USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1216 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 26 ASN : amide:sc= -1.45 K(o=-2.2,f=-0.18) USER MOD Set 1.2: B 91 ASN : amide:sc= -0.772 K(o=-2.2,f=-3.9!) USER MOD Set 2.1: B 47 CYS SG : rot 180:sc= 0.815 USER MOD Set 2.2: B 55 SER OG : rot -114:sc= 0.531 USER MOD Set 3.1: B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 90 SER OG : rot 180:sc= 0 USER MOD Set 4.1: B 37 SER OG : rot 73:sc= 1.14 USER MOD Set 4.2: B 38 CYS SG : rot 180:sc= 0.777 USER MOD Set 5.1: A 9 LYS NZ :NH3+ 158:sc= -0.13 (180deg=-1.08) USER MOD Set 5.2: B 75 TYR OH : rot -166:sc= -7.62! USER MOD Single : A 6 LYS NZ :NH3+ -144:sc= -0.118 (180deg=-1.36!) USER MOD Single : A 7 SER OG : rot 180:sc= 0.108 USER MOD Single : A 15 SER OG : rot 180:sc= -0.249 USER MOD Single : A 18 LYS NZ :NH3+ 166:sc= 0.481 (180deg=0.425) USER MOD Single : A 25 SER OG : rot 132:sc= -4.2! USER MOD Single : A 26 CYS SG : rot -56:sc= -1.99! USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 44 SER OG : rot -72:sc= -8.44! USER MOD Single : A 47 CYS SG : rot 180:sc= -2.52! USER MOD Single : A 49 TYR OH : rot 30:sc= -0.168 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -46:sc= 0.172 USER MOD Single : A 66 ASN : amide:sc= -2.05! C(o=-2!,f=-1!) USER MOD Single : A 73 THR OG1 : rot 69:sc= 0.941 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 GLN : amide:sc= -0.0948 X(o=-0.095,f=-0.41) USER MOD Single : B 19 LYS NZ :NH3+ 149:sc= 0.365 (180deg=-0.876) USER MOD Single : B 21 CYS SG : rot 53:sc= 1.23 USER MOD Single : B 27 TYR OH : rot 15:sc= -0.0709 USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 32 HIS : no HD1:sc= -15.6! C(o=-16!,f=-12!) USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ -120:sc= 0.394 (180deg=0) USER MOD Single : B 57 THR OG1 : rot -82:sc= -5.01! USER MOD Single : B 60 THR OG1 : rot 180:sc= -0.0191 USER MOD Single : B 68 THR OG1 : rot -19:sc= -0.799! USER MOD Single : B 78 CYS SG : rot -30:sc= 0.00557 USER MOD Single : B 81 SER OG : rot 180:sc= -2.53! USER MOD Single : B 82 ASN : amide:sc= -0.41 K(o=-0.41,f=-2.4) USER MOD Single : B 83 THR OG1 : rot -89:sc= 0.876 USER MOD Single : B 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 96 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 78 N PRO A 5 2.691 14.466 2.671 1.00 0.00 N ATOM 79 CA PRO A 5 3.772 13.566 2.215 1.00 0.00 C ATOM 80 C PRO A 5 3.841 13.535 0.684 1.00 0.00 C ATOM 81 O PRO A 5 3.018 14.111 0.002 1.00 0.00 O ATOM 82 CB PRO A 5 3.347 12.206 2.750 1.00 0.00 C ATOM 83 CG PRO A 5 1.854 12.278 2.893 1.00 0.00 C ATOM 84 CD PRO A 5 1.460 13.735 2.980 1.00 0.00 C ATOM 0 HA PRO A 5 4.758 13.878 2.561 1.00 0.00 H new ATOM 0 HB2 PRO A 5 3.637 11.408 2.067 1.00 0.00 H new ATOM 0 HB3 PRO A 5 3.823 11.995 3.708 1.00 0.00 H new ATOM 0 HG2 PRO A 5 1.367 11.802 2.042 1.00 0.00 H new ATOM 0 HG3 PRO A 5 1.531 11.742 3.786 1.00 0.00 H new ATOM 0 HD2 PRO A 5 0.667 13.975 2.271 1.00 0.00 H new ATOM 0 HD3 PRO A 5 1.087 13.987 3.973 1.00 0.00 H new ATOM 92 N LYS A 6 4.816 12.854 0.143 1.00 0.00 N ATOM 93 CA LYS A 6 4.936 12.772 -1.341 1.00 0.00 C ATOM 94 C LYS A 6 4.421 11.417 -1.833 1.00 0.00 C ATOM 95 O LYS A 6 4.261 10.489 -1.067 1.00 0.00 O ATOM 96 CB LYS A 6 