USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1063 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 120:sc= -4.43! USER MOD Single : A 13 LYS NZ :NH3+ -163:sc= -0.215 (180deg=-0.532) USER MOD Single : A 24 LYS NZ :NH3+ 158:sc= -0.0184 (180deg=-0.404) USER MOD Single : A 25 SER OG : rot -93:sc= -0.234 USER MOD Single : A 29 LYS NZ :NH3+ -118:sc= -0.389 (180deg=-1.02) USER MOD Single : A 34 TYR OH : rot -178:sc= -1.13 USER MOD Single : A 36 SER OG : rot 180:sc= -0.0234 USER MOD Single : A 38 SER OG : rot -51:sc= 0.0629 USER MOD Single : A 47 THR OG1 : rot 180:sc= -1.08! USER MOD Single : A 49 GLN : amide:sc= -2.34 K(o=-2.3,f=-3.1!) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -2.94 K(o=-2.9,f=-5.3!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -168:sc= -2.81! (180deg=-3.03!) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 68 CYS SG : rot -172:sc= 0.0481 USER MOD Single : A 69 THR OG1 : rot -124:sc= 0.694 USER MOD Single : A 80 TYR OH : rot -36:sc= 0.453 USER MOD Single : A 83 LYS NZ :NH3+ 174:sc= 0.539 (180deg=0.484) USER MOD Single : A 84 MET CE :methyl 142:sc= -0.718 (180deg=-1.78!) USER MOD Single : A 93 GLN : amide:sc= -0.0736 K(o=-0.074,f=-0.91) USER MOD Single : A 94 SER OG : rot -82:sc= 0.734 USER MOD Single : A 98 GLN : amide:sc=-0.00298 X(o=-0.003,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 174:sc= -0.46 (180deg=-0.522) USER MOD Single : A 101 SER OG : rot 10:sc= -0.208 USER MOD Single : A 102 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.071) USER MOD Single : A 103 HIS : no HE2:sc= 0.0837 K(o=0.084,f=-1.2) USER MOD Single : A 105 ASN : amide:sc= -0.311 X(o=-0.31,f=-0.13) USER MOD Single : A 108 SER OG : rot -18:sc= 0.869 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0.718 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 118:sc= -0.997! USER MOD Single : A 133 LYS NZ :NH3+ -166:sc= -0.0377 (180deg=-0.295) USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 LYS NZ :NH3+ 152:sc= -0.12 (180deg=-0.555) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -4.334 10.520 3.140 1.00 0.00 N ATOM 22 CA LEU A 4 -4.683 9.888 1.873 1.00 0.00 C ATOM 23 C LEU A 4 -5.565 10.800 1.024 1.00 0.00 C ATOM 24 O LEU A 4 -5.555 10.722 -0.205 1.00 0.00 O ATOM 25 CB LEU A 4 -5.397 8.559 2.126 1.00 0.00 C ATOM 26 CG LEU A 4 -4.510 7.450 2.696 1.00 0.00 C ATOM 27 CD1 LEU A 4 -4.433 7.547 4.213 1.00 0.00 C ATOM 28 CD2 LEU A 4 -5.030 6.084 2.271 1.00 0.00 C ATOM 0 HA LEU A 4 -3.759 9.702 1.325 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.224 8.733 2.814 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.830 8.212 1.188 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.503 7.576 2.297 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -3.797 6.749 4.597 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -4.013 8.513 4.495 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.433 7.449 4.635 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -4.388 5.306 2.684 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.047 5.951 2.641 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.028 6.016 1.183 1.00 0.00 H new ATOM 40 N ASP A 5 -6.326 11.665 1.687 1.00 0.00 N ATOM 41 CA ASP A 5 -7.211 12.593 0.990 1.00 0.00 C ATOM 42 C ASP A 5 -6.406 13.686 0.295 1.00 0.00 C ATOM 43 O ASP A 5 -6.728 14.094 -0.821 1.00 0.00 O ATOM 44 CB ASP A 5 -8.205 13.218 1.969 1.00 0.00 C ATOM 45 CG ASP A 5 -9.578 13.412 1.355 1.00 0.00 C ATOM 46 OD1 ASP A 5 -9.672 13.439 0.109 1.00 0.00 O ATOM 47 OD2 ASP A 5 -10.558 13.537 2.119 1.00 0.00 O ATOM 0 H ASP A 5 -6.348 11.743 2.704 1.00 0.00 H new ATOM 0 HA ASP A 5 -7.763 12.034 0.234 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -8.291 12.583 2.850 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -7.822 14.181 2.306 1.00 0.00 H new ATOM 52 N LYS A 6 -5.356 14.153 0.960 1.00 0.00 N ATOM 53 CA LYS A 6 -4.498 15.190 0.410 1.00 0.00 C ATOM 54 C LYS A 6 -3.486 14.580 -0.548 1.00 0.00 C ATOM 55 O LYS A 6 -3.282 15.070 -1.658 1.00 0.00 O ATOM 56 CB LYS A 6 -3.764 15.918 1.536 1.00 0.00 C ATOM 57 CG LYS A 6 -4.516 15.930 2.854 1.00 0.00 C ATOM 58 CD LYS A 6 -3.941 16.954 3.818 1.00 0.00 C ATOM 59 CE LYS A 6 -2.540 16.572 4.266 1.00 0.00 C ATOM 60 NZ LYS A 6 -1.659 17.764 4.414 1.00 0.00 N ATOM 0 H LYS A 6 -5.079 13.826 1.886 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.119 15.903 -0.132 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.793 15.447 1.687 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -3.575 16.946 1.228 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -5.567 16.152 2.671 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -4.473 14.939 3.307 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -3.917 17.933 3.339 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -4.591 17.041 4.688 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.595 16.041 5.216 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -2.102 15.885 3.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -0.713 17.460 4.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.585 18.257 3.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.063 18.408 5.124 1.00 0.00 H new ATOM 74 N TYR A 7 -2.856 13.500 -0.098 1.00 0.00 N ATOM 75 CA TYR A 7 -1.859 12.800 -0.901 1.00 0.00 C ATOM 76 C TYR A 7 -2.422 12.418 -2.266 1.00 0.00 C ATOM 77 O TYR A 7 -1.686 12.321 -3.248 1.00 0.00 O ATOM 78 CB TYR A 7 -1.376 11.546 -0.168 1.00 0.00 C ATOM 79 CG TYR A 7 -0.123 11.767 0.649 1.00 0.00 C ATOM 80 CD1 TYR A 7 1.130 11.754 0.050 1.00 0.00 C ATOM 81 CD2 TYR A 7 -0.193 11.988 2.018 1.00 0.00 C ATOM 82 CE1 TYR A 7 2.278 11.956 0.793 1.00 0.00 C ATOM 83 CE2 TYR A 7 0.950 12.191 2.768 1.00 0.00 C ATOM 84 CZ TYR A 7 2.182 12.174 2.151 1.00 0.00 C ATOM 85 OH TYR A 7 3.323 12.376 2.894 1.00 0.00 O ATOM 0 H TYR A 7 -3.019 13.089 0.821 1.00 0.00 H new ATOM 0 HA TYR A 7 -1.017 13.474 -1.054 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.170 11.191 0.489 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -1.190 10.758 -0.898 1.00 0.00 H new ATOM 0 HD1 TYR A 7 1.209 11.583 -1.014 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -1.157 12.001 2.505 1.00 0.00 H new ATOM 0 HE1 TYR A 7 3.245 11.943 0.312 1.00 0.00 H new ATOM 0 HE2 TYR A 7 0.878 12.362 3.832 1.00 0.00 H new ATOM 0 HH TYR A 7 3.284 13.257 3.321 1.00 0.00 H new ATOM 135 N ILE A 11 -9.577 10.911 -4.604 1.00 0.00 N ATOM 136 CA ILE A 11 -9.889 9.565 -4.135 1.00 0.00 C ATOM 137 C ILE A 11 -11.219 9.545 -3.388 1.00 0.00 C ATOM 138 O ILE A 11 -11.506 10.435 -2.586 1.00 0.00 O ATOM 139 CB ILE A 11 -8.781 9.011 -3.213 1.00 0.00 C ATOM 140 CG1 ILE A 11 -7.431 9.001 -3.936 1.00 0.00 C ATOM 141 CG2 ILE A 11 -9.137 7.610 -2.731 1.00 0.00 C ATOM 142 CD1 ILE A 11 -7.371 8.035 -5.100 1.00 0.00 C ATOM 0 HA ILE A 11 -9.958 8.930 -5.018 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.701 9.665 -2.345 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.215 10.006 -4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.648 8.745 -3.222 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.345 7.236 -2.083 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.075 7.643 -2.176 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.247 6.947 -3.589 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.385 8.083 -5.563 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.554 7.022 -4.742 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.130 8.303 -5.835 1.00 0.00 H new ATOM 154 N GLU A 12 -12.029 8.526 -3.656 1.00 0.00 N ATOM 155 CA GLU A 12 -13.329 8.392 -3.009 1.00 0.00 C ATOM 156 C GLU A 12 -13.523 6.981 -2.462 1.00 0.00 C ATOM 157 O GLU A 12 -13.841 6.800 -1.287 1.00 0.00 O ATOM 158 CB GLU A 12 -14.450 8.726 -3.996 1.00 0.00 C ATOM 159 CG GLU A 12 -14.205 10.002 -4.785 1.00 0.00 C ATOM 160 CD GLU A 12 -13.797 9.732 -6.220 1.00 0.00 C ATOM 161 OE1 GLU A 12 -12.960 8.832 -6.439 1.00 0.00 O ATOM 162 OE2 GLU A 12 -14.316 10.419 -7.125 1.00 0.00 O ATOM 0 H GLU A 12 -11.808 7.781 -4.317 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.365 9.094 -2.176 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.570 7.896 -4.692 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.388 8.821 -3.449 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.110 10.609 -4.777 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -13.426 10.585 -4.293 1.00 0.00 H new ATOM 169 N LYS A 13 -13.331 5.986 -3.322 1.00 0.00 N ATOM 170 CA LYS A 13 -13.488 4.590 -2.920 1.00 0.00 C ATOM 171 C LYS A 13 -12.296 3.753 -3.376 1.00 0.00 C ATOM 172 O LYS A 13 -11.496 4.191 -4.203 1.00 0.00 O ATOM 173 CB LYS A 13 -14.782 4.014 -3.497 1.00 0.00 C ATOM 174 CG LYS A 13 -15.992 4.221 -2.601 1.00 0.00 C ATOM 175 CD LYS A 13 -17.206 4.677 -3.394 1.00 0.00 C ATOM 176 CE LYS A 13 -18.164 3.526 -3.658 1.00 0.00 C ATOM 177 NZ LYS A 13 -17.449 2.304 -4.122 1.00 0.00 N ATOM 0 H LYS A 13 -13.067 6.118 -4.298 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.537 4.555 -1.832 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -14.975 4.475 -4.466 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.648 2.947 -3.672 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.224 3.291 -2.082 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.757 4.962 -1.837 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.724 5.465 -2.847 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -16.882 5.107 -4.342 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -18.718 3.299 -2.747 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -18.895 3.827 -4.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -18.128 1.650 -4.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -16.725 2.569 -4.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -16.994 1.839 -3.311 1.00 0.00 H new ATOM 191 N LEU A 14 -12.187 2.548 -2.829 1.00 0.00 N ATOM 192 CA LEU A 14 -11.095 1.645 -3.173 1.00 0.00 C ATOM 193 C LEU A 14 -11.627 0.268 -3.558 1.00 0.00 C ATOM 194 O LEU A 14 -12.788 -0.053 -3.304 1.00 0.00 O ATOM 195 CB LEU A 14 -10.116 1.521 -2.004 1.00 0.00 C ATOM 196 CG LEU A 14 -8.965 2.528 -2.014 1.00 0.00 C ATOM 197 CD1 LEU A 14 -9.355 3.792 -1.266 1.00 0.00 C ATOM 198 CD2 LEU A 14 -7.714 1.912 -1.407 1.00 0.00 C ATOM 0 H LEU A 14 -12.843 2.173 -2.144 1.00 0.00 H new ATOM 0 HA LEU A 14 -10.570 2.063 -4.031 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -10.670 1.635 -1.072 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.698 0.514 -2.005 1.00 0.00 H new ATOM 0 HG LEU A 14 -8.750 2.795 -3.049 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -8.523 4.497 -1.284 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -10.224 4.244 -1.744 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -9.598 3.543 -0.233 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -6.905 2.642 -1.422 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -7.917 1.616 -0.378 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -7.423 1.035 -1.986 1.00 0.00 H new ATOM 210 N ARG A 15 -10.771 -0.542 -4.170 1.00 0.00 N ATOM 211 CA ARG A 15 -11.148 -1.879 -4.587 1.00 0.00 C ATOM 212 C ARG A 15 -10.733 -2.907 -3.555 1.00 0.00 C ATOM 213 O ARG A 15 -9.579 -3.330 -3.491 1.00 0.00 O ATOM 214 CB ARG A 15 -10.530 -2.234 -5.930 1.00 0.00 C ATOM 215 CG ARG A 15 -10.717 -1.167 -6.995 1.00 0.00 C ATOM 216 CD ARG A 15 -11.809 -1.548 -7.983 1.00 0.00 C ATOM 217 NE ARG A 15 -13.065 -0.854 -7.708 1.00 0.00 N ATOM 218 CZ ARG A 15 -14.058 -0.741 -8.587 1.00 0.00 C ATOM 219 NH1 ARG A 15 -13.946 -1.275 -9.797 1.00 0.00 N ATOM 220 NH2 ARG A 15 -15.165 -0.092 -8.255 1.00 0.00 N ATOM 0 H ARG A 15 -9.807 -0.290 -4.388 1.00 0.00 H new ATOM 0 HA ARG A 15 -12.233 -1.890 -4.686 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -9.464 -2.413 -5.792 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -10.967 -3.168 -6.284 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -10.969 -0.219 -6.521 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -9.779 -1.016 -7.529 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -11.480 -1.313 -8.995 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -11.974 -2.625 -7.943 1.00 0.00 H new ATOM 0 HE ARG A 15 -13.188 -0.431 -6.788 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -13.096 -1.775 -10.057 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -14.710 -1.185 -10.467 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -15.255 0.320 -7.326 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -15.926 -0.005 -8.928 1.00 0.00 H new ATOM 234 N ARG A 16 -11.699 -3.298 -2.762 1.00 0.00 N ATOM 235 CA ARG A 16 -11.497 -4.290 -1.710 1.00 0.00 C ATOM 236 C ARG A 16 -11.680 -5.699 -2.266 1.00 0.00 C ATOM 237 O ARG A 16 -12.262 -5.883 -3.335 1.00 0.00 O ATOM 238 CB ARG A 16 -12.478 -4.043 -0.557 1.00 0.00 C ATOM 239 CG ARG A 16 -12.376 -5.058 0.570 1.00 0.00 C ATOM 240 CD ARG A 16 -11.022 -4.996 1.259 1.00 0.00 C ATOM 241 NE ARG A 16 -11.094 -4.303 2.544 1.00 0.00 N ATOM 242 CZ ARG A 16 -11.771 -4.758 3.596 1.00 0.00 C ATOM 243 NH1 ARG A 16 -12.436 -5.904 3.520 1.00 0.00 N ATOM 244 NH2 ARG A 16 -11.783 -4.066 4.726 1.00 0.00 N ATOM 0 H ARG A 16 -12.653 -2.943 -2.820 1.00 0.00 H new ATOM 0 HA ARG A 16 -10.479 -4.196 -1.332 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -12.303 -3.047 -0.152 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -13.495 -4.053 -0.950 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -13.165 -4.873 1.299 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -12.537 -6.060 0.173 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -10.647 -6.008 1.413 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -10.308 -4.486 0.611 1.00 0.00 H new ATOM 0 HE ARG A 16 -10.596 -3.418 2.640 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -12.430 -6.441 2.653 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -12.953 -6.248 4.329 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -11.274 -3.185 4.790 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -12.302 -4.415 5.532 1.00 0.00 H new ATOM 258 N GLY A 17 -11.178 -6.694 -1.538 1.00 0.00 N ATOM 259 CA GLY A 17 -11.298 -8.073 -1.982 1.00 0.00 C ATOM 260 C GLY A 17 -12.706 -8.427 -2.425 1.00 0.00 C ATOM 261 O GLY A 17 -12.984 -8.507 -3.622 1.00 0.00 O ATOM 0 H GLY A 17 -10.691 -6.570 -0.650 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -10.608 -8.246 -2.808 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -10.999 -8.738 -1.172 1.00 0.00 H new ATOM 265 N ASP A 18 -13.596 -8.641 -1.458 1.00 0.00 N ATOM 266 CA ASP A 18 -14.979 -8.992 -1.744 1.00 0.00 C ATOM 267 C ASP A 18 -15.569 -8.103 -2.835 1.00 0.00 C ATOM 268 O ASP A 18 -16.231 -8.584 -3.754 1.00 0.00 O ATOM 269 CB ASP A 18 -15.825 -8.884 -0.474 1.00 0.00 C ATOM 270 CG ASP A 18 -16.983 -9.863 -0.465 1.00 0.00 C ATOM 271 OD1 ASP A 18 -18.046 -9.530 -1.030 1.00 0.00 O ATOM 272 OD2 ASP A 18 -16.827 -10.962 0.107 1.00 0.00 O ATOM 0 H ASP A 18 -13.378 -8.576 -0.464 1.00 0.00 H new ATOM 0 HA ASP A 18 -14.991 -10.021 -2.103 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.194 -9.064 0.396 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -16.211 -7.869 -0.383 1.00 0.00 H new ATOM 277 N GLY A 19 -15.322 -6.804 -2.723 1.00 0.00 N ATOM 278 CA GLY A 19 -15.831 -5.861 -3.701 1.00 0.00 C ATOM 279 C GLY A 19 -15.307 -4.456 -3.477 1.00 0.00 C ATOM 280 O GLY A 19 -14.098 -4.244 -3.392 1.00 0.00 O ATOM 0 H GLY A 19 -14.776 -6.385 -1.970 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -15.554 -6.194 -4.701 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -16.920 -5.851 -3.659 1.00 0.00 H new ATOM 284 N GLU A 20 -16.217 -3.493 -3.376 1.00 0.00 N ATOM 285 CA GLU A 20 -15.832 -2.104 -3.155 1.00 0.00 C ATOM 286 C GLU A 20 -15.918 -1.747 -1.676 1.00 0.00 C ATOM 287 O GLU A 20 -16.729 -2.306 -0.938 1.00 0.00 O ATOM 288 CB GLU A 20 -16.720 -1.164 -3.969 1.00 0.00 C ATOM 289 CG GLU A 20 -16.197 -0.896 -5.370 1.00 0.00 C ATOM 290 CD GLU A 20 -16.434 -2.060 -6.313 1.00 0.00 C ATOM 291 OE1 GLU A 20 -17.525 -2.122 -6.917 1.00 0.00 O ATOM 292 OE2 GLU A 20 -15.527 -2.908 -6.447 1.00 0.00 O ATOM 0 H GLU A 20 -17.223 -3.648 -3.443 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.799 -1.986 -3.483 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -17.720 -1.592 -4.039 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.815 -0.217 -3.438 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -16.680 -0.005 -5.770 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -15.129 -0.684 -5.321 1.00 0.00 H new ATOM 299 N VAL A 21 -15.072 -0.819 -1.250 1.00 0.00 N ATOM 300 CA VAL A 21 -15.047 -0.392 0.142 1.00 0.00 C ATOM 301 C VAL A 21 -14.725 1.099 