USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1071 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 CYS SG : rot 160:sc= 0.432 USER MOD Set 1.2: A 54 TYR OH : rot 16:sc= 0.774 USER MOD Single : A 1 MET CE :methyl 175:sc= 0 (180deg=-0.0279) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.00625) USER MOD Single : A 7 HIS : no HE2:sc= 0.413 K(o=0.41,f=-1.4) USER MOD Single : A 11 GLN : amide:sc= 0.168 K(o=0.17,f=-3!) USER MOD Single : A 12 ASN : amide:sc= 0.401 K(o=0.4,f=-0.16) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 174:sc= 0.00431 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.527 K(o=0.53,f=-5.7!) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 CYS SG : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 CYS SG : rot 180:sc= -0.792 USER MOD Single : A 45 ASN : amide:sc= -0.829 K(o=-0.83,f=-4.3!) USER MOD Single : A 49 CYS SG : rot 45:sc= 0.372 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl -172:sc= 0 (180deg=-0.0739) USER MOD Single : A 61 GLN : amide:sc= -0.192 X(o=-0.19,f=-0.3) USER MOD Single : A 64 CYS SG : rot 180:sc= 0.0196 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HE2:sc= 0.754 K(o=0.75,f=-2.4!) USER MOD Single : A 74 THR OG1 : rot -68:sc= 1.96 USER MOD Single : A 75 GLN : amide:sc= 0.157 X(o=0.16,f=-0.28) USER MOD Single : A 81 GLN : amide:sc= 0.862 K(o=0.86,f=-5.4!) USER MOD Single : A 84 GLN : amide:sc=-0.00983 X(o=-0.0098,f=-0.021) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00105) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 CYS SG : rot -51:sc= 0.569 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 0.367 K(o=0.37,f=-3.1!) USER MOD Single : A 124 MET CE :methyl 137:sc= -0.0252 (180deg=-0.239) USER MOD Single : A 128 ASN : amide:sc= 0.781 K(o=0.78,f=-0.37) USER MOD Single : A 133 MET CE :methyl 173:sc= 0 (180deg=-0.0577) USER MOD Single : A 135 LYS NZ :NH3+ 158:sc= 0.0121 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 47.289 0.087 -34.654 1.00 0.00 N ATOM 2 CA MET A 1 46.911 1.457 -35.121 1.00 0.00 C ATOM 3 C MET A 1 46.113 2.243 -34.057 1.00 0.00 C ATOM 4 O MET A 1 46.734 3.104 -33.426 1.00 0.00 O ATOM 5 CB MET A 1 46.273 1.477 -36.533 1.00 0.00 C ATOM 6 CG MET A 1 47.317 1.356 -37.656 1.00 0.00 C ATOM 7 SD MET A 1 46.640 1.346 -39.345 1.00 0.00 S ATOM 8 CE MET A 1 46.064 3.062 -39.503 1.00 0.00 C ATOM 0 H1 MET A 1 47.935 -0.349 -35.343 1.00 0.00 H new ATOM 0 H2 MET A 1 47.762 0.153 -33.730 1.00 0.00 H new ATOM 0 H3 MET A 1 46.433 -0.497 -34.564 1.00 0.00 H new ATOM 0 HA MET A 1 47.846 2.003 -35.245 1.00 0.00 H new ATOM 0 HB2 MET A 1 45.559 0.658 -36.616 1.00 0.00 H new ATOM 0 HB3 MET A 1 45.713 2.403 -36.661 1.00 0.00 H new ATOM 0 HG2 MET A 1 48.019 2.185 -37.568 1.00 0.00 H new ATOM 0 HG3 MET A 1 47.886 0.439 -37.504 1.00 0.00 H new ATOM 0 HE1 MET A 1 45.705 3.233 -40.518 1.00 0.00 H new ATOM 0 HE2 MET A 1 45.254 3.240 -38.796 1.00 0.00 H new ATOM 0 HE3 MET A 1 46.888 3.743 -39.290 1.00 0.00 H new ATOM 18 N PRO A 2 44.793 2.019 -33.823 1.00 0.00 N ATOM 19 CA PRO A 2 44.020 2.816 -32.864 1.00 0.00 C ATOM 20 C PRO A 2 44.406 2.500 -31.409 1.00 0.00 C ATOM 21 O PRO A 2 44.580 1.338 -31.043 1.00 0.00 O ATOM 22 CB PRO A 2 42.547 2.489 -33.136 1.00 0.00 C ATOM 23 CG PRO A 2 42.601 1.061 -33.675 1.00 0.00 C ATOM 24 CD PRO A 2 43.903 1.057 -34.475 1.00 0.00 C ATOM 0 HA PRO A 2 44.222 3.880 -32.991 1.00 0.00 H new ATOM 0 HB2 PRO A 2 41.946 2.555 -32.229 1.00 0.00 H new ATOM 0 HB3 PRO A 2 42.109 3.176 -33.860 1.00 0.00 H new ATOM 0 HG2 PRO A 2 42.616 0.325 -32.872 1.00 0.00 H new ATOM 0 HG3 PRO A 2 41.739 0.831 -34.302 1.00 0.00 H new ATOM 0 HD2 PRO A 2 44.348 0.062 -34.487 1.00 0.00 H new ATOM 0 HD3 PRO A 2 43.722 1.337 -35.513 1.00 0.00 H new ATOM 32 N VAL A 3 44.507 3.546 -30.577 1.00 0.00 N ATOM 33 CA VAL A 3 44.762 3.468 -29.123 1.00 0.00 C ATOM 34 C VAL A 3 43.997 4.603 -28.431 1.00 0.00 C ATOM 35 O VAL A 3 44.116 5.763 -28.833 1.00 0.00 O ATOM 36 CB VAL A 3 46.274 3.576 -28.779 1.00 0.00 C ATOM 37 CG1 VAL A 3 46.518 3.535 -27.258 1.00 0.00 C ATOM 38 CG2 VAL A 3 47.117 2.460 -29.419 1.00 0.00 C ATOM 0 H VAL A 3 44.411 4.507 -30.905 1.00 0.00 H new ATOM 0 HA VAL A 3 44.422 2.494 -28.772 1.00 0.00 H new ATOM 0 HB VAL A 3 46.586 4.537 -29.188 1.00 0.00 H new ATOM 0 HG11 VAL A 3 47.587 3.613 -27.059 1.00 0.00 H new ATOM 0 HG12 VAL A 3 45.999 4.368 -26.784 1.00 0.00 H new ATOM 0 HG13 VAL A 3 46.141 2.595 -26.854 1.00 0.00 H new ATOM 0 HG21 VAL A 3 48.163 2.590 -29.142 1.00 0.00 H new ATOM 0 HG22 VAL A 3 46.766 1.491 -29.066 1.00 0.00 H new ATOM 0 HG23 VAL A 3 47.020 2.508 -30.504 1.00 0.00 H new ATOM 48 N ARG A 4 43.231 4.271 -27.383 1.00 0.00 N ATOM 49 CA ARG A 4 42.500 5.236 -26.548 1.00 0.00 C ATOM 50 C ARG A 4 43.232 5.454 -25.214 1.00 0.00 C ATOM 51 O ARG A 4 43.518 4.492 -24.494 1.00 0.00 O ATOM 52 CB ARG A 4 41.052 4.762 -26.319 1.00 0.00 C ATOM 53 CG ARG A 4 40.263 4.674 -27.639 1.00 0.00 C ATOM 54 CD ARG A 4 38.789 4.302 -27.424 1.00 0.00 C ATOM 55 NE ARG A 4 38.033 5.372 -26.745 1.00 0.00 N ATOM 56 CZ ARG A 4 37.505 6.458 -27.304 1.00 0.00 C ATOM 57 NH1 ARG A 4 37.621 6.715 -28.591 1.00 0.00 N ATOM 58 NH2 ARG A 4 36.840 7.316 -26.560 1.00 0.00 N ATOM 0 H ARG A 4 43.099 3.304 -27.085 1.00 0.00 H new ATOM 0 HA ARG A 4 42.461 6.192 -27.070 1.00 0.00 H new ATOM 0 HB2 ARG A 4 41.062 3.785 -25.836 1.00 0.00 H new ATOM 0 HB3 ARG A 4 40.548 5.449 -25.639 1.00 0.00 H new ATOM 0 HG2 ARG A 4 40.320 5.632 -28.156 1.00 0.00 H new ATOM 0 HG3 ARG A 4 40.730 3.933 -28.288 1.00 0.00 H new ATOM 0 HD2 ARG A 4 38.326 4.089 -28.388 1.00 0.00 H new ATOM 0 HD3 ARG A 4 38.730 3.388 -26.833 1.00 0.00 H new ATOM 0 HE ARG A 4 37.901 5.268 -25.739 1.00 0.00 H new ATOM 0 HH11 ARG A 4 38.130 6.070 -29.196 1.00 0.00 H new ATOM 0 HH12 ARG A 4 37.202 7.559 -28.982 1.00 0.00 H new ATOM 0 HH21 ARG A 4 36.731 7.147 -25.560 1.00 0.00 H new ATOM 0 HH22 ARG A 4 36.433 8.150 -26.983 1.00 0.00 H new ATOM 72 N ARG A 5 43.529 6.720 -24.899 1.00 0.00 N ATOM 73 CA ARG A 5 44.315 7.184 -23.737 1.00 0.00 C ATOM 74 C ARG A 5 44.221 8.713 -23.558 1.00 0.00 C ATOM 75 O ARG A 5 43.746 9.419 -24.454 1.00 0.00 O ATOM 76 CB ARG A 5 45.779 6.687 -23.818 1.00 0.00 C ATOM 77 CG ARG A 5 46.545 7.167 -25.063 1.00 0.00 C ATOM 78 CD ARG A 5 47.961 6.575 -25.088 1.00 0.00 C ATOM 79 NE ARG A 5 48.696 6.985 -26.300 1.00 0.00 N ATOM 80 CZ ARG A 5 49.434 8.081 -26.461 1.00 0.00 C ATOM 81 NH1 ARG A 5 49.579 8.979 -25.508 1.00 0.00 N ATOM 82 NH2 ARG A 5 50.047 8.289 -27.605 1.00 0.00 N ATOM 0 H ARG A 5 43.211 7.497 -25.478 1.00 0.00 H new ATOM 0 HA ARG A 5 43.878 6.742 -22.841 1.00 0.00 H new ATOM 0 HB2 ARG A 5 46.313 7.019 -22.928 1.00 0.00 H new ATOM 0 HB3 ARG A 5 45.781 5.597 -23.803 1.00 0.00 H new ATOM 0 HG2 ARG A 5 46.006 6.873 -25.964 1.00 0.00 H new ATOM 0 HG3 ARG A 5 46.600 8.256 -25.065 1.00 0.00 H new ATOM 0 HD2 ARG A 5 48.508 6.899 -24.202 1.00 0.00 H new ATOM 0 HD3 ARG A 5 47.903 5.487 -25.047 1.00 0.00 H new ATOM 0 HE ARG A 5 48.631 6.360 -27.103 1.00 0.00 H new ATOM 0 HH11 ARG A 5 49.117 8.847 -24.608 1.00 0.00 H new ATOM 0 HH12 ARG A 5 50.153 9.806 -25.670 1.00 0.00 H new ATOM 0 HH21 ARG A 5 49.956 7.613 -28.363 1.00 0.00 H new ATOM 0 HH22 ARG A 5 50.614 9.127 -27.735 1.00 0.00 H new ATOM 96 N GLY A 6 44.671 9.218 -22.404 1.00 0.00 N ATOM 97 CA GLY A 6 44.569 10.628 -21.990 1.00 0.00 C ATOM 98 C GLY A 6 44.024 10.747 -20.569 1.00 0.00 C ATOM 99 O GLY A 6 44.717 10.407 -19.611 1.00 0.00 O ATOM 0 H GLY A 6 45.134 8.637 -21.705 1.00 0.00 H new ATOM 0 HA2 GLY A 6 45.551 11.098 -22.047 1.00 0.00 H new ATOM 0 HA3 GLY A 6 43.917 11.166 -22.679 1.00 0.00 H new ATOM 103 N HIS A 7 42.785 11.220 -20.430 1.00 0.00 N ATOM 104 CA HIS A 7 42.072 11.349 -19.151 1.00 0.00 C ATOM 105 C HIS A 7 40.581 10.951 -19.277 1.00 0.00 C ATOM 106 O HIS A 7 40.037 10.883 -20.386 1.00 0.00 O ATOM 107 CB HIS A 7 42.229 12.795 -18.637 1.00 0.00 C ATOM 108 CG HIS A 7 41.576 13.844 -19.508 1.00 0.00 C ATOM 109 ND1 HIS A 7 40.256 14.240 -19.470 1.00 0.00 N ATOM 110 CD2 HIS A 7 42.188 14.586 -20.485 1.00 0.00 C ATOM 111 CE1 HIS A 7 40.078 15.191 -20.403 1.00 0.00 C ATOM 112 NE2 HIS A 7 41.232 15.440 -21.053 1.00 0.00 N ATOM 0 H HIS A 7 42.230 11.534 -21.226 1.00 0.00 H new ATOM 0 HA HIS A 7 42.510 10.658 -18.431 1.00 0.00 H new ATOM 0 HB2 HIS A 7 41.806 12.859 -17.634 1.00 0.00 H new ATOM 0 HB3 HIS A 7 43.291 13.023 -18.550 1.00 0.00 H new ATOM 0 HD1 HIS A 7 39.539 13.875 -18.843 1.00 0.00 H new ATOM 0 HD2 HIS A 7 43.228 14.523 -20.769 1.00 0.00 H new ATOM 0 HE1 HIS A 7 39.140 15.687 -20.604 1.00 0.00 H new ATOM 120 N VAL A 8 39.902 10.716 -18.145 1.00 0.00 N ATOM 121 CA VAL A 8 38.458 10.394 -18.102 1.00 0.00 C ATOM 122 C VAL A 8 37.598 11.615 -18.476 1.00 0.00 C ATOM 123 O VAL A 8 37.958 12.757 -18.178 1.00 0.00 O ATOM 124 CB VAL A 8 38.053 9.787 -16.732 1.00 0.00 C ATOM 125 CG1 VAL A 8 38.002 10.813 -15.585 1.00 0.00 C ATOM 126 CG2 VAL A 8 36.723 9.021 -16.812 1.00 0.00 C ATOM 0 H VAL A 8 40.338 10.743 -17.223 1.00 0.00 H new ATOM 0 HA VAL A 8 38.265 9.630 -18.855 1.00 0.00 H new ATOM 0 HB VAL A 8 38.853 9.086 -16.494 1.00 0.00 H new ATOM 0 HG11 VAL A 8 37.712 10.312 -14.661 1.00 0.00 H new ATOM 0 HG12 VAL A 8 38.985 11.266 -15.458 1.00 0.00 H new ATOM 0 HG13 VAL A 8 37.273 11.588 -15.822 1.00 0.00 H new ATOM 0 HG21 VAL A 8 36.478 8.613 -15.831 1.00 0.00 H new ATOM 0 HG22 VAL A 8 35.931 9.699 -17.131 1.00 0.00 H new ATOM 0 HG23 VAL A 8 36.815 8.207 -17.531 1.00 0.00 H new ATOM 136 N ALA A 9 36.451 11.374 -19.120 1.00 0.00 N ATOM 137 CA ALA A 9 35.440 12.395 -19.414 1.00 0.00 C ATOM 138 C ALA A 9 34.742 12.913 -18.126 1.00 0.00 C ATOM 139 O ALA A 9 34.658 12.167 -17.141 1.00 0.00 O ATOM 140 CB ALA A 9 34.432 11.785 -20.402 1.00 0.00 C ATOM 0 H ALA A 9 36.195 10.446 -19.458 1.00 0.00 H new ATOM 0 HA ALA A 9 35.918 13.268 -19.859 1.00 0.00 H new ATOM 0 HB1 ALA A 9 33.665 12.522 -20.641 1.00 0.00 H new ATOM 0 HB2 ALA A 9 34.950 11.491 -21.315 1.00 0.00 H new ATOM 0 HB3 ALA A 9 33.965 10.909 -19.951 1.00 0.00 H new ATOM 146 N PRO A 10 34.223 14.160 -18.115 1.00 0.00 N ATOM 147 CA PRO A 10 33.518 14.722 -16.965 1.00 0.00 C ATOM 148 C PRO A 10 32.183 14.006 -16.712 1.00 0.00 C ATOM 149 O PRO A 10 31.560 13.464 -17.627 1.00 0.00 O ATOM 150 CB PRO A 10 33.325 16.209 -17.280 1.00 0.00 C ATOM 151 CG PRO A 10 33.293 16.243 -18.806 1.00 0.00 C ATOM 152 CD PRO A 10 34.279 15.141 -19.192 1.00 0.00 C ATOM 0 HA PRO A 10 34.088 14.589 -16.045 1.00 0.00 H new ATOM 0 HB2 PRO A 10 32.401 16.595 -16.850 1.00 0.00 H new ATOM 0 HB3 PRO A 10 34.139 16.814 -16.881 1.00 0.00 H new ATOM 0 HG2 PRO A 10 32.294 16.045 -19.194 1.00 0.00 H new ATOM 0 HG3 PRO A 10 33.599 17.214 -19.195 1.00 0.00 H new ATOM 0 HD2 PRO A 10 34.007 14.690 -20.146 1.00 0.00 H new ATOM 0 HD3 PRO A 10 35.287 15.540 -19.305 1.00 0.00 H new ATOM 160 N GLN A 11 31.750 14.009 -15.448 1.00 0.00 N ATOM 161 CA GLN A 11 30.531 13.344 -14.979 1.00 0.00 C ATOM 162 C GLN A 11 29.251 14.054 -15.467 1.00 0.00 C ATOM 163 O GLN A 11 29.254 15.237 -15.816 1.00 0.00 O ATOM 164 CB GLN A 11 30.544 13.240 -13.438 1.00 0.00 C ATOM 165 CG GLN A 11 31.649 12.327 -12.863 1.00 0.00 C ATOM 166 CD GLN A 11 33.072 12.905 -12.887 1.00 0.00 C ATOM 167 OE1 GLN A 11 33.306 14.101 -13.038 1.00 0.00 O ATOM 168 NE2 GLN A 11 34.090 12.078 -12.742 1.00 0.00 N ATOM 0 H GLN A 11 32.253 14.488 -14.701 1.00 0.00 H new ATOM 0 HA GLN A 11 30.519 12.342 -15.407 1.00 0.00 H new ATOM 0 HB2 GLN A 11 30.664 14.240 -13.021 1.00 0.00 H new ATOM 0 HB3 GLN A 11 29.575 12.869 -13.104 1.00 0.00 H new ATOM 0 HG2 GLN A 11 31.393 12.084 -11.832 1.00 0.00 H new ATOM 0 HG3 GLN A 11 31.648 11.391 -13.421 1.00 0.00 H new ATOM 0 HE21 GLN A 11 33.922 11.080 -12.615 1.00 0.00 H new ATOM 0 HE22 GLN A 11 35.045 12.437 -12.757 1.00 0.00 H new ATOM 177 N ASN A 12 28.123 13.334 -15.452 1.00 0.00 N ATOM 178 CA ASN A 12 26.819 13.785 -15.958 1.00 0.00 C ATOM 179 C ASN A 12 26.036 14.641 -14.941 1.00 0.00 C ATOM 180 O ASN A 12 24.851 14.428 -14.682 1.00 0.00 O ATOM 181 CB ASN A 12 26.048 12.567 -16.486 1.00 0.00 C ATOM 182 CG ASN A 12 25.845 11.450 -15.460 1.00 0.00 C ATOM 183 OD1 ASN A 12 26.481 10.404 -15.525 1.00 0.00 O ATOM 184 ND2 ASN A 12 24.992 11.643 -14.471 1.00 0.00 N ATOM 0 H ASN A 12 28.091 12.387 -15.074 1.00 0.00 H new ATOM 0 HA ASN A 12 26.973 14.473 -16.790 1.00 0.00 H new ATOM 0 HB2 ASN A 12 25.072 12.897 -16.842 1.00 0.00 H new ATOM 0 HB3 ASN A 12 26.581 12.161 -17.346 1.00 0.00 H new ATOM 0 HD21 ASN A 12 24.862 10.922 -13.761 1.00 0.00 H new ATOM 0 HD22 ASN A 12 24.463 12.513 -14.417 1.00 0.00 H new ATOM 191 N THR A 13 26.726 15.612 -14.350 1.00 0.00 N ATOM 192 CA THR A 13 26.280 16.493 -13.247 1.00 0.00 C ATOM 193 C THR A 13 24.952 17.202 -13.512 1.00 0.00 C ATOM 194 O THR A 13 24.191 17.436 -12.576 1.00 0.00 O ATOM 195 CB THR A 13 27.354 17.540 -12.930 1.00 0.00 C ATOM 196 OG1 THR A 13 27.650 18.279 -14.099 1.00 0.00 O ATOM 197 CG2 THR A 13 28.642 16.885 -12.428 1.00 0.00 C ATOM 0 H THR A 13 27.679 15.829 -14.641 1.00 0.00 H new ATOM 0 HA THR A 13 26.121 15.832 -12.395 1.00 0.00 H new ATOM 0 HB THR A 13 26.965 18.193 -12.148 1.00 0.00 H new ATOM 0 HG1 THR A 13 28.335 18.950 -13.897 1.00 0.00 H new ATOM 0 HG21 THR A 13 29.382 17.656 -12.213 1.00 0.00 H new ATOM 0 HG22 THR A 13 28.433 16.319 -11.520 1.00 0.00 H new ATOM 0 HG23 THR A 13 29.030 16.213 -13.193 1.00 0.00 H new ATOM 205 N PHE A 14 24.643 17.500 -14.777 1.00 0.00 N ATOM 206 CA PHE A 14 23.351 18.054 -15.193 1.00 0.00 C ATOM 207 C PHE A 14 22.219 17.029 -15.043 1.00 0.00 C ATOM 208 O PHE A 14 21.207 17.301 -14.399 1.00 0.00 O ATOM 209 CB PHE A 14 23.461 18.533 -16.644 1.00 0.00 C ATOM 210 CG PHE A 14 22.337 19.467 -17.052 1.00 0.00 C ATOM 211 CD1 PHE A 14 21.119 18.949 -17.538 1.00 0.00 C ATOM 212 CD2 PHE A 14 22.495 20.860 -16.916 1.00 0.00 C ATOM 213 CE1 PHE A 14 20.070 19.818 -17.885 1.00 0.00 C ATOM 214 CE2 PHE A 14 21.445 21.729 -17.268 1.00 0.00 C ATOM 215 CZ PHE A 14 20.233 21.208 -17.752 1.00 0.00 C ATOM 0 H PHE A 14 25.292 17.361 -15.552 1.00 0.00 H new ATOM 0 HA PHE A 14 23.104 18.895 -14.545 1.00 0.00 H new ATOM 0 HB2 PHE A 14 24.415 19.042 -16.780 1.00 0.00 H new ATOM 0 HB3 PHE A 14 23.464 17.667 -17.306 1.00 0.00 H new ATOM 0 HD1 PHE A 14 20.992 17.882 -17.644 1.00 0.00 H new ATOM 0 HD2 PHE A 14 23.424 21.262 -16.541 1.00 0.00 H new ATOM 0 HE1 PHE A 14 19.138 19.417 -18.254 1.00 0.00 H new ATOM 0 HE2 PHE A 14 21.571 22.797 -17.166 1.00 0.00 H new ATOM 0 HZ PHE A 14 19.427 21.875 -18.022 1.00 0.00 H new ATOM 225 N LEU A 15 22.409 15.830 -15.610 1.00 0.00 N ATOM 226 CA LEU A 15 21.476 14.701 -15.516 1.00 0.00 C ATOM 227 C LEU A 15 21.293 14.255 -14.063 1.00 0.00 C ATOM 228 O LEU A 15 20.185 13.910 -13.668 1.00 0.00 O ATOM 229 CB LEU A 15 22.000 13.555 -16.403 1.00 0.00 C ATOM 230 CG LEU A 15 21.179 12.253 -16.312 1.00 0.00 C ATOM 231 CD1 LEU A 15 19.753 12.423 -16.855 1.00 0.00 C ATOM 232 CD2 LEU A 15 21.894 11.135 -17.082 1.00 0.00 C ATOM 0 H LEU A 15 23.239 15.614 -16.162 1.00 0.00 H new ATOM 0 HA LEU A 15 20.492 15.006 -15.872 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.012 13.891 -17.440 1.00 0.00 H new ATOM 0 HB3 LEU A 15 23.032 13.340 -16.126 1.00 0.00 H new ATOM 0 HG LEU A 15 21.099 11.992 -15.257 1.00 0.00 H new ATOM 0 HD11 LEU A 15 19.216 11.478 -16.769 1.00 0.00 H new ATOM 0 HD12 LEU A 15 19.234 13.190 -16.280 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.796 12.722 -17.902 1.00 0.00 H new ATOM 0 HD21 LEU A 15 21.311 10.217 -17.015 1.00 0.00 H new ATOM 0 HD22 LEU A 15 21.999 11.423 -18.128 1.00 0.00 H new ATOM 0 HD23 LEU A 15 22.881 10.970 -16.651 1.00 0.00 H new ATOM 244 N ASP A 16 22.345 14.314 -13.247 1.00 0.00 N ATOM 245 CA ASP A 16 22.291 13.979 -11.816 1.00 0.00 C ATOM 246 C ASP A 16 21.271 14.827 -11.037 1.00 0.00 C ATOM 247 O ASP A 16 20.635 14.337 -10.099 1.00 0.00 O ATOM 248 CB ASP A 16 23.688 14.173 -11.228 1.00 0.00 C ATOM 249 CG ASP A 16 23.798 13.593 -9.809 1.00 0.00 C ATOM 250 OD1 ASP A 16 23.896 12.350 -9.676 1.00 0.00 O ATOM 251 OD2 ASP A 16 23.800 14.383 -8.833 1.00 0.00 O ATOM 0 H ASP A 16 23.273 14.599 -13.561 1.00 0.00 H new ATOM 0 HA ASP A 16 21.962 12.944 -11.723 1.00 0.00 H new ATOM 0 HB2 ASP A 16 24.424 13.694 -11.874 1.00 0.00 H new ATOM 0 HB3 ASP A 16 23.928 15.236 -11.205 1.00 0.00 H new ATOM 256 N THR A 17 21.066 16.073 -11.483 1.00 0.00 N ATOM 257 CA THR A 17 20.049 16.989 -10.941 1.00 0.00 C ATOM 258 C THR A 17 18.650 16.563 -11.368 1.00 0.00 C ATOM 259 O THR A 17 17.701 16.754 -10.617 1.00 0.00 O ATOM 260 CB THR A 17 20.349 18.443 -11.338 1.00 0.00 C ATOM 261 OG1 THR A 17 21.616 18.780 -10.812 1.00 0.00 O ATOM 262 CG2 THR A 17 19.337 19.442 -10.765 1.00 0.00 C ATOM 0 H THR A 17 21.610 16.481 -12.243 1.00 0.00 H new ATOM 0 HA THR A 17 20.088 16.936 -9.853 1.00 0.00 H new ATOM 0 HB THR A 17 20.304 18.504 -12.425 1.00 0.00 H new ATOM 0 HG1 THR A 17 21.835 19.705 -11.052 1.00 0.00 H new ATOM 0 HG21 THR A 17 19.603 20.451 -11.081 1.00 0.00 H new ATOM 0 HG22 THR A 17 18.339 19.199 -11.130 1.00 0.00 H new ATOM 0 HG23 THR A 17 19.348 19.388 -9.676 1.00 0.00 H new ATOM 270 N ILE A 18 18.504 15.928 -12.530 1.00 0.00 N ATOM 271 CA ILE A 18 17.217 15.381 -12.998 1.00 0.00 C ATOM 272 C ILE A 18 16.903 14.073 -12.268 1.00 0.00 C ATOM 273 O ILE A 18 15.784 13.879 -11.802 1.00 0.00 O ATOM 274 CB ILE A 18 17.224 15.191 -14.533 1.00 0.00 C ATOM 275 CG1 ILE A 18 17.864 16.376 -15.293 1.00 0.00 C ATOM 276 CG2 ILE A 18 15.798 14.923 -15.044 1.00 0.00 C ATOM 277 CD1 ILE A 18 17.259 17.760 -15.016 1.00 0.00 C ATOM 0 H ILE A 18 19.274 15.774 -13.181 1.00 0.00 H new ATOM 0 HA ILE A 18 16.426 16.094 -12.765 1.00 0.00 H new ATOM 0 HB ILE A 18 17.852 14.324 -14.738 1.00 0.00 H new ATOM 0 HG12 ILE A 18 18.925 16.409 -15.046 1.00 0.00 H new ATOM 0 HG13 ILE A 18 17.792 16.177 -16.362 1.00 0.00 H new ATOM 0 HG21 ILE A 18 15.818 14.791 -16.126 1.00 0.00 H new ATOM 0 HG22 ILE A 18 15.407 14.020 -14.576 1.00 0.00 H new ATOM 0 HG23 ILE A 18 15.157 15.768 -14.793 1.00 0.00 H new ATOM 0 HD11 ILE A 18 17.787 18.512 -15.603 1.00 0.00 H new ATOM 0 HD12 ILE A 18 16.205 17.758 -15.292 1.00 0.00 H new ATOM 0 HD13 ILE A 18 17.356 17.994 -13.956 1.00 0.00 H new ATOM 289 N ILE A 19 17.906 13.210 -12.084 1.00 0.00 N ATOM 290 CA ILE A 19 17.789 11.963 -11.313 1.00 0.00 C ATOM 291 C ILE A 19 17.279 12.255 -9.897 1.00 0.00 C ATOM 292 O ILE A 19 16.298 11.646 -9.480 1.00 0.00 O ATOM 293 CB ILE A 19 19.131 11.187 -11.335 1.00 0.00 C ATOM 294 CG1 ILE A 19 19.407 10.653 -12.764 1.00 0.00 C ATOM 295 CG2 ILE A 19 19.126 10.021 -10.325 1.00 0.00 C ATOM 296 CD1 ILE A 19 20.829 10.121 -12.977 1.00 0.00 C ATOM 0 H ILE A 19 18.838 13.358 -12.471 1.00 0.00 H new ATOM 0 HA ILE A 19 17.048 11.313 -11.779 1.00 0.00 H new ATOM 0 HB ILE A 19 19.924 11.876 -11.045 1.00 0.00 H new ATOM 0 HG12 ILE A 19 18.697 9.856 -12.984 1.00 0.00 H new ATOM 0 HG13 ILE A 19 19.220 11.453 -13.480 1.00 0.00 H new ATOM 0 HG21 ILE A 19 20.082 9.499 -10.367 1.00 0.00 H new ATOM 0 HG22 ILE A 19 18.970 10.411 -9.319 1.00 0.00 H new ATOM 0 HG23 ILE A 19 18.323 9.328 -10.574 1.00 0.00 H new ATOM 0 HD11 ILE A 19 20.935 9.768 -14.003 1.00 0.00 H new ATOM 0 HD12 ILE A 19 21.548 10.919 -12.792 1.00 0.00 H new ATOM 0 HD13 ILE A 19 21.016 9.297 -12.288 1.00 0.00 H new ATOM 308 N ARG A 20 17.867 13.213 -9.169 1.00 0.00 N ATOM 309 CA ARG A 20 17.466 13.493 -7.778 1.00 0.00 C ATOM 310 C ARG A 20 16.092 14.181 -7.644 1.00 0.00 C ATOM 311 O ARG A 20 15.466 14.092 -6.587 1.00 0.00 O ATOM 312 CB ARG A 20 18.596 14.226 -7.039 1.00 0.00 C ATOM 313 CG ARG A 20 18.792 15.685 -7.474 1.00 0.00 C ATOM 314 CD ARG A 20 20.165 16.234 -7.064 1.00 0.00 C ATOM 315 NE ARG A 20 20.338 16.274 -5.600 1.00 0.00 N ATOM 316 CZ ARG A 20 21.494 16.256 -4.943 1.00 0.00 C ATOM 317 NH1 ARG A 20 22.654 16.165 -5.562 1.00 0.00 N ATOM 318 NH2 ARG A 20 21.497 16.333 -3.629 1.00 0.00 N ATOM 0 H ARG A 20 18.620 13.807 -9.516 1.00 0.00 H new ATOM 0 HA ARG A 20 17.313 12.532 -7.286 1.00 0.00 H new ATOM 0 HB2 ARG A 20 18.390 14.203 -5.969 1.00 0.00 H new ATOM 0 HB3 ARG A 20 19.529 13.684 -7.196 1.00 0.00 H new ATOM 0 HG2 ARG A 20 18.682 15.757 -8.556 1.00 0.00 H new ATOM 0 HG3 ARG A 20 18.009 16.302 -7.032 1.00 0.00 H new ATOM 0 HD2 ARG A 20 20.947 15.615 -7.503 1.00 0.00 H new ATOM 0 HD3 ARG A 20 20.288 17.238 -7.470 1.00 0.00 H new ATOM 0 HE ARG A 20 19.489 16.320 -5.037 1.00 0.00 H new ATOM 0 HH11 ARG A 20 22.686 16.105 -6.580 1.00 0.00 H new ATOM 0 HH12 ARG A 20 23.520 16.154 -5.023 1.00 0.00 H new ATOM 0 HH21 ARG A 20 20.616 16.406 -3.120 1.00 0.00 H new ATOM 0 HH22 ARG A 20 22.380 16.320 -3.119 1.00 0.00 H new ATOM 332 N LYS A 21 15.576 14.806 -8.711 1.00 0.00 N ATOM 333 CA LYS A 21 14.184 15.282 -8.795 1.00 0.00 C ATOM 334 C LYS A 21 13.181 14.132 -9.026 1.00 0.00 C ATOM 335 O LYS A 21 12.097 14.134 -8.437 1.00 0.00 O ATOM 336 CB LYS A 21 14.077 16.306 -9.937 1.00 0.00 C ATOM 337 CG LYS A 21 14.771 17.638 -9.603 1.00 0.00 C ATOM 338 CD LYS A 21 14.929 18.551 -10.827 1.00 0.00 C ATOM 339 CE LYS A 21 13.569 18.916 -11.440 1.00 0.00 C ATOM 340 NZ LYS A 21 13.692 19.966 -12.489 1.00 0.00 N ATOM 0 H LYS A 21 16.119 14.999 -9.553 1.00 0.00 H new ATOM 0 HA LYS A 21 13.927 15.741 -7.841 1.00 0.00 H new ATOM 0 HB2 LYS A 21 14.520 15.886 -10.840 1.00 0.00 H new ATOM 0 HB3 LYS A 21 13.026 16.493 -10.155 1.00 0.00 H new ATOM 0 HG2 LYS A 21 14.196 18.160 -8.838 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.754 17.434 -9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 21 15.454 19.461 -10.537 1.00 0.00 H new ATOM 0 HD3 LYS A 21 15.544 18.053 -11.576 1.00 0.00 H new ATOM 0 HE2 LYS A 21 13.115 18.024 -11.872 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.900 19.266 -10.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 12.751 20.182 -12.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 14.101 20.827 -12.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 14.310 19.623 -13.252 1.00 0.00 H new ATOM 354 N PHE A 22 13.537 13.156 -9.872 1.00 0.00 N ATOM 355 CA PHE A 22 12.696 11.999 -10.210 1.00 0.00 C ATOM 356 C PHE A 22 12.774 10.867 -9.168 1.00 0.00 C ATOM 357 O PHE A 22 11.800 10.129 -9.005 1.00 0.00 O ATOM 358 CB PHE A 22 13.068 11.499 -11.616 1.00 0.00 C ATOM 359 CG PHE A 22 12.337 12.217 -12.741 1.00 0.00 C ATOM 360 CD1 PHE A 22 12.654 13.550 -13.071 1.00 0.00 C ATOM 361 CD2 PHE A 22 11.318 11.554 -13.453 1.00 0.00 C ATOM 362 CE1 PHE A 22 11.968 14.209 -14.106 1.00 0.00 C ATOM 363 CE2 PHE A 22 10.630 12.214 -14.488 1.00 0.00 C ATOM 364 CZ PHE A 22 10.956 13.541 -14.817 1.00 0.00 C ATOM 0 H PHE A 22 14.437 13.148 -10.351 1.00 0.00 H new ATOM 0 HA PHE A 22 11.657 12.327 -10.201 1.00 0.00 H new ATOM 0 HB2 PHE A 22 14.142 11.618 -11.760 1.00 0.00 H new ATOM 0 HB3 PHE A 22 12.854 10.432 -11.680 1.00 0.00 H new ATOM 0 HD1 PHE A 22 13.429 14.068 -12.525 1.00 0.00 H new ATOM 0 HD2 PHE A 22 11.064 10.534 -13.203 1.00 0.00 H new ATOM 0 HE1 PHE A 22 12.219 15.230 -14.355 1.00 0.00 H new ATOM 0 HE2 PHE A 22 9.850 11.700 -15.030 1.00 0.00 H new ATOM 0 HZ PHE A 22 10.430 14.046 -15.614 1.00 0.00 H new ATOM 374 N GLU A 23 13.891 10.736 -8.446 1.00 0.00 N ATOM 375 CA GLU A 23 14.045 9.783 -7.341 1.00 0.00 C ATOM 376 C GLU A 23 13.103 10.108 -6.169 1.00 0.00 C ATOM 377 O GLU A 23 12.830 11.271 -5.856 1.00 0.00 O ATOM 378 CB GLU A 23 15.506 9.738 -6.854 1.00 0.00 C ATOM 379 CG GLU A 23 16.420 8.891 -7.751 1.00 0.00 C ATOM 380 CD GLU A 23 16.155 7.387 -7.576 1.00 0.00 C ATOM 381 OE1 GLU A 23 16.642 6.796 -6.583 1.00 0.00 O ATOM 382 OE2 GLU A 23 15.462 6.783 -8.428 1.00 0.00 O ATOM 0 H GLU A 23 14.726 11.297 -8.615 1.00 0.00 H new ATOM 0 HA GLU A 23 13.772 8.800 -7.725 1.00 0.00 H new ATOM 0 HB2 GLU A 23 15.897 10.754 -6.806 1.00 0.00 H new ATOM 0 HB3 GLU A 23 15.532 9.338 -5.840 1.00 0.00 H new ATOM 0 HG2 GLU A 23 16.265 9.169 -8.794 1.00 0.00 H new ATOM 0 HG3 GLU A 23 17.462 9.107 -7.515 1.00 0.00 H new ATOM 389 N GLY A 24 12.636 9.062 -5.480 1.00 0.00 N ATOM 390 CA GLY A 24 11.634 9.127 -4.410 1.00 0.00 C ATOM 391 C GLY A 24 12.216 9.551 -3.066 1.00 0.00 C ATOM 392 O GLY A 24 12.019 8.863 -2.066 1.00 0.00 O ATOM 0 H GLY A 24 12.957 8.111 -5.659 1.00 0.00 H new ATOM 0 HA2 GLY A 24 10.851 9.829 -4.697 1.00 0.00 H new ATOM 0 HA3 GLY A 24 11.163 8.150 -4.303 1.00 0.00 H new ATOM 396 N GLN A 25 12.942 10.669 -3.040 1.00 0.00 N ATOM 397 CA GLN A 25 13.385 11.308 -1.795 1.00 0.00 C ATOM 398 C GLN A 25 12.247 12.087 -1.105 1.00 0.00 C ATOM 399 O GLN A 25 12.248 12.218 0.118 1.00 0.00 O ATOM 400 CB GLN A 25 14.626 12.183 -2.046 1.00 0.00 C ATOM 401 CG GLN A 25 14.436 13.309 -3.076 1.00 0.00 C ATOM 402 CD GLN A 25 15.628 14.272 -3.095 1.00 0.00 C ATOM 403 OE1 GLN A 25 16.755 13.916 -3.422 1.00 0.00 O ATOM 404 NE2 GLN A 25 15.440 15.520 -2.710 1.00 0.00 N ATOM 0 H GLN A 25 13.241 11.160 -3.882 1.00 0.00 H new ATOM 0 HA GLN A 25 13.673 10.520 -1.099 1.00 0.00 H new ATOM 0 HB2 GLN A 25 14.935 12.627 -1.100 1.00 0.00 H new ATOM 0 HB3 GLN A 25 15.442 11.541 -2.379 1.00 0.00 H new ATOM 0 HG2 GLN A 25 14.303 12.876 -4.067 1.00 0.00 H new ATOM 0 HG3 GLN A 25 13.526 13.862 -2.845 1.00 0.00 H new ATOM 0 HE21 GLN A 25 14.509 15.834 -2.434 1.00 0.00 H new ATOM 0 HE22 GLN A 25 16.225 16.171 -2.688 1.00 0.00 H new ATOM 413 N SER A 26 11.264 12.578 -1.870 1.00 0.00 N ATOM 414 CA SER A 26 10.168 13.423 -1.349 1.00 0.00 C ATOM 415 C SER A 26 8.810 12.697 -1.255 1.00 0.00 C ATOM 416 O SER A 26 8.043 12.962 -0.327 1.00 0.00 O ATOM 417 CB SER A 26 10.020 14.679 -2.228 1.00 0.00 C ATOM 418 OG SER A 26 11.233 15.428 -2.279 1.00 0.00 O ATOM 0 H SER A 26 11.201 12.403 -2.873 1.00 0.00 H new ATOM 0 HA SER A 26 10.446 13.691 -0.330 1.00 0.00 H new ATOM 0 HB2 SER A 26 9.730 14.386 -3.237 1.00 0.00 H new ATOM 0 HB3 SER A 26 9.220 15.307 -1.836 1.00 0.00 H new ATOM 0 HG SER A 26 11.106 16.217 -2.846 1.00 0.00 H new ATOM 424 N ARG A 27 8.499 11.782 -2.193 1.00 0.00 N ATOM 425 CA ARG A 27 7.261 10.977 -2.224 1.00 0.00 C ATOM 426 C ARG A 27 7.587 9.494 -2.001 1.00 0.00 C ATOM 427 O ARG A 27 8.656 9.025 -2.388 1.00 0.00 O ATOM 428 CB ARG A 27 6.529 11.130 -3.571 1.00 0.00 C ATOM 429 CG ARG A 27 5.797 12.463 -3.809 1.00 0.00 C ATOM 430 CD ARG A 27 6.715 13.682 -3.968 1.00 0.00 C ATOM 431 NE ARG A 27 5.987 14.840 -4.522 1.00 0.00 N ATOM 432 CZ ARG A 27 5.874 15.182 -5.803 1.00 0.00 C ATOM 433 NH1 ARG A 27 6.406 14.470 -6.775 1.00 0.00 N ATOM 434 NH2 ARG A 27 5.211 16.271 -6.127 1.00 0.00 N ATOM 0 H ARG A 27 9.121 11.576 -2.975 1.00 0.00 H new ATOM 0 HA ARG A 27 6.613 11.340 -1.426 1.00 0.00 H new ATOM 0 HB2 ARG A 27 7.256 10.993 -4.372 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.803 10.322 -3.658 1.00 0.00 H new ATOM 0 HG2 ARG A 27 5.183 12.369 -4.705 1.00 0.00 H new ATOM 0 HG3 ARG A 27 5.119 12.643 -2.975 1.00 0.00 H new ATOM 0 HD2 ARG A 27 7.140 13.947 -3.000 1.00 0.00 H new ATOM 0 HD3 ARG A 27 7.548 13.428 -4.623 1.00 0.00 H new ATOM 0 HE ARG A 27 5.518 15.446 -3.848 1.00 0.00 H new ATOM 0 HH11 ARG A 27 6.928 13.621 -6.558 1.00 0.00 H new ATOM 0 HH12 ARG A 27 6.296 14.768 -7.744 1.00 0.00 H new ATOM 0 HH21 ARG A 27 4.788 16.846 -5.399 1.00 0.00 H new ATOM 0 HH22 ARG A 27 5.120 16.540 -7.107 1.00 0.00 H new ATOM 448 N LYS A 28 6.656 8.752 -1.393 1.00 0.00 N ATOM 449 CA LYS A 28 6.845 7.355 -0.976 1.00 0.00 C ATOM 450 C LYS A 28 6.031 6.376 -1.832 1.00 0.00 C ATOM 451 O LYS A 28 4.930 6.698 -2.270 1.00 0.00 O ATOM 452 CB LYS A 28 6.476 7.214 0.512 1.00 0.00 C ATOM 453 CG LYS A 28 7.343 8.106 1.407 1.00 0.00 C ATOM 454 CD LYS A 28 6.660 9.416 1.793 1.00 0.00 C ATOM 455 CE LYS A 28 7.672 10.513 2.117 1.00 0.00 C ATOM 456 NZ LYS A 28 8.651 10.205 3.206 1.00 0.00 N ATOM 0 H LYS A 28 5.728 9.112 -1.171 1.00 0.00 H new ATOM 0 HA LYS A 28 7.894 7.098 -1.122 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.426 7.473 0.651 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.591 6.174 0.817 1.00 0.00 H new ATOM 0 HG2 LYS A 28 7.602 7.558 2.313 1.00 0.00 H new ATOM 0 HG3 LYS A 28 8.277 8.329 0.891 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.018 9.745 0.976 1.00 0.00 H new ATOM 0 HD3 LYS A 28 6.017 9.249 2.657 1.00 0.00 H new ATOM 0 HE2 LYS A 28 8.230 10.744 1.209 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.124 11.414 2.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 9.350 10.973 3.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 8.147 10.117 4.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 9.138 9.311 2.992 1.00 0.00 H new ATOM 470 N PHE A 29 6.542 5.155 -2.011 1.00 0.00 N ATOM 471 CA PHE A 29 5.920 4.097 -2.817 1.00 0.00 C ATOM 472 C PHE A 29 6.509 2.699 -2.584 1.00 0.00 C ATOM 473 O PHE A 29 7.597 2.546 -2.036 1.00 0.00 O ATOM 474 CB PHE A 29 5.972 4.485 -4.311 1.00 0.00 C ATOM 475 CG PHE A 29 7.367 4.748 -4.852 1.00 0.00 C ATOM 476 CD1 PHE A 29 8.181 3.672 -5.259 1.00 0.00 C ATOM 477 CD2 PHE A 29 7.857 6.067 -4.950 1.00 0.00 C ATOM 478 CE1 PHE A 29 9.476 3.910 -5.752 1.00 0.00 C ATOM 479 CE2 PHE A 29 9.145 6.303 -5.460 1.00 0.00 C ATOM 480 CZ PHE A 29 9.958 5.227 -5.857 1.00 0.00 C ATOM 0 H PHE A 29 7.424 4.866 -1.588 1.00 0.00 H new ATOM 0 HA PHE A 29 4.883 4.022 -2.488 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.515 3.686 -4.896 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.365 5.378 -4.462 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.809 2.660 -5.192 1.00 0.00 H new ATOM 0 HD2 PHE A 29 7.242 6.896 -4.633 1.00 0.00 H new ATOM 0 HE1 PHE A 29 10.101 3.081 -6.050 1.00 0.00 H new ATOM 0 HE2 PHE A 29 9.512 7.315 -5.547 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.950 5.411 -6.242 1.00 0.00 H new ATOM 490 N ILE A 30 5.796 1.677 -3.054 1.00 0.00 N ATOM 491 CA ILE A 30 6.210 0.266 -3.123 1.00 0.00 C ATOM 492 C ILE A 30 5.647 -0.376 -4.395 1.00 0.00 C ATOM 493 O ILE A 30 4.606 0.049 -4.890 1.00 0.00 O ATOM 494 CB ILE A 30 5.758 -0.518 -1.864 1.00 0.00 C ATOM 495 CG1 ILE A 30 4.223 -0.487 -1.681 1.00 0.00 C ATOM 496 CG2 ILE A 30 6.485 0.001 -0.613 1.00 0.00 C ATOM 497 CD1 ILE A 30 3.739 -1.128 -0.380 1.00 0.00 C ATOM 0 H ILE A 30 4.854 1.815 -3.421 1.00 0.00 H new ATOM 0 HA ILE A 30 7.299 0.227 -3.156 1.00 0.00 H new ATOM 0 HB ILE A 30 6.034 -1.562 -2.009 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.885 0.549 -1.712 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.757 -1.000 -2.522 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.154 -0.562 0.260 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.560 -0.124 -0.739 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.257 1.057 -0.471 1.00 0.00 H new ATOM 0 HD11 ILE A 30 2.652 -1.066 -0.326 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.045 -2.174 -0.354 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.175 -0.601 0.469 1.00 0.00 H new ATOM 509 N ILE A 31 6.310 -1.407 -4.918 1.00 0.00 N ATOM 510 CA ILE A 31 5.874 -2.178 -6.088 1.00 0.00 C ATOM 511 C ILE A 31 5.679 -3.633 -5.673 1.00 0.00 C ATOM 512 O ILE A 31 6.583 -4.255 -5.114 1.00 0.00 O ATOM 513 CB ILE A 31 6.886 -2.066 -7.254 1.00 0.00 C ATOM 514 CG1 ILE A 31 7.118 -0.595 -7.682 1.00 0.00 C ATOM 515 CG2 ILE A 31 6.369 -2.869 -8.469 1.00 0.00 C ATOM 516 CD1 ILE A 31 8.334 0.073 -7.026 1.00 0.00 C ATOM 0 H ILE A 31 7.192 -1.741 -4.530 1.00 0.00 H new ATOM 0 HA ILE A 31 4.930 -1.770 -6.450 1.00 0.00 H new ATOM 0 HB ILE A 31 7.836 -2.471 -6.904 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.240 -0.559 -8.765 1.00 0.00 H new ATOM 0 HG13 ILE A 31 6.227 -0.015 -7.442 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.083 -2.789 -9.289 1.00 0.00 H new ATOM 0 HG22 ILE A 31 6.253 -3.916 -8.190 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.406 -2.469 -8.786 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.421 1.100 -7.382 1.00 0.00 H new ATOM 0 HD12 ILE A 31 8.209 0.074 -5.943 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.237 -0.479 -7.286 1.00 0.00 H new ATOM 528 N ALA A 32 4.511 -4.182 -5.986 1.00 0.00 N ATOM 529 CA ALA A 32 4.163 -5.577 -5.768 1.00 0.00 C ATOM 530 C ALA A 32 3.803 -6.274 -7.080 1.00 0.00 C ATOM 531 O ALA A 32 3.179 -5.686 -7.963 1.00 0.00 O ATOM 532 CB ALA A 32 3.001 -5.618 -4.779 1.00 0.00 C ATOM 0 H ALA A 32 3.755 -3.647 -6.414 1.00 0.00 H new ATOM 0 HA ALA A 32 5.019 -6.115 -5.361 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.716 -6.654 -4.595 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.305 -5.153 -3.841 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.151 -5.076 -5.194 1.00 0.00 H new ATOM 538 N ASN A 33 4.164 -7.551 -7.196 1.00 0.00 N ATOM 539 CA ASN A 33 3.765 -8.396 -8.312 1.00 0.00 C ATOM 540 C ASN A 33 2.251 -8.686 -8.266 1.00 0.00 C ATOM 541 O ASN A 33 1.736 -9.110 -7.231 1.00 0.00 O ATOM 542 CB ASN A 33 4.619 -9.668 -8.239 1.00 0.00 C ATOM 543 CG ASN A 33 4.671 -10.403 -9.567 1.00 0.00 C ATOM 544 OD1 ASN A 33 3.665 -10.600 -10.231 1.00 0.00 O ATOM 545 ND2 ASN A 33 5.856 -10.793 -9.987 1.00 0.00 N ATOM 0 H ASN A 33 4.747 -8.029 -6.509 1.00 0.00 H new ATOM 0 HA ASN A 33 3.936 -7.901 -9.268 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.631 -9.406 -7.931 1.00 0.00 H new ATOM 0 HB3 ASN A 33 4.215 -10.331 -7.474 1.00 0.00 H new ATOM 0 HD21 ASN A 33 5.948 -11.270 -10.884 1.00 0.00 H new ATOM 0 HD22 ASN A 33 6.683 -10.618 -9.416 1.00 0.00 H new ATOM 552 N ALA A 34 1.530 -8.478 -9.373 1.00 0.00 N ATOM 553 CA ALA A 34 0.098 -8.807 -9.465 1.00 0.00 C ATOM 554 C ALA A 34 -0.160 -10.314 -9.684 1.00 0.00 C ATOM 555 O ALA A 34 -1.192 -10.834 -9.262 1.00 0.00 O ATOM 556 CB ALA A 34 -0.529 -7.964 -10.584 1.00 0.00 C ATOM 0 H ALA A 34 1.918 -8.079 -10.228 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.371 -8.567 -8.511 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.591 -8.197 -10.664 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.406 -6.906 -10.354 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.036 -8.190 -11.529 1.00 0.00 H new ATOM 562 N ARG A 35 0.791 -11.048 -10.280 1.00 0.00 N ATOM 563 CA ARG A 35 0.679 -12.468 -10.682 1.00 0.00 C ATOM 564 C ARG A 35 0.806 -13.467 -9.502 1.00 0.00 C ATOM 565 O ARG A 35 1.280 -14.589 -9.682 1.00 0.00 O ATOM 566 CB ARG A 35 1.716 -12.769 -11.792 1.00 0.00 C ATOM 567 CG ARG A 35 1.685 -11.832 -13.016 1.00 0.00 C ATOM 568 CD ARG A 35 0.400 -11.946 -13.845 1.00 0.00 C ATOM 569 NE ARG A 35 0.306 -13.253 -14.522 1.00 0.00 N ATOM 570 CZ ARG A 35 -0.738 -13.729 -15.193 1.00 0.00 C ATOM 571 NH1 ARG A 35 -1.858 -13.046 -15.324 1.00 0.00 N ATOM 572 NH2 ARG A 35 -0.665 -14.917 -15.751 1.00 0.00 N ATOM 0 H ARG A 35 1.704 -10.654 -10.508 1.00 0.00 H new ATOM 0 HA ARG A 35 -0.330 -12.616 -11.067 1.00 0.00 H new ATOM 0 HB2 ARG A 35 2.712 -12.727 -11.352 1.00 0.00 H new ATOM 0 HB3 ARG A 35 1.563 -13.791 -12.138 1.00 0.00 H new ATOM 0 HG2 ARG A 35 1.799 -10.802 -12.677 1.00 0.00 H new ATOM 0 HG3 ARG A 35 2.540 -12.054 -13.655 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -0.465 -11.808 -13.197 1.00 0.00 H new ATOM 0 HD3 ARG A 35 0.373 -11.148 -14.587 1.00 0.00 H new ATOM 0 HE ARG A 35 1.128 -13.854 -14.470 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -1.943 -12.121 -14.903 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -2.639 -13.443 -15.846 1.00 0.00 H new ATOM 0 HH21 ARG A 35 0.189 -15.468 -15.668 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -1.463 -15.288 -16.267 1.00 0.00 H new ATOM 586 N VAL A 36 0.413 -13.060 -8.292 1.00 0.00 N ATOM 587 CA VAL A 36 0.521 -13.816 -7.023 1.00 0.00 C ATOM 588 C VAL A 36 -0.641 -13.448 -6.089 1.00 0.00 C ATOM 589 O VAL A 36 -1.129 -12.320 -6.123 1.00 0.00 O ATOM 590 CB VAL A 36 1.876 -13.608 -6.293 1.00 0.00 C ATOM 591 CG1 VAL A 36 3.055 -14.260 -7.034 1.00 0.00 C ATOM 592 CG2 VAL A 36 2.210 -12.132 -6.033 1.00 0.00 C ATOM 0 H VAL A 36 -0.014 -12.144 -8.155 1.00 0.00 H new ATOM 0 HA VAL A 36 0.470 -14.872 -7.288 1.00 0.00 H new ATOM 0 HB VAL A 36 1.739 -14.103 -5.332 1.00 0.00 H new ATOM 0 HG11 VAL A 36 3.976 -14.083 -6.479 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.883 -15.333 -7.119 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.143 -13.827 -8.030 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.169 -12.061 -5.520 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.265 -11.599 -6.982 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.433 -11.687 -5.412 1.00 0.00 H new ATOM 602 N GLU A 37 -1.080 -14.400 -5.257 1.00 0.00 N ATOM 603 CA GLU A 37 -2.324 -14.306 -4.474 1.00 0.00 C ATOM 604 C GLU A 37 -2.318 -13.162 -3.440 1.00 0.00 C ATOM 605 O GLU A 37 -3.335 -12.494 -3.242 1.00 0.00 O ATOM 606 CB GLU A 37 -2.557 -15.661 -3.786 1.00 0.00 C ATOM 607 CG GLU A 37 -3.929 -15.774 -3.110 1.00 0.00 C ATOM 608 CD GLU A 37 -4.157 -17.195 -2.571 1.00 0.00 C ATOM 609 OE1 GLU A 37 -3.764 -17.482 -1.415 1.00 0.00 O ATOM 610 OE2 GLU A 37 -4.736 -18.037 -3.298 1.00 0.00 O ATOM 0 H GLU A 37 -0.575 -15.273 -5.104 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.138 -14.069 -5.159 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -2.458 -16.457 -4.524 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -1.779 -15.820 -3.040 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -3.997 -15.055 -2.293 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.713 -15.521 -3.824 1.00 0.00 H new ATOM 617 N ASN A 38 -1.172 -12.919 -2.791 1.00 0.00 N ATOM 618 CA ASN A 38 -1.042 -11.943 -1.697 1.00 0.00 C ATOM 619 C ASN A 38 -0.686 -10.515 -2.164 1.00 0.00 C ATOM 620 O ASN A 38 -0.668 -9.604 -1.337 1.00 0.00 O ATOM 621 CB ASN A 38 0.011 -12.466 -0.702 1.00 0.00 C ATOM 622 CG ASN A 38 -0.431 -13.760 -0.022 1.00 0.00 C ATOM 623 OD1 ASN A 38 -1.386 -13.784 0.745 1.00 0.00 O ATOM 624 ND2 ASN A 38 0.239 -14.871 -0.283 1.00 0.00 N ATOM 0 H ASN A 38 -0.299 -13.398 -3.012 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.020 -11.851 -1.224 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.951 -12.636 -1.227 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.202 -11.706 0.056 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -0.039 -15.749 0.155 1.00 0.00 H new ATOM 0 HD22 ASN A 38 1.034 -14.849 -0.922 1.00 0.00 H new ATOM 631 N CYS A 39 -0.344 -10.311 -3.447 1.00 0.00 N ATOM 632 CA CYS A 39 0.261 -9.066 -3.967 1.00 0.00 C ATOM 633 C CYS A 39 1.481 -8.639 -3.121 1.00 0.00 C ATOM 634 O CYS A 39 1.511 -7.564 -2.519 1.00 0.00 O ATOM 635 CB CYS A 39 -0.818 -7.977 -4.115 1.00 0.00 C ATOM 636 SG CYS A 39 -2.008 -8.472 -5.398 1.00 0.00 S ATOM 0 H CYS A 39 -0.482 -11.019 -4.169 1.00 0.00 H new ATOM 0 HA CYS A 39 0.659 -9.242 -4.966 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.332 -7.828 -3.165 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.356 -7.026 -4.380 1.00 0.00 H new ATOM 0 HG CYS A 39 -2.920 -7.554 -5.521 1.00 0.00 H new ATOM 642 N ALA A 40 2.471 -9.533 -3.020 1.00 0.00 N ATOM 643 CA ALA A 40 3.671 -9.338 -2.204 1.00 0.00 C ATOM 644 C ALA A 40 4.591 -8.241 -2.780 1.00 0.00 C ATOM 645 O ALA A 40 4.835 -8.216 -3.986 1.00 0.00 O ATOM 646 CB ALA A 40 4.401 -10.683 -2.076 1.00 0.00 C ATOM 0 H ALA A 40 2.459 -10.427 -3.512 1.00 0.00 H new ATOM 0 HA ALA A 40 3.377 -8.990 -1.214 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.298 -10.554 -1.470 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.743 -11.410 -1.600 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.681 -11.041 -3.067 1.00 0.00 H new ATOM 652 N VAL A 41 5.128 -7.367 -1.919 1.00 0.00 N ATOM 653 CA VAL A 41 6.097 -6.319 -2.307 1.00 0.00 C ATOM 654 C VAL A 41 7.380 -6.970 -2.831 1.00 0.00 C ATOM 655 O VAL A 41 8.015 -7.758 -2.127 1.00 0.00 O ATOM 656 CB VAL A 41 6.426 -5.327 -1.159 1.00 0.00 C ATOM 657 CG1 VAL A 41 7.366 -4.215 -1.636 1.00 0.00 C ATOM 658 CG2 VAL A 41 5.142 -4.660 -0.640 1.00 0.00 C ATOM 0 H VAL A 41 4.904 -7.363 -0.924 1.00 0.00 H new ATOM 0 HA VAL A 41 5.626 -5.729 -3.093 1.00 0.00 H new ATOM 0 HB VAL A 41 6.907 -5.904 -0.369 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.577 -3.537 -0.809 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.298 -4.654 -1.992 1.00 0.00 H new ATOM 0 HG13 VAL A 41 6.893 -3.661 -2.447 1.00 0.00 H new ATOM 0 HG21 VAL A 41 5.391 -3.968 0.164 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.661 -4.115 -1.452 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.462 -5.424 -0.264 1.00 0.00 H new ATOM 668 N ILE A 42 7.751 -6.622 -4.066 1.00 0.00 N ATOM 669 CA ILE A 42 8.998 -7.043 -4.734 1.00 0.00 C ATOM 670 C ILE A 42 10.053 -5.931 -4.754 1.00 0.00 C ATOM 671 O ILE A 42 11.240 -6.213 -4.927 1.00 0.00 O ATOM 672 CB ILE A 42 8.722 -7.537 -6.174 1.00 0.00 C ATOM 673 CG1 ILE A 42 7.997 -6.489 -7.052 1.00 0.00 C ATOM 674 CG2 ILE A 42 7.948 -8.862 -6.117 1.00 0.00 C ATOM 675 CD1 ILE A 42 7.930 -6.861 -8.536 1.00 0.00 C ATOM 0 H ILE A 42 7.176 -6.019 -4.654 1.00 0.00 H new ATOM 0 HA ILE A 42 9.399 -7.869 -4.147 1.00 0.00 H new ATOM 0 HB ILE A 42 9.684 -7.699 -6.659 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.983 -6.353 -6.676 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.506 -5.530 -6.951 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.752 -9.213 -7.130 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.539 -9.606 -5.583 1.00 0.00 H new ATOM 0 HG23 ILE A 42 7.002 -8.709 -5.597 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.407 -6.077 -9.084 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.941 -6.968 -8.930 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.394 -7.803 -8.651 1.00 0.00 H new ATOM 687 N TYR A 43 9.629 -4.678 -4.565 1.00 0.00 N ATOM 688 CA TYR A 43 10.500 -3.506 -4.526 1.00 0.00 C ATOM 689 C TYR A 43 9.894 -2.403 -3.652 1.00 0.00 C ATOM 690 O TYR A 43 8.696 -2.141 -3.710 1.00 0.00 O ATOM 691 CB TYR A 43 10.734 -2.998 -5.956 1.00 0.00 C ATOM 692 CG TYR A 43 11.995 -2.170 -6.111 1.00 0.00 C ATOM 693 CD1 TYR A 43 13.218 -2.801 -6.413 1.00 0.00 C ATOM 694 CD2 TYR A 43 11.955 -0.773 -5.925 1.00 0.00 C ATOM 695 CE1 TYR A 43 14.398 -2.041 -6.534 1.00 0.00 C ATOM 696 CE2 TYR A 43 13.131 -0.009 -6.042 1.00 0.00 C ATOM 697 CZ TYR A 43 14.358 -0.639 -6.349 1.00 0.00 C ATOM 698 OH TYR A 43 15.495 0.105 -6.461 1.00 0.00 O ATOM 0 H TYR A 43 8.644 -4.448 -4.432 1.00 0.00 H new ATOM 0 HA TYR A 43 11.456 -3.789 -4.085 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.786 -3.852 -6.631 1.00 0.00 H new ATOM 0 HB3 TYR A 43 9.877 -2.399 -6.264 1.00 0.00 H new ATOM 0 HD1 TYR A 43 13.251 -3.871 -6.552 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.019 -0.288 -5.692 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.333 -2.529 -6.768 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.096 1.061 -5.897 1.00 0.00 H new ATOM 0 HH TYR A 43 15.285 1.049 -6.304 1.00 0.00 H new ATOM 708 N CYS A 44 10.722 -1.719 -2.865 1.00 0.00 N ATOM 709 CA CYS A 44 10.297 -0.606 -2.006 1.00 0.00 C ATOM 710 C CYS A 44 11.037 0.694 -2.349 1.00 0.00 C ATOM 711 O CYS A 44 12.168 0.648 -2.833 1.00 0.00 O ATOM 712 CB CYS A 44 10.520 -0.951 -0.521 1.00 0.00 C ATOM 713 SG CYS A 44 10.000 -2.630 -0.068 1.00 0.00 S ATOM 0 H CYS A 44 11.720 -1.921 -2.802 1.00 0.00 H new ATOM 0 HA CYS A 44 9.233 -0.450 -2.186 1.00 0.00 H new ATOM 0 HB2 CYS A 44 11.578 -0.833 -0.286 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.975 -0.234 0.094 1.00 0.00 H new ATOM 0 HG CYS A 44 10.228 -2.829 1.196 1.00 0.00 H new ATOM 719 N ASN A 45 10.455 1.839 -1.990 1.00 0.00 N ATOM 720 CA ASN A 45 11.196 3.103 -1.869 1.00 0.00 C ATOM 721 C ASN A 45 12.158 3.079 -0.651 1.00 0.00 C ATOM 722 O ASN A 45 12.283 2.065 0.030 1.00 0.00 O ATOM 723 CB ASN A 45 10.131 4.213 -1.783 1.00 0.00 C ATOM 724 CG ASN A 45 10.620 5.642 -1.782 1.00 0.00 C ATOM 725 OD1 ASN A 45 10.190 6.410 -0.944 1.00 0.00 O ATOM 726 ND2 ASN A 45 11.550 6.028 -2.628 1.00 0.00 N ATOM 0 H ASN A 45 9.461 1.920 -1.775 1.00 0.00 H new ATOM 0 HA ASN A 45 11.847 3.278 -2.726 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.447 4.091 -2.623 1.00 0.00 H new ATOM 0 HB3 ASN A 45 9.551 4.054 -0.874 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.916 6.979 -2.584 1.00 0.00 H new ATOM 0 HD22 ASN A 45 11.905 5.376 -3.328 1.00 0.00 H new ATOM 733 N ASP A 46 12.800 4.204 -0.324 1.00 0.00 N ATOM 734 CA ASP A 46 13.534 4.411 0.945 1.00 0.00 C ATOM 735 C ASP A 46 12.925 5.543 1.808 1.00 0.00 C ATOM 736 O ASP A 46 13.178 5.623 3.009 1.00 0.00 O ATOM 737 CB ASP A 46 15.018 4.651 0.630 1.00 0.00 C ATOM 738 CG ASP A 46 15.685 3.378 0.076 1.00 0.00 C ATOM 739 OD1 ASP A 46 15.629 3.138 -1.153 1.00 0.00 O ATOM 740 OD2 ASP A 46 16.244 2.584 0.869 1.00 0.00 O ATOM 0 H ASP A 46 12.830 5.017 -0.940 1.00 0.00 H new ATOM 0 HA ASP A 46 13.441 3.511 1.553 1.00 0.00 H new ATOM 0 HB2 ASP A 46 15.112 5.459 -0.096 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.536 4.972 1.533 1.00 0.00 H new ATOM 745 N GLY A 47 12.035 6.351 1.218 1.00 0.00 N ATOM 746 CA GLY A 47 11.148 7.327 1.864 1.00 0.00 C ATOM 747 C GLY A 47 10.069 6.676 2.713 1.00 0.00 C ATOM 748 O GLY A 47 9.752 7.174 3.788 1.00 0.00 O ATOM 0 H GLY A 47 11.907 6.339 0.206 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.743 7.992 2.490 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.678 7.945 1.099 1.00 0.00 H new ATOM 752 N PHE A 48 9.472 5.582 2.227 1.00 0.00 N ATOM 753 CA PHE A 48 8.349 4.895 2.891 1.00 0.00 C ATOM 754 C PHE A 48 8.774 4.284 4.251 1.00 0.00 C ATOM 755 O PHE A 48 8.012 4.287 5.214 1.00 0.00 O ATOM 756 CB PHE A 48 7.760 3.844 1.913 1.00 0.00 C ATOM 757 CG PHE A 48 8.391 2.461 1.977 1.00 0.00 C ATOM 758 CD1 PHE A 48 9.780 2.290 1.829 1.00 0.00 C ATOM 759 CD2 PHE A 48 7.596 1.353 2.303 1.00 0.00 C ATOM 760 CE1 PHE A 48 10.384 1.070 2.188 1.00 0.00 C ATOM 761 CE2 PHE A 48 8.195 0.118 2.596 1.00 0.00 C ATOM 762 CZ PHE A 48 9.589 -0.016 2.589 1.00 0.00 C ATOM 0 H PHE A 48 9.755 5.141 1.352 1.00 0.00 H new ATOM 0 HA PHE A 48 7.568 5.616 3.133 1.00 0.00 H new ATOM 0 HB2 PHE A 48 6.693 3.746 2.112 1.00 0.00 H new ATOM 0 HB3 PHE A 48 7.861 4.223 0.896 1.00 0.00 H new ATOM 0 HD1 PHE A 48 10.384 3.096 1.439 1.00 0.00 H new ATOM 0 HD2 PHE A 48 6.521 1.450 2.329 1.00 0.00 H new ATOM 0 HE1 PHE A 48 11.459 0.969 2.155 1.00 0.00 H new ATOM 0 HE2 PHE A 48 7.576 -0.736 2.829 1.00 0.00 H new ATOM 0 HZ PHE A 48 10.048 -0.946 2.889 1.00 0.00 H new ATOM 772 N CYS A 49 10.037 3.851 4.349 1.00 0.00 N ATOM 773 CA CYS A 49 10.717 3.420 5.573 1.00 0.00 C ATOM 774 C CYS A 49 10.686 4.518 6.647 1.00 0.00 C ATOM 775 O CYS A 49 10.240 4.266 7.764 1.00 0.00 O ATOM 776 CB CYS A 49 12.141 2.998 5.157 1.00 0.00 C ATOM 777 SG CYS A 49 13.187 2.602 6.586 1.00 0.00 S ATOM 0 H CYS A 49 10.643 3.789 3.531 1.00 0.00 H new ATOM 0 HA CYS A 49 10.212 2.574 6.040 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.083 2.130 4.500 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.603 3.802 4.583 1.00 0.00 H new ATOM 0 HG CYS A 49 12.517 1.869 7.424 1.00 0.00 H new ATOM 783 N GLU A 50 11.081 5.745 6.296 1.00 0.00 N ATOM 784 CA GLU A 50 11.078 6.888 7.221 1.00 0.00 C ATOM 785 C GLU A 50 9.666 7.437 7.501 1.00 0.00 C ATOM 786 O GLU A 50 9.430 7.999 8.572 1.00 0.00 O ATOM 787 CB GLU A 50 11.993 8.000 6.688 1.00 0.00 C ATOM 788 CG GLU A 50 13.452 7.531 6.632 1.00 0.00 C ATOM 789 CD GLU A 50 14.399 8.707 6.352 1.00 0.00 C ATOM 790 OE1 GLU A 50 14.540 9.117 5.175 1.00 0.00 O ATOM 791 OE2 GLU A 50 15.017 9.232 7.309 1.00 0.00 O ATOM 0 H GLU A 50 11.413 5.977 5.360 1.00 0.00 H new ATOM 0 HA GLU A 50 11.460 6.524 8.175 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.665 8.300 5.693 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.914 8.879 7.328 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.722 7.059 7.577 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.565 6.776 5.854 1.00 0.00 H new ATOM 798 N LEU A 51 8.712 7.240 6.576 1.00 0.00 N ATOM 799 CA LEU A 51 7.289 7.536 6.789 1.00 0.00 C ATOM 800 C LEU A 51 6.703 6.673 7.921 1.00 0.00 C ATOM 801 O LEU A 51 5.996 7.191 8.784 1.00 0.00 O ATOM 802 CB LEU A 51 6.530 7.309 5.461 1.00 0.00 C ATOM 803 CG LEU A 51 5.021 7.627 5.498 1.00 0.00 C ATOM 804 CD1 LEU A 51 4.773 9.135 5.617 1.00 0.00 C ATOM 805 CD2 LEU A 51 4.328 7.072 4.248 1.00 0.00 C ATOM 0 H LEU A 51 8.912 6.866 5.648 1.00 0.00 H new ATOM 0 HA LEU A 51 7.178 8.576 7.096 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.994 7.921 4.688 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.657 6.268 5.163 1.00 0.00 H new ATOM 0 HG LEU A 51 4.599 7.146 6.380 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.700 9.327 5.641 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.228 9.507 6.535 1.00 0.00 H new ATOM 0 HD13 LEU A 51 5.214 9.645 4.760 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.264 7.304 4.289 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.765 7.526 3.358 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.462 5.991 4.207 1.00 0.00 H new ATOM 817 N CYS A 52 6.967 5.360 7.895 1.00 0.00 N ATOM 