6.430 12.914 -1.628 1.00 0.00 C ATOM 97 CG LYS A 6 6.641 13.954 -2.730 1.00 0.00 C ATOM 98 CD LYS A 6 8.136 14.236 -2.885 1.00 0.00 C ATOM 99 CE LYS A 6 8.375 15.747 -2.862 1.00 0.00 C ATOM 100 NZ LYS A 6 7.499 16.289 -3.939 1.00 0.00 N ATOM 0 H LYS A 6 5.534 12.351 0.665 1.00 0.00 H new ATOM 0 HA LYS A 6 4.352 13.540 -1.847 1.00 0.00 H new ATOM 0 HB2 LYS A 6 6.958 13.215 -0.723 1.00 0.00 H new ATOM 0 HB3 LYS A 6 6.845 11.954 -1.935 1.00 0.00 H new ATOM 0 HG2 LYS A 6 6.229 13.591 -3.671 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.110 14.874 -2.484 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.693 13.757 -2.080 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.502 13.813 -3.821 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.119 16.173 -1.892 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.423 15.984 -3.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 7.976 17.087 -4.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.307 15.544 -4.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 6.602 16.615 -3.526 1.00 0.00 H new ATOM 114 N SER A 7 4.160 11.296 -3.105 1.00 0.00 N ATOM 115 CA SER A 7 3.656 9.999 -3.639 1.00 0.00 C ATOM 116 C SER A 7 4.817 9.017 -3.825 1.00 0.00 C ATOM 117 O SER A 7 5.668 9.201 -4.672 1.00 0.00 O ATOM 118 CB SER A 7 3.025 10.345 -4.987 1.00 0.00 C ATOM 119 OG SER A 7 2.720 11.733 -5.021 1.00 0.00 O ATOM 0 H SER A 7 4.273 12.037 -3.797 1.00 0.00 H new ATOM 0 HA SER A 7 2.943 9.523 -2.965 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.709 10.091 -5.797 1.00 0.00 H new ATOM 0 HB3 SER A 7 2.119 9.758 -5.139 1.00 0.00 H new ATOM 0 HG SER A 7 2.317 11.958 -5.885 1.00 0.00 H new ATOM 125 N VAL A 8 4.858 7.976 -3.038 1.00 0.00 N ATOM 126 CA VAL A 8 5.965 6.986 -3.171 1.00 0.00 C ATOM 127 C VAL A 8 5.430 5.560 -3.002 1.00 0.00 C ATOM 128 O VAL A 8 5.215 5.094 -1.901 1.00 0.00 O ATOM 129 CB VAL A 8 6.939 7.329 -2.043 1.00 0.00 C ATOM 130 CG1 VAL A 8 6.185 7.378 -0.714 1.00 0.00 C ATOM 131 CG2 VAL A 8 8.030 6.258 -1.969 1.00 0.00 C ATOM 0 H VAL A 8 4.174 7.769 -2.310 1.00 0.00 H new ATOM 0 HA VAL A 8 6.440 7.030 -4.151 1.00 0.00 H new ATOM 0 HB VAL A 8 7.393 8.300 -2.239 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.880 7.622 0.090 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.407 8.139 -0.765 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.730 6.407 -0.518 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.725 6.501 -1.165 1.00 0.00 H new ATOM 0 HG22 VAL A 8 7.574 5.287 -1.773 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.569 6.221 -2.916 1.00 0.00 H new ATOM 141 N LYS A 9 5.220 4.862 -4.085 1.00 0.00 N ATOM 142 CA LYS A 9 4.706 3.463 -3.986 1.00 0.00 C ATOM 143 C LYS A 9 5.855 2.509 -3.642 1.00 0.00 C ATOM 144 O LYS A 9 7.009 2.888 -3.652 1.00 0.00 O ATOM 145 CB LYS A 9 4.145 3.150 -5.375 1.00 0.00 C ATOM 146 CG LYS A 9 3.096 4.199 -5.747 1.00 0.00 C ATOM 147 CD LYS A 9 2.884 4.198 -7.263 1.00 0.00 C ATOM 148 CE LYS A 9 1.695 5.095 -7.613 1.00 0.00 C ATOM 149 NZ LYS A 9 2.030 6.424 -7.026 1.00 0.00 N ATOM 0 H LYS A 9 5.382 5.198 -5.034 1.00 0.00 H new ATOM 0 HA LYS A 9 3.951 3.349 -3.208 1.00 0.00 H new ATOM 0 HB2 LYS A 9 4.949 3.146 -6.111 1.00 0.00 H new ATOM 0 HB3 LYS A 9 3.700 2.155 -5.384 1.00 0.00 H new ATOM 0 HG2 LYS A 9 2.156 3.985 -5.238 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.420 5.186 -5.416 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.783 4.554 -7.767 1.00 0.00 H new ATOM 0 HD3 LYS A 9 2.703 3.182 -7.615 1.00 0.00 H new ATOM 0 HE2 LYS A 9 1.556 5.164 -8.692 1.00 0.00 H new ATOM 0 HE3 LYS A 9 0.768 4.702 -7.