0.249 1.00 0.00 C ATOM 302 O VAL A 21 -14.039 1.661 -0.605 1.00 0.00 O ATOM 303 CB VAL A 21 -14.026 -1.229 0.949 1.00 0.00 C ATOM 304 CG1 VAL A 21 -13.366 -0.420 2.055 1.00 0.00 C ATOM 305 CG2 VAL A 21 -14.699 -2.467 1.522 1.00 0.00 C ATOM 0 H VAL A 21 -14.394 -0.347 -1.849 1.00 0.00 H new ATOM 0 HA VAL A 21 -16.038 -0.556 0.565 1.00 0.00 H new ATOM 0 HB VAL A 21 -13.237 -1.535 0.262 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.658 -1.050 2.593 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -12.839 0.429 1.620 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -14.128 -0.058 2.746 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -13.971 -3.048 2.088 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -15.514 -2.166 2.181 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -15.095 -3.075 0.709 1.00 0.00 H new ATOM 315 N GLU A 22 -15.233 1.732 1.302 1.00 0.00 N ATOM 316 CA GLU A 22 -15.010 3.159 1.521 1.00 0.00 C ATOM 317 C GLU A 22 -13.669 3.414 2.200 1.00 0.00 C ATOM 318 O GLU A 22 -13.155 2.565 2.929 1.00 0.00 O ATOM 319 CB GLU A 22 -16.138 3.749 2.369 1.00 0.00 C ATOM 320 CG GLU A 22 -16.454 2.937 3.615 1.00 0.00 C ATOM 321 CD GLU A 22 -16.897 3.803 4.779 1.00 0.00 C ATOM 322 OE1 GLU A 22 -17.594 4.811 4.536 1.00 0.00 O ATOM 323 OE2 GLU A 22 -16.547 3.474 5.931 1.00 0.00 O ATOM 0 H GLU A 22 -15.802 1.280 2.018 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.998 3.645 0.546 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -15.866 4.762 2.665 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.038 3.826 1.758 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -17.238 2.215 3.385 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -15.572 2.367 3.906 1.00 0.00 H new ATOM 330 N VAL A 23 -13.111 4.597 1.960 1.00 0.00 N ATOM 331 CA VAL A 23 -11.833 4.978 2.550 1.00 0.00 C ATOM 332 C VAL A 23 -11.984 5.247 4.045 1.00 0.00 C ATOM 333 O VAL A 23 -11.068 5.001 4.829 1.00 0.00 O ATOM 334 CB VAL A 23 -11.258 6.234 1.866 1.00 0.00 C ATOM 335 CG1 VAL A 23 -9.935 6.635 2.501 1.00 0.00 C ATOM 336 CG2 VAL A 23 -11.094 5.999 0.373 1.00 0.00 C ATOM 0 H VAL A 23 -13.526 5.310 1.359 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.146 4.145 2.400 1.00 0.00 H new ATOM 0 HB VAL A 23 -11.961 7.055 2.007 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -9.547 7.524 2.003 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -10.089 6.850 3.558 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -9.220 5.819 2.397 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -10.687 6.896 -0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -10.413 5.164 0.209 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -12.064 5.769 -0.068 1.00 0.00 H new ATOM 346 N LYS A 24 -13.150 5.756 4.426 1.00 0.00 N ATOM 347 CA LYS A 24 -13.444 6.067 5.822 1.00 0.00 C ATOM 348 C LYS A 24 -13.156 4.875 6.730 1.00 0.00 C ATOM 349 O LYS A 24 -12.872 5.042 7.917 1.00 0.00 O ATOM 350 CB LYS A 24 -14.906 6.492 5.972 1.00 0.00 C ATOM 351 CG LYS A 24 -15.167 7.351 7.199 1.00 0.00 C ATOM 352 CD LYS A 24 -16.555 7.103 7.768 1.00 0.00 C ATOM 353 CE LYS A 24 -17.537 8.176 7.327 1.00 0.00 C ATOM 354 NZ LYS A 24 -17.458 8.434 5.863 1.00 0.00 N ATOM 0 H LYS A 24 -13.914 5.964 3.782 1.00 0.00 H new ATOM 0 HA LYS A 24 -12.795 6.889 6.124 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.209 7.043 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.531 5.601 6.023 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -14.417 7.137 7.960 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.063 8.404 6.936 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.913 6.126 7.444 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -16.504 7.080 8.857 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.550 7.870 7.587 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.334 9.099 7.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -18.347 8.865 5.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -16.668 9.081 5.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -17.304 7.537 5.360 1.00 0.00 H new ATOM 368 N SER A 25 -13.242 3.671 6.173 1.00 0.00 N ATOM 369 CA SER A 25 -13.003 2.455 6.943 1.00 0.00 C ATOM 370 C SER A 25 -11.587 2.424 7.520 1.00 0.00 C ATOM 371 O SER A 25 -11.307 1.661 8.445 1.00 0.00 O ATOM 372 CB SER A 25 -13.234 1.222 6.068 1.00 0.00 C ATOM 373 OG SER A 25 -12.100 0.945 5.264 1.00 0.00 O ATOM 0 H SER A 25 -13.475 3.511 5.193 1.00 0.00 H new ATOM 0 HA SER A 25 -13.707 2.447 7.775 1.00 0.00 H new ATOM 0 HB2 SER A 25 -13.455 0.361 6.699 1.00 0.00 H new ATOM 0 HB3 SER A 25 -14.104 1.382 5.431 1.00 0.00 H new ATOM 0 HG SER A 25 -12.201 1.384 4.394 1.00 0.00 H new ATOM 379 N LEU A 26 -10.702 3.261 6.988 1.00 0.00 N ATOM 380 CA LEU A 26 -9.328 3.324 7.477 1.00 0.00 C ATOM 381 C LEU A 26 -9.174 4.489 8.454 1.00 0.00 C ATOM 382 O LEU A 26 -8.479 4.381 9.463 1.00 0.00 O ATOM 383 CB LEU A 26 -8.338 3.481 6.314 1.00 0.00 C ATOM 384 CG LEU A 26 -8.569 2.569 5.099 1.00 0.00 C ATOM 385 CD1 LEU A 26 -7.307 2.486 4.254 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.008 1.175 5.528 1.00 0.00 C ATOM 0 H LEU A 26 -10.909 3.902 6.222 1.00 0.00 H new ATOM 0 HA LEU A 26 -9.105 2.390 7.992 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.368 4.517 5.976 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.332 3.299 6.693 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.370 3.004 4.501 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -7.485 1.837 3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.037 3.483 3.904 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.493 2.079 4.854 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.163 0.555 4.645 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.237 0.728 6.155 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -9.939 1.244 6.091 1.00 0.00 H new ATOM 398 N ALA A 27 -9.839 5.597 8.122 1.00 0.00 N ATOM 399 CA ALA A 27 -9.837 6.823 8.903 1.00 0.00 C ATOM 400 C ALA A 27 -9.216 6.671 10.273 1.00 0.00 C ATOM 401 O ALA A 27 -9.881 6.373 11.265 1.00 0.00 O ATOM 402 CB ALA A 27 -11.238 7.355 9.020 1.00 0.00 C ATOM 0 H ALA A 27 -10.408 5.662 7.278 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.208 7.533 8.366 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.231 8.274 9.606 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.633 7.562 8.025 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.868 6.615 9.513 1.00 0.00 H new ATOM 408 N GLY A 28 -7.934 6.911 10.290 1.00 0.00 N ATOM 409 CA GLY A 28 -7.162 6.848 11.519 1.00 0.00 C ATOM 410 C GLY A 28 -6.432 5.533 11.718 1.00 0.00 C ATOM 411 O GLY A 28 -6.606 4.869 12.739 1.00 0.00 O ATOM 0 H GLY A 28 -7.390 7.155 9.463 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.435 7.660 11.522 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.829 7.014 12.365 1.00 0.00 H new ATOM 415 N LYS A 29 -5.605 5.162 10.748 1.00 0.00 N ATOM 416 CA LYS A 29 -4.841 3.929 10.831 1.00 0.00 C ATOM 417 C LYS A 29 -3.630 3.972 9.899 1.00 0.00 C ATOM 418 O LYS A 29 -3.588 4.766 8.960 1.00 0.00 O ATOM 419 CB LYS A 29 -5.741 2.739 10.502 1.00 0.00 C ATOM 420 CG LYS A 29 -5.993 2.527 9.016 1.00 0.00 C ATOM 421 CD LYS A 29 -6.584 1.153 8.745 1.00 0.00 C ATOM 422 CE LYS A 29 -7.854 0.918 9.547 1.00 0.00 C ATOM 423 NZ LYS A 29 -8.806 0.023 8.834 1.00 0.00 N ATOM 0 H LYS A 29 -5.448 5.700 9.895 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.468 3.816 11.849 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.291 1.835 10.913 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.699 2.875 11.004 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.672 3.296 8.647 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.058 2.637 8.467 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.802 1.054 7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.850 0.386 8.993 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.598 0.480 10.512 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.337 1.874 9.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.689 0.538 8.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.384 -0.288 7.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -9.011 -0.807 9.426 1.00 0.00 H new ATOM 437 N LEU A 30 -2.651 3.112 10.163 1.00 0.00 N ATOM 438 CA LEU A 30 -1.445 3.056 9.345 1.00 0.00 C ATOM 439 C LEU A 30 -1.740 2.374 8.015 1.00 0.00 C ATOM 440 O LEU A 30 -1.906 1.156 7.954 1.00 0.00 O ATOM 441 CB LEU A 30 -0.335 2.314 10.090 1.00 0.00 C ATOM 442 CG LEU A 30 1.062 2.448 9.481 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.622 3.842 9.719 1.00 0.00 C ATOM 444 CD2 LEU A 30 1.991 1.393 10.060 1.00 0.00 C ATOM 0 H LEU A 30 -2.669 2.446 10.935 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.110 4.074 9.146 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.302 2.678 11.117 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.594 1.256 10.135 1.00 0.00 H new ATOM 0 HG LEU A 30 0.986 2.293 8.405 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.616 3.915 9.278 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.966 4.581 9.259 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.686 4.030 10.791 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.982 1.499 9.619 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.059 1.522 11.140 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.599 0.401 9.837 1.00 0.00 H new ATOM 456 N VAL A 31 -1.824 3.170 6.954 1.00 0.00 N ATOM 457 CA VAL A 31 -2.122 2.642 5.629 1.00 0.00 C ATOM 458 C VAL A 31 -0.881 2.583 4.744 1.00 0.00 C ATOM 459 O VAL A 31 -0.333 3.613 4.353 1.00 0.00 O ATOM 460 CB VAL A 31 -3.197 3.487 4.919 1.00 0.00 C ATOM 461 CG1 VAL A 31 -3.719 2.763 3.689 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.335 3.819 5.873 1.00 0.00 C ATOM 0 H VAL A 31 -1.690 4.181 6.986 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.494 1.629 5.782 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.740 4.423 4.596 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.477 3.375 3.201 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.897 2.583 2.996 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.158 1.811 3.986 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.084 4.416 5.352 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -4.791 2.896 6.230 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.946 4.383 6.721 1.00 0.00 H new ATOM 472 N PHE A 32 -0.458 1.367 4.416 1.00 0.00 N ATOM 473 CA PHE A 32 0.701 1.161 3.556 1.00 0.00 C ATOM 474 C PHE A 32 0.273 1.206 2.091 1.00 0.00 C ATOM 475 O PHE A 32 -0.913 1.079 1.785 1.00 0.00 O ATOM 476 CB PHE A 32 1.370 -0.180 3.874 1.00 0.00 C ATOM 477 CG PHE A 32 1.674 -0.373 5.333 1.00 0.00 C ATOM 478 CD1 PHE A 32 0.681 -0.757 6.219 1.00 0.00 C ATOM 479 CD2 PHE A 32 2.958 -0.175 5.816 1.00 0.00 C ATOM 480 CE1 PHE A 32 0.961 -0.939 7.559 1.00 0.00 C ATOM 481 CE2 PHE A 32 3.244 -0.357 7.155 1.00 0.00 C ATOM 482 CZ PHE A 32 2.245 -0.740 8.027 1.00 0.00 C ATOM 0 H PHE A 32 -0.903 0.506 4.734 1.00 0.00 H new ATOM 0 HA PHE A 32 1.423 1.957 3.739 1.00 0.00 H new ATOM 0 HB2 PHE A 32 0.721 -0.988 3.537 1.00 0.00 H new ATOM 0 HB3 PHE A 32 2.297 -0.257 3.306 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -0.324 -0.916 5.858 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.743 0.125 5.138 1.00 0.00 H new ATOM 0 HE1 PHE A 32 0.177 -1.236 8.240 1.00 0.00 H new ATOM 0 HE2 PHE A 32 4.248 -0.200 7.519 1.00 0.00 H new ATOM 0 HZ PHE A 32 2.467 -0.884 9.074 1.00 0.00 H new ATOM 492 N PHE A 33 1.228 1.396 1.186 1.00 0.00 N ATOM 493 CA PHE A 33 0.909 1.464 -0.236 1.00 0.00 C ATOM 494 C PHE A 33 1.954 0.749 -1.086 1.00 0.00 C ATOM 495 O PHE A 33 3.065 1.245 -1.274 1.00 0.00 O ATOM 496 CB PHE A 33 0.781 2.921 -0.692 1.00 0.00 C ATOM 497 CG PHE A 33 -0.574 3.516 -0.432 1.00 0.00 C ATOM 498 CD1 PHE A 33 -1.579 3.421 -1.380 1.00 0.00 C ATOM 499 CD2 PHE A 33 -0.840 4.171 0.761 1.00 0.00 C ATOM 500 CE1 PHE A 33 -2.827 3.968 -1.144 1.00 0.00 C ATOM 501 CE2 PHE A 33 -2.086 4.719 1.002 1.00 0.00 C ATOM 502 CZ PHE A 33 -3.080 4.618 0.047 1.00 0.00 C ATOM 0 H PHE A 33 2.218 1.504 1.408 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.046 0.957 -0.375 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.536 3.520 -0.182 1.00 0.00 H new ATOM 0 HB3 PHE A 33 0.995 2.979 -1.759 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -1.386 2.914 -2.314 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -0.066 4.254 1.509 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.603 3.887 -1.891 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -2.283 5.225 1.935 1.00 0.00 H new ATOM 0 HZ PHE A 33 -4.054 5.047 0.232 1.00 0.00 H new ATOM 512 N TYR A 34 1.580 -0.415 -1.605 1.00 0.00 N ATOM 513 CA TYR A 34 2.471 -1.203 -2.450 1.00 0.00 C ATOM 514 C TYR A 34 2.253 -0.869 -3.927 1.00 0.00 C ATOM 515 O TYR A 34 1.205 -1.180 -4.494 1.00 0.00 O ATOM 516 CB TYR A 34 2.239 -2.698 -2.217 1.00 0.00 C ATOM 517 CG TYR A 34 3.316 -3.583 -2.806 1.00 0.00 C ATOM 518 CD1 TYR A 34 3.329 -3.889 -4.161 1.00 0.00 C ATOM 519 CD2 TYR A 34 4.320 -4.112 -2.005 1.00 0.00 C ATOM 520 CE1 TYR A 34 4.312 -4.696 -4.701 1.00 0.00 C ATOM 521 CE2 TYR A 34 5.306 -4.920 -2.537 1.00 0.00 C ATOM 522 CZ TYR A 34 5.298 -5.208 -3.885 1.00 0.00 C ATOM 523 OH TYR A 34 6.280 -6.011 -4.419 1.00 0.00 O ATOM 0 H TYR A 34 0.663 -0.835 -1.455 1.00 0.00 H new ATOM 0 HA TYR A 34 3.499 -0.955 -2.184 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.176 -2.883 -1.145 1.00 0.00 H new ATOM 0 HB3 TYR A 34 1.277 -2.978 -2.646 1.00 0.00 H new ATOM 0 HD1 TYR A 34 2.558 -3.489 -4.803 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.330 -3.888 -0.949 1.00 0.00 H new ATOM 0 HE1 TYR A 34 4.308 -4.924 -5.757 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.079 -5.324 -1.900 1.00 0.00 H new ATOM 0 HH TYR A 34 6.879 -6.314 -3.705 1.00 0.00 H new ATOM 533 N PHE A 35 3.248 -0.233 -4.544 1.00 0.00 N ATOM 534 CA PHE A 35 3.160 0.145 -5.955 1.00 0.00 C ATOM 535 C PHE A 35 3.759 -0.937 -6.851 1.00 0.00 C ATOM 536 O PHE A 35 4.905 -1.345 -6.658 1.00 0.00 O ATOM 537 CB PHE A 35 3.885 1.472 -6.196 1.00 0.00 C ATOM 538 CG PHE A 35 3.274 2.637 -5.467 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.264 2.677 -4.082 1.00 0.00 C ATOM 540 CD2 PHE A 35 2.717 3.693 -6.169 1.00 0.00 C ATOM 541 CE1 PHE A 35 2.706 3.749 -3.411 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.158 4.767 -5.504 1.00 0.00 C ATOM 543 CZ PHE A 35 2.152 4.795 -4.122 1.00 0.00 C ATOM 0 H PHE A 35 4.123 0.031 -4.091 1.00 0.00 H new ATOM 0 HA PHE A 35 2.105 0.259 -6.206 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.926 1.368 -5.889 1.00 0.00 H new ATOM 0 HB3 PHE A 35 3.888 1.685 -7.265 1.00 0.00 H new ATOM 0 HD1 PHE A 35 3.697 1.862 -3.521 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.720 3.677 -7.249 1.00 0.00 H new ATOM 0 HE1 PHE A 35 2.703 3.768 -2.331 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.726 5.584 -6.063 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.715 5.633 -3.600 1.00 0.00 H new ATOM 553 N SER A 36 2.985 -1.400 -7.833 1.00 0.00 N ATOM 554 CA SER A 36 3.460 -2.433 -8.748 1.00 0.00 C ATOM 555 C SER A 36 2.447 -2.699 -9.859 1.00 0.00 C ATOM 556 O SER A 36 1.363 -2.117 -9.878 1.00 0.00 O ATOM 557 CB SER A 36 3.749 -3.723 -7.980 1.00 0.00 C ATOM 558 OG SER A 36 2.569 -4.487 -7.799 1.00 0.00 O ATOM 0 H SER A 36 2.034 -1.078 -8.013 1.00 0.00 H new ATOM 0 HA SER A 36 4.380 -2.076 -9.210 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.488 -4.314 -8.521 1.00 0.00 H new ATOM 0 HB3 SER A 36 4.182 -3.482 -7.009 1.00 0.00 H new ATOM 0 HG SER A 36 2.782 -5.307 -7.306 1.00 0.00 H new ATOM 564 N ALA A 37 2.808 -3.589 -10.779 1.00 0.00 N ATOM 565 CA ALA A 37 1.933 -3.944 -11.890 1.00 0.00 C ATOM 566 C ALA A 37 1.986 -5.447 -12.156 1.00 0.00 C ATOM 567 O ALA A 37 2.879 -6.139 -11.666 1.00 0.00 O ATOM 568 CB ALA A 37 2.321 -3.163 -13.137 1.00 0.00 C ATOM 0 H ALA A 37 3.703 -4.078 -10.776 1.00 0.00 H new ATOM 0 HA ALA A 37 0.909 -3.682 -11.623 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.660 -3.438 -13.959 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.231 -2.095 -12.940 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.351 -3.396 -13.407 1.00 0.00 H new ATOM 574 N SER A 38 1.026 -5.949 -12.927 1.00 0.00 N ATOM 575 CA SER A 38 0.968 -7.372 -13.246 1.00 0.00 C ATOM 576 C SER A 38 1.787 -7.702 -14.495 1.00 0.00 C ATOM 577 O SER A 38 1.535 -8.710 -15.158 1.00 0.00 O ATOM 578 CB SER A 38 -0.484 -7.805 -13.454 1.00 0.00 C ATOM 579 OG SER A 38 -0.637 -9.199 -13.251 1.00 0.00 O ATOM 0 H SER A 38 0.279 -5.393 -13.342 1.00 0.00 H new ATOM 0 HA SER A 38 1.397 -7.917 -12.405 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.131 -7.261 -12.765 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.803 -7.545 -14.463 1.00 0.00 H new ATOM 0 HG SER A 38 0.029 -9.682 -13.784 1.00 0.00 H new ATOM 585 N TRP A 39 2.758 -6.851 -14.824 1.00 0.00 N ATOM 586 CA TRP A 39 3.590 -7.064 -16.003 1.00 0.00 C ATOM 587 C TRP A 39 5.079 -6.984 -15.665 1.00 0.00 C ATOM 588 O TRP A 39 5.899 -7.656 -16.292 1.00 0.00 O ATOM 589 CB TRP A 39 3.263 -6.024 -17.079 1.00 0.00 C ATOM 590 CG TRP A 39 1.855 -5.516 -17.025 1.00 0.00 C ATOM 591 CD1 TRP A 39 1.283 -4.806 -16.010 1.00 0.00 C ATOM 592 CD2 TRP A 39 0.843 -5.672 -18.026 1.00 0.00 C ATOM 593 NE1 TRP A 39 -0.022 -4.514 -16.314 1.00 0.00 N ATOM 594 CE2 TRP A 39 -0.317 -5.033 -17.548 1.00 0.00 C ATOM 595 CE3 TRP A 39 0.805 -6.289 -19.279 1.00 0.00 C ATOM 596 CZ2 TRP A 39 -1.501 -4.996 -18.280 1.00 0.00 C ATOM 597 CZ3 TRP A 39 -0.371 -6.251 -20.005 1.00 0.00 C ATOM 598 CH2 TRP A 39 -1.509 -5.608 -19.504 1.00 0.00 C ATOM 0 H TRP A 39 2.986 -6.011 -14.292 1.00 0.00 H new ATOM 0 HA TRP A 39 3.373 -8.065 -16.376 1.00 0.00 H new ATOM 0 HB2 TRP A 39 3.947 -5.182 -16.976 1.00 0.00 H new ATOM 0 HB3 TRP A 39 3.443 -6.462 -18.061 1.00 0.00 H new ATOM 0 HD1 TRP A 39 1.785 -4.516 -15.099 1.00 0.00 H new ATOM 0 HE1 TRP A 39 -0.668 -3.995 -15.719 1.00 0.00 H new ATOM 0 HE3 TRP A 39 1.679 -6.787 -19.