818 CA CYS A 52 6.279 4.382 8.750 1.00 0.00 C ATOM 819 C CYS A 52 7.073 3.957 10.000 1.00 0.00 C ATOM 820 O CYS A 52 6.473 3.666 11.039 1.00 0.00 O ATOM 821 CB CYS A 52 5.902 3.179 7.878 1.00 0.00 C ATOM 822 SG CYS A 52 4.845 3.730 6.503 1.00 0.00 S ATOM 0 H CYS A 52 7.666 4.944 7.279 1.00 0.00 H new ATOM 0 HA CYS A 52 5.389 4.859 9.159 1.00 0.00 H new ATOM 0 HB2 CYS A 52 6.802 2.702 7.490 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.379 2.433 8.476 1.00 0.00 H new ATOM 0 HG CYS A 52 4.870 2.842 5.554 1.00 0.00 H new ATOM 828 N GLY A 53 8.405 3.908 9.900 1.00 0.00 N ATOM 829 CA GLY A 53 9.333 3.499 10.962 1.00 0.00 C ATOM 830 C GLY A 53 9.711 2.013 10.925 1.00 0.00 C ATOM 831 O GLY A 53 10.380 1.538 11.843 1.00 0.00 O ATOM 0 H GLY A 53 8.888 4.163 9.039 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.242 4.096 10.886 1.00 0.00 H new ATOM 0 HA3 GLY A 53 8.884 3.725 11.929 1.00 0.00 H new ATOM 835 N TYR A 54 9.293 1.278 9.886 1.00 0.00 N ATOM 836 CA TYR A 54 9.735 -0.094 9.602 1.00 0.00 C ATOM 837 C TYR A 54 11.035 -0.106 8.762 1.00 0.00 C ATOM 838 O TYR A 54 11.876 0.777 8.910 1.00 0.00 O ATOM 839 CB TYR A 54 8.547 -0.882 9.017 1.00 0.00 C ATOM 840 CG TYR A 54 7.743 -0.296 7.863 1.00 0.00 C ATOM 841 CD1 TYR A 54 8.339 0.453 6.829 1.00 0.00 C ATOM 842 CD2 TYR A 54 6.358 -0.551 7.817 1.00 0.00 C ATOM 843 CE1 TYR A 54 7.557 0.935 5.760 1.00 0.00 C ATOM 844 CE2 TYR A 54 5.573 -0.087 6.744 1.00 0.00 C ATOM 845 CZ TYR A 54 6.174 0.651 5.703 1.00 0.00 C ATOM 846 OH TYR A 54 5.423 1.079 4.651 1.00 0.00 O ATOM 0 H TYR A 54 8.622 1.629 9.203 1.00 0.00 H new ATOM 0 HA TYR A 54 10.025 -0.613 10.515 1.00 0.00 H new ATOM 0 HB2 TYR A 54 8.928 -1.849 8.689 1.00 0.00 H new ATOM 0 HB3 TYR A 54 7.851 -1.074 9.833 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.399 0.659 6.856 1.00 0.00 H new ATOM 0 HD2 TYR A 54 5.892 -1.110 8.615 1.00 0.00 H new ATOM 0 HE1 TYR A 54 8.017 1.524 4.981 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.514 -0.296 6.718 1.00 0.00 H new ATOM 0 HH TYR A 54 6.012 1.337 3.912 1.00 0.00 H new ATOM 856 N SER A 55 11.201 -1.071 7.854 1.00 0.00 N ATOM 857 CA SER A 55 12.277 -1.108 6.853 1.00 0.00 C ATOM 858 C SER A 55 11.926 -1.999 5.653 1.00 0.00 C ATOM 859 O SER A 55 11.036 -2.855 5.741 1.00 0.00 O ATOM 860 CB SER A 55 13.578 -1.605 7.499 1.00 0.00 C ATOM 861 OG SER A 55 13.500 -2.988 7.825 1.00 0.00 O ATOM 0 H SER A 55 10.574 -1.873 7.791 1.00 0.00 H new ATOM 0 HA SER A 55 12.408 -0.091 6.483 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.412 -1.437 6.818 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.782 -1.028 8.401 1.00 0.00 H new ATOM 0 HG SER A 55 14.343 -3.276 8.233 1.00 0.00 H new ATOM 867 N ARG A 56 12.683 -1.874 4.551 1.00 0.00 N ATOM 868 CA ARG A 56 12.612 -2.803 3.416 1.00 0.00 C ATOM 869 C ARG A 56 12.770 -4.259 3.877 1.00 0.00 C ATOM 870 O ARG A 56 11.934 -5.081 3.533 1.00 0.00 O ATOM 871 CB ARG A 56 13.653 -2.394 2.358 1.00 0.00 C ATOM 872 CG ARG A 56 13.714 -3.366 1.166 1.00 0.00 C ATOM 873 CD ARG A 56 14.710 -2.904 0.100 1.00 0.00 C ATOM 874 NE ARG A 56 14.268 -1.648 -0.534 1.00 0.00 N ATOM 875 CZ ARG A 56 14.894 -0.469 -0.500 1.00 0.00 C ATOM 876 NH1 ARG A 56 15.908 -0.219 0.299 1.00 0.00 N ATOM 877 NH2 ARG A 56 14.510 0.518 -1.271 1.00 0.00 N ATOM 0 H ARG A 56 13.362 -1.124 4.424 1.00 0.00 H new ATOM 0 HA ARG A 56 11.626 -2.743 2.956 1.00 0.00 H new ATOM 0 HB2 ARG A 56 13.418 -1.394 1.993 1.00 0.00 H new ATOM 0 HB3 ARG A 56 14.636 -2.339 2.826 1.00 0.00 H new ATOM 0 HG2 ARG A 56 13.996 -4.357 1.521 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.723 -3.457 0.721 1.00 0.00 H new ATOM 0 HD2 ARG A 56 15.691 -2.760 0.553 1.00 0.00 H new ATOM 0 HD3 ARG A 56 14.820 -3.679 -0.659 1.00 0.00 H new ATOM 0 HE ARG A 56 13.391 -1.684 -1.054 1.00 0.00 H new ATOM 0 HH11 ARG A 56 16.250 -0.943 0.931 1.00 0.00 H new ATOM 0 HH12 ARG A 56 16.353 0.699 0.287 1.00 0.00 H new ATOM 0 HH21 ARG A 56 13.723 0.391 -1.908 1.00 0.00 H new ATOM 0 HH22 ARG A 56 14.998 1.413 -1.234 1.00 0.00 H new ATOM 891 N ALA A 57 13.749 -4.576 4.726 1.00 0.00 N ATOM 892 CA ALA A 57 13.945 -5.930 5.266 1.00 0.00 C ATOM 893 C ALA A 57 12.693 -6.509 5.968 1.00 0.00 C ATOM 894 O ALA A 57 12.476 -7.720 5.913 1.00 0.00 O ATOM 895 CB ALA A 57 15.153 -5.897 6.210 1.00 0.00 C ATOM 0 H ALA A 57 14.434 -3.899 5.063 1.00 0.00 H new ATOM 0 HA ALA A 57 14.129 -6.606 4.431 1.00 0.00 H new ATOM 0 HB1 ALA A 57 15.319 -6.892 6.624 1.00 0.00 H new ATOM 0 HB2 ALA A 57 16.038 -5.582 5.657 1.00 0.00 H new ATOM 0 HB3 ALA A 57 14.962 -5.194 7.021 1.00 0.00 H new ATOM 901 N GLU A 58 11.854 -5.659 6.577 1.00 0.00 N ATOM 902 CA GLU A 58 10.612 -6.074 7.247 1.00 0.00 C ATOM 903 C GLU A 58 9.397 -6.074 6.308 1.00 0.00 C ATOM 904 O GLU A 58 8.560 -6.975 6.408 1.00 0.00 O ATOM 905 CB GLU A 58 10.331 -5.142 8.434 1.00 0.00 C ATOM 906 CG GLU A 58 11.438 -5.209 9.486 1.00 0.00 C ATOM 907 CD GLU A 58 11.412 -6.526 10.279 1.00 0.00 C ATOM 908 OE1 GLU A 58 10.526 -6.696 11.149 1.00 0.00 O ATOM 909 OE2 GLU A 58 12.285 -7.398 10.051 1.00 0.00 O ATOM 0 H GLU A 58 12.020 -4.653 6.619 1.00 0.00 H new ATOM 0 HA GLU A 58 10.762 -7.099 7.586 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.232 -4.117 8.076 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.379 -5.413 8.891 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.407 -5.101 8.998 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.333 -4.371 10.175 1.00 0.00 H new ATOM 916 N VAL A 59 9.296 -5.089 5.402 1.00 0.00 N ATOM 917 CA VAL A 59 8.182 -4.962 4.437 1.00 0.00 C ATOM 918 C VAL A 59 8.379 -5.858 3.192 1.00 0.00 C ATOM 919 O VAL A 59 7.437 -6.098 2.436 1.00 0.00 O ATOM 920 CB VAL A 59 7.896 -3.480 4.074 1.00 0.00 C ATOM 921 CG1 VAL A 59 6.659 -3.354 3.157 1.00 0.00 C ATOM 922 CG2 VAL A 59 7.604 -2.680 5.351 1.00 0.00 C ATOM 0 H VAL A 59 9.991 -4.348 5.314 1.00 0.00 H new ATOM 0 HA VAL A 59 7.286 -5.334 4.934 1.00 0.00 H new ATOM 0 HB VAL A 59 8.776 -3.096 3.559 1.00 0.00 H new ATOM 0 HG11 VAL A 59 6.486 -2.304 2.922 1.00 0.00 H new ATOM 0 HG12 VAL A 59 6.832 -3.909 2.235 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.785 -3.760 3.667 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.404 -1.640 5.091 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.734 -3.102 5.854 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.466 -2.728 6.016 1.00 0.00 H new ATOM 932 N MET A 60 9.570 -6.431 2.998 1.00 0.00 N ATOM 933 CA MET A 60 9.800 -7.448 1.957 1.00 0.00 C ATOM 934 C MET A 60 9.029 -8.739 2.279 1.00 0.00 C ATOM 935 O MET A 60 9.005 -9.186 3.425 1.00 0.00 O ATOM 936 CB MET A 60 11.302 -7.710 1.766 1.00 0.00 C ATOM 937 CG MET A 60 11.930 -6.631 0.867 1.00 0.00 C ATOM 938 SD MET A 60 11.506 -6.714 -0.897 1.00 0.00 S ATOM 939 CE MET A 60 12.438 -8.190 -1.383 1.00 0.00 C ATOM 0 H MET A 60 10.398 -6.209 3.550 1.00 0.00 H new ATOM 0 HA MET A 60 9.417 -7.066 1.011 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.801 -7.719 2.735 1.00 0.00 H new ATOM 0 HB3 MET A 60 11.451 -8.694 1.321 1.00 0.00 H new ATOM 0 HG2 MET A 60 11.632 -5.653 1.246 1.00 0.00 H new ATOM 0 HG3 MET A 60 13.014 -6.693 0.963 1.00 0.00 H new ATOM 0 HE1 MET A 60 12.403 -8.302 -2.467 1.00 0.00 H new ATOM 0 HE2 MET A 60 13.475 -8.088 -1.063 1.00 0.00 H new ATOM 0 HE3 MET A 60 11.998 -9.069 -0.913 1.00 0.00 H new ATOM 949 N GLN A 61 8.366 -9.301 1.256 1.00 0.00 N ATOM 950 CA GLN A 61 7.494 -10.494 1.319 1.00 0.00 C ATOM 951 C GLN A 61 6.115 -10.213 1.960 1.00 0.00 C ATOM 952 O GLN A 61 5.295 -11.119 2.103 1.00 0.00 O ATOM 953 CB GLN A 61 8.267 -11.688 1.941 1.00 0.00 C ATOM 954 CG GLN A 61 7.808 -13.096 1.507 1.00 0.00 C ATOM 955 CD GLN A 61 6.706 -13.718 2.375 1.00 0.00 C ATOM 956 OE1 GLN A 61 6.750 -13.715 3.602 1.00 0.00 O ATOM 957 NE2 GLN A 61 5.693 -14.320 1.780 1.00 0.00 N ATOM 0 H GLN A 61 8.424 -8.919 0.312 1.00 0.00 H new ATOM 0 HA GLN A 61 7.236 -10.783 0.300 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.323 -11.580 1.692 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.187 -11.621 3.026 1.00 0.00 H new ATOM 0 HG2 GLN A 61 7.452 -13.044 0.478 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.672 -13.761 1.513 1.00 0.00 H new ATOM 0 HE21 GLN A 61 5.636 -14.335 0.762 1.00 0.00 H new ATOM 0 HE22 GLN A 61 4.968 -14.770 2.339 1.00 0.00 H new ATOM 966 N ARG A 62 5.816 -8.948 2.286 1.00 0.00 N ATOM 967 CA ARG A 62 4.515 -8.505 2.823 1.00 0.00 C ATOM 968 C ARG A 62 3.543 -8.138 1.695 1.00 0.00 C ATOM 969 O ARG A 62 4.006 -7.737 0.621 1.00 0.00 O ATOM 970 CB ARG A 62 4.666 -7.284 3.753 1.00 0.00 C ATOM 971 CG ARG A 62 5.607 -7.498 4.939 1.00 0.00 C ATOM 972 CD ARG A 62 5.220 -8.617 5.905 1.00 0.00 C ATOM 973 NE ARG A 62 6.385 -8.936 6.747 1.00 0.00 N ATOM 974 CZ ARG A 62 6.537 -9.967 7.566 1.00 0.00 C ATOM 975 NH1 ARG A 62 5.582 -10.853 7.766 1.00 0.00 N ATOM 976 NH2 ARG A 62 7.677 -10.117 8.202 1.00 0.00 N ATOM 0 H ARG A 62 6.485 -8.185 2.183 1.00 0.00 H new ATOM 0 HA ARG A 62 4.118 -9.345 3.393 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.029 -6.440 3.166 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.682 -7.009 4.132 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.605 -7.706 4.553 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.671 -6.566 5.500 1.00 0.00 H new ATOM 0 HD2 ARG A 62 4.379 -8.307 6.525 1.00 0.00 H new ATOM 0 HD3 ARG A 62 4.900 -9.500 5.352 1.00 0.00 H new ATOM 0 HE ARG A 62 7.169 -8.286 6.694 1.00 0.00 H new ATOM 0 HH11 ARG A 62 4.689 -10.758 7.283 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.736 -11.634 8.404 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.431 -9.445 8.062 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.808 -10.906 8.835 1.00 0.00 H new ATOM 990 N PRO A 63 2.220 -8.207 1.936 1.00 0.00 N ATOM 991 CA PRO A 63 1.210 -7.695 1.014 1.00 0.00 C ATOM 992 C PRO A 63 1.266 -6.162 0.948 1.00 0.00 C ATOM 993 O PRO A 63 1.426 -5.496 1.972 1.00 0.00 O ATOM 994 CB PRO A 63 -0.126 -8.208 1.561 1.00 0.00 C ATOM 995 CG PRO A 63 0.120 -8.395 3.056 1.00 0.00 C ATOM 996 CD PRO A 63 1.598 -8.756 3.138 1.00 0.00 C ATOM 0 HA PRO A 63 1.366 -8.034 -0.010 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -0.930 -7.495 1.377 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.416 -9.145 1.086 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -0.101 -7.486 3.615 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.508 -9.184 3.469 1.00 0.00 H new ATOM 0 HD2 PRO A 63 2.051 -8.337 4.037 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.732 -9.837 3.187 1.00 0.00 H new ATOM 1004 N CYS A 64 1.109 -5.589 -0.252 1.00 0.00 N ATOM 1005 CA CYS A 64 1.168 -4.133 -0.481 1.00 0.00 C ATOM 1006 C CYS A 64 0.000 -3.328 0.127 1.00 0.00 C ATOM 1007 O CYS A 64 -0.003 -2.095 0.046 1.00 0.00 O ATOM 1008 CB CYS A 64 1.294 -3.879 -1.987 1.00 0.00 C ATOM 1009 SG CYS A 64 -0.199 -4.456 -2.852 1.00 0.00 S ATOM 0 H CYS A 64 0.936 -6.125 -1.102 1.00 0.00 H new ATOM 0 HA CYS A 64 2.045 -3.765 0.051 1.00 0.00 H new ATOM 0 HB2 CYS A 64 1.441 -2.815 -2.172 1.00 0.00 H new ATOM 0 HB3 CYS A 64 2.171 -4.395 -2.378 1.00 0.00 H new ATOM 0 HG CYS A 64 -0.076 -4.231 -4.127 1.00 0.00 H new ATOM 1015 N THR A 65 -0.976 -4.007 0.742 1.00 0.00 N ATOM 1016 CA THR A 65 -2.076 -3.402 1.506 1.00 0.00 C ATOM 1017 C THR A 65 -1.578 -2.644 2.734 1.00 0.00 C ATOM 1018 O THR A 65 -2.216 -1.664 3.122 1.00 0.00 O ATOM 1019 CB THR A 65 -3.071 -4.474 1.960 1.00 0.00 C ATOM 1020 OG1 THR A 65 -2.359 -5.476 2.658 1.00 0.00 O ATOM 1021 CG2 THR A 65 -3.798 -5.124 0.783 1.00 0.00 C ATOM 0 H THR A 65 -1.024 -5.026 0.721 1.00 0.00 H new ATOM 0 HA THR A 65 -2.565 -2.694 0.837 1.00 0.00 H new ATOM 0 HB THR A 65 -3.819 -3.995 2.592 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.982 -6.171 2.958 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.492 -5.877 1.155 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.350 -4.363 0.231 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.071 -5.596 0.122 1.00 0.00 H new ATOM 1029 N CYS A 66 -0.467 -3.093 3.345 1.00 0.00 N ATOM 1030 CA CYS A 66 0.069 -2.561 4.607 1.00 0.00 C ATOM 1031 C CYS A 66 -0.995 -2.488 5.729 1.00 0.00 C ATOM 1032 O CYS A 66 -0.974 -1.586 6.566 1.00 0.00 O ATOM 1033 CB CYS A 66 0.805 -1.237 4.335 1.00 0.00 C ATOM 1034 SG CYS A 66 2.247 -1.542 3.269 1.00 0.00 S ATOM 0 H CYS A 66 0.095 -3.854 2.964 1.00 0.00 H new ATOM 0 HA CYS A 66 0.804 -3.261 5.004 1.00 0.00 H new ATOM 0 HB2 CYS A 66 0.131 -0.527 3.856 1.00 0.00 H new ATOM 0 HB3 CYS A 66 1.125 -0.788 5.275 1.00 0.00 H new ATOM 0 HG CYS A 66 2.863 -0.420 3.041 1.00 0.00 H new ATOM 1040 N ASP A 67 -1.924 -3.454 5.760 1.00 0.00 N ATOM 1041 CA ASP A 67 -3.064 -3.494 6.689 1.00 0.00 C ATOM 1042 C ASP A 67 -2.626 -3.479 8.161 1.00 0.00 C ATOM 1043 O ASP A 67 -3.304 -2.899 9.010 1.00 0.00 O ATOM 1044 CB ASP A 67 -3.896 -4.748 6.387 1.00 0.00 C ATOM 1045 CG ASP A 67 -5.106 -4.879 7.328 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -6.155 -4.254 7.046 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -5.006 -5.616 8.339 1.00 0.00 O ATOM 0 H ASP A 67 -1.903 -4.250 5.123 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.661 -2.595 6.539 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -4.242 -4.713 5.354 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -3.266 -5.632 6.482 1.00 0.00 H new ATOM 1052 N PHE A 68 -1.454 -4.056 8.450 1.00 0.00 N ATOM 1053 CA PHE A 68 -0.827 -4.088 9.769 1.00 0.00 C ATOM 1054 C PHE A 68 -0.562 -2.695 10.381 1.00 0.00 C ATOM 1055 O PHE A 68 -0.343 -2.597 11.590 1.00 0.00 O ATOM 1056 CB PHE A 68 0.462 -4.925 9.674 1.00 0.00 C ATOM 1057 CG PHE A 68 1.464 -4.449 8.634 1.00 0.00 C ATOM 1058 CD1 PHE A 68 2.300 -3.350 8.911 1.00 0.00 C ATOM 1059 CD2 PHE A 68 1.563 -5.101 7.389 1.00 0.00 C ATOM 1060 CE1 PHE A 68 3.215 -2.899 7.945 1.00 0.00 C ATOM 1061 CE2 PHE A 68 2.491 -4.656 6.428 1.00 0.00 C ATOM 1062 CZ PHE A 68 3.312 -3.548 6.703 1.00 0.00 C ATOM 0 H PHE A 68 -0.897 -4.532 7.740 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.532 -4.550 10.460 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.948 -4.928 10.650 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.191 -5.957 9.450 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.238 -2.853 9.868 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.925 -5.945 7.171 1.00 0.00 H new ATOM 0 HE1 PHE A 68 3.847 -2.049 8.158 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.572 -5.166 5.479 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.015 -3.197 5.962 1.00 0.00 H new ATOM 1072 N LEU A 69 -0.611 -1.617 9.582 1.00 0.00 N ATOM 1073 CA LEU A 69 -0.520 -0.229 10.058 1.00 0.00 C ATOM 1074 C LEU A 69 -1.791 0.291 10.754 1.00 0.00 C ATOM 1075 O LEU A 69 -1.765 1.404 11.281 1.00 0.00 O ATOM 1076 CB LEU A 69 -0.180 0.693 8.877 1.00 0.00 C ATOM 1077 CG LEU A 69 1.181 0.468 8.196 1.00 0.00 C ATOM 1078 CD1 LEU A 69 1.297 1.493 7.060 1.00 0.00 C ATOM 1079 CD2 LEU A 69 2.355 0.639 9.172 1.00 0.00 C ATOM 0 H LEU A 69 -0.717 -1.688 8.570 1.00 0.00 H new ATOM 0 HA LEU A 69 0.266 -0.222 10.813 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.960 0.583 8.124 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.219 1.724 9.228 1.00 0.00 H new ATOM 0 HG LEU A 69 1.231 -0.555 7.823 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.252 1.365 6.551 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.484 1.342 6.350 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.237 2.501 7.472 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.294 0.470 8.645 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.345 1.650 9.580 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.261 -0.081 9.984 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.908 -0.444 10.751 1.00 0.00 N ATOM 1092 CA HIS A 70 -4.128 -0.001 11.428 1.00 0.00 C ATOM 1093 C HIS A 70 -3.945 0.192 12.955 1.00 0.00 C ATOM 1094 O HIS A 70 -3.289 -0.603 13.640 1.00 0.00 O ATOM 1095 CB HIS A 70 -5.313 -0.927 11.091 1.00 0.00 C ATOM 1096 CG HIS A 70 -5.326 -2.272 11.779 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -4.916 -3.471 11.243 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -5.842 -2.548 13.018 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -5.161 -4.441 12.139 