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.488 7.165 -7.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.789 6.427 -6.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.047 6.608 -7.140 1.00 0.00 H new ATOM 163 N LEU A 10 5.556 1.272 -3.340 1.00 0.00 N ATOM 164 CA LEU A 10 6.646 0.309 -3.000 1.00 0.00 C ATOM 165 C LEU A 10 6.454 -1.008 -3.753 1.00 0.00 C ATOM 166 O LEU A 10 5.410 -1.270 -4.317 1.00 0.00 O ATOM 167 CB LEU A 10 6.528 0.077 -1.495 1.00 0.00 C ATOM 168 CG LEU A 10 7.844 0.457 -0.815 1.00 0.00 C ATOM 169 CD1 LEU A 10 7.644 0.507 0.700 1.00 0.00 C ATOM 170 CD2 LEU A 10 8.910 -0.588 -1.148 1.00 0.00 C ATOM 0 H LEU A 10 4.611 0.889 -3.314 1.00 0.00 H new ATOM 0 HA LEU A 10 7.626 0.696 -3.279 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.711 0.672 -1.088 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.292 -0.968 -1.295 1.00 0.00 H new ATOM 0 HG LEU A 10 8.164 1.436 -1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 10 8.583 0.778 1.182 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.884 1.250 0.942 1.00 0.00 H new ATOM 0 HD13 LEU A 10 7.322 -0.471 1.057 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.848 -0.318 -0.664 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.586 -1.565 -0.791 1.00 0.00 H new ATOM 0 HD23 LEU A 10 9.057 -0.627 -2.227 1.00 0.00 H new ATOM 182 N ARG A 11 7.460 -1.836 -3.761 1.00 0.00 N ATOM 183 CA ARG A 11 7.349 -3.142 -4.473 1.00 0.00 C ATOM 184 C ARG A 11 8.152 -4.225 -3.742 1.00 0.00 C ATOM 185 O ARG A 11 9.028 -3.938 -2.950 1.00 0.00 O ATOM 186 CB ARG A 11 7.933 -2.889 -5.863 1.00 0.00 C ATOM 187 CG ARG A 11 7.673 -4.106 -6.753 1.00 0.00 C ATOM 188 CD ARG A 11 8.539 -4.018 -8.011 1.00 0.00 C ATOM 189 NE ARG A 11 7.771 -4.755 -9.054 1.00 0.00 N ATOM 190 CZ ARG A 11 8.384 -5.250 -10.098 1.00 0.00 C ATOM 191 NH1 ARG A 11 9.673 -5.102 -10.238 1.00 0.00 N ATOM 192 NH2 ARG A 11 7.702 -5.894 -11.005 1.00 0.00 N ATOM 0 H ARG A 11 8.356 -1.666 -3.305 1.00 0.00 H new ATOM 0 HA ARG A 11 6.319 -3.494 -4.520 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.481 -2.000 -6.303 1.00 0.00 H new ATOM 0 HB3 ARG A 11 9.004 -2.700 -5.791 1.00 0.00 H new ATOM 0 HG2 ARG A 11 7.899 -5.022 -6.208 1.00 0.00 H new ATOM 0 HG3 ARG A 11 6.619 -4.150 -7.027 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.708 -2.982 -8.303 1.00 0.00 H new ATOM 0 HD3 ARG A 11 9.519 -4.468 -7.849 1.00 0.00 H new ATOM 0 HE ARG A 11 6.763 -4.874 -8.953 1.00 0.00 H new ATOM 0 HH11 ARG A 11 10.208 -4.598 -9.531 1.00 0.00 H new ATOM 0 HH12 ARG A 11 10.145 -5.490 -11.054 1.00 0.00 H new ATOM 0 HH21 ARG A 11 6.694 -6.010 -10.899 1.00 0.00 H new ATOM 0 HH22 ARG A 11 8.177 -6.281 -11.821 1.00 0.00 H new ATOM 206 N ALA A 12 7.860 -5.470 -4.013 1.00 0.00 N ATOM 207 CA ALA A 12 8.601 -6.584 -3.348 1.00 0.00 C ATOM 208 C ALA A 12 9.110 -7.570 -4.409 1.00 0.00 C ATOM 209 