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -2.381 -4.502 -17.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -0.412 -6.725 -20.974 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -2.412 -5.595 -20.096 1.00 0.00 H new ATOM 609 N CYS A 40 5.427 -6.146 -14.689 1.00 0.00 N ATOM 610 CA CYS A 40 6.824 -5.969 -14.292 1.00 0.00 C ATOM 611 C CYS A 40 7.544 -7.312 -14.147 1.00 0.00 C ATOM 612 O CYS A 40 6.907 -8.365 -14.092 1.00 0.00 O ATOM 613 CB CYS A 40 6.914 -5.144 -12.996 1.00 0.00 C ATOM 614 SG CYS A 40 6.750 -6.080 -11.434 1.00 0.00 S ATOM 0 H CYS A 40 4.763 -5.580 -14.160 1.00 0.00 H new ATOM 0 HA CYS A 40 7.331 -5.419 -15.084 1.00 0.00 H new ATOM 0 HB2 CYS A 40 7.872 -4.625 -12.986 1.00 0.00 H new ATOM 0 HB3 CYS A 40 6.137 -4.380 -13.021 1.00 0.00 H new ATOM 619 N PRO A 41 8.887 -7.301 -14.108 1.00 0.00 N ATOM 620 CA PRO A 41 9.673 -8.529 -13.987 1.00 0.00 C ATOM 621 C PRO A 41 9.437 -9.244 -12.656 1.00 0.00 C ATOM 622 O PRO A 41 9.074 -10.419 -12.641 1.00 0.00 O ATOM 623 CB PRO A 41 11.131 -8.068 -14.117 1.00 0.00 C ATOM 624 CG PRO A 41 11.069 -6.663 -14.624 1.00 0.00 C ATOM 625 CD PRO A 41 9.738 -6.105 -14.198 1.00 0.00 C ATOM 0 HA PRO A 41 9.393 -9.257 -14.748 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.643 -8.115 -13.156 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.684 -8.708 -14.805 1.00 0.00 H new ATOM 0 HG2 PRO A 41 11.886 -6.068 -14.215 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.169 -6.639 -15.709 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.806 -5.586 -13.242 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.351 -5.389 -14.923 1.00 0.00 H new ATOM 633 N PRO A 42 9.637 -8.557 -11.511 1.00 0.00 N ATOM 634 CA PRO A 42 9.434 -9.169 -10.194 1.00 0.00 C ATOM 635 C PRO A 42 7.980 -9.590 -9.959 1.00 0.00 C ATOM 636 O PRO A 42 7.656 -10.769 -10.089 1.00 0.00 O ATOM 637 CB PRO A 42 9.866 -8.078 -9.200 1.00 0.00 C ATOM 638 CG PRO A 42 10.638 -7.090 -10.007 1.00 0.00 C ATOM 639 CD PRO A 42 10.075 -7.155 -11.398 1.00 0.00 C ATOM 0 HA PRO A 42 10.007 -10.090 -10.088 1.00 0.00 H new ATOM 0 HB2 PRO A 42 9.001 -7.611 -8.729 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.478 -8.495 -8.400 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.539 -6.087 -9.593 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.701 -7.332 -10.005 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.245 -6.461 -11.531 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.824 -6.904 -12.149 1.00 0.00 H new ATOM 647 N CYS A 43 7.116 -8.623 -9.599 1.00 0.00 N ATOM 648 CA CYS A 43 5.687 -8.877 -9.321 1.00 0.00 C ATOM 649 C CYS A 43 5.319 -10.345 -9.478 1.00 0.00 C ATOM 650 O CYS A 43 4.672 -10.746 -10.445 1.00 0.00 O ATOM 651 CB CYS A 43 4.774 -8.018 -10.202 1.00 0.00 C ATOM 652 SG CYS A 43 5.450 -7.584 -11.838 1.00 0.00 S ATOM 0 H CYS A 43 7.386 -7.645 -9.492 1.00 0.00 H new ATOM 0 HA CYS A 43 5.532 -8.598 -8.279 1.00 0.00 H new ATOM 0 HB2 CYS A 43 3.832 -8.548 -10.346 1.00 0.00 H new ATOM 0 HB3 CYS A 43 4.543 -7.097 -9.667 1.00 0.00 H new ATOM 657 N ARG A 44 5.743 -11.131 -8.505 1.00 0.00 N ATOM 658 CA ARG A 44 5.478 -12.565 -8.495 1.00 0.00 C ATOM 659 C ARG A 44 5.655 -13.136 -7.090 1.00 0.00 C ATOM 660 O ARG A 44 4.838 -13.933 -6.625 1.00 0.00 O ATOM 661 CB ARG A 44 6.405 -13.288 -9.478 1.00 0.00 C ATOM 662 CG ARG A 44 7.862 -13.315 -9.041 1.00 0.00 C ATOM 663 CD ARG A 44 8.789 -13.602 -10.212 1.00 0.00 C ATOM 664 NE ARG A 44 10.149 -13.131 -9.961 1.00 0.00 N ATOM 665 CZ ARG A 44 11.215 -13.548 -10.640 1.00 0.00 C ATOM 666 NH1 ARG A 44 11.084 -14.443 -11.610 1.00 0.00 N ATOM 667 NH2 ARG A 44 12.416 -13.068 -10.347 1.00 0.00 N ATOM 0 H ARG A 44 6.278 -10.799 -7.702 1.00 0.00 H new ATOM 0 HA ARG A 44 4.445 -12.722 -8.806 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.055 -14.312 -9.607 1.00 0.00 H new ATOM 0 HB3 ARG A 44 6.336 -12.803 -10.452 1.00 0.00 H new ATOM 0 HG2 ARG A 44 8.126 -12.357 -8.592 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.999 -14.076 -8.272 1.00 0.00 H new ATOM 0 HD2 ARG A 44 8.807 -14.674 -10.406 1.00 0.00 H new ATOM 0 HD3 ARG A 44 8.399 -13.122 -11.109 1.00 0.00 H new ATOM 0 HE ARG A 44 10.290 -12.442 -9.222 1.00 0.00 H new ATOM 0 HH11 ARG A 44 10.163 -14.816 -11.839 1.00 0.00 H new ATOM 0 HH12 ARG A 44 11.905 -14.759 -12.127 1.00 0.00 H new ATOM 0 HH21 ARG A 44 12.522 -12.380 -9.602 1.00 0.00 H new ATOM 0 HH22 ARG A 44 13.233 -13.387 -10.867 1.00 0.00 H new ATOM 681 N GLY A 45 6.724 -12.720 -6.419 1.00 0.00 N ATOM 682 CA GLY A 45 6.988 -13.196 -5.074 1.00 0.00 C ATOM 683 C GLY A 45 6.327 -12.332 -4.019 1.00 0.00 C ATOM 684 O GLY A 45 5.698 -12.843 -3.093 1.00 0.00 O ATOM 0 H GLY A 45 7.413 -12.061 -6.783 1.00 0.00 H new ATOM 0 HA2 GLY A 45 6.631 -14.221 -4.977 1.00 0.00 H new ATOM 0 HA3 GLY A 45 8.064 -13.216 -4.902 1.00 0.00 H new ATOM 688 N PHE A 46 6.468 -11.017 -4.159 1.00 0.00 N ATOM 689 CA PHE A 46 5.877 -10.081 -3.211 1.00 0.00 C ATOM 690 C PHE A 46 4.357 -10.076 -3.335 1.00 0.00 C ATOM 691 O PHE A 46 3.804 -9.561 -4.307 1.00 0.00 O ATOM 692 CB PHE A 46 6.423 -8.671 -3.440 1.00 0.00 C ATOM 693 CG PHE A 46 6.626 -7.896 -2.169 1.00 0.00 C ATOM 694 CD1 PHE A 46 5.587 -7.735 -1.268 1.00 0.00 C ATOM 695 CD2 PHE A 46 7.857 -7.332 -1.875 1.00 0.00 C ATOM 696 CE1 PHE A 46 5.770 -7.026 -0.096 1.00 0.00 C ATOM 697 CE2 PHE A 46 8.046 -6.620 -0.706 1.00 0.00 C ATOM 698 CZ PHE A 46 7.001 -6.467 0.185 1.00 0.00 C ATOM 0 H PHE A 46 6.986 -10.577 -4.919 1.00 0.00 H new ATOM 0 HA PHE A 46 6.144 -10.404 -2.205 1.00 0.00 H new ATOM 0 HB2 PHE A 46 7.372 -8.739 -3.971 1.00 0.00 H new ATOM 0 HB3 PHE A 46 5.736 -8.123 -4.085 1.00 0.00 H new ATOM 0 HD1 PHE A 46 4.622 -8.169 -1.484 1.00 0.00 H new ATOM 0 HD2 PHE A 46 8.678 -7.450 -2.567 1.00 0.00 H new ATOM 0 HE1 PHE A 46 4.952 -6.909 0.599 1.00 0.00 H new ATOM 0 HE2 PHE A 46 9.010 -6.183 -0.489 1.00 0.00 H new ATOM 0 HZ PHE A 46 7.147 -5.911 1.099 1.00 0.00 H new ATOM 708 N THR A 47 3.687 -10.656 -2.343 1.00 0.00 N ATOM 709 CA THR A 47 2.230 -10.721 -2.339 1.00 0.00 C ATOM 710 C THR A 47 1.716 -11.289 -1.016 1.00 0.00 C ATOM 711 O THR A 47 0.968 -10.627 -0.298 1.00 0.00 O ATOM 712 CB THR A 47 1.722 -11.573 -3.509 1.00 0.00 C ATOM 713 OG1 THR A 47 2.799 -12.045 -4.301 1.00 0.00 O ATOM 714 CG2 THR A 47 0.776 -10.825 -4.423 1.00 0.00 C ATOM 0 H THR A 47 4.130 -11.087 -1.532 1.00 0.00 H new ATOM 0 HA THR A 47 1.849 -9.706 -2.454 1.00 0.00 H new ATOM 0 HB THR A 47 1.184 -12.401 -3.047 1.00 0.00 H new ATOM 0 HG1 THR A 47 2.449 -12.586 -5.039 1.00 0.00 H new ATOM 0 HG21 THR A 47 0.453 -11.483 -5.230 1.00 0.00 H new ATOM 0 HG22 THR A 47 -0.093 -10.494 -3.855 1.00 0.00 H new ATOM 0 HG23 THR A 47 1.286 -9.958 -4.844 1.00 0.00 H new ATOM 722 N PRO A 48 2.109 -12.532 -0.678 1.00 0.00 N ATOM 723 CA PRO A 48 1.677 -13.183 0.564 1.00 0.00 C ATOM 724 C PRO A 48 2.357 -12.612 1.809 1.00 0.00 C ATOM 725 O PRO A 48 2.100 -13.066 2.923 1.00 0.00 O ATOM 726 CB PRO A 48 2.084 -14.641 0.356 1.00 0.00 C ATOM 727 CG PRO A 48 3.242 -14.583 -0.579 1.00 0.00 C ATOM 728 CD PRO A 48 2.996 -13.401 -1.477 1.00 0.00 C ATOM 0 HA PRO A 48 0.612 -13.038 0.742 1.00 0.00 H new ATOM 0 HB2 PRO A 48 2.360 -15.113 1.299 1.00 0.00 H new ATOM 0 HB3 PRO A 48 1.265 -15.224 -0.065 1.00 0.00 H new ATOM 0 HG2 PRO A 48 4.178 -14.469 -0.033 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.321 -15.503 -1.159 1.00 0.00 H new ATOM 0 HD2 PRO A 48 3.926 -12.894 -1.736 1.00 0.00 H new ATOM 0 HD3 PRO A 48 2.525 -13.701 -2.413 1.00 0.00 H new ATOM 736 N GLN A 49 3.218 -11.611 1.623 1.00 0.00 N ATOM 737 CA GLN A 49 3.909 -10.991 2.747 1.00 0.00 C ATOM 738 C GLN A 49 2.966 -10.049 3.484 1.00 0.00 C ATOM 739 O GLN A 49 3.017 -9.928 4.708 1.00 0.00 O ATOM 740 CB GLN A 49 5.157 -10.237 2.270 1.00 0.00 C ATOM 741 CG GLN A 49 6.351 -11.141 2.015 1.00 0.00 C ATOM 742 CD GLN A 49 6.414 -11.635 0.582 1.00 0.00 C ATOM 743 OE1 GLN A 49 7.062 -11.025 -0.269 1.00 0.00 O ATOM 744 NE2 GLN A 49 5.738 -12.743 0.310 1.00 0.00 N ATOM 0 H GLN A 49 3.450 -11.217 0.711 1.00 0.00 H new ATOM 0 HA GLN A 49 4.229 -11.776 3.432 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.918 -9.697 1.354 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.429 -9.491 3.017 1.00 0.00 H new ATOM 0 HG2 GLN A 49 7.268 -10.600 2.250 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.304 -11.997 2.689 1.00 0.00 H new ATOM 0 HE21 GLN A 49 5.215 -13.215 1.047 1.00 0.00 H new ATOM 0 HE22 GLN A 49 5.741 -13.123 -0.637 1.00 0.00 H new ATOM 753 N LEU A 50 2.099 -9.386 2.725 1.00 0.00 N ATOM 754 CA LEU A 50 1.134 -8.457 3.290 1.00 0.00 C ATOM 755 C LEU A 50 0.059 -9.191 4.078 1.00 0.00 C ATOM 756 O LEU A 50 -0.250 -8.837 5.216 1.00 0.00 O ATOM 757 CB LEU A 50 0.467 -7.681 2.159 1.00 0.00 C ATOM 758 CG LEU A 50 0.318 -6.183 2.385 1.00 0.00 C ATOM 759 CD1 LEU A 50 -0.183 -5.882 3.794 1.00 0.00 C ATOM 760 CD2 LEU A 50 1.639 -5.482 2.116 1.00 0.00 C ATOM 0 H LEU A 50 2.047 -9.478 1.710 1.00 0.00 H new ATOM 0 HA LEU A 50 1.662 -7.783 3.964 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.043 -7.837 1.247 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -0.523 -8.104 1.987 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.428 -5.803 1.687 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.279 -4.804 3.924 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.155 -6.353 3.943 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.526 -6.274 4.524 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.522 -4.411 2.280 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.402 -5.872 2.790 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.942 -5.660 1.084 1.00 0.00 H new ATOM 772 N ILE A 51 -0.511 -10.210 3.453 1.00 0.00 N ATOM 773 CA ILE A 51 -1.566 -10.999 4.078 1.00 0.00 C ATOM 774 C ILE A 51 -1.112 -11.581 5.414 1.00 0.00 C ATOM 775 O ILE A 51 -1.840 -11.519 6.405 1.00 0.00 O ATOM 776 CB ILE A 51 -2.042 -12.141 3.153 1.00 0.00 C ATOM 777 CG1 ILE A 51 -2.669 -11.566 1.881 1.00 0.00 C ATOM 778 CG2 ILE A 51 -3.032 -13.043 3.880 1.00 0.00 C ATOM 779 CD1 ILE A 51 -3.956 -10.810 2.129 1.00 0.00 C ATOM 0 H ILE A 51 -0.261 -10.512 2.511 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.400 -10.321 4.256 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.178 -12.743 2.872 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -1.952 -10.899 1.402 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.864 -12.379 1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.356 -13.841 3.212 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.553 -13.477 4.758 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.897 -12.457 4.191 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -4.343 -10.431 1.183 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -4.690 -11.478 2.580 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.764 -9.975 2.803 1.00 0.00 H new ATOM 791 N GLU A 52 0.088 -12.150 5.437 1.00 0.00 N ATOM 792 CA GLU A 52 0.620 -12.740 6.658 1.00 0.00 C ATOM 793 C GLU A 52 0.926 -11.665 7.692 1.00 0.00 C ATOM 794 O GLU A 52 0.489 -11.752 8.839 1.00 0.00 O ATOM 795 CB GLU A 52 1.880 -13.551 6.355 1.00 0.00 C ATOM 796 CG GLU A 52 2.370 -14.377 7.533 1.00 0.00 C ATOM 797 CD GLU A 52 3.498 -13.702 8.290 1.00 0.00 C ATOM 798 OE1 GLU A 52 4.242 -12.916 7.668 1.00 0.00 O ATOM 799 OE2 GLU A 52 3.634 -13.959 9.505 1.00 0.00 O ATOM 0 H GLU A 52 0.707 -12.215 4.629 1.00 0.00 H new ATOM 0 HA GLU A 52 -0.138 -13.407 7.068 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.681 -14.215 5.514 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.673 -12.871 6.044 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.539 -14.560 8.214 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.709 -15.349 7.175 1.00 0.00 H new ATOM 806 N PHE A 53 1.670 -10.644 7.279 1.00 0.00 N ATOM 807 CA PHE A 53 2.019 -9.552 8.178 1.00 0.00 C ATOM 808 C PHE A 53 0.761 -8.845 8.671 1.00 0.00 C ATOM 809 O PHE A 53 0.727 -8.317 9.783 1.00 0.00 O ATOM 810 CB PHE A 53 2.935 -8.549 7.476 1.00 0.00 C ATOM 811 CG PHE A 53 3.401 -7.444 8.379 1.00 0.00 C ATOM 812 CD1 PHE A 53 4.309 -7.699 9.395 1.00 0.00 C ATOM 813 CD2 PHE A 53 2.927 -6.153 8.218 1.00 0.00 C ATOM 814 CE1 PHE A 53 4.735 -6.686 10.232 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.351 -5.136 9.051 1.00 0.00 C ATOM 816 CZ PHE A 53 4.255 -5.403 10.060 1.00 0.00 C ATOM 0 H PHE A 53 2.041 -10.551 6.333 1.00 0.00 H new ATOM 0 HA PHE A 53 2.548 -9.972 9.033 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.803 -9.075 7.078 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.407 -8.117 6.626 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.688 -8.701 9.534 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.218 -5.939 7.432 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.443 -6.897 11.020 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.976 -4.133 8.913 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.586 -4.609 10.714 1.00 0.00 H new ATOM 826 N TYR A 54 -0.267 -8.835 7.829 1.00 0.00 N ATOM 827 CA TYR A 54 -1.529 -8.188 8.164 1.00 0.00 C ATOM 828 C TYR A 54 -2.420 -9.097 9.013 1.00 0.00 C ATOM 829 O TYR A 54 -2.753 -8.766 10.147 1.00 0.00 O ATOM 830 CB TYR A 54 -2.260 -7.784 6.876 1.00 0.00 C ATOM 831 CG TYR A 54 -3.708 -7.392 7.080 1.00 0.00 C ATOM 832 CD1 TYR A 54 -4.051 -6.308 7.878 1.00 0.00 C ATOM 833 CD2 TYR A 54 -4.731 -8.108 6.471 1.00 0.00 C ATOM 834 CE1 TYR A 54 -5.372 -5.950 8.064 1.00 0.00 C ATOM 835 CE2 TYR A 54 -6.055 -7.755 6.652 1.00 0.00 C ATOM 836 CZ TYR A 54 -6.370 -6.676 7.449 1.00 0.00 C ATOM 837 OH TYR A 54 -7.687 -6.322 7.631 1.00 0.00 O ATOM 0 H TYR A 54 -0.250 -9.270 6.906 1.00 0.00 H new ATOM 0 HA TYR A 54 -1.308 -7.299 8.754 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.730 -6.949 6.418 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -2.216 -8.614 6.171 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -3.272 -5.736 8.361 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.488 -8.954 5.846 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.622 -5.105 8.688 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.839 -8.322 6.171 1.00 0.00 H new ATOM 0 HH TYR A 54 -8.263 -6.935 7.128 1.00 0.00 H new ATOM 847 N ASP A 55 -2.817 -10.233 8.450 1.00 0.00 N ATOM 848 CA ASP A 55 -3.691 -11.173 9.148 1.00 0.00 C ATOM 849 C ASP A 55 -3.121 -11.611 10.498 1.00 0.00 C ATOM 850 O ASP A 55 -3.868 -12.004 11.394 1.00 0.00 O ATOM 851 CB ASP A 55 -3.942 -12.403 8.274 1.00 0.00 C ATOM 852 CG ASP A 55 -4.875 -12.109 7.114 1.00 0.00 C ATOM 853 OD1 ASP A 55 -5.036 -10.920 6.770 1.00 0.00 O ATOM 854 OD2 ASP A 55 -5.443 -13.068 6.552 1.00 0.00 O ATOM 0 H ASP A 55 -2.548 -10.527 7.511 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.629 -10.653 9.342 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -2.991 -12.771 7.888 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -4.367 -13.199 8.885 1.00 0.00 H new ATOM 859 N LYS A 56 -1.802 -11.574 10.631 1.00 0.00 N ATOM 860 CA LYS A 56 -1.148 -12.002 11.863 1.00 0.00 C ATOM 861 C LYS A 56 -1.355 -11.028 13.027 1.00 0.00 C ATOM 862 O LYS A 56 -1.356 -11.445 14.185 1.00 0.00 O ATOM 863 CB LYS A 56 0.348 -12.198 11.627 1.00 0.00 C ATOM 864 CG LYS A 56 0.689 -13.500 10.920 1.00 0.00 C ATOM 865 CD LYS A 56 0.817 -14.651 11.905 1.00 0.00 C ATOM 866 CE LYS A 56 2.271 -14.937 12.241 1.00 0.00 C ATOM 867 NZ LYS A 56 2.442 -15.352 13.660 1.00 0.00 N ATOM 0 H LYS A 56 -1.164 -11.253 9.903 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.615 -12.946 12.145 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.726 -11.364 11.036 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.865 -12.169 12.586 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.084 -13.731 10.187 1.00 0.00 H new ATOM 0 HG3 LYS A 56 1.624 -13.384 10.371 1.00 0.00 H new ATOM 0 HD2 LYS A 56 0.272 -14.412 12.818 1.00 0.00 H new ATOM 0 HD3 LYS A 56 0.357 -15.545 11.484 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.647 -15.722 11.585 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.870 -14.047 12.