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -5.730 -3.927 13.248 1.00 0.00 N ATOM 0 H HIS A 70 -2.991 -1.348 10.287 1.00 0.00 H new ATOM 0 HA HIS A 70 -4.361 0.991 11.041 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -6.237 -0.406 11.341 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.322 -1.093 10.014 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -4.497 -3.601 10.322 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -6.264 -1.826 13.702 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -4.934 -5.487 11.992 1.00 0.00 H new ATOM 1108 N GLY A 71 -4.561 1.255 13.484 1.00 0.00 N ATOM 1109 CA GLY A 71 -4.697 1.565 14.911 1.00 0.00 C ATOM 1110 C GLY A 71 -6.169 1.762 15.315 1.00 0.00 C ATOM 1111 O GLY A 71 -7.064 1.390 14.547 1.00 0.00 O ATOM 0 H GLY A 71 -5.002 1.961 12.895 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.263 0.758 15.501 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -4.133 2.468 15.142 1.00 0.00 H new ATOM 1115 N PRO A 72 -6.448 2.371 16.485 1.00 0.00 N ATOM 1116 CA PRO A 72 -7.815 2.613 16.957 1.00 0.00 C ATOM 1117 C PRO A 72 -8.563 3.682 16.138 1.00 0.00 C ATOM 1118 O PRO A 72 -9.794 3.682 16.143 1.00 0.00 O ATOM 1119 CB PRO A 72 -7.662 3.023 18.426 1.00 0.00 C ATOM 1120 CG PRO A 72 -6.277 3.663 18.480 1.00 0.00 C ATOM 1121 CD PRO A 72 -5.480 2.835 17.472 1.00 0.00 C ATOM 0 HA PRO A 72 -8.428 1.720 16.839 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -8.439 3.724 18.729 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.732 2.163 19.091 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -6.308 4.717 18.203 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -5.845 3.608 19.479 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -4.700 3.435 17.003 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.986 1.995 17.960 1.00 0.00 H new ATOM 1129 N ARG A 73 -7.849 4.566 15.418 1.00 0.00 N ATOM 1130 CA ARG A 73 -8.435 5.620 14.572 1.00 0.00 C ATOM 1131 C ARG A 73 -8.594 5.201 13.094 1.00 0.00 C ATOM 1132 O ARG A 73 -8.990 6.030 12.271 1.00 0.00 O ATOM 1133 CB ARG A 73 -7.605 6.920 14.723 1.00 0.00 C ATOM 1134 CG ARG A 73 -8.456 8.160 15.060 1.00 0.00 C ATOM 1135 CD ARG A 73 -9.464 8.557 13.971 1.00 0.00 C ATOM 1136 NE ARG A 73 -10.199 9.782 14.340 1.00 0.00 N ATOM 1137 CZ ARG A 73 -11.304 9.865 15.076 1.00 0.00 C ATOM 1138 NH1 ARG A 73 -11.891 8.803 15.592 1.00 0.00 N ATOM 1139 NH2 ARG A 73 -11.847 11.041 15.305 1.00 0.00 N ATOM 0 H ARG A 73 -6.829 4.567 15.408 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.452 5.801 14.921 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -6.861 6.777 15.506 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.061 7.104 13.796 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.997 7.972 15.987 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -7.790 9.003 15.245 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -8.940 8.715 13.028 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -10.169 7.742 13.811 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.818 10.662 13.993 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -11.499 7.875 15.432 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -12.738 8.909 16.151 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -11.421 11.883 14.919 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -12.694 11.110 15.869 1.00 0.00 H new ATOM 1153 N THR A 74 -8.261 3.952 12.734 1.00 0.00 N ATOM 1154 CA THR A 74 -8.381 3.401 11.368 1.00 0.00 C ATOM 1155 C THR A 74 -9.795 2.859 11.146 1.00 0.00 C ATOM 1156 O THR A 74 -10.341 2.183 12.018 1.00 0.00 O ATOM 1157 CB THR A 74 -7.338 2.301 11.126 1.00 0.00 C ATOM 1158 OG1 THR A 74 -6.079 2.768 11.536 1.00 0.00 O ATOM 1159 CG2 THR A 74 -7.236 1.926 9.649 1.00 0.00 C ATOM 0 H THR A 74 -7.890 3.275 13.401 1.00 0.00 H new ATOM 0 HA THR A 74 -8.193 4.203 10.654 1.00 0.00 H new ATOM 0 HB THR A 74 -7.648 1.422 11.692 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.782 3.481 10.933 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.487 1.145 9.523 1.00 0.00 H new ATOM 0 HG22 THR A 74 -8.202 1.562 9.298 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.947 2.803 9.070 1.00 0.00 H new ATOM 1167 N GLN A 75 -10.381 3.131 9.975 1.00 0.00 N ATOM 1168 CA GLN A 75 -11.733 2.690 9.605 1.00 0.00 C ATOM 1169 C GLN A 75 -11.651 1.493 8.646 1.00 0.00 C ATOM 1170 O GLN A 75 -10.948 1.546 7.632 1.00 0.00 O ATOM 1171 CB GLN A 75 -12.511 3.857 8.956 1.00 0.00 C ATOM 1172 CG GLN A 75 -13.126 4.852 9.965 1.00 0.00 C ATOM 1173 CD GLN A 75 -12.116 5.479 10.928 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -12.118 5.219 12.125 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -11.194 6.292 10.452 1.00 0.00 N ATOM 0 H GLN A 75 -9.922 3.674 9.244 1.00 0.00 H new ATOM 0 HA GLN A 75 -12.266 2.377 10.503 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.839 4.401 8.291 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -13.309 3.446 8.337 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -13.626 5.648 9.413 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -13.891 4.336 10.545 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -11.178 6.519 9.458 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -10.496 6.694 11.078 1.00 0.00 H new ATOM 1184 N ARG A 76 -12.418 0.430 8.929 1.00 0.00 N ATOM 1185 CA ARG A 76 -12.426 -0.814 8.140 1.00 0.00 C ATOM 1186 C ARG A 76 -12.790 -0.577 6.668 1.00 0.00 C ATOM 1187 O ARG A 76 -12.202 -1.203 5.791 1.00 0.00 O ATOM 1188 CB ARG A 76 -13.382 -1.823 8.814 1.00 0.00 C ATOM 1189 CG ARG A 76 -13.420 -3.222 8.168 1.00 0.00 C ATOM 1190 CD ARG A 76 -12.079 -3.977 8.182 1.00 0.00 C ATOM 1191 NE ARG A 76 -11.596 -4.231 9.555 1.00 0.00 N ATOM 1192 CZ ARG A 76 -11.980 -5.211 10.370 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -12.882 -6.105 10.020 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -11.451 -5.301 11.571 1.00 0.00 N ATOM 0 H ARG A 76 -13.059 0.408 9.722 1.00 0.00 H new ATOM 0 HA ARG A 76 -11.416 -1.224 8.125 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -13.093 -1.931 9.859 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.390 -1.408 8.803 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -14.166 -3.825 8.686 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -13.753 -3.121 7.135 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -12.193 -4.926 7.657 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -11.333 -3.399 7.637 1.00 0.00 H new ATOM 0 HE ARG A 76 -10.893 -3.587 9.917 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -13.312 -6.061 9.096 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -13.150 -6.841 10.673 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.751 -4.623 11.872 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -11.740 -6.049 12.201 1.00 0.00 H new ATOM 1208 N ARG A 77 -13.688 0.376 6.379 1.00 0.00 N ATOM 1209 CA ARG A 77 -14.102 0.753 5.012 1.00 0.00 C ATOM 1210 C ARG A 77 -12.914 1.183 4.136 1.00 0.00 C ATOM 1211 O ARG A 77 -12.804 0.754 2.992 1.00 0.00 O ATOM 1212 CB ARG A 77 -15.173 1.860 5.112 1.00 0.00 C ATOM 1213 CG ARG A 77 -15.885 2.201 3.790 1.00 0.00 C ATOM 1214 CD ARG A 77 -16.722 1.040 3.232 1.00 0.00 C ATOM 1215 NE ARG A 77 -17.519 1.462 2.065 1.00 0.00 N ATOM 1216 CZ ARG A 77 -18.713 2.052 2.079 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -19.338 2.355 3.200 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -19.305 2.352 0.943 1.00 0.00 N ATOM 0 H ARG A 77 -14.159 0.920 7.102 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.525 -0.121 4.517 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -15.922 1.554 5.842 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -14.703 2.765 5.498 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -16.532 3.064 3.946 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -15.140 2.492 3.049 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -16.064 0.219 2.947 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -17.385 0.661 4.010 1.00 0.00 H new ATOM 0 HE ARG A 77 -17.111 1.282 1.147 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -18.907 2.138 4.099 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -20.252 2.807 3.168 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -18.850 2.133 0.057 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -20.219 2.804 0.948 1.00 0.00 H new ATOM 1232 N ALA A 78 -11.979 1.964 4.679 1.00 0.00 N ATOM 1233 CA ALA A 78 -10.772 2.391 3.961 1.00 0.00 C ATOM 1234 C ALA A 78 -9.758 1.245 3.795 1.00 0.00 C ATOM 1235 O ALA A 78 -9.252 1.022 2.696 1.00 0.00 O ATOM 1236 CB ALA A 78 -10.187 3.589 4.709 1.00 0.00 C ATOM 0 H ALA A 78 -12.036 2.321 5.633 1.00 0.00 H new ATOM 0 HA ALA A 78 -11.028 2.685 2.943 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.286 3.931 4.200 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -10.919 4.396 4.733 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -9.938 3.295 5.729 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.517 0.455 4.846 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.656 -0.736 4.766 1.00 0.00 C ATOM 1244 C ALA A 79 -9.161 -1.745 3.711 1.00 0.00 C ATOM 1245 O ALA A 79 -8.371 -2.339 2.974 1.00 0.00 O ATOM 1246 CB ALA A 79 -8.579 -1.360 6.165 1.00 0.00 C ATOM 0 H ALA A 79 -9.910 0.619 5.773 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.658 -0.446 4.438 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -7.946 -2.246 6.134 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -8.157 -0.637 6.863 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -9.580 -1.641 6.494 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.486 -1.864 3.586 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.176 -2.660 2.572 1.00 0.00 C ATOM 1254 C ALA A 80 -11.002 -2.075 1.172 1.00 0.00 C ATOM 1255 O ALA A 80 -10.653 -2.805 0.253 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.664 -2.705 2.925 1.00 0.00 C ATOM 0 H ALA A 80 -11.132 -1.388 4.216 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.745 -3.661 2.564 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.197 -3.295 2.179 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -12.791 -3.160 3.907 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.065 -1.692 2.940 1.00 0.00 H new ATOM 1262 N GLN A 81 -11.215 -0.766 1.004 1.00 0.00 N ATOM 1263 CA GLN A 81 -11.042 -0.086 -0.281 1.00 0.00 C ATOM 1264 C GLN A 81 -9.614 -0.273 -0.822 1.00 0.00 C ATOM 1265 O GLN A 81 -9.473 -0.539 -2.012 1.00 0.00 O ATOM 1266 CB GLN A 81 -11.419 1.397 -0.144 1.00 0.00 C ATOM 1267 CG GLN A 81 -12.933 1.660 -0.020 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.475 2.504 -1.177 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -13.393 2.142 -2.345 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -14.017 3.676 -0.909 1.00 0.00 N ATOM 0 H GLN A 81 -11.513 -0.148 1.758 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.713 -0.537 -1.012 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -10.918 1.807 0.733 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -11.038 1.938 -1.010 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -13.463 0.708 0.011 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -13.135 2.168 0.923 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -14.094 3.994 0.057 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -14.360 4.265 -1.668 1.00 0.00 H new ATOM 1279 N ILE A 82 -8.562 -0.231 0.014 1.00 0.00 N ATOM 1280 CA ILE A 82 -7.190 -0.572 -0.434 1.00 0.00 C ATOM 1281 C ILE A 82 -7.098 -2.014 -0.963 1.00 0.00 C ATOM 1282 O ILE A 82 -6.532 -2.229 -2.033 1.00 0.00 O ATOM 1283 CB ILE A 82 -6.166 -0.297 0.696 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -6.093 1.223 0.949 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -4.764 -0.832 0.340 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -5.341 1.625 2.217 1.00 0.00 C ATOM 0 H ILE A 82 -8.629 0.033 0.997 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.940 0.076 -1.274 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.499 -0.817 1.594 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.613 1.697 0.093 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.108 1.617 1.005 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.075 -0.620 1.158 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.815 -1.909 0.179 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.409 -0.346 -0.569 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.341 2.711 2.311 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.831 1.185 3.086 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.313 1.266 2.160 1.00 0.00 H new ATOM 1298 N ALA A 83 -7.668 -2.996 -0.259 1.00 0.00 N ATOM 1299 CA ALA A 83 -7.655 -4.402 -0.684 1.00 0.00 C ATOM 1300 C ALA A 83 -8.503 -4.654 -1.949 1.00 0.00 C ATOM 1301 O ALA A 83 -8.112 -5.440 -2.813 1.00 0.00 O ATOM 1302 CB ALA A 83 -8.120 -5.261 0.499 1.00 0.00 C ATOM 0 H ALA A 83 -8.153 -2.840 0.624 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.639 -4.678 -0.968 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.119 -6.312 0.208 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -7.443 -5.117 1.341 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -9.128 -4.966 0.789 1.00 0.00 H new ATOM 1308 N GLN A 84 -9.641 -3.966 -2.084 1.00 0.00 N ATOM 1309 CA GLN A 84 -10.511 -4.014 -3.264 1.00 0.00 C ATOM 1310 C GLN A 84 -9.857 -3.336 -4.476 1.00 0.00 C ATOM 1311 O GLN A 84 -10.050 -3.797 -5.601 1.00 0.00 O ATOM 1312 CB GLN A 84 -11.860 -3.337 -2.952 1.00 0.00 C ATOM 1313 CG GLN A 84 -12.753 -4.116 -1.967 1.00 0.00 C ATOM 1314 CD GLN A 84 -13.280 -5.442 -2.527 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -13.797 -5.526 -3.635 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -13.169 -6.532 -1.792 1.00 0.00 N ATOM 0 H GLN A 84 -9.992 -3.344 -1.356 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.676 -5.062 -3.513 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -11.668 -2.345 -2.543 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -12.406 -3.197 -3.885 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.187 -4.316 -1.057 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.599 -3.490 -1.685 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -12.742 -6.482 -0.867 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.511 -7.425 -2.149 1.00 0.00 H new ATOM 1325 N ALA A 85 -9.045 -2.287 -4.277 1.00 0.00 N ATOM 1326 CA ALA A 85 -8.364 -1.585 -5.366 1.00 0.00 C ATOM 1327 C ALA A 85 -7.427 -2.507 -6.179 1.00 0.00 C ATOM 1328 O ALA A 85 -7.256 -2.311 -7.383 1.00 0.00 O ATOM 1329 CB ALA A 85 -7.596 -0.393 -4.796 1.00 0.00 C ATOM 0 H ALA A 85 -8.844 -1.904 -3.353 1.00 0.00 H new ATOM 0 HA ALA A 85 -9.124 -1.235 -6.064 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -7.087 0.132 -5.604 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -8.292 0.286 -4.303 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -6.860 -0.746 -4.073 1.00 0.00 H new ATOM 1335 N LEU A 86 -6.861 -3.537 -5.533 1.00 0.00 N ATOM 1336 CA LEU A 86 -5.991 -4.554 -6.148 1.00 0.00 C ATOM 1337 C LEU A 86 -6.750 -5.520 -7.080 1.00 0.00 C ATOM 1338 O LEU A 86 -6.126 -6.222 -7.876 1.00 0.00 O ATOM 1339 CB LEU A 86 -5.278 -5.356 -5.042 1.00 0.00 C ATOM 1340 CG LEU A 86 -4.527 -4.527 -3.982 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -3.900 -5.472 -2.952 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -3.445 -3.626 -4.591 1.00 0.00 C ATOM 0 H LEU A 86 -7.000 -3.691 -4.534 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.268 -4.022 -6.767 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.019 -5.973 -4.534 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.567 -6.035 -5.514 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.254 -3.870 -3.504 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.368 -4.889 -2.200 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.684 -6.057 -2.470 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.202 -6.143 -3.452 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.949 -3.066 -3.798 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.712 -4.240 -5.114 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.904 -2.931 -5.294 1.00 0.00 H new ATOM 1354 N LEU A 87 -8.085 -5.570 -6.994 1.00 0.00 N ATOM 1355 CA LEU A 87 -8.940 -6.351 -7.898 1.00 0.00 C ATOM 1356 C LEU A 87 -9.304 -5.573 -9.179 1.00 0.00 C ATOM 1357 O LEU A 87 -9.797 -6.172 -10.139 1.00 0.00 O ATOM 1358 CB LEU A 87 -10.208 -6.807 -7.144 1.00 0.00 C ATOM 1359 CG LEU A 87 -9.956 -7.563 -5.819 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -11.302 -7.951 -5.193 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -9.099 -8.823 -6.016 1.00 0.00 C ATOM 0 H LEU A 87 -8.610 -5.061 -6.283 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.378 -7.227 -8.221 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.819 -5.930 -6.931 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.791 -7.449 -7.804 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.404 -6.895 -5.158 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.128 -8.484 -4.258 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.884 -7.051 -4.994 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -11.851 -8.594 -5.881 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.952 -9.317 -5.055 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.605 -9.504 -6.700 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.131 -8.543 -6.432 1.00 0.00 H new ATOM 1373 N GLY A 88 -9.057 -4.256 -9.210 1.00 0.00 N ATOM 1374 CA GLY A 88 -9.309 -3.370 -10.353 1.00 0.00 C ATOM 1375 C GLY A 88 -8.101 -3.232 -11.283 1.00 0.00 C ATOM 1376 O GLY A 88 -6.950 -3.318 -10.854 1.00 0.00 O ATOM 0 H GLY A 88 -8.662 -3.761 -8.410 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.156 -3.753 -10.922 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.592 -2.384 -9.985 1.00 0.00 H new ATOM 1380 N ALA A 89 -8.372 -2.969 -12.565 1.00 0.00 N ATOM 1381 CA ALA A 89 -7.361 -2.746 -13.611 1.00 0.00 C ATOM 1382 C ALA A 89 -7.001 -1.259 -13.827 1.00 0.00 C ATOM 1383 O ALA A 89 -6.188 -0.948 -14.699 1.00 0.00 O ATOM 1384 CB ALA A 89 -7.898 -3.374 -14.903 1.00 0.00 C ATOM 0 H ALA A 89 -9.327 -2.903 -12.917 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.427 -3.212 -13.296 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.175 -3.230 -15.706 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.061 -4.441 -14.749 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.841 -2.899 -15.174 1.00 0.00 H new ATOM 1390 N GLU A 90 -7.620 -0.347 -13.068 1.00 0.00 N ATOM 1391 CA GLU A 90 -7.513 1.110 -13.212 1.00 0.00 C ATOM 1392 C GLU A 90 -7.026 1.767 -11.901 1.00 0.00 C ATOM 1393 O GLU A 90 -7.107 1.165 -10.826 1.00 0.00 O ATOM 1394 CB GLU A 90 -8.886 1.658 -13.651 1.00 0.00 C ATOM 1395 CG GLU A 90 -8.760 2.886 -14.557 1.00 0.00 C ATOM 1396 CD GLU A 90 -10.144 3.386 -15.003 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -10.742 4.235 -14.301 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -10.642 2.939 -16.064 1.00 0.00 O ATOM 0 H GLU A 90 -8.237 -0.617 -12.302 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.770 1.353 -13.971 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -9.435 0.877 -14.176 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -9.469 1.919 -12.768 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -8.236 3.681 -14.027 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -8.160 2.637 -15.432 1.00 0.00 H new ATOM 1405 N GLU A 91 -6.500 2.996 -11.985 1.00 0.00 N ATOM 1406 CA GLU A 91 -5.971 3.748 -10.835 1.00 0.00 C ATOM 1407 C GLU A 91 -7.037 3.999 -9.752 1.00 0.00 C ATOM 1408 O GLU A 91 -8.210 4.247 -10.055 1.00 0.00 O ATOM 1409 CB GLU A 91 -5.394 5.101 -11.294 1.00 0.00 C ATOM 1410 CG GLU A 91 -4.150 4.979 -12.182 1.00 0.00 C ATOM 1411 CD GLU A 91 -3.752 6.350 -12.748 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -3.070 7.132 -12.045 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -4.119 6.657 -13.908 1.00 0.00 O ATOM 0 H GLU A 91 -6.428 3.505 -12.866 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.185 3.132 -10.399 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.164 5.647 -11.838 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -5.144 5.695 -10.415 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.324 4.564 -11.604 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.347 4.286 -13.000 1.00 0.00 H new ATOM 1420 N ARG A 92 -6.604 3.976 -8.483 1.00 0.00 N ATOM 1421 CA ARG A 92 -7.472 4.153 -7.311 1.00 0.00 C ATOM 1422 C ARG A 92 -6.719 4.787 -6.145 1.00 0.00 C ATOM 1423 O ARG A 92 -5.654 4.309 -5.753 1.00 0.00 O ATOM 1424 CB ARG A 92 -8.045 2.782 -6.903 1.00 0.00 C ATOM 1425 CG ARG A 92 -9.152 2.812 -5.830 1.00 0.00 C ATOM 1426 CD ARG A 92 -10.349 3.697 -6.213 1.00 0.00 C ATOM 1427 NE ARG A 92 -11.545 3.365 -5.414 1.00 0.00 N ATOM 1428 CZ ARG A 92 -12.804 3.670 -5.717 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -13.121 4.359 -6.796 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -13.779 3.280 -4.928 1.00 0.00 N ATOM 0 H ARG A 92 -5.624 3.831 -8.239 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.284 4.831 -7.574 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.441 2.295 -7.794 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.227 2.161 -6.537 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -9.503 1.796 -5.652 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.729 3.172 -4.892 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.090 4.745 -6.064 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -10.572 3.571 -7.273 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.391 2.852 -4.546 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -12.389 4.677 -7.431 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -14.098 4.574 -6.995 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.570 2.745 -4.085 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.745 3.513 -5.158 1.00 0.00 H new ATOM 1444 N LYS A 93 -7.301 5.828 -5.553 1.00 0.00 N ATOM 1445 CA LYS A 93 -6.814 6.492 -4.342 1.00 0.00 C ATOM 1446 C LYS A 93 -7.761 6.213 -3.158 1.00 0.00 C ATOM 1447 O LYS A 93 -8.976 6.344 -3.301 1.00 0.00 O ATOM 1448 CB LYS A 93 -6.684 7.999 -4.622 1.00 0.00 C ATOM 1449 CG LYS A 93 -5.870 8.316 -5.892 1.00 0.00 C ATOM 1450 CD LYS A 93 -5.366 9.765 -5.926 1.00 0.00 C ATOM 1451 CE LYS A 93 -6.513 10.771 -5.748 1.00 0.00 C ATOM 1452 NZ LYS A 93 -6.046 12.179 -5.894 1.00 0.00 N ATOM 0 H LYS A 93 -8.156 6.249 -5.916 1.00 0.00 H new ATOM 0 HA LYS A 93 -5.835 6.100 -4.068 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.680 8.430 -4.720 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.211 8.481 -3.766 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.019 7.638 -5.952 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.488 8.130 -6.770 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.628 9.912 -5.138 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -4.862 9.952 -6.874 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.291 10.568 -6.484 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -6.963 10.638 -4.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.850 12.826 -5.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.322 12.381 -5.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.640 12.313 -6.842 1.00 0.00 H new ATOM 1466 N VAL A 94 -7.216 5.826 -2.001 1.00 0.00 N ATOM 1467 CA VAL A 94 -7.969 5.569 -0.751 1.00 0.00 C ATOM 1468 C VAL A 94 -7.290 6.325 0.386 1.00 0.00 C ATOM 1469 O VAL A 94 -6.066 6.284 0.504 1.00 0.00 O ATOM 1470 CB VAL A 94 -8.070 4.059 -0.408 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -8.944 3.840 0.831 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -8.621 3.282 -1.601 1.00 0.00 C ATOM 0 H VAL A 94 -6.213 5.676 -1.896 1.00 0.00 H new ATOM 0 HA VAL A 94 -8.992 5.919 -0.893 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.070 3.688 -0.184 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -9.001 2.774 1.053 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.508 4.365 1.681 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.946 4.225 0.642 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.687 2.224 -1.347 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.613 3.657 -1.853 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.957 3.409 -2.456 1.00 0.00 H new ATOM 1482 N GLU A 95 -8.079 7.029 1.197 1.00 0.00 N ATOM 1483 CA GLU A 95 -7.595 7.827 2.321 1.00 0.00 C ATOM 1484 C GLU A 95 -7.833 7.088 3.647 1.00 0.00 C ATOM 1485 O GLU A 95 -8.913 6.536 3.861 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.304 9.190 2.294 1.00 0.00 C ATOM 1487 CG GLU A 95 -7.708 10.189 3.286 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.499 11.509 3.270 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.438 12.250 2.262 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.199 11.808 4.267 1.00 0.00 O ATOM 0 H GLU A 95 -9.093 7.061 1.088 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.520 7.986 2.235 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.245 9.605 1.288 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.361 9.049 2.519 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.720 9.764 4.290 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.665 10.381 3.034 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.836 7.060 4.539 1.00 0.00 N ATOM 1498 CA ILE A 96 -6.813 6.160 5.709 1.00 0.00 C ATOM 1499 C ILE A 96 -5.862 6.663 6.806 1.00 0.00 C ATOM 1500 O ILE A 96 -4.829 7.260 6.511 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.474 4.715 5.242 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -6.666 3.684 6.375 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.070 4.609 4.622 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -6.629 2.228 5.894 1.00 0.00 C ATOM 0 H ILE A 96 -6.016 7.663 4.473 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.803 6.150 6.165 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.187 4.475 4.453 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.887 3.830 7.124 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.620 3.871 6.867 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -4.885 3.580 4.314 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.005 5.265 3.754 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.324 4.907 5.359 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.771 1.560 6.744 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.425 2.064 5.168 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.665 2.023 5.428 1.00 0.00 H new ATOM 1516 N ALA A 97 -6.196 6.432 8.079 1.00 0.00 N ATOM 1517 CA ALA A 97 -5.304 6.728 9.204 1.00 0.00 C ATOM 1518 C ALA A 97 -4.393 5.529 9.496 1.00 0.00 C ATOM 1519 O ALA A 97 -4.886 4.437 9.779 1.00 0.00 O ATOM 1520 CB ALA A 97 -6.146 7.117 10.428 1.00 0.00 C ATOM 0 H ALA A 97 -7.093 6.034 8.359 1.00 0.00 H new ATOM 0 HA ALA A 97 -4.657 7.568 8.951 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.487 7.338 11.268 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.743 7.998 10.194 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.806 6.291 10.693 1.00 0.00 H new ATOM 1526 N PHE A 98 -3.079 5.745 9.458 1.00 0.00 N ATOM 1527 CA PHE A 98 -2.066 4.767 9.838 1.00 0.00 C ATOM 1528 C PHE A 98 -1.347 5.156 11.133 1.00 0.00 C ATOM 1529 O PHE A 98 -1.119 6.333 11.415 1.00 0.00 O ATOM 1530 CB PHE A 98 -1.060 4.653 8.688 1.00 0.00 C ATOM 1531 CG PHE A 98 -1.552 3.991 7.412 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -2.414 2.877 7.446 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -1.062 4.447 6.178 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.742 2.199 6.258 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -1.391 3.773 4.989 1.00 0.00 C ATOM 1536 CZ PHE A 98 -2.222 2.640 5.030 1.00 0.00 C ATOM 0 H PHE A 98 -2.680 6.633 9.152 1.00 0.00 H new ATOM 0 HA PHE A 98 -2.552 3.809 10.024 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -0.713 5.656 8.439 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -0.194 4.097 9.048 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.824 2.543 8.387 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -0.428 5.321 6.142 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -3.394 1.339 6.290 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -1.005 4.126 4.044 1.00 0.00 H new ATOM 0 HZ PHE A 98 -2.460 2.110 4.120 1.00 0.00 H new ATOM 1546 N TYR A 99 -0.937 4.138 11.889 1.00 0.00 N ATOM 1547 CA TYR A 99 -0.176 4.244 13.140 1.00 0.00 C ATOM 1548 C TYR A 99 1.281 3.794 12.928 1.00 0.00 C ATOM 1549 O TYR A 99 1.555 2.808 12.239 1.00 0.00 O ATOM 1550 CB TYR A 99 -0.879 3.398 14.212 1.00 0.00 C ATOM 1551 CG TYR A 99 -0.090 3.224 15.497 1.00 0.00 C ATOM 1552 CD1 TYR A 99 -0.110 4.224 16.487 1.00 0.00 C ATOM 1553 CD2 TYR A 99 0.682 2.060 15.692 1.00 0.00 C ATOM 1554 CE1 TYR A 99 0.631 4.061 17.672 1.00 0.00 C ATOM 1555 CE2 TYR A 99 1.431 1.893 16.871 1.00 0.00 C ATOM 1556 CZ TYR A 99 1.406 2.895 17.869 1.00 0.00 C ATOM 1557 OH TYR A 99 2.115 2.736 19.023 1.00 0.00 O ATOM 0 H TYR A 99 -1.134 3.170 11.636 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.142 5.282 13.471 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -1.838 3.859 14.449 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -1.093 2.413 13.796 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.696 5.119 16.337 1.00 0.00 H new ATOM 0 HD2 TYR A 99 0.698 1.293 14.932 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.608 4.828 18.432 1.00 0.00 H new ATOM 0 HE2 TYR A 99 2.024 1.002 17.014 1.00 0.00 H new ATOM 0 HH TYR A 99 2.592 1.880 18.999 1.00 0.00 H new ATOM 1567 N ARG A 100 2.218 4.587 13.455 1.00 0.00 N ATOM 1568 CA ARG A 100 3.657 4.532 13.160 1.00 0.00 C ATOM 1569 C ARG A 100 4.453 3.976 14.352 1.00 0.00 C ATOM 1570 O ARG A 100 4.027 4.075 15.501 1.00 0.00 O ATOM 1571 CB ARG A 100 4.135 5.948 12.762 1.00 0.00 C ATOM 1572 CG ARG A 100 3.801 6.327 11.307 1.00 0.00 C ATOM 1573 CD ARG A 100 2.312 6.424 10.918 1.00 0.00 C ATOM 1574 NE ARG A 100 2.128 6.610 9.467 1.00 0.00 N ATOM 1575 CZ ARG A 100 2.307 5.707 8.507 1.00 0.00 C ATOM 1576 NH1 ARG A 100 2.652 4.463 8.772 1.00 0.00 N ATOM 1577 NH2 ARG A 100 2.128 6.039 7.247 1.00 0.00 N ATOM 0 H ARG A 100 1.987 5.317 14.128 1.00 0.00 H new ATOM 0 HA ARG A 100 3.833 3.849 12.329 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.680 6.677 13.432 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.213 6.012 12.907 1.00 0.00 H new ATOM 0 HG2 ARG A 100 4.267 7.289 11.095 1.00 0.00 H new ATOM 0 HG3 ARG A 100 4.272 5.594 10.652 1.00 0.00 H new ATOM 0 HD2 ARG A 100 1.795 5.518 11.235 1.00 0.00 H new ATOM 0 HD3 ARG A 100 1.852 7.256 11.451 1.00 0.00 H new ATOM 0 HE ARG A 100 1.829 7.537 9.165 1.00 0.00 H new ATOM 0 HH11 ARG A 100 2.790 4.167 9.738 1.00 0.00 H new ATOM 0 HH12 ARG A 100 2.781 3.796 8.011 1.00 0.00 H new ATOM 0 HH21 ARG A 100 1.851 6.990 7.005 1.00 0.00 H new ATOM 0 HH22 ARG A 100 2.266 5.345 6.512 1.00 0.00 H new ATOM 1591 N LYS A 101 5.648 3.429 14.089 1.00 0.00 N ATOM 1592 CA LYS A 101 6.496 2.781 15.115 1.00 0.00 C ATOM 1593 C LYS A 101 7.001 3.749 16.211 1.00 0.00 C ATOM 1594 O LYS A 101 7.332 3.311 17.314 1.00 0.00 O ATOM 1595 CB LYS A 101 7.681 2.054 14.441 1.00 0.00 C ATOM 1596 CG LYS A 101 7.386 0.616 13.984 1.00 0.00 C ATOM 1597 CD LYS A 101 6.598 0.529 12.667 1.00 0.00 C ATOM 1598 CE LYS A 101 6.349 -0.925 12.232 1.00 0.00 C ATOM 1599 NZ LYS A 101 5.402 -1.652 13.129 1.00 0.00 N ATOM 0 H LYS A 101 6.061 3.420 13.156 1.00 0.00 H new ATOM 0 HA LYS A 101 5.861 2.058 15.628 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.000 2.636 13.576 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.519 2.033 15.138 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.329 0.082 13.867 1.00 0.00 H new ATOM 0 HG3 LYS A 101 6.825 0.105 14.766 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.642 1.040 12.783 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.146 1.052 11.883 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.955 -0.931 11.216 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.299 -1.458 12.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.262 -2.620 12.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 5.795 -1.689 14.