O ALA A 12 8.668 -7.555 -5.540 1.00 0.00 O ATOM 210 CB ALA A 12 7.563 -7.252 -2.444 1.00 0.00 C ATOM 0 H ALA A 12 7.137 -5.765 -4.669 1.00 0.00 H new ATOM 0 HA ALA A 12 9.470 -6.241 -2.786 1.00 0.00 H new ATOM 0 HB1 ALA A 12 8.024 -8.086 -1.915 1.00 0.00 H new ATOM 0 HB2 ALA A 12 7.188 -6.526 -1.722 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.736 -7.621 -3.050 1.00 0.00 H new ATOM 216 N LEU A 13 10.034 -8.426 -4.058 1.00 0.00 N ATOM 217 CA LEU A 13 10.563 -9.402 -5.058 1.00 0.00 C ATOM 218 C LEU A 13 10.115 -10.825 -4.711 1.00 0.00 C ATOM 219 O LEU A 13 9.442 -11.480 -5.483 1.00 0.00 O ATOM 220 CB LEU A 13 12.085 -9.293 -4.959 1.00 0.00 C ATOM 221 CG LEU A 13 12.547 -7.976 -5.581 1.00 0.00 C ATOM 222 CD1 LEU A 13 14.056 -7.820 -5.382 1.00 0.00 C ATOM 223 CD2 LEU A 13 12.228 -7.985 -7.078 1.00 0.00 C ATOM 0 H LEU A 13 10.444 -8.492 -3.126 1.00 0.00 H new ATOM 0 HA LEU A 13 10.198 -9.188 -6.063 1.00 0.00 H new ATOM 0 HB2 LEU A 13 12.396 -9.343 -3.915 1.00 0.00 H new ATOM 0 HB3 LEU A 13 12.554 -10.133 -5.472 1.00 0.00 H new ATOM 0 HG LEU A 13 12.031 -7.144 -5.102 1.00 0.00 H new ATOM 0 HD11 LEU A 13 14.386 -6.881 -5.826 1.00 0.00 H new ATOM 0 HD12 LEU A 13 14.284 -7.818 -4.316 1.00 0.00 H new ATOM 0 HD13 LEU A 13 14.574 -8.650 -5.862 1.00 0.00 H new ATOM 0 HD21 LEU A 13 12.556 -7.047 -7.526 1.00 0.00 H new ATOM 0 HD22 LEU A 13 12.747 -8.816 -7.556 1.00 0.00 H new ATOM 0 HD23 LEU A 13 11.153 -8.099 -7.220 1.00 0.00 H new ATOM 235 N ARG A 14 10.488 -11.313 -3.558 1.00 0.00 N ATOM 236 CA ARG A 14 10.089 -12.696 -3.170 1.00 0.00 C ATOM 237 C ARG A 14 8.619 -12.939 -3.521 1.00 0.00 C ATOM 238 O ARG A 14 8.293 -13.810 -4.304 1.00 0.00 O ATOM 239 CB ARG A 14 10.298 -12.760 -1.657 1.00 0.00 C ATOM 240 CG ARG A 14 10.282 -14.220 -1.200 1.00 0.00 C ATOM 241 CD ARG A 14 10.195 -14.277 0.327 1.00 0.00 C ATOM 242 NE ARG A 14 10.928 -15.515 0.709 1.00 0.00 N ATOM 243 CZ ARG A 14 12.234 -15.527 0.728 1.00 0.00 C ATOM 244 NH1 ARG A 14 12.905 -14.451 0.411 1.00 0.00 N ATOM 245 NH2 ARG A 14 12.872 -16.615 1.063 1.00 0.00 N ATOM 0 H ARG A 14 11.051 -10.814 -2.869 1.00 0.00 H new ATOM 0 HA ARG A 14 10.670 -13.456 -3.693 1.00 0.00 H new ATOM 0 HB2 ARG A 14 11.247 -12.295 -1.390 1.00 0.00 H new ATOM 0 HB3 ARG A 14 9.514 -12.200 -1.147 1.00 0.00 H new ATOM 0 HG2 ARG A 14 9.433 -14.741 -1.643 1.00 0.00 H new ATOM 0 HG3 ARG A 14 11.183 -14.729 -1.543 1.00 0.00 H new ATOM 0 HD2 ARG A 14 10.647 -13.395 0.781 1.00 0.00 H new ATOM 0 HD3 ARG A 14 9.158 -14.313 0.662 1.00 0.00 H new ATOM 0 HE ARG A 14 10.408 -16.357 0.957 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.409 -13.600 0.148 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.925 -14.463 0.427 1.00 0.00 H new ATOM 0 HH21 ARG A 14 12.351 -17.456 1.310 1.00 0.00 H new ATOM 0 HH22 ARG A 14 13.892 -16.624 1.078 1.00 0.00 H new ATOM 259 N SER A 15 7.731 -12.173 -2.953 1.00 0.00 N ATOM 260 CA SER A 15 6.283 -12.355 -3.261 1.00 0.00 C ATOM 261 C SER A 15 5.803 -11.229 -4.180 1.00 0.00 C ATOM 262 O SER A 15 6.241 -10.103 -4.058 1.00 0.00 O ATOM 263 CB SER A 15 5.577 -12.283 -1.907 1.00 0.00 C ATOM 264 OG SER A 15 4.247 -12.767 -2.045 1.00 0.00 O ATOM 0 H SER A 15 7.944 -11.429 -2.289 1.00 0.00 H new ATOM 0 HA SER A 15 6.080 -13.296 -3.772 1.00 0.00 H new ATOM 0 HB2 SER A 15 6.118 -12.877 -1.170 1.00 0.00 H new ATOM 0 HB3 SER A 15 5.567 -11.255 -1.543 1.00 0.00 H new ATOM 0 HG SER A 15 3.792 -12.724 -1.178 1.00 0.00 H new ATOM 270 N PRO A 16 4.915 -11.572 -5.073 1.00 0.00 N ATOM 271 CA PRO A 16 4.376 -10.568 -6.021 1.00 0.00 C ATOM 272 C PRO A 16 3.412 -9.623 -5.301 1.00 0.00 C ATOM 273 O PRO A 16 2.211 -9.805 -5.326 1.00 0.00 O ATOM 274 CB PRO A 16 3.640 -11.414 -7.056 1.00 0.00 C ATOM 275 CG PRO A 16 3.287 -12.682 -6.343 1.00 0.00 C ATOM 276 CD PRO A 16 4.337 -12.903 -5.282 1.00 0.00 C ATOM 0 HA PRO A 16 5.146 -9.937 -6.465 1.00 0.00 H new ATOM 0 HB2 PRO A 16 2.748 -10.904 -7.419 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.270 -11.612 -7.924 1.00 0.00 H new ATOM 0 HG2 PRO A 16 2.296 -12.609 -5.895 1.00 0.00 H new ATOM 0 HG3 PRO A 16 3.261 -13.520 -7.039 1.00 0.00 H new ATOM 0 HD2 PRO A 16 3.900 -13.297 -4.364 1.00 0.00 H new ATOM 0 HD3 PRO A 16 5.091 -13.619 -5.609 1.00 0.00 H new ATOM 284 N ARG A 17 3.930 -8.609 -4.665 1.00 0.00 N ATOM 285 CA ARG A 17 3.049 -7.645 -3.947 1.00 0.00 C ATOM 286 C ARG A 17 3.641 -6.236 -4.026 1.00 0.00 C ATOM 287 O ARG A 17 4.840 -6.062 -4.107 1.00 0.00 O ATOM 288 CB ARG A 17 3.013 -8.132 -2.500 1.00 0.00 C ATOM 289 CG ARG A 17 1.868 -7.439 -1.760 1.00 0.00 C ATOM 290 CD ARG A 17 1.534 -8.217 -0.486 1.00 0.00 C ATOM 291 NE ARG A 17 0.319 -9.007 -0.827 1.00 0.00 N ATOM 292 CZ ARG A 17 -0.415 -9.526 0.121 1.00 0.00 C ATOM 293 NH1 ARG A 17 -0.087 -9.354 1.373 1.00 0.00 N ATOM 294 NH2 ARG A 17 -1.479 -10.217 -0.185 1.00 0.00 N ATOM 0 H ARG A 17 4.928 -8.406 -4.611 1.00 0.00 H new ATOM 0 HA ARG A 17 2.050 -7.598 -4.380 1.00 0.00 H new ATOM 0 HB2 ARG A 17 2.877 -9.213 -2.472 1.00 0.00 H new ATOM 0 HB3 ARG A 17 3.962 -7.917 -2.008 1.00 0.00 H new ATOM 0 HG2 ARG A 17 2.150 -6.416 -1.510 1.00 0.00 H new ATOM 0 HG3 ARG A 17 0.990 -7.380 -2.403 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.358 -8.867 -0.192 1.00 0.00 H new ATOM 0 HD3 ARG A 17 1.346 -7.544 0.350 1.00 0.00 H new ATOM 0 HE ARG A 17 0.059 -9.143 -1.804 1.00 0.00 H new ATOM 0 HH11 ARG A 17 0.744 -8.813 1.613 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -0.662 -9.760 2.111 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -1.736 -10.351 -1.163 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -2.053 -10.623 0.554 1.00 0.00 H new ATOM 308 N LYS A 18 2.812 -5.230 -4.000 1.00 0.00 N ATOM 309 CA LYS A 18 3.336 -3.836 -4.074 1.00 0.00 C ATOM 310 C LYS A 18 2.546 -2.920 -3.135 1.00 0.00 C ATOM 311 O LYS A 18 1.370 -2.683 -3.327 1.00 0.00 O ATOM 312 CB LYS A 18 3.142 -3.416 -5.531 1.00 0.00 C ATOM 313 CG LYS A 18 1.649 -3.277 -5.829 1.00 0.00 C ATOM 314 CD LYS A 18 1.425 -3.301 -7.342 1.00 0.00 C ATOM 315 CE LYS A 18 2.322 -2.255 -8.008 1.00 0.00 C ATOM 316 NZ LYS A 18 1.565 -1.810 -9.211 1.00 0.00 N ATOM 0 H LYS A 18 1.798 -5.311 -3.931 1.00 0.00 H new ATOM 0 HA LYS A 18 4.380 -3.771 -3.769 1.00 0.00 H new ATOM 0 HB2 LYS A 18 3.650 -2.470 -5.718 1.00 0.00 H new ATOM 0 HB3 LYS A 18 3.589 -4.155 -6.196 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.096 -4.089 -5.356 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.269 -2.346 -5.409 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.648 -4.292 -7.738 1.00 0.00 H new ATOM 0 HD3 LYS A 18 0.379 -3.096 -7.569 1.00 0.00 H new ATOM 0 HE2 LYS A 18 2.522 -1.420 -7.336 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.287 -2.680 -8.