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.448 -15.538 13.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 2.107 -14.593 14.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.891 -16.216 13.838 1.00 0.00 H new ATOM 881 N PHE A 57 -1.498 -9.736 12.738 1.00 0.00 N ATOM 882 CA PHE A 57 -1.663 -8.750 13.805 1.00 0.00 C ATOM 883 C PHE A 57 -2.742 -7.711 13.497 1.00 0.00 C ATOM 884 O PHE A 57 -2.940 -6.778 14.274 1.00 0.00 O ATOM 885 CB PHE A 57 -0.331 -8.046 14.072 1.00 0.00 C ATOM 886 CG PHE A 57 0.495 -8.710 15.137 1.00 0.00 C ATOM 887 CD1 PHE A 57 1.051 -9.961 14.921 1.00 0.00 C ATOM 888 CD2 PHE A 57 0.716 -8.083 16.353 1.00 0.00 C ATOM 889 CE1 PHE A 57 1.812 -10.575 15.899 1.00 0.00 C ATOM 890 CE2 PHE A 57 1.475 -8.692 17.334 1.00 0.00 C ATOM 891 CZ PHE A 57 2.023 -9.939 17.107 1.00 0.00 C ATOM 0 H PHE A 57 -1.503 -9.352 11.793 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.988 -9.295 14.691 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.244 -8.011 13.147 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.527 -7.015 14.365 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.888 -10.462 13.978 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.290 -7.107 16.536 1.00 0.00 H new ATOM 0 HE1 PHE A 57 2.240 -11.550 15.719 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.640 -8.193 18.278 1.00 0.00 H new ATOM 0 HZ PHE A 57 2.616 -10.417 17.873 1.00 0.00 H new ATOM 901 N HIS A 58 -3.427 -7.852 12.367 1.00 0.00 N ATOM 902 CA HIS A 58 -4.459 -6.893 11.991 1.00 0.00 C ATOM 903 C HIS A 58 -5.451 -6.658 13.129 1.00 0.00 C ATOM 904 O HIS A 58 -6.072 -5.598 13.211 1.00 0.00 O ATOM 905 CB HIS A 58 -5.211 -7.362 10.742 1.00 0.00 C ATOM 906 CG HIS A 58 -6.048 -8.587 10.961 1.00 0.00 C ATOM 907 ND1 HIS A 58 -5.532 -9.785 11.412 1.00 0.00 N ATOM 908 CD2 HIS A 58 -7.375 -8.795 10.786 1.00 0.00 C ATOM 909 CE1 HIS A 58 -6.504 -10.674 11.504 1.00 0.00 C ATOM 910 NE2 HIS A 58 -7.632 -10.099 11.131 1.00 0.00 N ATOM 0 H HIS A 58 -3.288 -8.613 11.702 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.956 -5.951 11.773 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.852 -6.554 10.391 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.490 -7.563 9.950 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -8.097 -8.070 10.440 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -6.395 -11.698 11.829 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -8.546 -10.550 11.103 1.00 0.00 H new ATOM 919 N GLU A 59 -5.601 -7.650 14.000 1.00 0.00 N ATOM 920 CA GLU A 59 -6.523 -7.544 15.124 1.00 0.00 C ATOM 921 C GLU A 59 -5.916 -6.740 16.271 1.00 0.00 C ATOM 922 O GLU A 59 -6.632 -6.087 17.030 1.00 0.00 O ATOM 923 CB GLU A 59 -6.919 -8.936 15.619 1.00 0.00 C ATOM 924 CG GLU A 59 -7.700 -9.745 14.597 1.00 0.00 C ATOM 925 CD GLU A 59 -8.514 -10.856 15.232 1.00 0.00 C ATOM 926 OE1 GLU A 59 -9.166 -10.598 16.265 1.00 0.00 O ATOM 927 OE2 GLU A 59 -8.501 -11.983 14.695 1.00 0.00 O ATOM 0 H GLU A 59 -5.097 -8.535 13.949 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.412 -7.019 14.774 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.018 -9.485 15.893 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -7.518 -8.834 16.524 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.366 -9.081 14.046 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -7.008 -10.175 13.873 1.00 0.00 H new ATOM 934 N SER A 60 -4.594 -6.795 16.397 1.00 0.00 N ATOM 935 CA SER A 60 -3.899 -6.075 17.459 1.00 0.00 C ATOM 936 C SER A 60 -3.431 -4.704 16.982 1.00 0.00 C ATOM 937 O SER A 60 -3.567 -3.709 17.695 1.00 0.00 O ATOM 938 CB SER A 60 -2.704 -6.890 17.957 1.00 0.00 C ATOM 939 OG SER A 60 -2.386 -6.561 19.298 1.00 0.00 O ATOM 0 H SER A 60 -3.983 -7.329 15.779 1.00 0.00 H new ATOM 0 HA SER A 60 -4.601 -5.929 18.280 1.00 0.00 H new ATOM 0 HB2 SER A 60 -2.930 -7.954 17.884 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.841 -6.703 17.319 1.00 0.00 H new ATOM 0 HG SER A 60 -1.620 -7.096 19.593 1.00 0.00 H new ATOM 945 N LYS A 61 -2.874 -4.658 15.777 1.00 0.00 N ATOM 946 CA LYS A 61 -2.379 -3.409 15.210 1.00 0.00 C ATOM 947 C LYS A 61 -3.507 -2.601 14.577 1.00 0.00 C ATOM 948 O LYS A 61 -3.436 -1.373 14.502 1.00 0.00 O ATOM 949 CB LYS A 61 -1.295 -3.696 14.171 1.00 0.00 C ATOM 950 CG LYS A 61 0.007 -4.207 14.771 1.00 0.00 C ATOM 951 CD LYS A 61 1.137 -4.207 13.751 1.00 0.00 C ATOM 952 CE LYS A 61 0.740 -4.973 12.465 1.00 0.00 C ATOM 953 NZ LYS A 61 1.831 -4.948 11.453 1.00 0.00 N ATOM 0 H LYS A 61 -2.754 -5.472 15.174 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.954 -2.818 16.021 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.671 -4.432 13.460 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.093 -2.784 13.609 1.00 0.00 H new ATOM 0 HG2 LYS A 61 0.285 -3.584 15.621 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -0.140 -5.218 15.151 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.400 -3.180 13.498 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.024 -4.664 14.189 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.499 -6.006 12.716 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.161 -4.530 12.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 1.466 -5.287 10.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.183 -3.975 11.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.608 -5.564 11.765 1.00 0.00 H new ATOM 967 N ASN A 62 -4.551 -3.292 14.127 1.00 0.00 N ATOM 968 CA ASN A 62 -5.697 -2.637 13.504 1.00 0.00 C ATOM 969 C ASN A 62 -5.262 -1.630 12.439 1.00 0.00 C ATOM 970 O ASN A 62 -5.487 -0.427 12.577 1.00 0.00 O ATOM 971 CB ASN A 62 -6.539 -1.942 14.573 1.00 0.00 C ATOM 972 CG ASN A 62 -7.999 -1.832 14.180 1.00 0.00 C ATOM 973 OD1 ASN A 62 -8.662 -2.835 13.920 1.00 0.00 O ATOM 974 ND2 ASN A 62 -8.507 -0.605 14.134 1.00 0.00 N ATOM 0 H ASN A 62 -4.627 -4.308 14.183 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.294 -3.403 13.009 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -6.459 -2.493 15.510 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.139 -0.945 14.755 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -9.484 -0.467 13.875 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.920 0.199 14.358 1.00 0.00 H new ATOM 981 N PHE A 63 -4.647 -2.133 11.372 1.00 0.00 N ATOM 982 CA PHE A 63 -4.188 -1.284 10.276 1.00 0.00 C ATOM 983 C PHE A 63 -4.660 -1.846 8.938 1.00 0.00 C ATOM 984 O PHE A 63 -5.179 -2.959 8.876 1.00 0.00 O ATOM 985 CB PHE A 63 -2.661 -1.158 10.285 1.00 0.00 C ATOM 986 CG PHE A 63 -2.107 -0.562 11.550 1.00 0.00 C ATOM 987 CD1 PHE A 63 -2.808 0.415 12.241 1.00 0.00 C ATOM 988 CD2 PHE A 63 -0.883 -0.979 12.046 1.00 0.00 C ATOM 989 CE1 PHE A 63 -2.298 0.964 13.403 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.369 -0.435 13.208 1.00 0.00 C ATOM 991 CZ PHE A 63 -1.076 0.537 13.887 1.00 0.00 C ATOM 0 H PHE A 63 -4.455 -3.126 11.243 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.615 -0.291 10.414 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -2.224 -2.146 10.138 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -2.352 -0.544 9.439 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.764 0.751 11.867 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.324 -1.738 11.519 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -2.853 1.725 13.931 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.586 -0.770 13.585 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.675 0.963 14.795 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.482 -1.075 7.870 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.888 -1.497 6.552 1.00 0.00 C ATOM 1003 C GLU A 64 -3.757 -1.285 5.562 1.00 0.00 C ATOM 1004 O GLU A 64 -2.792 -0.569 5.833 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.133 -0.727 6.106 1.00 0.00 C ATOM 1006 CG GLU A 64 -6.788 -1.297 4.857 1.00 0.00 C ATOM 1007 CD GLU A 64 -7.075 -2.781 4.973 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -7.676 -3.192 5.988 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -6.699 -3.532 4.049 1.00 0.00 O ATOM 0 H GLU A 64 -4.055 -0.149 7.902 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.130 -2.559 6.586 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.860 -0.726 6.919 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.860 0.312 5.921 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.720 -0.765 4.665 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -6.139 -1.123 3.999 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.892 -1.920 4.423 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.898 -1.837 3.359 1.00 0.00 C ATOM 1018 C VAL A 65 -3.566 -1.652 2.002 1.00 0.00 C ATOM 1019 O VAL A 65 -4.474 -2.395 1.640 1.00 0.00 O ATOM 1020 CB VAL A 65 -2.016 -3.107 3.329 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -1.158 -3.167 2.065 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.147 -3.173 4.578 1.00 0.00 C ATOM 0 H VAL A 65 -4.692 -2.512 4.199 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.269 -0.971 3.565 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.676 -3.975 3.314 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.552 -4.073 2.079 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.804 -3.176 1.187 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.506 -2.295 2.026 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.531 -4.071 4.545 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.505 -2.294 4.621 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.783 -3.201 5.463 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.105 -0.660 1.251 1.00 0.00 N ATOM 1033 CA VAL A 66 -3.653 -0.391 -0.070 1.00 0.00 C ATOM 1034 C VAL A 66 -2.655 -0.803 -1.151 1.00 0.00 C ATOM 1035 O VAL A 66 -1.451 -0.607 -0.991 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.005 1.098 -0.245 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -4.711 1.328 -1.572 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.860 1.584 0.915 1.00 0.00 C ATOM 0 H VAL A 66 -2.354 -0.030 1.534 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.568 -0.976 -0.169 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.079 1.673 -0.249 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.952 2.386 -1.678 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.058 1.021 -2.389 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.630 0.742 -1.602 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.099 2.638 0.774 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.783 1.005 0.955 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.312 1.458 1.849 1.00 0.00 H new ATOM 1048 N PHE A 67 -3.147 -1.380 -2.244 1.00 0.00 N ATOM 1049 CA PHE A 67 -2.266 -1.812 -3.322 1.00 0.00 C ATOM 1050 C PHE A 67 -2.258 -0.813 -4.474 1.00 0.00 C ATOM 1051 O PHE A 67 -3.230 -0.705 -5.222 1.00 0.00 O ATOM 1052 CB PHE A 67 -2.674 -3.196 -3.827 1.00 0.00 C ATOM 1053 CG PHE A 67 -2.233 -3.494 -5.235 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -0.986 -4.046 -5.481 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -3.064 -3.219 -6.309 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -0.577 -4.320 -6.772 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -2.660 -3.489 -7.603 1.00 0.00 C ATOM 1058 CZ PHE A 67 -1.414 -4.040 -7.835 1.00 0.00 C ATOM 0 H PHE A 67 -4.139 -1.557 -2.405 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.255 -1.866 -2.918 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -2.257 -3.951 -3.160 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.759 -3.285 -3.771 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -0.326 -4.265 -4.654 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -4.039 -2.789 -6.133 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.396 -4.753 -6.950 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -3.317 -3.270 -8.432 1.00 0.00 H new ATOM 0 HZ PHE A 67 -1.095 -4.251 -8.845 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.147 -0.105 -4.626 1.00 0.00 N ATOM 1069 CA CYS A 68 -1.005 0.859 -5.706 1.00 0.00 C ATOM 1070 C CYS A 68 -0.608 0.131 -6.982 1.00 0.00 C ATOM 1071 O CYS A 68 0.340 -0.655 -6.986 1.00 0.00 O ATOM 1072 CB CYS A 68 0.040 1.920 -5.351 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.666 3.497 -4.817 1.00 0.00 S ATOM 0 H CYS A 68 -0.333 -0.181 -4.016 1.00 0.00 H new ATOM 0 HA CYS A 68 -1.959 1.364 -5.859 1.00 0.00 H new ATOM 0 HB2 CYS A 68 0.681 1.533 -4.558 1.00 0.00 H new ATOM 0 HB3 CYS A 68 0.676 2.094 -6.219 1.00 0.00 H new ATOM 0 HG CYS A 68 0.280 4.382 -4.710 1.00 0.00 H new ATOM 1079 N THR A 69 -1.345 0.367 -8.058 1.00 0.00 N ATOM 1080 CA THR A 69 -1.060 -0.299 -9.319 1.00 0.00 C ATOM 1081 C THR A 69 -0.260 0.591 -10.266 1.00 0.00 C ATOM 1082 O THR A 69 -0.248 1.814 -10.134 1.00 0.00 O ATOM 1083 CB THR A 69 -2.363 -0.751 -9.987 1.00 0.00 C ATOM 1084 OG1 THR A 69 -2.104 -1.730 -10.978 1.00 0.00 O ATOM 1085 CG2 THR A 69 -3.126 0.375 -10.649 1.00 0.00 C ATOM 0 H THR A 69 -2.137 1.009 -8.083 1.00 0.00 H new ATOM 0 HA THR A 69 -0.448 -1.173 -9.097 1.00 0.00 H new ATOM 0 HB THR A 69 -2.973 -1.153 -9.178 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.474 -1.433 -11.836 1.00 0.00 H new ATOM 0 HG21 THR A 69 -4.037 -0.019 -11.101 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.386 1.126 -9.903 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.506 0.830 -11.421 1.00 0.00 H new ATOM 1093 N TRP A 70 0.394 -0.046 -11.223 1.00 0.00 N ATOM 1094 CA TRP A 70 1.199 0.654 -12.221 1.00 0.00 C ATOM 1095 C TRP A 70 1.037 -0.010 -13.586 1.00 0.00 C ATOM 1096 O TRP A 70 1.989 -0.120 -14.358 1.00 0.00 O ATOM 1097 CB TRP A 70 2.674 0.657 -11.805 1.00 0.00 C ATOM 1098 CG TRP A 70 3.125 1.961 -11.223 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.297 2.253 -9.900 1.00 0.00 C ATOM 1100 CD2 TRP A 70 3.461 3.152 -11.944 1.00 0.00 C ATOM 1101 NE1 TRP A 70 3.720 3.552 -9.755 1.00 0.00 N ATOM 1102 CE2 TRP A 70 3.829 4.124 -10.996 1.00 0.00 C ATOM 1103 CE3 TRP A 70 3.489 3.490 -13.301 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 4.219 5.411 -11.360 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 3.876 4.767 -13.661 1.00 0.00 C ATOM 1106 CH2 TRP A 70 4.237 5.713 -12.695 1.00 0.00 C ATOM 0 H TRP A 70 0.385 -1.060 -11.333 1.00 0.00 H new ATOM 0 HA TRP A 70 0.854 1.686 -12.289 1.00 0.00 H new ATOM 0 HB2 TRP A 70 2.839 -0.135 -11.075 1.00 0.00 H new ATOM 0 HB3 TRP A 70 3.289 0.423 -12.674 1.00 0.00 H new ATOM 0 HD1 TRP A 70 3.126 1.563 -9.087 1.00 0.00 H new ATOM 0 HE1 TRP A 70 3.920 4.015 -8.869 1.00 0.00 H new ATOM 0 HE3 TRP A 70 3.213 2.766 -14.054 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 4.497 6.143 -10.616 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 3.900 5.040 -14.706 1.00 0.00 H new ATOM 0 HH2 TRP A 70 4.536 6.702 -13.009 1.00 0.00 H new ATOM 1117 N ASP A 71 -0.182 -0.459 -13.863 1.00 0.00 N ATOM 1118 CA ASP A 71 -0.501 -1.128 -15.115 1.00 0.00 C ATOM 1119 C ASP A 71 -0.716 -0.129 -16.247 1.00 0.00 C ATOM 1120 O ASP A 71 -0.824 1.076 -16.019 1.00 0.00 O ATOM 1121 CB ASP A 71 -1.761 -1.978 -14.934 1.00 0.00 C ATOM 1122 CG ASP A 71 -2.995 -1.135 -14.670 1.00 0.00 C ATOM 1123 OD1 ASP A 71 -3.227 -0.775 -13.496 1.00 0.00 O ATOM 1124 OD2 ASP A 71 -3.726 -0.834 -15.636 1.00 0.00 O ATOM 0 H ASP A 71 -0.974 -0.369 -13.227 1.00 0.00 H new ATOM 0 HA ASP A 71 0.344 -1.763 -15.383 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.921 -2.581 -15.828 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.613 -2.670 -14.105 1.00 0.00 H new ATOM 1129 N GLU A 72 -0.792 -0.648 -17.468 1.00 0.00 N ATOM 1130 CA GLU A 72 -1.013 0.181 -18.645 1.00 0.00 C ATOM 1131 C GLU A 72 -2.432 -0.014 -19.168 1.00 0.00 C ATOM 1132 O GLU A 72 -3.045 0.912 -19.698 1.00 0.00 O ATOM 1133 CB GLU A 72 0.001 -0.162 -19.739 1.00 0.00 C ATOM 1134 CG GLU A 72 1.425 -0.306 -19.225 1.00 0.00 C ATOM 1135 CD GLU A 72 1.998 