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.489 -1.154 13.147 1.00 0.00 H new ATOM 1613 N ASP A 102 7.018 5.059 15.938 1.00 0.00 N ATOM 1614 CA ASP A 102 7.375 6.109 16.907 1.00 0.00 C ATOM 1615 C ASP A 102 6.255 6.410 17.935 1.00 0.00 C ATOM 1616 O ASP A 102 6.471 7.165 18.884 1.00 0.00 O ATOM 1617 CB ASP A 102 7.768 7.371 16.122 1.00 0.00 C ATOM 1618 CG ASP A 102 8.482 8.421 16.992 1.00 0.00 C ATOM 1619 OD1 ASP A 102 9.544 8.098 17.577 1.00 0.00 O ATOM 1620 OD2 ASP A 102 8.008 9.581 17.056 1.00 0.00 O ATOM 0 H ASP A 102 6.779 5.429 15.018 1.00 0.00 H new ATOM 0 HA ASP A 102 8.214 5.752 17.504 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.419 7.090 15.294 1.00 0.00 H new ATOM 0 HB3 ASP A 102 6.873 7.815 15.687 1.00 0.00 H new ATOM 1625 N GLY A 103 5.062 5.820 17.755 1.00 0.00 N ATOM 1626 CA GLY A 103 3.879 6.001 18.612 1.00 0.00 C ATOM 1627 C GLY A 103 2.875 7.035 18.093 1.00 0.00 C ATOM 1628 O GLY A 103 1.856 7.277 18.741 1.00 0.00 O ATOM 0 H GLY A 103 4.889 5.180 16.980 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.372 5.042 18.719 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.208 6.300 19.607 1.00 0.00 H new ATOM 1632 N SER A 104 3.146 7.651 16.943 1.00 0.00 N ATOM 1633 CA SER A 104 2.282 8.660 16.307 1.00 0.00 C ATOM 1634 C SER A 104 1.264 8.032 15.334 1.00 0.00 C ATOM 1635 O SER A 104 1.442 6.907 14.863 1.00 0.00 O ATOM 1636 CB SER A 104 3.149 9.679 15.539 1.00 0.00 C ATOM 1637 OG SER A 104 4.136 10.290 16.367 1.00 0.00 O ATOM 0 H SER A 104 3.994 7.461 16.409 1.00 0.00 H new ATOM 0 HA SER A 104 1.724 9.153 17.103 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.639 9.178 14.704 1.00 0.00 H new ATOM 0 HB3 SER A 104 2.507 10.451 15.115 1.00 0.00 H new ATOM 0 HG SER A 104 4.660 10.925 15.836 1.00 0.00 H new ATOM 1643 N CYS A 105 0.228 8.785 14.951 1.00 0.00 N ATOM 1644 CA CYS A 105 -0.663 8.439 13.838 1.00 0.00 C ATOM 1645 C CYS A 105 -1.043 9.676 13.007 1.00 0.00 C ATOM 1646 O CYS A 105 -0.933 10.810 13.476 1.00 0.00 O ATOM 1647 CB CYS A 105 -1.888 7.663 14.363 1.00 0.00 C ATOM 1648 SG CYS A 105 -2.942 8.707 15.414 1.00 0.00 S ATOM 0 H CYS A 105 -0.019 9.662 15.410 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.130 7.780 13.152 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -2.470 7.288 13.521 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.553 6.795 14.931 1.00 0.00 H new ATOM 0 HG CYS A 105 -3.960 8.015 15.831 1.00 0.00 H new ATOM 1654 N PHE A 106 -1.464 9.445 11.760 1.00 0.00 N ATOM 1655 CA PHE A 106 -1.836 10.484 10.787 1.00 0.00 C ATOM 1656 C PHE A 106 -2.555 9.921 9.553 1.00 0.00 C ATOM 1657 O PHE A 106 -2.463 8.731 9.248 1.00 0.00 O ATOM 1658 CB PHE A 106 -0.611 11.342 10.404 1.00 0.00 C ATOM 1659 CG PHE A 106 0.665 10.600 10.050 1.00 0.00 C ATOM 1660 CD1 PHE A 106 0.913 10.210 8.722 1.00 0.00 C ATOM 1661 CD2 PHE A 106 1.648 10.378 11.036 1.00 0.00 C ATOM 1662 CE1 PHE A 106 2.159 9.657 8.375 1.00 0.00 C ATOM 1663 CE2 PHE A 106 2.899 9.848 10.681 1.00 0.00 C ATOM 1664 CZ PHE A 106 3.164 9.508 9.345 1.00 0.00 C ATOM 0 H PHE A 106 -1.559 8.501 11.385 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.561 11.133 11.277 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.887 11.966 9.554 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -0.394 12.013 11.235 1.00 0.00 H new ATOM 0 HD1 PHE A 106 0.148 10.335 7.970 1.00 0.00 H new ATOM 0 HD2 PHE A 106 1.438 10.616 12.068 1.00 0.00 H new ATOM 0 HE1 PHE A 106 2.344 9.345 7.358 1.00 0.00 H new ATOM 0 HE2 PHE A 106 3.657 9.702 11.436 1.00 0.00 H new ATOM 0 HZ PHE A 106 4.137 9.133 9.064 1.00 0.00 H new ATOM 1674 N LEU A 107 -3.277 10.798 8.842 1.00 0.00 N ATOM 1675 CA LEU A 107 -3.982 10.469 7.600 1.00 0.00 C ATOM 1676 C LEU A 107 -3.006 10.402 6.421 1.00 0.00 C ATOM 1677 O LEU A 107 -2.363 11.387 6.046 1.00 0.00 O ATOM 1678 CB LEU A 107 -5.100 11.493 7.302 1.00 0.00 C ATOM 1679 CG LEU A 107 -6.494 11.256 7.912 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -7.078 9.887 7.548 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -6.492 11.435 9.432 1.00 0.00 C ATOM 0 H LEU A 107 -3.388 11.773 9.121 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.440 9.489 7.734 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.753 12.470 7.638 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.217 11.551 6.220 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.137 12.018 7.472 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.061 9.777 8.006 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.172 9.808 6.465 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.417 9.101 7.914 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.495 11.259 9.820 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.799 10.724 9.881 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.181 12.450 9.678 1.00 0.00 H new ATOM 1693 N CYS A 108 -2.977 9.239 5.783 1.00 0.00 N ATOM 1694 CA CYS A 108 -2.260 8.957 4.550 1.00 0.00 C ATOM 1695 C CYS A 108 -3.260 8.851 3.385 1.00 0.00 C ATOM 1696 O CYS A 108 -4.333 8.256 3.525 1.00 0.00 O ATOM 1697 CB CYS A 108 -1.503 7.641 4.780 1.00 0.00 C ATOM 1698 SG CYS A 108 -0.223 7.408 3.516 1.00 0.00 S ATOM 0 H CYS A 108 -3.481 8.424 6.132 1.00 0.00 H new ATOM 0 HA CYS A 108 -1.557 9.748 4.290 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -1.047 7.646 5.770 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -2.202 6.805 4.756 1.00 0.00 H new ATOM 0 HG CYS A 108 -0.745 7.564 2.336 1.00 0.00 H new ATOM 1704 N LEU A 109 -2.890 9.369 2.213 1.00 0.00 N ATOM 1705 CA LEU A 109 -3.459 8.929 0.940 1.00 0.00 C ATOM 1706 C LEU A 109 -2.635 7.726 0.464 1.00 0.00 C ATOM 1707 O LEU A 109 -1.405 7.777 0.516 1.00 0.00 O ATOM 1708 CB LEU A 109 -3.429 10.083 -0.093 1.00 0.00 C ATOM 1709 CG LEU A 109 -4.673 10.287 -1.007 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -5.710 9.155 -1.036 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -5.402 11.576 -0.598 1.00 0.00 C ATOM 0 H LEU A 109 -2.189 10.104 2.120 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.503 8.640 1.058 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.260 11.012 0.451 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.564 9.930 -0.738 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.251 10.322 -2.011 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -6.523 9.424 -1.710 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.237 8.237 -1.386 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -6.107 8.999 -0.033 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -6.273 11.720 -1.237 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -5.723 11.498 0.441 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -4.728 12.426 -0.707 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.302 6.658 0.031 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.682 5.498 -0.624 1.00 0.00 C ATOM 1725 C VAL A 110 -3.237 5.390 -2.041 1.00 0.00 C ATOM 1726 O VAL A 110 -4.443 5.194 -2.209 1.00 0.00 O ATOM 1727 CB VAL A 110 -2.922 4.167 0.122 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -1.945 3.114 -0.406 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -2.743 4.310 1.640 1.00 0.00 C ATOM 0 H VAL A 110 -4.314 6.569 0.126 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.604 5.662 -0.624 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.953 3.865 -0.060 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.109 2.171 0.116 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.108 2.970 -1.474 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.922 3.450 -0.237 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.922 3.348 2.120 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.727 4.640 1.857 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.452 5.044 2.022 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.377 5.524 -3.048 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.755 5.529 -4.455 1.00 0.00 C ATOM 1741 C ASP A 111 -2.175 4.279 -5.125 1.00 0.00 C ATOM 1742 O ASP A 111 -0.956 4.164 -5.227 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.227 6.812 -5.125 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.548 8.124 -4.375 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -3.521 8.176 -3.589 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -1.822 9.118 -4.617 1.00 0.00 O ATOM 0 H ASP A 111 -1.374 5.635 -2.902 1.00 0.00 H new ATOM 0 HA ASP A 111 -3.840 5.514 -4.559 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.145 6.728 -5.232 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.643 6.876 -6.131 1.00 0.00 H new ATOM 1751 N VAL A 112 -3.021 3.350 -5.582 1.00 0.00 N ATOM 1752 CA VAL A 112 -2.562 2.243 -6.440 1.00 0.00 C ATOM 1753 C VAL A 112 -2.561 2.700 -7.888 1.00 0.00 C ATOM 1754 O VAL A 112 -3.571 3.174 -8.408 1.00 0.00 O ATOM 1755 CB VAL A 112 -3.313 0.907 -6.266 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -4.822 1.017 -6.264 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -2.906 -0.174 -7.276 1.00 0.00 C ATOM 0 H VAL A 112 -4.020 3.338 -5.377 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.550 2.007 -6.112 1.00 0.00 H new ATOM 0 HB VAL A 112 -2.995 0.603 -5.269 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -5.259 0.027 -6.136 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -5.139 1.662 -5.444 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.157 1.442 -7.210 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.478 -1.082 -7.087 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.108 0.179 -8.287 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -1.842 -0.387 -7.172 1.00 0.00 H new ATOM 1767 N VAL A 113 -1.410 2.516 -8.525 1.00 0.00 N ATOM 1768 CA VAL A 113 -1.195 2.748 -9.951 1.00 0.00 C ATOM 1769 C VAL A 113 -0.891 1.378 -10.577 1.00 0.00 C ATOM 1770 O VAL A 113 0.182 0.827 -10.316 1.00 0.00 O ATOM 1771 CB VAL A 113 -0.067 3.781 -10.176 1.00 0.00 C ATOM 1772 CG1 VAL A 113 0.224 3.970 -11.674 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -0.440 5.143 -9.562 1.00 0.00 C ATOM 0 H VAL A 113 -0.570 2.190 -8.047 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.075 3.179 -10.428 1.00 0.00 H new ATOM 0 HB VAL A 113 0.826 3.394 -9.685 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.022 4.702 -11.800 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.533 3.019 -12.108 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.676 4.323 -12.178 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.369 5.853 -9.733 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.353 5.514 -10.027 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.600 5.027 -8.490 1.00 0.00 H new ATOM 1783 N PRO A 114 -1.835 0.784 -11.334 1.00 0.00 N ATOM 1784 CA PRO A 114 -1.643 -0.513 -11.970 1.00 0.00 C ATOM 1785 C PRO A 114 -0.718 -0.366 -13.178 1.00 0.00 C ATOM 1786 O PRO A 114 -0.914 0.515 -14.015 1.00 0.00 O ATOM 1787 CB PRO A 114 -3.042 -0.984 -12.378 1.00 0.00 C ATOM 1788 CG PRO A 114 -3.816 0.312 -12.589 1.00 0.00 C ATOM 1789 CD PRO A 114 -3.187 1.272 -11.583 1.00 0.00 C ATOM 0 HA PRO A 114 -1.172 -1.239 -11.307 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -3.012 -1.585 -13.287 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -3.498 -1.601 -11.603 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -3.714 0.678 -13.611 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -4.882 0.178 -12.403 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -3.166 2.288 -11.977 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -3.765 1.300 -10.660 1.00 0.00 H new ATOM 1797 N VAL A 115 0.276 -1.250 -13.278 1.00 0.00 N ATOM 1798 CA VAL A 115 1.152 -1.355 -14.451 1.00 0.00 C ATOM 1799 C VAL A 115 0.610 -2.476 -15.332 1.00 0.00 C ATOM 1800 O VAL A 115 0.693 -3.646 -14.959 1.00 0.00 O ATOM 1801 CB VAL A 115 2.617 -1.636 -14.044 1.00 0.00 C ATOM 1802 CG1 VAL A 115 3.542 -1.787 -15.263 1.00 0.00 C ATOM 1803 CG2 VAL A 115 3.164 -0.524 -13.135 1.00 0.00 C ATOM 0 H VAL A 115 0.499 -1.920 -12.542 1.00 0.00 H new ATOM 0 HA VAL A 115 1.157 -0.410 -14.993 1.00 0.00 H new ATOM 0 HB VAL A 115 2.605 -2.581 -13.500 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.560 -1.983 -14.925 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.198 -2.617 -15.880 1.00 0.00 H new ATOM 0 HG13 VAL A 115 3.525 -0.868 -15.849 1.00 0.00 H new ATOM 0 HG21 VAL A 115 4.196 -0.749 -12.865 1.00 0.00 H new ATOM 0 HG22 VAL A 115 3.127 0.429 -13.663 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.558 -0.462 -12.231 1.00 0.00 H new ATOM 1813 N LYS A 116 0.064 -2.133 -16.501 1.00 0.00 N ATOM 1814 CA LYS A 116 -0.248 -3.121 -17.540 1.00 0.00 C ATOM 1815 C LYS A 116 0.989 -3.457 -18.390 1.00 0.00 C ATOM 1816 O LYS A 116 1.890 -2.633 -18.566 1.00 0.00 O ATOM 1817 CB LYS A 116 -1.411 -2.657 -18.435 1.00 0.00 C ATOM 1818 CG LYS A 116 -2.737 -2.669 -17.668 1.00 0.00 C ATOM 1819 CD LYS A 116 -3.920 -2.353 -18.593 1.00 0.00 C ATOM 1820 CE LYS A 116 -5.174 -3.044 -18.043 1.00 0.00 C ATOM 1821 NZ LYS A 116 -6.360 -2.816 -18.917 1.00 0.00 N ATOM 0 H LYS A 116 -0.173 -1.174 -16.754 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.562 -4.030 -17.028 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -1.210 -1.651 -18.805 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -1.485 -3.308 -19.306 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.884 -3.646 -17.207 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -2.699 -1.938 -16.860 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -4.077 -1.276 -18.651 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.711 -2.699 -19.605 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.989 -4.114 -17.953 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -5.384 -2.671 -17.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -7.188 -3.299 -18.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -6.552 -1.796 -18.