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.991 -0.939 -9.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.600 -2.553 -9.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.575 -1.627 -8.950 1.00 0.00 H new ATOM 330 N PHE A 19 3.184 -2.402 -2.121 1.00 0.00 N ATOM 331 CA PHE A 19 2.477 -1.499 -1.170 1.00 0.00 C ATOM 332 C PHE A 19 2.662 -0.041 -1.593 1.00 0.00 C ATOM 333 O PHE A 19 3.760 0.399 -1.869 1.00 0.00 O ATOM 334 CB PHE A 19 3.145 -1.748 0.182 1.00 0.00 C ATOM 335 CG PHE A 19 2.763 -3.114 0.696 1.00 0.00 C ATOM 336 CD1 PHE A 19 3.232 -4.264 0.052 1.00 0.00 C ATOM 337 CD2 PHE A 19 1.941 -3.229 1.824 1.00 0.00 C ATOM 338 CE1 PHE A 19 2.878 -5.530 0.534 1.00 0.00 C ATOM 339 CE2 PHE A 19 1.586 -4.496 2.305 1.00 0.00 C ATOM 340 CZ PHE A 19 2.055 -5.646 1.660 1.00 0.00 C ATOM 0 H PHE A 19 4.168 -2.566 -1.910 1.00 0.00 H new ATOM 0 HA PHE A 19 1.404 -1.690 -1.138 1.00 0.00 H new ATOM 0 HB2 PHE A 19 4.228 -1.677 0.082 1.00 0.00 H new ATOM 0 HB3 PHE A 19 2.840 -0.982 0.895 1.00 0.00 H new ATOM 0 HD1 PHE A 19 3.867 -4.175 -0.817 1.00 0.00 H new ATOM 0 HD2 PHE A 19 1.581 -2.341 2.323 1.00 0.00 H new ATOM 0 HE1 PHE A 19 3.240 -6.418 0.037 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.950 -4.585 3.174 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.782 -6.623 2.031 1.00 0.00 H new ATOM 350 N GLY A 20 1.600 0.715 -1.644 1.00 0.00 N ATOM 351 CA GLY A 20 1.731 2.143 -2.047 1.00 0.00 C ATOM 352 C GLY A 20 1.422 3.045 -0.851 1.00 0.00 C ATOM 353 O GLY A 20 0.341 3.011 -0.298 1.00 0.00 O ATOM 0 H GLY A 20 0.652 0.408 -1.425 1.00 0.00 H new ATOM 0 HA2 GLY A 20 2.740 2.337 -2.411 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.048 2.364 -2.868 1.00 0.00 H new ATOM 357 N VAL A 21 2.365 3.854 -0.450 1.00 0.00 N ATOM 358 CA VAL A 21 2.131 4.763 0.709 1.00 0.00 C ATOM 359 C VAL A 21 2.770 6.131 0.449 1.00 0.00 C ATOM 360 O VAL A 21 3.891 6.226 -0.011 1.00 0.00 O ATOM 361 CB VAL A 21 2.803 4.071 1.896 1.00 0.00 C ATOM 362 CG1 VAL A 21 2.857 5.028 3.087 1.00 0.00 C ATOM 363 CG2 VAL A 21 1.996 2.829 2.279 1.00 0.00 C ATOM 0 H VAL A 21 3.289 3.925 -0.876 1.00 0.00 H new ATOM 0 HA VAL A 21 1.070 4.940 0.888 1.00 0.00 H new ATOM 0 HB VAL A 21 3.817 3.781 1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 21 3.336 4.532 3.931 1.00 0.00 H new ATOM 0 HG12 VAL A 21 3.429 5.915 2.815 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.844 5.320 3.365 1.00 0.00 H new ATOM 0 HG21 VAL A 21 2.472 2.333 3.125 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.983 3.124 2.554 1.00 0.00 H new ATOM 0 HG23 VAL A 21 1.957 2.145 1.432 1.00 0.00 H new ATOM 373 N ALA A 22 2.066 7.191 0.739 1.00 0.00 N ATOM 374 CA ALA A 22 2.631 8.553 0.508 1.00 0.00 C ATOM 375 C ALA A 22 3.153 9.146 1.823 1.00 0.00 C ATOM 376 O ALA A 22 2.432 9.797 2.551 1.00 0.00 O ATOM 377 CB ALA A 22 1.460 9.378 -0.025 1.00 0.00 C ATOM 0 H ALA A 22 1.123 7.174 1.126 1.00 0.00 H new ATOM 0 HA ALA A 22 3.472 8.539 -0.185 1.00 0.00 H new ATOM 0 HB1 ALA A 22 1.793 10.397 -0.221 1.00 0.00 