1.006 -18.727 1.00 0.00 C ATOM 1136 OE1 GLU A 72 1.525 1.503 -17.684 1.00 0.00 O ATOM 1137 OE2 GLU A 72 2.923 1.536 -19.379 1.00 0.00 O ATOM 0 H GLU A 72 -0.703 -1.644 -17.668 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.881 1.225 -18.362 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -0.298 -1.093 -20.221 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -0.024 0.615 -20.503 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.444 -1.037 -18.417 1.00 0.00 H new ATOM 0 HG3 GLU A 72 2.058 -0.696 -20.022 1.00 0.00 H new ATOM 1144 N GLU A 73 -2.948 -1.230 -19.004 1.00 0.00 N ATOM 1145 CA GLU A 73 -4.297 -1.560 -19.446 1.00 0.00 C ATOM 1146 C GLU A 73 -5.131 -2.079 -18.278 1.00 0.00 C ATOM 1147 O GLU A 73 -4.590 -2.504 -17.257 1.00 0.00 O ATOM 1148 CB GLU A 73 -4.248 -2.606 -20.561 1.00 0.00 C ATOM 1149 CG GLU A 73 -5.239 -2.345 -21.684 1.00 0.00 C ATOM 1150 CD GLU A 73 -5.076 -0.969 -22.298 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -4.249 -0.825 -23.224 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -5.773 -0.033 -21.851 1.00 0.00 O ATOM 0 H GLU A 73 -2.449 -2.004 -18.566 1.00 0.00 H new ATOM 0 HA GLU A 73 -4.764 -0.654 -19.832 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -3.241 -2.635 -20.976 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -4.446 -3.589 -20.134 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.112 -3.102 -22.458 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -6.254 -2.449 -21.300 1.00 0.00 H new ATOM 1159 N GLU A 74 -6.450 -2.039 -18.431 1.00 0.00 N ATOM 1160 CA GLU A 74 -7.355 -2.502 -17.384 1.00 0.00 C ATOM 1161 C GLU A 74 -7.350 -4.026 -17.281 1.00 0.00 C ATOM 1162 O GLU A 74 -7.641 -4.584 -16.224 1.00 0.00 O ATOM 1163 CB GLU A 74 -8.777 -2.005 -17.655 1.00 0.00 C ATOM 1164 CG GLU A 74 -8.849 -0.524 -17.990 1.00 0.00 C ATOM 1165 CD GLU A 74 -9.775 -0.234 -19.154 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -10.649 -1.079 -19.443 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -9.628 0.839 -19.778 1.00 0.00 O ATOM 0 H GLU A 74 -6.917 -1.691 -19.269 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.005 -2.094 -16.436 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.202 -2.577 -18.480 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.395 -2.202 -16.779 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.190 0.027 -17.113 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.849 -0.160 -18.226 1.00 0.00 H new ATOM 1174 N ASP A 75 -7.023 -4.692 -18.384 1.00 0.00 N ATOM 1175 CA ASP A 75 -6.988 -6.150 -18.416 1.00 0.00 C ATOM 1176 C ASP A 75 -6.013 -6.707 -17.382 1.00 0.00 C ATOM 1177 O ASP A 75 -6.314 -7.684 -16.696 1.00 0.00 O ATOM 1178 CB ASP A 75 -6.600 -6.639 -19.812 1.00 0.00 C ATOM 1179 CG ASP A 75 -6.654 -8.149 -19.932 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -5.789 -8.824 -19.335 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -7.562 -8.658 -20.623 1.00 0.00 O ATOM 0 H ASP A 75 -6.778 -4.245 -19.268 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.986 -6.512 -18.170 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -7.270 -6.195 -20.549 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -5.593 -6.294 -20.048 1.00 0.00 H new ATOM 1186 N GLY A 76 -4.843 -6.087 -17.279 1.00 0.00 N ATOM 1187 CA GLY A 76 -3.842 -6.543 -16.331 1.00 0.00 C ATOM 1188 C GLY A 76 -4.248 -6.312 -14.888 1.00 0.00 C ATOM 1189 O GLY A 76 -4.283 -7.247 -14.088 1.00 0.00 O ATOM 0 H GLY A 76 -4.569 -5.277 -17.835 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -3.660 -7.606 -16.486 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.902 -6.027 -16.526 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.551 -5.061 -14.553 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.953 -4.704 -13.196 1.00 0.00 C ATOM 1195 C PHE A 77 -6.105 -5.583 -12.710 1.00 0.00 C ATOM 1196 O PHE A 77 -6.247 -5.828 -11.513 1.00 0.00 O ATOM 1197 CB PHE A 77 -5.358 -3.227 -13.142 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.942 -2.802 -11.823 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -5.162 -2.775 -10.679 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -7.273 -2.426 -11.730 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -5.697 -2.382 -9.467 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -7.814 -2.033 -10.521 1.00 0.00 C ATOM 1203 CZ PHE A 77 -7.025 -2.011 -9.388 1.00 0.00 C ATOM 0 H PHE A 77 -4.526 -4.276 -15.204 1.00 0.00 H new ATOM 0 HA PHE A 77 -4.102 -4.869 -12.535 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.483 -2.613 -13.355 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -6.085 -3.031 -13.930 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -4.123 -3.065 -10.735 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -7.894 -2.440 -12.613 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -5.077 -2.365 -8.583 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -8.853 -1.743 -10.462 1.00 0.00 H new ATOM 0 HZ PHE A 77 -7.446 -1.704 -8.442 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.925 -6.049 -13.645 1.00 0.00 N ATOM 1214 CA ALA A 78 -8.068 -6.894 -13.313 1.00 0.00 C ATOM 1215 C ALA A 78 -7.635 -8.294 -12.929 1.00 0.00 C ATOM 1216 O ALA A 78 -7.966 -8.789 -11.852 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.977 -6.990 -14.500 1.00 0.00 C ATOM 0 H ALA A 78 -6.820 -5.856 -14.641 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.580 -6.441 -12.464 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.831 -7.621 -14.254 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -9.327 -5.994 -14.771 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.435 -7.425 -15.339 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.856 -8.917 -13.807 1.00 0.00 N ATOM 1224 CA GLY A 79 -6.352 -10.240 -13.527 1.00 0.00 C ATOM 1225 C GLY A 79 -5.516 -10.217 -12.276 1.00 0.00 C ATOM 1226 O GLY A 79 -5.190 -11.257 -11.703 1.00 0.00 O ATOM 0 H GLY A 79 -6.568 -8.527 -14.704 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.182 -10.937 -13.407 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.755 -10.596 -14.367 1.00 0.00 H new ATOM 1230 N TYR A 80 -5.161 -9.003 -11.864 1.00 0.00 N ATOM 1231 CA TYR A 80 -4.339 -8.813 -10.672 1.00 0.00 C ATOM 1232 C TYR A 80 -5.185 -8.455 -9.449 1.00 0.00 C ATOM 1233 O TYR A 80 -4.814 -8.775 -8.320 1.00 0.00 O ATOM 1234 CB TYR A 80 -3.286 -7.728 -10.916 1.00 0.00 C ATOM 1235 CG TYR A 80 -2.275 -7.605 -9.798 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -2.642 -7.105 -8.554 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -0.954 -7.993 -9.986 1.00 0.00 C ATOM 1238 CE1 TYR A 80 -1.721 -6.994 -7.531 1.00 0.00 C ATOM 1239 CE2 TYR A 80 -0.027 -7.884 -8.967 1.00 0.00 C ATOM 1240 CZ TYR A 80 -0.415 -7.384 -7.741 1.00 0.00 C ATOM 1241 OH TYR A 80 0.505 -7.275 -6.724 1.00 0.00 O ATOM 0 H TYR A 80 -5.428 -8.139 -12.336 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.840 -9.760 -10.467 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.762 -7.945 -11.847 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.788 -6.769 -11.048 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -3.664 -6.798 -8.385 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -0.647 -8.386 -10.944 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -2.022 -6.603 -6.570 1.00 0.00 H new ATOM 0 HE2 TYR A 80 0.996 -8.189 -9.129 1.00 0.00 H new ATOM 0 HH TYR A 80 0.319 -6.469 -6.199 1.00 0.00 H new ATOM 1251 N PHE A 81 -6.314 -7.787 -9.672 1.00 0.00 N ATOM 1252 CA PHE A 81 -7.191 -7.392 -8.567 1.00 0.00 C ATOM 1253 C PHE A 81 -8.052 -8.565 -8.091 1.00 0.00 C ATOM 1254 O PHE A 81 -8.540 -8.565 -6.961 1.00 0.00 O ATOM 1255 CB PHE A 81 -8.074 -6.192 -8.965 1.00 0.00 C ATOM 1256 CG PHE A 81 -9.546 -6.499 -9.055 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -10.073 -7.118 -10.178 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -10.400 -6.168 -8.016 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -11.424 -7.400 -10.261 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -11.752 -6.447 -8.093 1.00 0.00 C ATOM 1261 CZ PHE A 81 -12.263 -7.064 -9.218 1.00 0.00 C ATOM 0 H PHE A 81 -6.643 -7.509 -10.597 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.555 -7.087 -7.736 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -7.927 -5.393 -8.239 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.736 -5.813 -9.929 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.421 -7.383 -10.997 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -10.005 -5.686 -7.134 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.822 -7.883 -11.141 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -12.407 -6.183 -7.276 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.319 -7.283 -9.281 1.00 0.00 H new ATOM 1271 N ALA A 82 -8.241 -9.558 -8.956 1.00 0.00 N ATOM 1272 CA ALA A 82 -9.049 -10.727 -8.618 1.00 0.00 C ATOM 1273 C ALA A 82 -8.679 -11.288 -7.247 1.00 0.00 C ATOM 1274 O ALA A 82 -9.549 -11.695 -6.476 1.00 0.00 O ATOM 1275 CB ALA A 82 -8.894 -11.800 -9.686 1.00 0.00 C ATOM 0 H ALA A 82 -7.846 -9.577 -9.896 1.00 0.00 H new ATOM 0 HA ALA A 82 -10.091 -10.411 -8.577 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -9.501 -12.666 -9.422 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.222 -11.406 -10.648 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.848 -12.098 -9.754 1.00 0.00 H new ATOM 1281 N LYS A 83 -7.385 -11.309 -6.952 1.00 0.00 N ATOM 1282 CA LYS A 83 -6.895 -11.821 -5.678 1.00 0.00 C ATOM 1283 C LYS A 83 -6.735 -10.684 -4.661 1.00 0.00 C ATOM 1284 O LYS A 83 -7.501 -9.723 -4.685 1.00 0.00 O ATOM 1285 CB LYS A 83 -5.569 -12.557 -5.898 1.00 0.00 C ATOM 1286 CG LYS A 83 -4.407 -11.636 -6.238 1.00 0.00 C ATOM 1287 CD LYS A 83 -3.423 -12.309 -7.182 1.00 0.00 C ATOM 1288 CE LYS A 83 -2.164 -11.476 -7.361 1.00 0.00 C ATOM 1289 NZ LYS A 83 -2.254 -10.582 -8.548 1.00 0.00 N ATOM 0 H LYS A 83 -6.654 -10.976 -7.580 1.00 0.00 H new ATOM 0 HA LYS A 83 -7.622 -12.524 -5.271 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -5.323 -13.121 -4.998 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -5.695 -13.281 -6.703 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -4.787 -10.723 -6.696 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.893 -11.343 -5.322 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -3.158 -13.292 -6.793 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -3.897 -12.467 -8.151 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.995 -10.876 -6.467 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.304 -12.137 -7.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.422 -9.959 -8.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.287 -11.157 -9.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -3.116 -10.004 -8.483 1.00 0.00 H new ATOM 1303 N MET A 84 -5.729 -10.795 -3.785 1.00 0.00 N ATOM 1304 CA MET A 84 -5.439 -9.787 -2.768 1.00 0.00 C ATOM 1305 C MET A 84 -6.698 -9.136 -2.179 1.00 0.00 C ATOM 1306 O MET A 84 -7.386 -8.366 -2.848 1.00 0.00 O ATOM 1307 CB MET A 84 -4.505 -8.723 -3.339 1.00 0.00 C ATOM 1308 CG MET A 84 -4.716 -8.406 -4.815 1.00 0.00 C ATOM 1309 SD MET A 84 -6.048 -7.223 -5.098 1.00 0.00 S ATOM 1310 CE MET A 84 -5.126 -5.813 -5.703 1.00 0.00 C ATOM 0 H MET A 84 -5.093 -11.592 -3.765 1.00 0.00 H new ATOM 0 HA MET A 84 -4.950 -10.305 -1.943 1.00 0.00 H new ATOM 0 HB2 MET A 84 -4.630 -7.805 -2.764 1.00 0.00 H new ATOM 0 HB3 MET A 84 -3.475 -9.051 -3.197 1.00 0.00 H new ATOM 0 HG2 MET A 84 -3.790 -8.009 -5.232 1.00 0.00 H new ATOM 0 HG3 MET A 84 -4.937 -9.329 -5.351 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.691 -5.321 -6.495 1.00 0.00 H new ATOM 0 HE2 MET A 84 -4.959 -5.110 -4.887 1.00 0.00 H new ATOM 0 HE3 MET A 84 -4.166 -6.148 -6.096 1.00 0.00 H new ATOM 1320 N PRO A 85 -7.007 -9.427 -0.900 1.00 0.00 N ATOM 1321 CA PRO A 85 -8.177 -8.859 -0.222 1.00 0.00 C ATOM 1322 C PRO A 85 -7.993 -7.384 0.125 1.00 0.00 C ATOM 1323 O PRO A 85 -8.953 -6.614 0.123 1.00 0.00 O ATOM 1324 CB PRO A 85 -8.287 -9.699 1.050 1.00 0.00 C ATOM 1325 CG PRO A 85 -6.893 -10.140 1.330 1.00 0.00 C ATOM 1326 CD PRO A 85 -6.238 -10.323 -0.013 1.00 0.00 C ATOM 0 HA PRO A 85 -9.067 -8.890 -0.850 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -8.692 -9.115 1.877 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -8.951 -10.551 0.906 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -6.361 -9.398 1.926 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -6.885 -11.070 1.898 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -5.183 -10.050 0.015 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -6.291 -11.359 -0.347 1.00 0.00 H new ATOM 1334 N TRP A 86 -6.754 -6.993 0.423 1.00 0.00 N ATOM 1335 CA TRP A 86 -6.447 -5.605 0.771 1.00 0.00 C ATOM 1336 C TRP A 86 -7.087 -4.646 -0.228 1.00 0.00 C ATOM 1337 O TRP A 86 -7.496 -5.067 -1.309 1.00 0.00 O ATOM 1338 CB TRP A 86 -4.931 -5.393 0.818 1.00 0.00 C ATOM 1339 CG TRP A 86 -4.214 -5.692 -0.459 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -4.387 -5.069 -1.659 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -3.187 -6.671 -0.656 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -3.530 -5.598 -2.591 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -2.785 -6.585 -2.002 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -2.570 -7.610 0.174 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -1.793 -7.403 -2.536 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -1.585 -8.423 -0.357 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.204 -8.315 -1.701 1.00 0.00 C ATOM 0 H TRP A 86 -5.947 -7.617 0.431 1.00 0.00 H new ATOM 0 HA TRP A 86 -6.860 -5.397 1.758 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -4.732 -4.358 1.096 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -4.515 -6.020 1.607 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -5.095 -4.275 -1.848 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -3.459 -5.304 -3.565 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -2.857 -7.700 1.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.498 -7.321 -3.572 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -1.101 -9.153 0.275 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -0.431 -8.963 -2.086 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.203 -3.360 0.128 1.00 0.00 N ATOM 1359 CA LEU A 87 -7.825 -2.419 -0.768 1.00 0.00 C ATOM 1360 C LEU A 87 -6.845 -1.904 -1.814 1.00 0.00 C ATOM 1361 O LEU A 87 -5.653 -1.771 -1.556 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.415 -1.243 0.013 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.417 -1.618 1.106 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -9.086 -0.902 2.409 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -10.833 -1.291 0.659 1.00 0.00 C ATOM 0 H LEU A 87 -6.878 -2.969 1.012 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.626 -2.946 -1.286 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.597 -0.685 0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.906 -0.571 -0.691 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.349 -2.691 1.283 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.811 -1.183 3.173 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.086 -1.186 2.736 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -9.124 0.176 2.252 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.535 -1.563 1.447 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.913 -0.223 0.455 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.068 -1.852 -0.246 1.00 0.00 H new ATOM 1377 N ALA A 88 -7.362 -1.634 -3.007 1.00 0.00 N ATOM 1378 CA ALA A 88 -6.544 -1.148 -4.106 1.00 0.00 C ATOM 1379 C ALA A 88 -7.254 -0.041 -4.874 1.00 0.00 C ATOM 1380 O ALA A 88 -8.431 -0.166 -5.214 1.00 0.00 O ATOM 1381 CB ALA A 88 -6.219 -2.300 -5.033 1.00 0.00 C ATOM 0 H ALA A 88 -8.350 -1.745 -3.236 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.623 -0.731 -3.698 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.606 -1.940 -5.859 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.674 -3.067 -4.483 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.144 -2.723 -5.425 1.00 0.00 H new ATOM 1387 N VAL A 89 -6.534 1.040 -5.153 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.106 2.159 -5.892 1.00 0.00 C ATOM 1389 C VAL A 89 -7.518 1.724 -7.297 1.00 0.00 C ATOM 1390 O VAL A 89 -6.681 1.286 -8.086 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.115 3.333 -6.005 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -6.777 4.533 -6.670 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -5.572 3.707 -4.634 1.00 0.00 C ATOM 