1.00 33.30 H new ATOM 0 HA VAL A 644 -12.888 -20.419 12.981 1.00 72.12 H new ATOM 0 HB VAL A 644 -10.620 -21.578 14.628 1.00 61.01 H new ATOM 0 HG11 VAL A 644 -10.546 -23.274 12.831 1.00 21.01 H new ATOM 0 HG12 VAL A 644 -12.117 -23.263 13.667 1.00 21.01 H new ATOM 0 HG13 VAL A 644 -11.957 -22.509 12.063 1.00 21.01 H new ATOM 0 HG21 VAL A 644 -9.219 -21.227 12.651 1.00 62.52 H new ATOM 0 HG22 VAL A 644 -10.562 -20.370 11.858 1.00 62.52 H new ATOM 0 HG23 VAL A 644 -9.820 -19.694 13.328 1.00 62.52 H new ATOM 2256 N ILE A 645 -14.459 -21.446 14.609 1.00 70.21 N ATOM 2257 CA ILE A 645 -15.408 -22.109 15.480 1.00 23.13 C ATOM 2258 C ILE A 645 -15.420 -23.593 15.160 1.00 23.33 C ATOM 2259 O ILE A 645 -15.542 -23.965 13.997 1.00 30.33 O ATOM 2260 CB ILE A 645 -16.824 -21.531 15.264 1.00 70.14 C ATOM 2261 CG1 ILE A 645 -16.791 -20.000 15.399 1.00 24.02 C ATOM 2262 CG2 ILE A 645 -17.806 -22.139 16.273 1.00 3.22 C ATOM 2263 CD1 ILE A 645 -18.071 -19.315 14.989 1.00 52.42 C ATOM 0 H ILE A 645 -14.861 -21.114 13.732 1.00 70.21 H new ATOM 0 HA ILE A 645 -15.114 -21.950 16.518 1.00 23.13 H new ATOM 0 HB ILE A 645 -17.162 -21.786 14.260 1.00 70.14 H new ATOM 0 HG12 ILE A 645 -16.570 -19.743 16.435 1.00 24.02 H new ATOM 0 HG13 ILE A 645 -15.973 -19.611 14.792 1.00 24.02 H new ATOM 0 HG21 ILE A 645 -18.800 -21.723 16.109 1.00 3.22 H new ATOM 0 HG22 ILE A 645 -17.839 -23.221 16.142 1.00 3.22 H new ATOM 0 HG23 ILE A 645 -17.477 -21.906 17.286 1.00 3.22 H new ATOM 0 HD11 ILE A 645 -17.963 -18.238 15.115 1.00 52.42 H new ATOM 0 HD12 ILE A 645 -18.285 -19.539 13.944 1.00 52.42 H new ATOM 0 HD13 ILE A 645 -18.891 -19.673 15.612 1.00 52.42 H new ATOM 2275 N ILE A 646 -15.275 -24.432 16.163 1.00 32.10 N ATOM 2276 CA ILE A 646 -15.291 -25.861 15.929 1.00 20.43 C ATOM 2277 C ILE A 646 -16.619 -26.425 16.381 1.00 52.11 C ATOM 2278 O ILE A 646 -16.878 -26.578 17.584 1.00 31.33 O ATOM 2279 CB ILE A 646 -14.147 -26.625 16.659 1.00 73.24 C ATOM 2280 CG1 ILE A 646 -12.787 -26.012 16.328 1.00 61.15 C ATOM 2281 CG2 ILE A 646 -14.171 -28.101 16.266 1.00 12.35 C ATOM 2282 CD1 ILE A 646 -11.645 -26.636 17.093 1.00 11.32 C ATOM 0 H ILE A 646 -15.146 -24.155 17.136 1.00 32.10 H new ATOM 0 HA ILE A 646 -15.138 -26.003 14.859 1.00 20.43 H new ATOM 0 HB ILE A 646 -14.306 -26.540 17.734 1.00 73.24 H new ATOM 0 HG12 ILE A 646 -12.599 -26.118 15.260 1.00 61.15 H new ATOM 0 HG13 ILE A 646 -12.817 -24.944 16.542 1.00 61.15 H new ATOM 0 HG21 ILE A 646 -13.368 -28.628 16.781 1.00 12.35 H new ATOM 0 HG22 ILE A 646 -15.130 -28.537 16.547 1.00 12.35 H new ATOM 0 HG23 ILE A 646 -14.033 -28.193 15.189 1.00 12.35 H new ATOM 0 HD11 ILE A 646 -10.710 -26.153 16.809 1.00 11.32 H new ATOM 0 HD12 ILE A 646 -11.810 -26.507 18.163 1.00 11.32 H new ATOM 0 HD13 ILE A 646 -11.589 -27.699 16.860 1.00 11.32 H new ATOM 2294 N GLU A 647 -17.457 -26.710 15.445 1.00 4.34 N ATOM 2295 CA GLU A 647 -18.729 -27.276 15.745 1.00 22.14 C ATOM 2296 C GLU A 647 -18.653 -28.782 15.621 1.00 74.42 C ATOM 2297 O GLU A 647 -18.155 -29.320 14.626 1.00 64.03 O ATOM 2298 CB GLU A 647 -19.837 -26.651 14.893 1.00 41.31 C ATOM 2299 CG GLU A 647 -19.532 -26.579 13.417 1.00 3.31 C ATOM 2300 CD GLU A 647 -20.637 -25.930 12.638 1.00 21.32 C ATOM 2301 OE1 GLU A 647 -20.625 -24.703 12.484 1.00 71.45 O ATOM 2302 OE2 GLU A 647 -21.530 -26.640 12.137 1.00 51.24 O ATOM 0 H GLU A 647 -17.282 -26.558 14.452 1.00 4.34 H new ATOM 0 HA GLU A 647 -18.996 -27.046 16.776 1.00 22.14 H new ATOM 0 HB2 GLU A 647 -20.753 -27.226 15.033 1.00 41.31 H new ATOM 0 HB3 GLU A 647 -20.034 -25.643 15.259 1.00 41.31 H new ATOM 0 HG2 GLU A 647 -18.608 -26.021 13.266 1.00 3.31 H new ATOM 0 HG3 GLU A 647 -19.363 -27.585 13.034 1.00 3.31 H new