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -6.169 -3.194 -19.867 1.00 0.00 H new ATOM 1835 N ASN A 117 1.006 -4.670 -18.947 1.00 0.00 N ATOM 1836 CA ASN A 117 2.020 -5.115 -19.907 1.00 0.00 C ATOM 1837 C ASN A 117 1.580 -4.866 -21.361 1.00 0.00 C ATOM 1838 O ASN A 117 0.514 -4.306 -21.622 1.00 0.00 O ATOM 1839 CB ASN A 117 2.383 -6.586 -19.622 1.00 0.00 C ATOM 1840 CG ASN A 117 1.413 -7.603 -20.212 1.00 0.00 C ATOM 1841 OD1 ASN A 117 1.711 -8.239 -21.210 1.00 0.00 O ATOM 1842 ND2 ASN A 117 0.218 -7.748 -19.669 1.00 0.00 N ATOM 0 H ASN A 117 0.305 -5.382 -18.741 1.00 0.00 H new ATOM 0 HA ASN A 117 2.924 -4.520 -19.780 1.00 0.00 H new ATOM 0 HB2 ASN A 117 3.380 -6.784 -20.015 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.431 -6.732 -18.543 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -0.456 -8.392 -20.084 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -0.031 -7.216 -18.835 1.00 0.00 H new ATOM 1849 N GLU A 118 2.385 -5.355 -22.303 1.00 0.00 N ATOM 1850 CA GLU A 118 2.143 -5.270 -23.753 1.00 0.00 C ATOM 1851 C GLU A 118 0.839 -5.956 -24.224 1.00 0.00 C ATOM 1852 O GLU A 118 0.307 -5.598 -25.277 1.00 0.00 O ATOM 1853 CB GLU A 118 3.358 -5.832 -24.514 1.00 0.00 C ATOM 1854 CG GLU A 118 3.723 -7.274 -24.132 1.00 0.00 C ATOM 1855 CD GLU A 118 4.810 -7.831 -25.065 1.00 0.00 C ATOM 1856 OE1 GLU A 118 6.015 -7.643 -24.775 1.00 0.00 O ATOM 1857 OE2 GLU A 118 4.470 -8.464 -26.092 1.00 0.00 O ATOM 0 H GLU A 118 3.254 -5.838 -22.076 1.00 0.00 H new ATOM 0 HA GLU A 118 2.008 -4.212 -23.980 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.154 -5.791 -25.584 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.219 -5.189 -24.329 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.074 -7.303 -23.100 1.00 0.00 H new ATOM 0 HG3 GLU A 118 2.835 -7.904 -24.185 1.00 0.00 H new ATOM 1864 N ASP A 119 0.295 -6.908 -23.453 1.00 0.00 N ATOM 1865 CA ASP A 119 -0.962 -7.616 -23.750 1.00 0.00 C ATOM 1866 C ASP A 119 -2.206 -6.909 -23.165 1.00 0.00 C ATOM 1867 O ASP A 119 -3.340 -7.330 -23.405 1.00 0.00 O ATOM 1868 CB ASP A 119 -0.839 -9.056 -23.221 1.00 0.00 C ATOM 1869 CG ASP A 119 -1.973 -9.979 -23.699 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -2.115 -10.176 -24.931 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -2.695 -10.541 -22.840 1.00 0.00 O ATOM 0 H ASP A 119 0.727 -7.216 -22.582 1.00 0.00 H new ATOM 0 HA ASP A 119 -1.112 -7.619 -24.830 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.117 -9.472 -23.539 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -0.831 -9.036 -22.131 1.00 0.00 H new ATOM 1876 N GLY A 120 -2.004 -5.838 -22.382 1.00 0.00 N ATOM 1877 CA GLY A 120 -3.071 -5.074 -21.723 1.00 0.00 C ATOM 1878 C GLY A 120 -3.626 -5.732 -20.455 1.00 0.00 C ATOM 1879 O GLY A 120 -4.734 -5.394 -20.041 1.00 0.00 O ATOM 0 H GLY A 120 -1.072 -5.472 -22.186 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.690 -4.085 -21.468 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -3.888 -4.928 -22.430 1.00 0.00 H new ATOM 1883 N ALA A 121 -2.867 -6.635 -19.821 1.00 0.00 N ATOM 1884 CA ALA A 121 -3.175 -7.209 -18.504 1.00 0.00 C ATOM 1885 C ALA A 121 -2.340 -6.498 -17.437 1.00 0.00 C ATOM 1886 O ALA A 121 -1.180 -6.182 -17.700 1.00 0.00 O ATOM 1887 CB ALA A 121 -2.877 -8.720 -18.499 1.00 0.00 C ATOM 0 H ALA A 121 -2.000 -6.996 -20.219 1.00 0.00 H new ATOM 0 HA ALA A 121 -4.234 -7.069 -18.286 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.109 -9.133 -17.518 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.488 -9.214 -19.255 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.823 -8.884 -18.721 1.00 0.00 H new ATOM 1893 N VAL A 122 -2.888 -6.272 -16.245 1.00 0.00 N ATOM 1894 CA VAL A 122 -2.132 -5.695 -15.116 1.00 0.00 C ATOM 1895 C VAL A 122 -1.224 -6.759 -14.489 1.00 0.00 C ATOM 1896 O VAL A 122 -1.660 -7.846 -14.120 1.00 0.00 O ATOM 1897 CB VAL A 122 -3.015 -4.942 -14.095 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -4.190 -5.776 -13.588 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -2.200 -4.399 -12.913 1.00 0.00 C ATOM 0 H VAL A 122 -3.863 -6.479 -16.027 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.488 -4.911 -15.516 1.00 0.00 H new ATOM 0 HB VAL A 122 -3.429 -4.097 -14.644 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -4.771 -5.191 -12.875 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -4.825 -6.058 -14.428 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.814 -6.675 -13.099 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.863 -3.878 -12.223 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.715 -5.226 -12.395 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.443 -3.707 -13.281 1.00 0.00 H new ATOM 1909 N ILE A 123 0.065 -6.421 -14.415 1.00 0.00 N ATOM 1910 CA ILE A 123 1.166 -7.326 -14.022 1.00 0.00 C ATOM 1911 C ILE A 123 1.879 -6.900 -12.728 1.00 0.00 C ATOM 1912 O ILE A 123 2.442 -7.742 -12.033 1.00 0.00 O ATOM 1913 CB ILE A 123 2.165 -7.442 -15.198 1.00 0.00 C ATOM 1914 CG1 ILE A 123 2.636 -6.054 -15.703 1.00 0.00 C ATOM 1915 CG2 ILE A 123 1.531 -8.264 -16.330 1.00 0.00 C ATOM 1916 CD1 ILE A 123 4.069 -6.020 -16.219 1.00 0.00 C ATOM 0 H ILE A 123 0.390 -5.479 -14.633 1.00 0.00 H new ATOM 0 HA ILE A 123 0.730 -8.300 -13.802 1.00 0.00 H new ATOM 0 HB ILE A 123 3.057 -7.956 -14.840 1.00 0.00 H new ATOM 0 HG12 ILE A 123 1.969 -5.726 -16.500 1.00 0.00 H new ATOM 0 HG13 ILE A 123 2.539 -5.334 -14.890 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.235 -8.346 -17.158 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.286 -9.260 -15.963 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.622 -7.770 -16.673 1.00 0.00 H new ATOM 0 HD11 ILE A 123 4.312 -5.011 -16.551 1.00 0.00 H new ATOM 0 HD12 ILE A 123 4.750 -6.313 -15.420 1.00 0.00 H new ATOM 0 HD13 ILE A 123 4.171 -6.712 -17.055 1.00 0.00 H new ATOM 1928 N MET A 124 1.800 -5.620 -12.356 1.00 0.00 N ATOM 1929 CA MET A 124 2.344 -5.055 -11.112 1.00 0.00 C ATOM 1930 C MET A 124 1.453 -3.928 -10.593 1.00 0.00 C ATOM 1931 O MET A 124 0.837 -3.199 -11.374 1.00 0.00 O ATOM 1932 CB MET A 124 3.772 -4.519 -11.333 1.00 0.00 C ATOM 1933 CG MET A 124 4.842 -5.614 -11.300 1.00 0.00 C ATOM 1934 SD MET A 124 6.514 -5.003 -11.633 1.00 0.00 S ATOM 1935 CE MET A 124 6.416 -4.840 -13.431 1.00 0.00 C ATOM 0 H MET A 124 1.337 -4.918 -12.934 1.00 0.00 H new ATOM 0 HA MET A 124 2.374 -5.854 -10.372 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.816 -4.007 -12.294 1.00 0.00 H new ATOM 0 HB3 MET A 124 3.997 -3.778 -10.566 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.828 -6.095 -10.322 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.590 -6.379 -12.035 1.00 0.00 H new ATOM 0 HE1 MET A 124 6.880 -3.902 -13.737 1.00 0.00 H new ATOM 0 HE2 MET A 124 6.938 -5.673 -13.901 1.00 0.00 H new ATOM 0 HE3 MET A 124 5.371 -4.846 -13.740 1.00 0.00 H new ATOM 1945 N PHE A 125 1.438 -3.754 -9.276 1.00 0.00 N ATOM 1946 CA PHE A 125 0.786 -2.649 -8.581 1.00 0.00 C ATOM 1947 C PHE A 125 1.840 -1.785 -7.897 1.00 0.00 C ATOM 1948 O PHE A 125 2.625 -2.276 -7.090 1.00 0.00 O ATOM 1949 CB PHE A 125 -0.204 -3.229 -7.560 1.00 0.00 C ATOM 1950 CG PHE A 125 -1.395 -3.910 -8.198 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -2.307 -3.144 -8.949 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -1.593 -5.295 -8.050 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -3.424 -3.763 -9.539 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -2.699 -5.915 -8.656 1.00 0.00 C ATOM 1955 CZ PHE A 125 -3.609 -5.149 -9.406 1.00 0.00 C ATOM 0 H PHE A 125 1.897 -4.404 -8.638 1.00 0.00 H new ATOM 0 HA PHE A 125 0.241 -2.021 -9.285 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.318 -3.945 -6.925 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.557 -2.427 -6.912 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.149 -2.083 -9.072 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.895 -5.882 -7.471 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.139 -3.173 -10.094 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.850 -6.979 -8.546 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.453 -5.628 -9.881 1.00 0.00 H new ATOM 1965 N ILE A 126 1.838 -0.489 -8.205 1.00 0.00 N ATOM 1966 CA ILE A 126 2.629 0.519 -7.483 1.00 0.00 C ATOM 1967 C ILE A 126 1.680 1.183 -6.488 1.00 0.00 C ATOM 1968 O ILE A 126 0.724 1.819 -6.929 1.00 0.00 O ATOM 1969 CB ILE A 126 3.249 1.554 -8.456 1.00 0.00 C ATOM 1970 CG1 ILE A 126 4.019 0.877 -9.615 1.00 0.00 C ATOM 1971 CG2 ILE A 126 4.156 2.518 -7.662 1.00 0.00 C ATOM 1972 CD1 ILE A 126 4.522 1.855 -10.684 1.00 0.00 C ATOM 0 H ILE A 126 1.284 -0.101 -8.969 1.00 0.00 H new ATOM 0 HA ILE A 126 3.470 0.057 -6.966 1.00 0.00 H new ATOM 0 HB ILE A 126 2.441 2.121 -8.919 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.870 0.334 -9.204 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.370 0.140 -10.088 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.595 3.248 -8.342 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.564 3.035 -6.907 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.951 1.952 -7.176 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.051 1.304 -11.461 1.00 0.00 H new ATOM 0 HD12 ILE A 126 3.674 2.380 -11.124 1.00 0.00 H new ATOM 0 HD13 ILE A 126 5.199 2.577 -10.227 1.00 0.00 H new ATOM 1984 N LEU A 127 1.903 1.022 -5.182 1.00 0.00 N ATOM 1985 CA LEU A 127 1.123 1.678 -4.124 1.00 0.00 C ATOM 1986 C LEU A 127 1.967 2.844 -3.609 1.00 0.00 C ATOM 1987 O LEU A 127 3.122 2.642 -3.243 1.00 0.00 O ATOM 1988 CB LEU A 127 0.784 0.673 -2.995 1.00 0.00 C ATOM 1989 CG LEU A 127 -0.478 -0.199 -3.203 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -1.765 0.587 -2.956 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -0.500 -0.899 -4.565 1.00 0.00 C ATOM 0 H LEU A 127 2.644 0.421 -4.821 1.00 0.00 H new ATOM 0 HA LEU A 127 0.170 2.045 -4.505 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.639 0.010 -2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.664 1.231 -2.066 1.00 0.00 H new ATOM 0 HG LEU A 127 -0.426 -0.986 -2.451 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.625 -0.064 -3.113 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.774 0.958 -1.931 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.816 1.428 -3.647 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -1.408 -1.495 -4.653 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.478 -0.152 -5.358 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.371 -1.549 -4.654 1.00 0.00 H new ATOM 2003 N ASN A 128 1.420 4.059 -3.612 1.00 0.00 N ATOM 2004 CA ASN A 128 2.144 5.289 -3.271 1.00 0.00 C ATOM 2005 C ASN A 128 1.523 5.949 -2.033 1.00 0.00 C ATOM 2006 O ASN A 128 0.310 6.147 -2.002 1.00 0.00 O ATOM 2007 CB ASN A 128 2.156 6.289 -4.441 1.00 0.00 C ATOM 2008 CG ASN A 128 2.460 5.686 -5.812 1.00 0.00 C ATOM 2009 OD1 ASN A 128 3.561 5.802 -6.333 1.00 0.00 O ATOM 2010 ND2 ASN A 128 1.490 5.053 -6.450 1.00 0.00 N ATOM 0 H ASN A 128 0.443 4.222 -3.856 1.00 0.00 H new ATOM 0 HA ASN A 128 3.175 5.009 -3.056 1.00 0.00 H new ATOM 0 HB2 ASN A 128 1.185 6.782 -4.486 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.896 7.061 -4.230 1.00 0.00 H new ATOM 0 HD21 ASN A 128 1.660 4.661 -7.376 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.572 4.956 -6.016 1.00 0.00 H new ATOM 2017 N PHE A 129 2.345 6.302 -1.041 1.00 0.00 N ATOM 2018 CA PHE A 129 1.922 6.883 0.233 1.00 0.00 C ATOM 2019 C PHE A 129 2.268 8.378 0.285 1.00 0.00 C ATOM 2020 O PHE A 129 3.385 8.770 -0.053 1.00 0.00 O ATOM 2021 CB PHE A 129 2.604 6.117 1.382 1.00 0.00 C ATOM 2022 CG PHE A 129 2.406 4.614 1.352 1.00 0.00 C ATOM 2023 CD1 PHE A 129 1.205 4.054 1.821 1.00 0.00 C ATOM 2024 CD2 PHE A 129 3.421 3.776 0.852 1.00 0.00 C ATOM 2025 CE1 PHE A 129 1.009 2.662 1.779 1.00 0.00 C ATOM 2026 CE2 PHE A 129 3.224 2.385 0.811 1.00 0.00 C ATOM 2027 CZ PHE A 129 2.017 1.827 1.267 1.00 0.00 C ATOM 0 H PHE A 129 3.356 6.187 -1.106 1.00 0.00 H new ATOM 0 HA PHE A 129 0.841 6.794 0.336 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.673 6.329 1.357 1.00 0.00 H new ATOM 0 HB3 PHE A 129 2.226 6.500 2.330 1.00 0.00 H new ATOM 0 HD1 PHE A 129 0.430 4.695 2.215 1.00 0.00 H new ATOM 0 HD2 PHE A 129 4.349 4.201 0.501 1.00 0.00 H new ATOM 0 HE1 PHE A 129 0.085 2.235 2.140 1.00 0.00 H new ATOM 0 HE2 PHE A 129 4.003 1.742 0.428 1.00 0.00 H new ATOM 0 HZ PHE A 129 1.865 0.759 1.224 1.00 0.00 H new ATOM 2037 N GLU A 130 1.335 9.210 0.750 1.00 0.00 N ATOM 2038 CA GLU A 130 1.526 10.649 0.956 1.00 0.00 C ATOM 2039 C GLU A 130 0.729 11.094 2.188 1.00 0.00 C ATOM 2040 O GLU A 130 -0.428 10.710 2.343 1.00 0.00 O ATOM 2041 CB GLU A 130 1.044 11.436 -0.279 1.00 0.00 C ATOM 2042 CG GLU A 130 2.071 11.435 -1.420 1.00 0.00 C ATOM 2043 CD GLU A 130 1.679 12.432 -2.522 1.00 0.00 C ATOM 2044 OE1 GLU A 130 1.859 13.657 -2.325 1.00 0.00 O ATOM 2045 OE2 GLU A 130 1.203 12.001 -3.599 1.00 0.00 O ATOM 0 H GLU A 130 0.398 8.894 1.001 1.00 0.00 H new ATOM 0 HA GLU A 130 2.587 10.848 1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 130 0.109 11.005 -0.637 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.831 12.465 0.011 1.00 0.00 H new ATOM 0 HG2 GLU A 130 3.055 11.691 -1.027 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.148 10.433 -1.843 1.00 0.00 H new ATOM 2052 N VAL A 131 1.314 11.922 3.057 1.00 0.00 N ATOM 2053 CA VAL A 131 0.616 12.449 4.247 1.00 0.00 C ATOM 2054 C VAL A 131 -0.381 13.519 3.799 1.00 0.00 C ATOM 2055 O VAL A 131 0.026 14.542 3.248 1.00 0.00 O ATOM 2056 CB VAL A 131 1.584 13.022 5.310 1.00 0.00 C ATOM 2057 CG1 VAL A 131 0.812 13.463 6.567 1.00 0.00 C ATOM 2058 CG2 VAL A 131 2.634 11.978 5.705 1.00 0.00 C ATOM 0 H VAL A 131 2.276 12.248 2.963 1.00 0.00 H new ATOM 0 HA VAL A 131 0.097 11.619 4.726 1.00 0.00 H new ATOM 0 HB VAL A 131 2.083 13.887 4.872 1.00 0.00 H new ATOM 0 HG11 VAL A 131 1.511 13.863 7.302 1.00 0.00 H new ATOM 0 HG12 VAL A 131 0.088 14.233 6.298 1.00 0.00 H new ATOM 0 HG13 VAL A 131 0.289 12.606 6.992 1.00 0.00 H new ATOM 0 HG21 VAL A 131 3.304 12.401 6.453 1.00 0.00 H new ATOM 0 HG22 VAL A 131 2.137 11.100 6.118 1.00 0.00 H new ATOM 0 HG23 VAL A 131 3.209 11.689 4.825 1.00 0.00 H new ATOM 2068 N VAL A 132 -1.675 13.281 4.037 1.00 0.00 N ATOM 2069 CA VAL A 132 -2.749 14.220 3.647 1.00 0.00 C ATOM 2070 C VAL A 132 -3.175 15.149 4.797 1.00 0.00 C ATOM 2071 O VAL A 132 -3.602 16.273 4.538 1.00 0.00 O ATOM 2072 CB VAL A 132 -3.949 13.489 2.999 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -4.875 12.782 3.979 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -4.757 14.424 2.085 1.00 0.00 C ATOM 0 H VAL A 132 -2.013 12.439 4.502 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.327 14.871 2.881 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.491 12.701 2.401 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -5.685 12.300 3.431 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -4.313 12.030 4.533 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -5.291 13.510 4.676 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.591 13.875 1.648 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -5.140 15.262 2.668 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.114 14.800 1.289 1.00 0.00 H new ATOM 2084 N MET A 133 -3.022 14.710 6.057 1.00 0.00 N ATOM 2085 CA MET A 133 -3.413 15.455 7.266 1.00 0.00 C ATOM 2086 C MET A 133 -2.817 14.802 8.524 1.00 0.00 C ATOM 2087 O MET A 133 -2.765 13.579 8.625 1.00 0.00 O ATOM 2088 CB MET A 133 -4.954 15.552 7.322 1.00 0.00 C ATOM 2089 CG MET A 133 -5.500 16.251 8.571 1.00 0.00 C ATOM 2090 SD MET A 133 -4.901 17.938 8.876 1.00 0.00 S ATOM 2091 CE MET A 133 -5.577 18.789 7.426 1.00 0.00 C ATOM 0 H MET A 133 -2.611 13.801 6.269 1.00 0.00 H new ATOM 0 HA MET A 133 -3.011 16.468 7.227 1.00 0.00 H new ATOM 0 HB2 MET A 133 -5.304 16.087 6.439 1.00 0.00 H new ATOM 0 HB3 MET A 133 -5.371 14.546 7.272 1.00 0.00 H new ATOM 0 HG2 MET A 133 -6.587 16.282 8.498 1.00 0.00 H new ATOM 0 HG3 MET A 133 -5.256 15.639 9.440 1.00 0.00 H new ATOM 0 HE1 MET A 133 -5.406 19.861 7.521 1.00 0.00 H new ATOM 0 HE2 MET A 133 -5.084 18.422 6.526 1.00 0.00 H new ATOM 0 HE3 MET A 133 -6.648 18.597 7.358 1.00 0.00 H new ATOM 2101 N GLU A 134 -2.375 15.595 9.499 1.00 0.00 N ATOM 2102 CA GLU A 134 -1.824 15.096 10.767 1.00 0.00 C ATOM 2103 C GLU A 134 -2.937 14.902 11.819 1.00 0.00 C ATOM 2104 O GLU A 134 -3.855 15.724 11.914 1.00 0.00 O ATOM 2105 CB GLU A 134 -0.732 16.066 11.247 1.00 0.00 C ATOM 2106 CG GLU A 134 0.074 15.524 12.433 1.00 0.00 C ATOM 2107 CD GLU A 134 1.241 16.463 12.770 1.00 0.00 C ATOM 2108 OE1 GLU A 134 1.039 17.444 13.525 1.00 0.00 O ATOM 2109 OE2 GLU A 134 2.373 16.230 12.283 1.00 0.00 O ATOM 0 H GLU A 134 -2.388 16.613 9.434 1.00 0.00 H new ATOM 0 HA GLU A 134 -1.376 14.114 10.615 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -0.054 16.278 10.421 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -1.194 17.012 11.531 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -0.575 15.417 13.302 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.456 14.531 12.196 1.00 0.00 H new ATOM 2116 N LYS A 135 -2.871 13.820 12.612 1.00 0.00 N ATOM 2117 CA LYS A 135 -3.727 13.610 13.802 1.00 0.00 C ATOM 2118 C LYS A 135 -3.030 13.996 15.118 1.00 0.00 C ATOM 2119 O LYS A 135 -3.702 14.632 15.963 1.00 0.00 O ATOM 2120 CB LYS A 135 -4.243 12.161 13.853 1.00 0.00 C ATOM 2121 CG LYS A 135 -5.199 11.786 12.708 1.00 0.00 C ATOM 2122 CD LYS A 135 -6.677 12.048 13.039 1.00 0.00 C ATOM 2123 CE LYS A 135 -7.050 13.496 13.392 1.00 0.00 C ATOM 2124 NZ LYS A 135 -6.947 14.443 12.243 1.00 0.00 N ATOM 2125 OXT LYS A 135 -1.834 13.680 15.314 1.00 0.00 O ATOM 0 H LYS A 135 -2.216 13.055 12.447 1.00 0.00 H new ATOM 0 HA LYS A 135 -4.579 14.282 13.698 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -3.389 11.483 13.834 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.754 12.003 14.803 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -4.928 12.352 11.817 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -5.069 10.731 12.467 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -7.279 11.738 12.185 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -6.959 11.409 13.876 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -8.070 13.515 13.776 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -6.400 13.843 14.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -7.542 15.276 12.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -5.958 14.742 12.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -7.269 13.971 11.374 1.00 0.00 H new TER 2139 LYS A 135