0 H VAL A 89 -5.559 1.165 -4.880 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.982 2.491 -5.336 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.279 3.018 -6.629 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.060 5.351 -6.740 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.111 4.256 -7.670 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.634 4.851 -6.076 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.874 4.538 -4.734 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.396 4.001 -3.984 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.057 2.850 -4.201 1.00 0.00 H new ATOM 1403 N PRO A 90 -8.815 1.838 -7.636 1.00 0.00 N ATOM 1404 CA PRO A 90 -9.317 1.451 -8.958 1.00 0.00 C ATOM 1405 C PRO A 90 -8.690 2.281 -10.072 1.00 0.00 C ATOM 1406 O PRO A 90 -8.242 3.404 -9.845 1.00 0.00 O ATOM 1407 CB PRO A 90 -10.824 1.717 -8.872 1.00 0.00 C ATOM 1408 CG PRO A 90 -10.985 2.675 -7.742 1.00 0.00 C ATOM 1409 CD PRO A 90 -9.890 2.351 -6.769 1.00 0.00 C ATOM 0 HA PRO A 90 -9.075 0.415 -9.197 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.204 2.138 -9.803 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -11.377 0.796 -8.690 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -10.907 3.705 -8.089 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -11.965 2.569 -7.277 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.572 3.232 -6.211 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.207 1.608 -6.037 1.00 0.00 H new ATOM 1417 N PHE A 91 -8.664 1.723 -11.279 1.00 0.00 N ATOM 1418 CA PHE A 91 -8.092 2.414 -12.431 1.00 0.00 C ATOM 1419 C PHE A 91 -8.641 3.835 -12.543 1.00 0.00 C ATOM 1420 O PHE A 91 -7.979 4.726 -13.074 1.00 0.00 O ATOM 1421 CB PHE A 91 -8.387 1.639 -13.716 1.00 0.00 C ATOM 1422 CG PHE A 91 -7.725 2.220 -14.933 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -8.317 3.261 -15.629 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -6.510 1.726 -15.379 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -7.711 3.799 -16.749 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -5.899 2.259 -16.498 1.00 0.00 C ATOM 1427 CZ PHE A 91 -6.500 3.297 -17.184 1.00 0.00 C ATOM 0 H PHE A 91 -9.032 0.794 -11.485 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.013 2.471 -12.289 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -8.059 0.607 -13.592 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -9.465 1.614 -13.876 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -9.264 3.657 -15.293 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -6.035 0.915 -14.846 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -8.184 4.610 -17.283 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -4.952 1.864 -16.836 1.00 0.00 H new ATOM 0 HZ PHE A 91 -6.024 3.715 -18.059 1.00 0.00 H new ATOM 1437 N ALA A 92 -9.856 4.034 -12.041 1.00 0.00 N ATOM 1438 CA ALA A 92 -10.501 5.342 -12.086 1.00 0.00 C ATOM 1439 C ALA A 92 -9.600 6.441 -11.520 1.00 0.00 C ATOM 1440 O ALA A 92 -9.593 7.564 -12.024 1.00 0.00 O ATOM 1441 CB ALA A 92 -11.820 5.302 -11.329 1.00 0.00 C ATOM 0 H ALA A 92 -10.415 3.305 -11.598 1.00 0.00 H new ATOM 0 HA ALA A 92 -10.692 5.580 -13.132 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -12.292 6.283 -11.369 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -12.479 4.563 -11.785 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -11.635 5.031 -10.290 1.00 0.00 H new ATOM 1447 N GLN A 93 -8.844 6.120 -10.471 1.00 0.00 N ATOM 1448 CA GLN A 93 -7.953 7.096 -9.853 1.00 0.00 C ATOM 1449 C GLN A 93 -6.495 6.662 -9.966 1.00 0.00 C ATOM 1450 O GLN A 93 -5.663 7.036 -9.141 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.319 7.296 -8.382 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.814 7.406 -8.136 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.465 8.485 -8.978 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -9.827 9.471 -9.349 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -11.745 8.304 -9.287 1.00 0.00 N ATOM 0 H GLN A 93 -8.831 5.198 -10.035 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.074 8.039 -10.385 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -7.924 6.462 -7.802 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.832 8.199 -8.015 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.286 6.447 -8.352 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -9.990 7.617 -7.081 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.236 7.472 -8.959 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -12.236 8.997 -9.852 1.00 0.00 H new ATOM 1464 N SER A 94 -6.189 5.873 -10.991 1.00 0.00 N ATOM 1465 CA SER A 94 -4.826 5.400 -11.201 1.00 0.00 C ATOM 1466 C SER A 94 -3.873 6.574 -11.400 1.00 0.00 C ATOM 1467 O SER A 94 -2.684 6.478 -11.094 1.00 0.00 O ATOM 1468 CB SER A 94 -4.762 4.463 -12.407 1.00 0.00 C ATOM 1469 OG SER A 94 -5.193 5.119 -13.587 1.00 0.00 O ATOM 0 H SER A 94 -6.862 5.549 -11.685 1.00 0.00 H new ATOM 0 HA SER A 94 -4.519 4.849 -10.312 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.741 4.104 -12.539 1.00 0.00 H new ATOM 0 HB3 SER A 94 -5.386 3.588 -12.225 1.00 0.00 H new ATOM 0 HG SER A 94 -6.172 5.106 -13.630 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.403 7.684 -11.908 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.598 8.879 -12.138 1.00 0.00 C ATOM 1477 C GLU A 95 -2.879 9.292 -10.858 1.00 0.00 C ATOM 1478 O GLU A 95 -1.755 9.792 -10.896 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.477 10.026 -12.638 1.00 0.00 C ATOM 1480 CG GLU A 95 -3.707 11.305 -12.922 1.00 0.00 C ATOM 1481 CD GLU A 95 -4.600 12.529 -12.952 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -4.908 13.066 -11.868 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -4.990 12.952 -14.061 1.00 0.00 O ATOM 0 H GLU A 95 -5.385 7.780 -12.168 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.853 8.649 -12.900 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.989 9.711 -13.547 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.247 10.233 -11.895 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.939 11.439 -12.160 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.194 11.211 -13.879 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.536 9.066 -9.725 1.00 0.00 N ATOM 1491 CA ALA A 96 -2.964 9.399 -8.429 1.00 0.00 C ATOM 1492 C ALA A 96 -1.710 8.585 -8.169 1.00 0.00 C ATOM 1493 O ALA A 96 -0.730 9.084 -7.627 1.00 0.00 O ATOM 1494 CB ALA A 96 -3.968 9.135 -7.322 1.00 0.00 C ATOM 0 H ALA A 96 -4.467 8.652 -9.680 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.707 10.458 -8.440 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.524 9.389 -6.360 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.857 9.745 -7.484 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.245 8.081 -7.326 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.763 7.320 -8.553 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.648 6.410 -8.358 1.00 0.00 C ATOM 1502 C VAL A 97 0.616 6.921 -9.036 1.00 0.00 C ATOM 1503 O VAL A 97 1.727 6.723 -8.544 1.00 0.00 O ATOM 1504 CB VAL A 97 -0.998 5.016 -8.884 1.00 0.00 C ATOM 1505 CG1 VAL A 97 0.200 4.087 -8.786 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.186 4.476 -8.109 1.00 0.00 C ATOM 0 H VAL A 97 -2.574 6.898 -9.005 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.455 6.350 -7.287 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.267 5.081 -9.938 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.072 3.102 -9.165 1.00 0.00 H new ATOM 0 HG12 VAL A 97 1.022 4.490 -9.378 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.510 4.002 -7.745 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.441 3.483 -8.479 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.933 4.415 -7.051 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.039 5.142 -8.240 1.00 0.00 H new ATOM 1516 N GLN A 98 0.429 7.580 -10.165 1.00 0.00 N ATOM 1517 CA GLN A 98 1.544 8.131 -10.927 1.00 0.00 C ATOM 1518 C GLN A 98 2.142 9.347 -10.223 1.00 0.00 C ATOM 1519 O GLN A 98 3.362 9.483 -10.128 1.00 0.00 O ATOM 1520 CB GLN A 98 1.085 8.517 -12.335 1.00 0.00 C ATOM 1521 CG GLN A 98 0.275 7.434 -13.028 1.00 0.00 C ATOM 1522 CD GLN A 98 0.657 7.263 -14.486 1.00 0.00 C ATOM 1523 OE1 GLN A 98 0.555 8.198 -15.280 1.00 0.00 O ATOM 1524 NE2 GLN A 98 1.099 6.065 -14.845 1.00 0.00 N ATOM 0 H GLN A 98 -0.488 7.749 -10.579 1.00 0.00 H new ATOM 0 HA GLN A 98 2.314 7.363 -11.000 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.486 9.426 -12.277 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.960 8.750 -12.942 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.418 6.488 -12.505 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.785 7.679 -12.960 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.167 5.318 -14.153 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.370 5.890 -15.813 1.00 0.00 H new ATOM 1533 N LYS A 99 1.277 10.229 -9.734 1.00 0.00 N ATOM 1534 CA LYS A 99 1.721 11.435 -9.041 1.00 0.00 C ATOM 1535 C LYS A 99 2.118 11.125 -7.600 1.00 0.00 C ATOM 1536 O LYS A 99 3.058 11.711 -7.065 1.00 0.00 O ATOM 1537 CB LYS A 99 0.617 12.495 -9.060 1.00 0.00 C ATOM 1538 CG LYS A 99 0.394 13.117 -10.429 1.00 0.00 C ATOM 1539 CD LYS A 99 1.447 14.167 -10.744 1.00 0.00 C ATOM 1540 CE LYS A 99 0.942 15.569 -10.449 1.00 0.00 C ATOM 1541 NZ LYS A 99 0.323 15.665 -9.098 1.00 0.00 N ATOM 0 H LYS A 99 0.264 10.132 -9.804 1.00 0.00 H new ATOM 0 HA LYS A 99 2.597 11.820 -9.564 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -0.315 12.043 -8.719 1.00 0.00 H new ATOM 0 HB3 LYS A 99 0.868 13.282 -8.349 1.00 0.00 H new ATOM 0 HG2 LYS A 99 0.416 12.338 -11.191 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.596 13.571 -10.466 1.00 0.00 H new ATOM 0 HD2 LYS A 99 2.344 13.971 -10.157 1.00 0.00 H new ATOM 0 HD3 LYS A 99 1.731 14.095 -11.794 1.00 0.00 H new ATOM 0 HE2 LYS A 99 1.769 16.275 -10.520 1.00 0.00 H new ATOM 0 HE3 LYS A 99 0.211 15.858 -11.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 0.084 16.657 -8.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -0.542 15.088 -9.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 0.994 15.318 -8.383 1.00 0.00 H new ATOM 1555 N LEU A 100 1.394 10.198 -6.980 1.00 0.00 N ATOM 1556 CA LEU A 100 1.672 9.805 -5.594 1.00 0.00 C ATOM 1557 C LEU A 100 3.143 9.438 -5.418 1.00 0.00 C ATOM 1558 O LEU A 100 3.786 9.851 -4.453 1.00 0.00 O ATOM 1559 CB LEU A 100 0.799 8.613 -5.188 1.00 0.00 C ATOM 1560 CG LEU A 100 0.755 8.286 -3.697 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.507 9.542 -2.876 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.324 7.241 -3.428 1.00 0.00 C ATOM 0 H LEU A 100 0.612 9.704 -7.410 1.00 0.00 H new ATOM 0 HA LEU A 100 1.440 10.656 -4.954 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.219 8.803 -5.527 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.154 7.731 -5.722 1.00 0.00 H new ATOM 0 HG LEU A 100 1.721 7.878 -3.398 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.480 9.285 -1.817 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.309 10.258 -3.055 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.446 9.984 -3.167 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.351 7.012 -2.363 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.293 7.630 -3.740 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.100 6.334 -3.989 1.00 0.00 H new ATOM 1574 N SER A 101 3.667 8.657 -6.359 1.00 0.00 N ATOM 1575 CA SER A 101 5.060 8.227 -6.313 1.00 0.00 C ATOM 1576 C SER A 101 6.000 9.426 -6.244 1.00 0.00 C ATOM 1577 O SER A 101 7.052 9.366 -5.607 1.00 0.00 O ATOM 1578 CB SER A 101 5.393 7.375 -7.540 1.00 0.00 C ATOM 1579 OG SER A 101 4.848 7.943 -8.718 1.00 0.00 O ATOM 0 H SER A 101 3.146 8.309 -7.164 1.00 0.00 H new ATOM 0 HA SER A 101 5.198 7.628 -5.413 1.00 0.00 H new ATOM 0 HB2 SER A 101 6.475 7.286 -7.642 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.002 6.367 -7.404 1.00 0.00 H new ATOM 0 HG SER A 101 4.516 8.844 -8.523 1.00 0.00 H new ATOM 1585 N LYS A 102 5.613 10.515 -6.900 1.00 0.00 N ATOM 1586 CA LYS A 102 6.422 11.728 -6.910 1.00 0.00 C ATOM 1587 C LYS A 102 6.697 12.210 -5.489 1.00 0.00 C ATOM 1588 O LYS A 102 7.730 12.824 -5.219 1.00 0.00 O ATOM 1589 CB LYS A 102 5.718 12.828 -7.707 1.00 0.00 C ATOM 1590 CG LYS A 102 6.663 13.669 -8.552 1.00 0.00 C ATOM 1591 CD LYS A 102 7.765 14.288 -7.708 1.00 0.00 C ATOM 1592 CE LYS A 102 8.674 15.174 -8.542 1.00 0.00 C ATOM 1593 NZ LYS A 102 9.451 14.390 -9.541 1.00 0.00 N ATOM 0 H LYS A 102 4.745 10.582 -7.431 1.00 0.00 H new ATOM 0 HA LYS A 102 7.375 11.496 -7.386 1.00 0.00 H new ATOM 0 HB2 LYS A 102 4.971 12.372 -8.357 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.184 13.480 -7.016 1.00 0.00 H new ATOM 0 HG2 LYS A 102 7.105 13.049 -9.331 1.00 0.00 H new ATOM 0 HG3 LYS A 102 6.101 14.457 -9.053 1.00 0.00 H new ATOM 0 HD2 LYS A 102 7.322 14.875 -6.903 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.354 13.499 -7.241 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.075 15.926 -9.057 1.00 0.00 H new ATOM 0 HE3 LYS A 102 9.361 15.708 -7.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 10.166 15.002 -9.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 9.923 13.594 -9.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 8.808 14.025 -10.272 1.00 0.00 H new ATOM 1607 N HIS A 103 5.766 11.925 -4.584 1.00 0.00 N ATOM 1608 CA HIS A 103 5.905 12.327 -3.191 1.00 0.00 C ATOM 1609 C HIS A 103 6.847 11.387 -2.443 1.00 0.00 C ATOM 1610 O HIS A 103 7.520 11.793 -1.495 1.00 0.00 O ATOM 1611 CB HIS A 103 4.538 12.347 -2.505 1.00 0.00 C ATOM 1612 CG HIS A 103 3.584 13.334 -3.103 1.00 0.00 C ATOM 1613 ND1 HIS A 103 3.037 13.185 -4.361 1.00 0.00 N ATOM 1614 CD2 HIS A 103 3.078 14.489 -2.610 1.00 0.00 C ATOM 1615 CE1 HIS A 103 2.238 14.206 -4.615 1.00 0.00 C ATOM 1616 NE2 HIS A 103 2.244 15.011 -3.567 1.00 0.00 N ATOM 0 H HIS A 103 4.907 11.416 -4.792 1.00 0.00 H new ATOM 0 HA HIS A 103 6.330 13.331 -3.171 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.099 11.351 -2.559 1.00 0.00 H new ATOM 0 HB3 HIS A 103 4.674 12.579 -1.449 1.00 0.00 H new ATOM 0 HD1 HIS A 103 3.221 12.408 -4.996 1.00 0.00 H new ATOM 0 HD2 HIS A 103 3.291 14.920 -1.643 1.00 0.00 H new ATOM 0 HE1 HIS A 103 1.676 14.357 -5.525 1.00 0.00 H new ATOM 1625 N PHE A 104 6.893 10.131 -2.875 1.00 0.00 N ATOM 1626 CA PHE A 104 7.755 9.137 -2.243 1.00 0.00 C ATOM 1627 C PHE A 104 9.028 8.904 -3.056 1.00 0.00 C ATOM 1628 O PHE A 104 9.858 8.071 -2.694 1.00 0.00 O ATOM 1629 CB PHE A 104 7.002 7.817 -2.069 1.00 0.00 C ATOM 1630 CG PHE A 104 5.619 7.979 -1.505 1.00 0.00 C ATOM 1631 CD1 PHE A 104 5.378 8.868 -0.468 1.00 0.00 C ATOM 1632 CD2 PHE A 104 4.559 7.242 -2.010 1.00 0.00 C ATOM 1633 CE1 PHE A 104 4.107 9.017 0.054 1.00 0.00 C ATOM 1634 CE2 PHE A 104 3.286 7.389 -1.494 1.00 0.00 C ATOM 1635 CZ PHE A 104 3.060 8.277 -0.461 1.00 0.00 C ATOM 0 H PHE A 104 6.345 9.777 -3.659 1.00 0.00 H new ATOM 0 HA PHE A 104 8.042 9.521 -1.264 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.934 7.318 -3.036 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.578 7.164 -1.413 1.00 0.00 H new ATOM 0 HD1 PHE A 104 6.193 9.450 -0.064 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.730 6.545 -2.817 1.00 0.00 H new ATOM 0 HE1 PHE A 104 3.932 9.711 0.863 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.469 6.810 -1.898 1.00 0.00 H new ATOM 0 HZ PHE A 104 2.066 8.393 -0.056 1.00 0.00 H new ATOM 1645 N ASN A 105 9.180 9.643 -4.154 1.00 0.00 N ATOM 1646 CA ASN A 105 10.354 9.510 -5.009 1.00 0.00 C ATOM 1647 C ASN A 105 10.574 8.056 -5.419 1.00 0.00 C ATOM 1648 O ASN A 105 11.709 7.589 -5.505 1.00 0.00 O ATOM 1649 CB ASN A 105 11.593 10.042 -4.288 1.00 0.00 C ATOM 1650 CG ASN A 105 12.734 10.341 -5.241 1.00 0.00 C ATOM 1651 OD1 ASN A 105 13.850 9.853 -5.065 1.00 0.00 O ATOM 1652 ND2 ASN A 105 12.458 11.147 -6.260 1.00 0.00 N ATOM 0 H ASN A 105 8.505 10.339 -4.470 1.00 0.00 H new ATOM 0 HA ASN A 105 10.183 10.097 -5.911 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.331 10.949 -3.743 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.922 9.311 -3.550 1.00 0.00 H new ATOM 0 HD21 ASN A 105 13.185 11.383 -6.935 1.00 0.00 H new ATOM 0 HD22 ASN A 105 11.519 11.529 -6.368 1.00 0.00 H new ATOM 1659 N VAL A 106 9.478 7.345 -5.671 1.00 0.00 N ATOM 1660 CA VAL A 106 9.550 5.944 -6.073 1.00 0.00 C ATOM 1661 C VAL A 106 10.452 5.765 -7.290 1.00 0.00 C ATOM 1662 O VAL A 106 10.059 6.068 -8.417 1.00 0.00 O ATOM 1663 CB VAL A 106 8.154 5.374 -6.396 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.235 3.880 -6.669 1.00 0.00 C ATOM 1665 CG2 VAL A 106 