H new ATOM 0 HB2 ALA A 22 1.092 8.932 -0.949 1.00 0.00 H new ATOM 0 HB3 ALA A 22 0.659 9.394 0.715 1.00 0.00 H new ATOM 383 N GLY A 23 4.403 8.928 2.130 1.00 0.00 N ATOM 384 CA GLY A 23 4.968 9.480 3.396 1.00 0.00 C ATOM 385 C GLY A 23 5.930 10.626 3.073 1.00 0.00 C ATOM 386 O GLY A 23 6.554 10.649 2.031 1.00 0.00 O ATOM 0 H GLY A 23 5.057 8.392 1.560 1.00 0.00 H new ATOM 0 HA2 GLY A 23 4.164 9.837 4.039 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.491 8.697 3.945 1.00 0.00 H new ATOM 390 N ARG A 24 6.053 11.578 3.959 1.00 0.00 N ATOM 391 CA ARG A 24 6.977 12.721 3.700 1.00 0.00 C ATOM 392 C ARG A 24 8.390 12.379 4.179 1.00 0.00 C ATOM 393 O ARG A 24 9.368 12.903 3.684 1.00 0.00 O ATOM 394 CB ARG A 24 6.409 13.886 4.513 1.00 0.00 C ATOM 395 CG ARG A 24 7.047 15.195 4.039 1.00 0.00 C ATOM 396 CD ARG A 24 6.870 16.269 5.115 1.00 0.00 C ATOM 397 NE ARG A 24 8.239 16.819 5.336 1.00 0.00 N ATOM 398 CZ ARG A 24 8.833 17.500 4.392 1.00 0.00 C ATOM 399 NH1 ARG A 24 8.231 17.702 3.250 1.00 0.00 N ATOM 400 NH2 ARG A 24 10.031 17.978 4.590 1.00 0.00 N ATOM 0 H ARG A 24 5.555 11.614 4.849 1.00 0.00 H new ATOM 0 HA ARG A 24 7.047 12.959 2.639 1.00 0.00 H new ATOM 0 HB2 ARG A 24 5.326 13.933 4.395 1.00 0.00 H new ATOM 0 HB3 ARG A 24 6.608 13.735 5.574 1.00 0.00 H new ATOM 0 HG2 ARG A 24 8.107 15.042 3.834 1.00 0.00 H new ATOM 0 HG3 ARG A 24 6.585 15.520 3.107 1.00 0.00 H new ATOM 0 HD2 ARG A 24 6.180 17.047 4.788 1.00 0.00 H new ATOM 0 HD3 ARG A 24 6.461 15.846 6.033 1.00 0.00 H new ATOM 0 HE ARG A 24 8.712 16.663 6.226 1.00 0.00 H new ATOM 0 HH11 ARG A 24 7.295 17.328 3.094 1.00 0.00 H new ATOM 0 HH12 ARG A 24 8.697 18.234 2.515 1.00 0.00 H new ATOM 0 HH21 ARG A 24 10.502 17.820 5.481 1.00 0.00 H new ATOM 0 HH22 ARG A 24 10.496 18.510 3.854 1.00 0.00 H new ATOM 414 N SER A 25 8.504 11.506 5.141 1.00 0.00 N ATOM 415 CA SER A 25 9.853 11.134 5.655 1.00 0.00 C ATOM 416 C SER A 25 10.385 9.898 4.919 1.00 0.00 C ATOM 417 O SER A 25 9.761 8.857 4.895 1.00 0.00 O ATOM 418 CB SER A 25 9.643 10.854 7.140 1.00 0.00 C ATOM 419 OG SER A 25 10.816 10.256 7.676 1.00 0.00 O ATOM 0 H SER A 25 7.722 11.034 5.594 1.00 0.00 H new ATOM 0 HA SER A 25 10.592 11.920 5.497 1.00 0.00 H new ATOM 0 HB2 SER A 25 9.419 11.781 7.668 1.00 0.00 H new ATOM 0 HB3 SER A 25 8.788 10.193 7.280 1.00 0.00 H new ATOM 0 HG SER A 25 11.065 10.712 8.507 1.00 0.00 H new ATOM 425 N CYS A 26 11.536 10.018 4.307 1.00 0.00 N ATOM 426 CA CYS A 26 12.120 8.867 3.555 1.00 0.00 C ATOM 427 C CYS A 26 12.299 7.651 4.469 1.00 0.00 C ATOM 428 O CYS A 26 11.519 6.721 4.430 1.00 0.00 O ATOM 429 CB CYS A 26 13.478 9.368 3.061 1.00 0.00 C ATOM 430 SG CYS A 26 13.228 10.650 1.809 1.00 0.00 S ATOM 0 H CYS A 26 12.099 10.869 4.296 1.00 0.00 H new ATOM 0 HA CYS A 26 11.474 8.547 2.737 1.00 0.00 H new ATOM 0 HB2 CYS A 26 14.056 9.767 3.895 1.00 0.00 H new ATOM 0 HB3 CYS A 26 14.052 8.542 2.641 1.00 0.00 H new ATOM 0 HG CYS A 26 12.487 10.181 0.849 1.00 0.00 H new ATOM 436 N GLN A 27 13.324 7.651 5.285 1.00 0.00 N ATOM 437 CA GLN A 27 13.553 6.492 6.201 1.00 0.00 C ATOM 438 C GLN A 27 12.217 6.006 6.760 1.00 0.00 C ATOM 439 O GLN A 27 11.969 4.823 6.882 1.00 0.00 O ATOM 440 CB GLN A 27 14.439 7.042 7.320 1.00 0.00 C ATOM 441 CG GLN A 