7.183 5.663 -5.260 1.00 0.00 C ATOM 0 H VAL A 106 8.530 7.716 -5.604 1.00 0.00 H new ATOM 0 HA VAL A 106 9.969 5.398 -5.228 1.00 0.00 H new ATOM 0 HB VAL A 106 7.782 5.864 -7.296 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.240 3.497 -6.895 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.894 3.701 -7.518 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.629 3.370 -5.790 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.203 5.253 -5.506 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.549 5.202 -4.342 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.100 6.740 -5.117 1.00 0.00 H new ATOM 1675 N GLU A 107 11.663 5.270 -7.055 1.00 0.00 N ATOM 1676 CA GLU A 107 12.621 5.049 -8.133 1.00 0.00 C ATOM 1677 C GLU A 107 12.048 4.100 -9.180 1.00 0.00 C ATOM 1678 O GLU A 107 12.022 4.416 -10.370 1.00 0.00 O ATOM 1679 CB GLU A 107 13.928 4.483 -7.574 1.00 0.00 C ATOM 1680 CG GLU A 107 14.909 5.552 -7.122 1.00 0.00 C ATOM 1681 CD GLU A 107 15.505 6.324 -8.282 1.00 0.00 C ATOM 1682 OE1 GLU A 107 14.906 6.306 -9.378 1.00 0.00 O ATOM 1683 OE2 GLU A 107 16.572 6.947 -8.095 1.00 0.00 O ATOM 0 H GLU A 107 12.004 5.014 -6.128 1.00 0.00 H new ATOM 0 HA GLU A 107 12.824 6.008 -8.609 1.00 0.00 H new ATOM 0 HB2 GLU A 107 13.701 3.830 -6.731 1.00 0.00 H new ATOM 0 HB3 GLU A 107 14.402 3.865 -8.337 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.402 6.245 -6.451 1.00 0.00 H new ATOM 0 HG3 GLU A 107 15.711 5.085 -6.550 1.00 0.00 H new ATOM 1690 N SER A 108 11.588 2.938 -8.729 1.00 0.00 N ATOM 1691 CA SER A 108 11.013 1.944 -9.626 1.00 0.00 C ATOM 1692 C SER A 108 10.243 0.885 -8.844 1.00 0.00 C ATOM 1693 O SER A 108 10.568 0.587 -7.694 1.00 0.00 O ATOM 1694 CB SER A 108 12.107 1.280 -10.461 1.00 0.00 C ATOM 1695 OG SER A 108 12.772 2.226 -11.279 1.00 0.00 O ATOM 0 H SER A 108 11.602 2.662 -7.747 1.00 0.00 H new ATOM 0 HA SER A 108 10.319 2.456 -10.293 1.00 0.00 H new ATOM 0 HB2 SER A 108 12.827 0.795 -9.802 1.00 0.00 H new ATOM 0 HB3 SER A 108 11.670 0.500 -11.084 1.00 0.00 H new ATOM 0 HG SER A 108 12.221 3.032 -11.362 1.00 0.00 H new ATOM 1701 N ILE A 109 9.222 0.323 -9.477 1.00 0.00 N ATOM 1702 CA ILE A 109 8.400 -0.703 -8.846 1.00 0.00 C ATOM 1703 C ILE A 109 9.062 -2.078 -8.932 1.00 0.00 C ATOM 1704 O ILE A 109 9.917 -2.310 -9.787 1.00 0.00 O ATOM 1705 CB ILE A 109 6.987 -0.769 -9.473 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.037 -0.698 -11.009 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.134 0.365 -8.931 1.00 0.00 C ATOM 1708 CD1 ILE A 109 8.112 -1.558 -11.639 1.00 0.00 C ATOM 0 H ILE A 109 8.942 0.560 -10.429 1.00 0.00 H new ATOM 0 HA ILE A 109 8.302 -0.423 -7.797 1.00 0.00 H new ATOM 0 HB ILE A 109 6.546 -1.728 -9.202 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.068 -1.000 -11.406 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.196 0.338 -11.308 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.139 0.316 -9.374 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.053 0.274 -7.848 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.596 1.320 -9.181 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.077 -1.448 -12.723 1.00 0.00 H new ATOM 0 HD12 ILE A 109 9.090 -1.244 -11.274 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.944 -2.602 -11.374 1.00 0.00 H new ATOM 1720 N PRO A 110 8.680 -3.015 -8.043 1.00 0.00 N ATOM 1721 CA PRO A 110 7.670 -2.785 -7.008 1.00 0.00 C ATOM 1722 C PRO A 110 8.258 -2.163 -5.745 1.00 0.00 C ATOM 1723 O PRO A 110 9.456 -2.272 -5.486 1.00 0.00 O ATOM 1724 CB PRO A 110 7.169 -4.197 -6.722 1.00 0.00 C ATOM 1725 CG PRO A 110 8.363 -5.065 -6.932 1.00 0.00 C ATOM 1726 CD PRO A 110 9.209 -4.390 -7.986 1.00 0.00 C ATOM 0 HA PRO A 110 6.897 -2.086 -7.327 1.00 0.00 H new ATOM 0 HB2 PRO A 110 6.788 -4.285 -5.704 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.355 -4.473 -7.392 1.00 0.00 H new ATOM 0 HG2 PRO A 110 8.923 -5.185 -6.004 1.00 0.00 H new ATOM 0 HG3 PRO A 110 8.065 -6.062 -7.255 1.00 0.00 H new ATOM 0 HD2 PRO A 110 10.265 -4.400 -7.717 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.121 -4.892 -8.950 1.00 0.00 H new ATOM 1734 N THR A 111 7.403 -1.516 -4.959 1.00 0.00 N ATOM 1735 CA THR A 111 7.832 -0.882 -3.718 1.00 0.00 C ATOM 1736 C THR A 111 6.710 -0.911 -2.683 1.00 0.00 C ATOM 1737 O THR A 111 5.556 -1.188 -3.014 1.00 0.00 O ATOM 1738 CB THR A 111 8.290 0.560 -3.984 1.00 0.00 C ATOM 1739 OG1 THR A 111 9.291 0.945 -3.059 1.00 0.00 O ATOM 1740 CG2 THR A 111 7.174 1.583 -3.903 1.00 0.00 C ATOM 0 H THR A 111 6.408 -1.417 -5.160 1.00 0.00 H new ATOM 0 HA THR A 111 8.677 -1.442 -3.318 1.00 0.00 H new ATOM 0 HB THR A 111 8.670 0.551 -5.005 1.00 0.00 H new ATOM 0 HG1 THR A 111 9.572 1.865 -3.245 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.576 2.576 -4.102 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.409 1.346 -4.642 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.734 1.563 -2.906 1.00 0.00 H new ATOM 1748 N LEU A 112 7.050 -0.611 -1.435 1.00 0.00 N ATOM 1749 CA LEU A 112 6.053 -0.592 -0.359 1.00 0.00 C ATOM 1750 C LEU A 112 6.405 0.470 0.678 1.00 0.00 C ATOM 1751 O LEU A 112 7.522 0.498 1.194 1.00 0.00 O ATOM 1752 CB LEU A 112 5.912 -1.986 0.306 1.00 0.00 C ATOM 1753 CG LEU A 112 4.791 -2.147 1.349 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.545 -1.371 0.978 1.00 0.00 C ATOM 1755 CD2 LEU A 112 4.452 -3.613 1.543 1.00 0.00 C ATOM 0 H LEU A 112 7.998 -0.379 -1.140 1.00 0.00 H new ATOM 0 HA LEU A 112 5.089 -0.338 -0.800 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.752 -2.723 -0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.860 -2.231 0.785 1.00 0.00 H new ATOM 0 HG LEU A 112 5.166 -1.735 2.286 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.784 -1.517 1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.786 -0.311 0.903 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.167 -1.726 0.019 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.658 -3.708 2.284 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.118 -4.038 0.596 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.336 -4.148 1.889 1.00 0.00 H new ATOM 1767 N ILE A 113 5.449 1.346 0.980 1.00 0.00 N ATOM 1768 CA ILE A 113 5.671 2.410 1.954 1.00 0.00 C ATOM 1769 C ILE A 113 4.481 2.562 2.899 1.00 0.00 C ATOM 1770 O ILE A 113 3.352 2.209 2.554 1.00 0.00 O ATOM 1771 CB ILE A 113 5.936 3.760 1.258 1.00 0.00 C ATOM 1772 CG1 ILE A 113 7.073 3.616 0.241 1.00 0.00 C ATOM 1773 CG2 ILE A 113 6.264 4.832 2.288 1.00 0.00 C ATOM 1774 CD1 ILE A 113 7.546 4.933 -0.337 1.00 0.00 C ATOM 0 H ILE A 113 4.517 1.340 0.566 1.00 0.00 H new ATOM 0 HA ILE A 113 6.550 2.125 2.533 1.00 0.00 H new ATOM 0 HB ILE A 113 5.035 4.064 0.726 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.915 3.117 0.720 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.741 2.971 -0.573 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.449 5.779 1.781 1.00 0.00 H new ATOM 0 HG22 ILE A 113 5.425 4.945 2.975 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.153 4.540 2.846 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.351 4.750 -1.048 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.717 5.425 -0.846 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.910 5.573 0.467 1.00 0.00 H new ATOM 1786 N GLY A 114 4.741 3.094 4.092 1.00 0.00 N ATOM 1787 CA GLY A 114 3.684 3.291 5.068 1.00 0.00 C ATOM 1788 C GLY A 114 3.467 4.755 5.400 1.00 0.00 C ATOM 1789 O GLY A 114 4.425 5.505 5.584 1.00 0.00 O ATOM 0 H GLY A 114 5.667 3.392 4.399 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.756 2.867 4.685 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.930 2.747 5.980 1.00 0.00 H new ATOM 1793 N VAL A 115 2.203 5.162 5.479 1.00 0.00 N ATOM 1794 CA VAL A 115 1.864 6.537 5.795 1.00 0.00 C ATOM 1795 C VAL A 115 0.778 6.592 6.861 1.00 0.00 C ATOM 1796 O VAL A 115 0.088 5.604 7.116 1.00 0.00 O ATOM 1797 CB VAL A 115 1.388 7.306 4.544 1.00 0.00 C ATOM 1798 CG1 VAL A 115 2.434 7.231 3.442 1.00 0.00 C ATOM 1799 CG2 VAL A 115 0.047 6.773 4.054 1.00 0.00 C ATOM 0 H VAL A 115 1.398 4.554 5.327 1.00 0.00 H new ATOM 0 HA VAL A 115 2.770 7.012 6.172 1.00 0.00 H new ATOM 0 HB VAL A 115 1.253 8.352 4.819 1.00 0.00 H new ATOM 0 HG11 VAL A 115 2.081 7.779 2.568 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.366 7.672 3.795 1.00 0.00 H new ATOM 0 HG13 VAL A 115 2.605 6.189 3.173 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.266 7.332 3.172 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.146 5.718 3.799 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.699 6.888 4.840 1.00 0.00 H new ATOM 1809 N ASP A 116 0.633 7.753 7.474 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.369 7.953 8.513 1.00 0.00 C ATOM 1811 C ASP A 116 -1.564 8.729 7.972 1.00 0.00 C ATOM 1812 O ASP A 116 -1.435 9.887 7.570 1.00 0.00 O ATOM 1813 CB ASP A 116 0.239 8.697 9.703 1.00 0.00 C ATOM 1814 CG ASP A 116 0.795 7.756 10.754 1.00 0.00 C ATOM 1815 OD1 ASP A 116 0.406 6.569 10.751 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.618 8.204 11.577 1.00 0.00 O ATOM 0 H ASP A 116 1.198 8.577 7.271 1.00 0.00 H new ATOM 0 HA ASP A 116 -0.713 6.973 8.844 1.00 0.00 H new ATOM 0 HB2 ASP A 116 1.035 9.352 9.349 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -0.521 9.334 10.156 1.00 0.00 H new ATOM 1821 N ALA A 117 -2.726 8.085 7.960 1.00 0.00 N ATOM 1822 CA ALA A 117 -3.944 8.715 7.466 1.00 0.00 C ATOM 1823 C ALA A 117 -4.337 9.906 8.333 1.00 0.00 C ATOM 1824 O ALA A 117 -4.563 11.006 7.830 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.077 7.702 7.413 1.00 0.00 C ATOM 0 H ALA A 117 -2.850 7.127 8.287 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.751 9.081 6.458 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -5.981 8.186 7.042 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -4.803 6.885 6.746 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.260 7.308 8.413 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.419 9.678 9.640 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.788 10.732 10.580 1.00 0.00 C ATOM 1833 C ASP A 118 -3.749 11.850 10.582 1.00 0.00 C ATOM 1834 O ASP A 118 -4.068 13.006 10.306 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.940 10.156 11.989 1.00 0.00 C ATOM 1836 CG ASP A 118 -6.392 9.985 12.389 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -7.252 9.906 11.486 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -6.671 9.929 13.605 1.00 0.00 O ATOM 0 H ASP A 118 -4.235 8.773 10.073 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.743 11.151 10.261 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.436 9.191 12.041 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.444 10.814 12.703 1.00 0.00 H new ATOM 1843 N SER A 119 -2.507 11.499 10.897 1.00 0.00 N ATOM 1844 CA SER A 119 -1.423 12.474 10.938 1.00 0.00 C ATOM 1845 C SER A 119 -1.249 13.153 9.583 1.00 0.00 C ATOM 1846 O SER A 119 -1.083 14.370 9.505 1.00 0.00 O ATOM 1847 CB SER A 119 -0.115 11.798 11.354 1.00 0.00 C ATOM 1848 OG SER A 119 0.905 12.755 11.577 1.00 0.00 O ATOM 0 H SER A 119 -2.226 10.546 11.128 1.00 0.00 H new ATOM 0 HA SER A 119 -1.681 13.235 11.675 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.276 11.215 12.261 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.200 11.100 10.578 1.00 0.00 H new ATOM 0 HG SER A 119 1.730 12.298 11.843 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.289 12.358 8.519 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.135 12.901 7.183 1.00 0.00 C ATOM 1856 C GLY A 120 0.303 13.254 6.859 1.00 0.00 C ATOM 1857 O GLY A 120 0.639 14.427 6.696 1.00 0.00 O ATOM 0 H GLY A 120 -1.425 11.348 8.558 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.500 12.176 6.456 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.755 13.792 7.083 1.00 0.00 H new ATOM 1861 N ASP A 121 1.154 12.237 6.765 1.00 0.00 N ATOM 1862 CA ASP A 121 2.565 12.443 6.458 1.00 0.00 C ATOM 1863 C ASP A 121 3.304 11.111 6.385 1.00 0.00 C ATOM 1864 O ASP A 121 3.042 10.201 7.172 1.00 0.00 O ATOM 1865 CB ASP A 121 3.213 13.345 7.513 1.00 0.00 C ATOM 1866 CG ASP A 121 3.475 14.746 6.994 1.00 0.00 C ATOM 1867 OD1 ASP A 121 2.912 15.105 5.939 1.00 0.00 O ATOM 1868 OD2 ASP A 121 4.247 15.484 7.642 1.00 0.00 O ATOM 0 H ASP A 121 0.890 11.261 6.897 1.00 0.00 H new ATOM 0 HA ASP A 121 2.633 12.930 5.485 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.565 13.400 8.388 1.00 0.00 H new ATOM 0 HB3 ASP A 121 4.153 12.900 7.840 1.00 0.00 H new ATOM 1873 N VAL A 122 4.229 11.004 5.437 1.00 0.00 N ATOM 1874 CA VAL A 122 5.005 9.782 5.264 1.00 0.00 C ATOM 1875 C VAL A 122 5.797 9.453 6.524 1.00 0.00 C ATOM 1876 O VAL A 122 6.665 10.219 6.943 1.00 0.00 O ATOM 1877 CB VAL A 122 5.978 9.899 4.076 1.00 0.00 C ATOM 1878 CG1 VAL A 122 6.621 8.554 3.778 1.00 0.00 C ATOM 1879 CG2 VAL A 122 5.260 10.439 2.847 1.00 0.00 C ATOM 0 H VAL A 122 4.459 11.748 4.778 1.00 0.00 H new ATOM 0 HA VAL A 122 4.294 8.980 5.064 1.00 0.00 H new ATOM 0 HB VAL A 122 6.767 10.601 4.345 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.305 8.656 2.936 1.00 0.00 H new ATOM 0 HG12 VAL A 122 7.172 8.212 4.654 1.00 0.00 H new ATOM 0 HG13 VAL A 122 5.847 7.828 3.530 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.964 10.515 2.018 1.00 0.00 H new ATOM 0 HG22 VAL A 122 4.449 9.764 2.574 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.852 11.426 3.068 1.00 0.00 H new ATOM 1889 N VAL A 123 5.491 8.308 7.125 1.00 0.00 N ATOM 1890 CA VAL A 123 6.171 7.876 8.338 1.00 0.00 C ATOM 1891 C VAL A 123 7.227 6.815 8.040 1.00 0.00 C ATOM 1892 O VAL A 123 8.119 6.573 8.853 1.00 0.00 O ATOM 1893 CB VAL A 123 5.175 7.311 9.370 1.00 0.00 C ATOM 1894 CG1 VAL A 123 5.851 7.125 10.719 1.00 0.00 C ATOM 1895 CG2 VAL A 123 3.961 8.220 9.494 1.00 0.00 C ATOM 0 H VAL A 123 4.775 7.663 6.790 1.00 0.00 H new ATOM 0 HA VAL A 123 6.657 8.759 8.752 1.00 0.00 H new ATOM 0 HB VAL A 123 4.835 6.335 9.023 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.132 6.725 11.434 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.684 6.430 10.616 1.00 0.00 H new ATOM 0 HG13 VAL A 123 6.222 8.086 11.076 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.269 7.805 10.227 1.00 0.00 H new ATOM 0 HG22 VAL A 123 4.280 9.211 9.817 1.00 0.00 H new ATOM 0 HG23 VAL A 123 3.463 8.296 8.527 1.00 0.00 H new ATOM 1905 N THR A 124 7.121 6.183 6.875 1.00 0.00 N ATOM 1906 CA THR A 124 8.070 5.147 6.482 1.00 0.00 C ATOM 1907 C THR A 124 8.444 5.287 5.010 1.00 0.00 C ATOM 1908 O THR A 124 7.804 6.029 4.265 1.00 0.00 O ATOM 1909 CB THR A 124 7.491 3.747 6.751 1.00 0.00 C ATOM 1910 OG1 THR A 124 7.162 3.089 5.539 1.00 0.00 O ATOM 1911 CG2 THR A 124 6.244 3.757 7.613 1.00 0.00 C ATOM 0 H THR A 124 6.390 6.369 6.189 1.00 0.00 H new ATOM 0 HA THR A 124 8.971 5.271 7.083 1.00 0.00 H new ATOM 0 HB THR A 124 8.280 3.221 7.288 1.00 0.00 H new ATOM 0 HG1 THR A 124 6.798 2.201 5.737 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.894 2.735 7.759 1.00 0.00 H new ATOM 0 HG22 THR A 124 6.474 4.203 8.580 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.466 4.340 7.120 1.00 0.00 H new ATOM 1919 N THR A 125 9.480 4.564 4.600 1.00 0.00 N ATOM 1920 CA THR A 125 9.943 4.598 3.218 1.00 0.00 C ATOM 1921 C THR A 125 10.730 3.335 2.884 1.00 0.00 C ATOM 1922 O THR A 125 11.763 3.389 2.216 1.00 0.00 O ATOM 1923 CB THR A 125 10.801 5.839 2.977 1.00 0.00 C ATOM 1924 OG1 THR A 125 11.865 5.904 3.910 1.00 0.00 O ATOM 1925 CG2 THR A 125 10.017 7.128 3.081 1.00 0.00 C ATOM 0 H THR A 125 10.017 3.945 5.208 1.00 0.00 H new ATOM 0 HA THR A 125 9.072 4.643 2.564 1.00 0.00 H new ATOM 0 HB THR A 125 11.179 5.740 1.959 1.00 0.00 H new ATOM 0 HG1 THR A 125 12.403 6.705 3.737 1.00 0.00 H new ATOM 0 HG21 THR A 125 10.681 7.973 2.900 1.00 0.00 H new ATOM 0 HG22 THR A 125 9.218 7.129 2.339 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.586 7.212 4.079 1.00 0.00 H new ATOM 1933 N ARG A 126 10.227 2.201 3.358 1.00 0.00 N ATOM 1934 CA ARG A 126 10.865 0.911 3.122 1.00 0.00 C ATOM 1935 C ARG A 126 10.002 -0.211 3.687 1.00 0.00 C ATOM 1936 O ARG A 126 10.486 -1.083 4.409 1.00 0.00 O ATOM 1937 CB ARG A 126 12.259 0.880 3.756 1.00 0.00 C ATOM 1938 CG ARG A 126 12.244 0.927 5.277 1.00 0.00 C ATOM 1939 CD ARG A 126 12.491 2.333 5.796 1.00 0.00 C ATOM 1940 NE ARG A 126 13.872 2.762 5.580 1.00 0.00 N ATOM 1941 CZ ARG A 126 14.443 3.775 6.229 1.00 0.00 C ATOM 1942 NH1 ARG A 126 13.757 4.464 7.134 1.00 0.00 N ATOM 1943 NH2 ARG A 126 15.703 4.100 5.974 1.00 0.00 N ATOM 0 H ARG A 126 9.372 2.149 3.912 1.00 0.00 H new ATOM 0 HA ARG A 126 10.971 0.765 2.047 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.774 -0.026 3.435 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.837 1.725 3.382 1.00 0.00 H new ATOM 0 HG2 ARG A 126 11.282 0.567 5.643 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.007 0.254 5.670 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.814 3.027 5.299 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.262 2.372 6.861 1.00 0.00 H new ATOM 0 HE ARG A 126 14.430 2.256 4.892 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.788 4.218 7.335 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.200 5.239 7.628 1.00 0.00 H new ATOM 0 HH21 ARG A 126 16.235 3.574 5.281 1.00 0.00 H new ATOM 0 HH22 ARG A 126 16.140 4.876 6.471 1.00 0.00 H new ATOM 1957 N ALA A 127 8.715 -0.171 3.361 1.00 0.00 N ATOM 1958 CA ALA A 127 7.768 -1.170 3.842 1.00 0.00 C ATOM 1959 C ALA A 127 7.826 -2.459 3.030 1.00 0.00 C ATOM 1960 O ALA A 127 7.018 -3.364 3.241 1.00 0.00 O ATOM 1961 CB ALA A 127 6.355 -0.603 3.825 1.00 0.00 C ATOM 0 H ALA A 127 8.302 0.545 2.763 1.00 0.00 H new ATOM 0 HA ALA A 127 8.050 -1.418 4.865 1.00 0.00 H new ATOM 0 HB1 ALA A 127 5.656 -1.357 4.186 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.307 0.274 4.470 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.089 -0.320 2.807 1.00 0.00 H new ATOM 1967 N ARG A 128 8.780 -2.553 2.112 1.00 0.00 N ATOM 1968 CA ARG A 128 8.917 -3.750 1.299 1.00 0.00 C ATOM 1969 C ARG A 128 9.620 -4.845 2.092 1.00 0.00 C ATOM 1970 O ARG A 128 9.148 -5.979 2.164 1.00 0.00 O ATOM 1971 CB ARG A 128 9.693 -3.441 0.009 1.00 0.00 C ATOM 1972 CG ARG A 128 11.175 -3.170 0.231 1.00 0.00 C ATOM 1973 CD ARG A 128 11.916 -2.971 -1.078 1.00 0.00 C ATOM 1974 NE ARG A 128 11.789 -1.603 -1.579 1.00 0.00 N ATOM 1975 CZ ARG A 128 12.417 -0.557 -1.047 1.00 0.00 C ATOM 1976 NH1 ARG A 128 13.217 -0.717 0.001 1.00 0.00 N ATOM 1977 NH2 ARG A 128 12.247 0.651 -1.565 1.00 0.00 N ATOM 0 H ARG A 128 9.463 -1.822 1.915 1.00 0.00 H new ATOM 0 HA ARG A 128 7.922 -4.099 1.025 1.00 0.00 H new ATOM 0 HB2 ARG A 128 9.586 -4.281 -0.678 1.00 0.00 H new ATOM 0 HB3 ARG A 128 9.244 -2.574 -0.475 1.00 0.00 H new ATOM 0 HG2 ARG A 128 11.293 -2.283 0.853 1.00 0.00 H new ATOM 0 HG3 ARG A 128 11.619 -4.003 0.776 1.00 0.00 H new ATOM 0 HD2 ARG A 128 12.970 -3.209 -0.937 1.00 0.00 H new ATOM 0 HD3 ARG A 128 11.529 -3.667 -1.823 1.00 0.00 H new ATOM 0 HE ARG A 128 11.183 -1.441 -2.384 1.00 0.00 H new ATOM 0 HH11 ARG A 128 13.353 -1.645 0.402 1.00 0.00 H new ATOM 0 HH12 ARG A 128 13.696 0.088 0.405 1.00 0.00 H new ATOM 0 HH21 ARG A 128 11.635 0.779 -2.371 1.00 0.00 H new ATOM 0 HH22 ARG A 128 12.728 1.453 -1.158 1.00 0.00 H new ATOM 1991 N ALA A 129 10.756 -4.490 2.675 1.00 0.00 N ATOM 1992 CA ALA A 129 11.553 -5.417 3.458 1.00 0.00 C ATOM 1993 C ALA A 129 11.088 -5.497 4.912 1.00 0.00 C ATOM 1994 O ALA A 129 11.147 -6.556 5.531 1.00 0.00 O ATOM 1995 CB ALA A 129 13.011 -4.998 3.394 1.00 0.00 C ATOM 0 H ALA A 129 11.149 -3.551 2.617 1.00 0.00 H new ATOM 0 HA ALA A 129 11.429 -6.412 3.031 1.00 0.00 H new ATOM 0 HB1 ALA A 129 13.615 -5.691 3.980 1.00 0.00 H new ATOM 0 HB2 ALA A 129 13.348 -5.011 2.357 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.118 -3.991 3.798 1.00 0.00 H new ATOM 2001 N THR A 130 10.665 -4.363 5.460 1.00 0.00 N ATOM 2002 CA THR A 130 10.239 -4.285 6.838 1.00 0.00 C ATOM 2003 C THR A 130 8.915 -4.986 7.090 1.00 0.00 C ATOM 2004 O THR A 130 8.799 -5.773 8.026 1.00 0.00 O ATOM 2005 CB THR A 130 10.158 -2.822 7.239 1.00 0.00 C ATOM 2006 OG1 THR A 130 9.211 -2.138 6.445 1.00 0.00 O ATOM 2007 CG2 THR A 130 11.478 -2.092 7.106 1.00 0.00 C ATOM 0 H THR A 130 10.611 -3.478 4.956 1.00 0.00 H new ATOM 0 HA THR A 130 10.974 -4.808 7.450 1.00 0.00 H new ATOM 0 HB THR A 130 9.866 -2.826 8.289 1.00 0.00 H new ATOM 0 HG1 THR A 130 8.494 -1.791 7.016 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.351 -1.052 7.408 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.222 -2.567 7.745 1.00 0.00 H new ATOM 0 HG23 THR A 130 11.812 -2.130 6.069 1.00 0.00 H new ATOM 2015 N LEU A 131 7.918 -4.707 6.268 1.00 0.00 N ATOM 2016 CA LEU A 131 6.616 -5.330 6.446 1.00 0.00 C ATOM 2017 C LEU A 131 6.761 -6.847 6.534 1.00 0.00 C ATOM 2018 O LEU A 131 6.032 -7.510 7.272 1.00 0.00 O ATOM 2019 CB LEU A 131 5.688 -4.955 5.289 1.00 0.00 C ATOM 2020 CG LEU A 131 4.362 -5.722 5.243 1.00 0.00 C ATOM 2021 CD1 LEU A 131 3.185 -4.758 5.211 1.00 0.00 C ATOM 2022 CD2 LEU A 131 4.327 -6.653 4.039 1.00 0.00 C ATOM 0 H LEU A 131 7.982 -4.062 5.480 1.00 0.00 H new ATOM 0 HA LEU A 131 6.181 -4.967 7.377 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.471 -3.889 5.349 1.00 0.00 H new ATOM 0 HB3 LEU A 131 6.218 -5.120 4.351 1.00 0.00 H new ATOM 0 HG LEU A 131 4.282 -6.326 6.147 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.253 -5.323 5.179 1.00 0.00 H new ATOM 0 HD12 LEU A 131 3.201 -4.135 6.105 1.00 0.00 H new ATOM 0 HD13 LEU A 131 3.257 -4.125 4.326 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.379 -7.190 4.022 1.00 0.00 H new ATOM 0 HD22 LEU A 131 4.430 -6.069 3.124 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.147 -7.368 4.108 1.00 0.00 H new ATOM 2034 N VAL A 132 7.711 -7.387 5.778 1.00 0.00 N ATOM 2035 CA VAL A 132 7.957 -8.824 5.772 1.00 0.00 C ATOM 2036 C VAL A 132 8.969 -9.247 6.838 1.00 0.00 C ATOM 2037 O VAL A 132 8.735 -10.192 7.591 1.00 0.00 O ATOM 2038 CB VAL A 132 8.433 -9.307 4.383 1.00 0.00 C ATOM 2039 CG1 VAL A 132 9.457 -8.360 3.776 1.00 0.00 C ATOM 2040 CG2 VAL A 132 8.998 -10.715 4.466 1.00 0.00 C ATOM 0 H VAL A 132 8.323 -6.851 5.162 1.00 0.00 H new ATOM 0 HA VAL A 132 7.003 -9.296 6.007 1.00 0.00 H new ATOM 0 HB VAL A 132 7.562 -9.317 3.728 1.00 0.00 H new ATOM 0 HG11 VAL A 132 9.766 -8.735 2.800 1.00 0.00 H new ATOM 0 HG12 VAL A 132 9.014 -7.371 3.661 1.00 0.00 H new ATOM 0 HG13 VAL A 132 10.326 -8.295 4.431 1.00 0.00 H new ATOM 0 HG21 VAL A 132 9.327 -11.034 3.477 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.845 -10.727 5.151 1.00 0.00 H new ATOM 0 HG23 VAL A 132 8.228 -11.395 4.829 1.00 0.00 H new ATOM 2050 N LYS A 133 10.107 -8.561 6.873 1.00 0.00 N ATOM 2051 CA LYS A 133 11.176 -8.882 7.818 1.00 0.00 C ATOM 2052 C LYS A 133 10.937 -8.292 9.211 1.00 0.00 C ATOM 2053 O LYS A 133 11.867 -8.193 10.011 1.00 0.00 O ATOM 2054 CB LYS A 133 12.520 -8.392 7.272 1.00 0.00 C ATOM 2055 CG LYS A 133 13.057 -9.234 6.126 1.00 0.00 C ATOM 2056 CD LYS A 133 13.137 -10.705 6.501 1.00 0.00 C ATOM 2057 CE LYS A 133 13.888 -11.509 5.450 1.00 0.00 C ATOM 2058 NZ LYS A 133 13.469 -11.146 4.068 1.00 0.00 N ATOM 0 H LYS A 133 10.315 -7.776 6.256 1.00 0.00 H new ATOM 0 HA LYS A 133 11.187 -9.966 7.927 1.00 0.00 H new ATOM 0 HB2 LYS A 133 12.411 -7.361 6.934 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.251 -8.387 8.081 1.00 0.00 H new ATOM 0 HG2 LYS A 133 12.414 -9.115 5.254 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.047 -8.876 5.843 1.00 0.00 H new ATOM 0 HD2 LYS A 133 13.635 -10.809 7.465 1.00 0.00 H new ATOM 0 HD3 LYS A 133 12.131 -11.107 6.617 1.00 0.00 H new ATOM 0 HE2 LYS A 133 14.959 -11.340 5.561 1.00 0.00 H new ATOM 0 HE3 LYS A 133 13.715 -12.573 5.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 13.817 -11.863 3.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 12.431 -11.102 4.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 13.866 -10.218 3.817 1.00 0.00 H new ATOM 2072 N ASP A 134 9.697 -7.916 9.509 1.00 0.00 N ATOM 2073 CA ASP A 134 9.366 -7.359 10.819 1.00 0.00 C ATOM 2074 C ASP A 134 8.442 -8.305 11.585 1.00 0.00 C ATOM 2075 O ASP A 134 7.233 -8.088 11.650 1.00 0.00 O ATOM 2076 CB ASP A 134 8.702 -5.989 10.670 1.00 0.00 C ATOM 2077 CG ASP A 134 8.380 -5.353 12.009 1.00 0.00 C ATOM 2078 OD1 ASP A 134 8.939 -5.803 13.031 1.00 0.00 O ATOM 2079 OD2 ASP A 134 7.568 -4.405 12.033 1.00 0.00 O ATOM 0 H ASP A 134 8.908 -7.986 8.866 1.00 0.00 H new ATOM 0 HA ASP A 134 10.292 -7.240 11.381 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.361 -5.328 10.106 1.00 0.00 H new ATOM 0 HB3 ASP A 134 7.785 -6.094 10.091 1.00 0.00 H new ATOM 2084 N PRO A 135 9.005 -9.379 12.167 1.00 0.00 N ATOM 2085 CA PRO A 135 8.230 -10.368 12.918 1.00 0.00 C ATOM 2086 C PRO A 135 7.932 -9.940 14.354 1.00 0.00 C ATOM 2087 O PRO A 135 7.364 -10.711 15.128 1.00 0.00 O ATOM 2088 CB PRO A 135 9.148 -11.587 12.909 1.00 0.00 C ATOM 2089 CG PRO A 135 10.524 -11.016 12.899 1.00 0.00 C ATOM 2090 CD PRO A 135 10.441 -9.722 12.127 1.00 0.00 C ATOM 0 HA PRO A 135 7.247 -10.533 12.476 1.00 0.00 H new ATOM 0 HB2 PRO A 135 8.984 -12.214 13.786 1.00 0.00 H new ATOM 0 HB3 PRO A 135 8.971 -12.211 12.033 1.00 0.00 H new ATOM 0 HG2 PRO A 135 10.879 -10.841 13.914 1.00 0.00 H new ATOM 0 HG3 PRO A 135 11.227 -11.704 12.430 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.051 -8.943 12.585 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.795 -9.844 11.103 1.00 0.00 H new ATOM 2098 N GLU A 136 8.313 -8.717 14.713 1.00 0.00 N ATOM 2099 CA GLU A 136 8.073 -8.218 16.059 1.00 0.00 C ATOM 2100 C GLU A 136 7.099 -7.049 16.036 1.00 0.00 C ATOM 2101 O GLU A 136 6.405 -6.788 17.019 1.00 0.00 O ATOM 2102 CB GLU A 136 9.391 -7.787 16.704 1.00 0.00 C ATOM 2103 CG GLU A 136 10.468 -8.858 16.662 1.00 0.00 C ATOM 2104 CD GLU A 136 11.811 -8.355 17.149 1.00 0.00 C ATOM 2105 OE1 GLU A 136 11.968 -8.173 18.376 1.00 0.00 O ATOM 2106 OE2 GLU A 136 12.708 -8.141 16.306 1.00 0.00 O ATOM 0 H GLU A 136 8.786 -8.059 14.094 1.00 0.00 H new ATOM 0 HA GLU A 136 7.633 -9.022 16.648 1.00 0.00 H new ATOM 0 HB2 GLU A 136 9.758 -6.894 16.198 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.205 -7.511 17.742 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.157 -9.704 17.275 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.570 -9.225 15.641 1.00 0.00 H new ATOM 2113 N GLY A 137 7.058 -6.336 14.913 1.00 0.00 N ATOM 2114 CA GLY A 137 6.173 -5.195 14.798 1.00 0.00 C ATOM 2115 C GLY A 137 6.414 -4.186 15.899 1.00 0.00 C ATOM 2116 O GLY A 137 5.528 -3.404 16.245 1.00 0.00 O ATOM 0 H GLY A 137 7.621 -6.529 14.085 1.00 0.00 H new ATOM 0 HA2 GLY A 137 6.319 -4.718 13.829 1.00 0.00 H new ATOM 0 HA3 GLY A 137 5.137 -5.533 14.834 1.00 0.00 H new ATOM 2120 N GLU A 138 7.619 -4.219 16.461 1.00 0.00 N ATOM 2121 CA GLU A 138 7.979 -3.310 17.543 1.00 0.00 C ATOM 2122 C GLU A 138 8.273 -1.901 17.029 1.00 0.00 C ATOM 2123 O GLU A 138 8.329 -0.953 17.811 1.00 0.00 O ATOM 2124 CB GLU A 138 9.175 -3.859 18.334 1.00 0.00 C ATOM 2125 CG GLU A 138 10.503 -3.795 17.593 1.00 0.00 C ATOM 2126 CD GLU A 138 11.419 -4.951 17.945 1.00 0.00 C ATOM 2127 OE1 GLU A 138 11.633 -5.194 19.150 1.00 0.00 O ATOM 2128 OE2 GLU A 138 11.925 -5.612 17.013 1.00 0.00 O ATOM 0 H GLU A 138 8.360 -4.863 16.186 1.00 0.00 H new ATOM 0 HA GLU A 138 7.120 -3.240 18.211 1.00 0.00 H new ATOM 0 HB2 GLU A 138 9.266 -3.301 19.266 1.00 0.00 H new ATOM 0 HB3 GLU A 138 8.972 -4.896 18.602 1.00 0.00 H new ATOM 0 HG2 GLU A 138 10.317 -3.797 16.519 1.00 0.00 H new ATOM 0 HG3 GLU A 138 11.002 -2.855 17.828 1.00 0.00 H new ATOM 2135 N GLN A 139 8.461 -1.761 15.717 1.00 0.00 N ATOM 2136 CA GLN A 139 8.746 -0.463 15.127 1.00 0.00 C ATOM 2137 C GLN A 139 7.947 -0.273 13.848 1.00 0.00 C ATOM 2138 O GLN A 139 8.373 0.459 12.964 1.00 0.00 O ATOM 2139 CB GLN A 139 10.231 -0.343 14.786 1.00 0.00 C ATOM 2140 CG GLN A 139 11.141 -1.276 15.563 1.00 0.00 C ATOM 2141 CD GLN A 139 12.474 -0.640 15.905 1.00 0.00 C ATOM 2142 OE1 GLN A 139 13.361 -0.531 15.058 1.00 0.00 O ATOM 2143 NE2 GLN A 139 12.623 -0.215 17.155 1.00 0.00 N ATOM 0 H GLN A 139 8.420 -2.530 15.048 1.00 0.00 H new ATOM 0 HA GLN A 139 8.470 0.299 15.856 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.361 -0.535 13.721 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.549 0.684 14.966 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.642 -1.582 16.483 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.313 -2.180 14.978 1.00 0.00 H new ATOM 0 HE21 GLN A 139 11.862 -0.325 17.825 1.00 0.00 H new ATOM 0 HE22 GLN A 139 13.498 0.221 17.444 1.00 0.00 H new ATOM 2152 N PHE A 140 6.810 -0.958 13.742 1.00 0.00 N ATOM 2153 CA PHE A 140 5.973 -0.895 12.541 1.00 0.00 C ATOM 2154 C PHE A 140 6.013 0.447 11.821 1.00 0.00 C ATOM 2155 O PHE A 140 6.180 0.469 10.602 1.00 0.00 O ATOM 2156 CB PHE A 140 4.543 -1.344 12.827 1.00 0.00 C ATOM 2157 CG PHE A 140 3.834 -0.553 13.889 1.00 0.00 C ATOM 2158 CD1 PHE A 140 4.186 -0.678 15.224 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.808 0.315 13.550 1.00 0.00 C ATOM 2160 CE1 PHE A 140 3.530 0.049 16.199 1.00 0.00 C ATOM 2161 CE2 PHE A 140 2.148 1.044 14.520 1.00 0.00 C ATOM 2162 CZ PHE A 140 2.511 0.911 15.847 1.00 0.00 C ATOM 0 H PHE A 140 6.444 -1.566 14.475 1.00 0.00 H new ATOM 0 HA PHE A 140 6.417 -1.605 11.843 1.00 0.00 H new ATOM 0 HB2 PHE A 140 3.967 -1.284 11.904 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.559 -2.392 13.125 1.00 0.00 H new ATOM 0 HD1 PHE A 140 4.982 -1.351 15.505 1.00 0.00 H new ATOM 0 HD2 PHE A 140 2.521 0.423 12.514 1.00 0.00 H new ATOM 0 HE1 PHE A 140 3.814 -0.057 17.235 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.350 1.717 14.242 1.00 0.00 H new ATOM 0 HZ PHE A 140 1.998 1.481 16.608 1.00 0.00 H new ATOM 2172 N PRO A 141 5.907 1.593 12.513 1.00 0.00 N ATOM 2173 CA PRO A 141 5.992 2.882 11.827 1.00 0.00 C ATOM 2174 C PRO A 141 7.355 3.065 11.148 1.00 0.00 C ATOM 2175 O PRO A 141 7.630 4.123 10.584 1.00 0.00 O ATOM 2176 CB PRO A 141 5.806 3.907 12.951 1.00 0.00 C ATOM 2177 CG PRO A 141 6.164 3.174 14.198 1.00 0.00 C ATOM 2178 CD PRO A 141 5.736 1.753 13.971 1.00 0.00 C ATOM 0 HA PRO A 141 5.251 2.979 11.033 1.00 0.00 H new ATOM 0 HB2 PRO A 141 6.448 4.775 12.805 1.00 0.00 H new ATOM 0 HB3 PRO A 141 4.780 4.272 12.988 1.00 0.00 H new ATOM 0 HG2 PRO A 141 7.235 3.234 14.394 1.00 0.00 H new ATOM 0 HG3 PRO A 141 5.657 3.602 15.063 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.353 1.050 14.531 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.704 1.587 14.279 1.00 0.00 H new ATOM 2186 N TRP A 142 8.203 2.014 11.220 1.00 0.00 N ATOM 2187 CA TRP A 142 9.557 2.003 10.641 1.00 0.00 C ATOM 2188 C TRP A 142 9.952 3.353 10.052 1.00 0.00 C ATOM 2189 O TRP A 142 10.149 3.489 8.844 1.00 0.00 O ATOM 2190 CB TRP A 142 9.687 0.905 9.577 1.00 0.00 C ATOM 2191 CG TRP A 142 8.872 -0.323 9.868 1.00 0.00 C ATOM 2192 CD1 TRP A 142 8.925 -1.112 10.989 1.00 0.00 C ATOM 2193 CD2 TRP A 142 7.886 -0.909 9.013 1.00 0.00 C ATOM 2194 NE1 TRP A 142 8.007 -2.131 10.888 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.365 -2.033 9.681 1.00 0.00 C ATOM 2196 CE3 TRP A 142 7.385 -0.586 7.749 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 6.372 -2.834 9.127 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 6.400 -1.383 7.200 1.00 0.00 C ATOM 2199 CH2 TRP A 142 5.902 -2.495 7.888 1.00 0.00 C ATOM 0 H TRP A 142 7.959 1.141 11.688 1.00 0.00 H new ATOM 0 HA TRP A 142 10.244 1.792 11.460 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.384 1.310 8.612 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.736 0.621 9.488 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.589 -0.956 11.826 1.00 0.00 H new ATOM 0 HE1 TRP A 142 7.832 -2.844 11.596 1.00 0.00 H new ATOM 0 HE3 TRP A 142 7.761 0.272 7.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 5.986 -3.693 9.656 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 6.007 -1.144 6.223 1.00 0.00 H new ATOM 0 HH2 TRP A 142 5.131 -3.098 7.431 1.00 0.00 H new ATOM 2210 N LYS A 143 10.064 4.347 10.923 1.00 0.00 N ATOM 2211 CA LYS A 143 10.434 5.695 10.507 1.00 0.00 C ATOM 2212 C LYS A 143 11.941 5.903 10.612 1.00 0.00 C ATOM 2213 O LYS A 143 12.651 5.090 11.204 1.00 0.00 O ATOM 2214 CB LYS A 143 9.703 6.732 11.362 1.00 0.00 C ATOM 2215 CG LYS A 143 10.095 6.696 12.831 1.00 0.00 C ATOM 2216 CD LYS A 143 8.876 6.753 13.737 1.00 0.00 C ATOM 2217 CE LYS A 143 8.515 5.378 14.275 1.00 0.00 C ATOM 2218 NZ LYS A 143 9.593 4.816 15.135 1.00 0.00 N ATOM 0 H LYS A 143 9.904 4.245 11.925 1.00 0.00 H new ATOM 0 HA LYS A 143 10.141 5.821 9.465 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.906 7.726 10.965 1.00 0.00 H new ATOM 0 HB3 LYS A 143 8.629 6.568 11.277 1.00 0.00 H new ATOM 0 HG2 LYS A 143 10.659 5.786 13.035 1.00 0.00 H new ATOM 0 HG3 LYS A 143 10.754 7.536 13.053 1.00 0.00 H new ATOM 0 HD2 LYS A 143 9.071 7.430 14.569 1.00 0.00 H new ATOM 0 HD3 LYS A 143 8.030 7.162 13.185 1.00 0.00 H new ATOM 0 HE2 LYS A 143 7.591 5.444 14.849 1.00 0.00 H new ATOM 0 HE3 LYS A 143 8.325 4.701 13.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 9.177 4.168 15.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 10.274 4.298 14.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 10.082 5.590 15.629 1.00 0.00 H new