27 14.840 5.905 8.263 1.00 0.00 C ATOM 442 CD GLN A 27 15.918 6.400 9.228 1.00 0.00 C ATOM 443 OE1 GLN A 27 16.997 6.774 8.813 1.00 0.00 O ATOM 444 NE2 GLN A 27 15.671 6.416 10.510 1.00 0.00 N ATOM 0 H GLN A 27 14.011 8.402 5.356 1.00 0.00 H new ATOM 0 HA GLN A 27 14.018 5.644 5.698 1.00 0.00 H new ATOM 0 HB2 GLN A 27 15.329 7.508 6.897 1.00 0.00 H new ATOM 0 HB3 GLN A 27 13.906 7.816 7.873 1.00 0.00 H new ATOM 0 HG2 GLN A 27 13.970 5.556 8.820 1.00 0.00 H new ATOM 0 HG3 GLN A 27 15.212 5.056 7.689 1.00 0.00 H new ATOM 0 HE21 GLN A 27 14.765 6.102 10.859 1.00 0.00 H new ATOM 0 HE22 GLN A 27 16.384 6.742 11.163 1.00 0.00 H new ATOM 453 N GLU A 28 11.353 6.923 7.081 1.00 0.00 N ATOM 454 CA GLU A 28 10.014 6.553 7.616 1.00 0.00 C ATOM 455 C GLU A 28 9.250 5.708 6.592 1.00 0.00 C ATOM 456 O GLU A 28 8.949 4.554 6.823 1.00 0.00 O ATOM 457 CB GLU A 28 9.326 7.896 7.828 1.00 0.00 C ATOM 458 CG GLU A 28 9.692 8.449 9.207 1.00 0.00 C ATOM 459 CD GLU A 28 8.750 9.600 9.564 1.00 0.00 C ATOM 460 OE1 GLU A 28 7.555 9.440 9.379 1.00 0.00 O ATOM 461 OE2 GLU A 28 9.240 10.621 10.017 1.00 0.00 O ATOM 0 H GLU A 28 11.518 7.926 6.995 1.00 0.00 H new ATOM 0 HA GLU A 28 10.066 5.959 8.529 1.00 0.00 H new ATOM 0 HB2 GLU A 28 9.630 8.598 7.051 1.00 0.00 H new ATOM 0 HB3 GLU A 28 8.245 7.779 7.747 1.00 0.00 H new ATOM 0 HG2 GLU A 28 9.620 7.661 9.957 1.00 0.00 H new ATOM 0 HG3 GLU A 28 10.725 8.797 9.208 1.00 0.00 H new ATOM 468 N VAL A 29 8.937 6.281 5.462 1.00 0.00 N ATOM 469 CA VAL A 29 8.193 5.520 4.418 1.00 0.00 C ATOM 470 C VAL A 29 8.784 4.117 4.263 1.00 0.00 C ATOM 471 O VAL A 29 8.102 3.124 4.419 1.00 0.00 O ATOM 472 CB VAL A 29 8.381 6.329 3.134 1.00 0.00 C ATOM 473 CG1 VAL A 29 7.946 5.489 1.931 1.00 0.00 C ATOM 474 CG2 VAL A 29 7.528 7.597 3.204 1.00 0.00 C ATOM 0 H VAL A 29 9.165 7.244 5.216 1.00 0.00 H new ATOM 0 HA VAL A 29 7.140 5.392 4.669 1.00 0.00 H new ATOM 0 HB VAL A 29 9.431 6.600 3.026 1.00 0.00 H new ATOM 0 HG11 VAL A 29 8.080 6.066 1.016 1.00 0.00 H new ATOM 0 HG12 VAL A 29 8.552 4.584 1.881 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.896 5.217 2.038 1.00 0.00 H new ATOM 0 HG21 VAL A 29 7.660 8.175 2.290 1.00 0.00 H new ATOM 0 HG22 VAL A 29 6.478 7.324 3.312 1.00 0.00 H new ATOM 0 HG23 VAL A 29 7.837 8.196 4.060 1.00 0.00 H new ATOM 484 N LEU A 30 10.050 4.028 3.957 1.00 0.00 N ATOM 485 CA LEU A 30 10.684 2.689 3.794 1.00 0.00 C ATOM 486 C LEU A 30 10.499 1.859 5.067 1.00 0.00 C ATOM 487 O LEU A 30 9.999 0.753 5.031 1.00 0.00 O ATOM 488 CB LEU A 30 12.165 2.979 3.553 1.00 0.00 C ATOM 489 CG LEU A 30 12.347 3.577 2.157 1.00 0.00 C ATOM 490 CD1 LEU A 30 13.825 3.901 1.927 1.00 0.00 C ATOM 491 CD2 LEU A 30 11.880 2.568 1.106 1.00 0.00 C ATOM 0 H LEU A 30 10.672 4.824 3.813 1.00 0.00 H new ATOM 0 HA LEU A 30 10.243 2.119 2.976 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.539 3.671 4.308 1.00 0.00 H new ATOM 0 HB3 LEU A 30 12.746 2.061 3.646 1.00 0.00 H new ATOM 0 HG LEU A 30 11.757 4.490 2.075 1.00 0.00 H new ATOM 0 HD11 LEU A 30 13.954 4.327 0.932 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.161 4.619 2.675 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.415 2.988 2.010 1.00 0.00 H new ATOM 0 HD21 LEU A 30 12.009 2.993 0.111 1.00 0.00 H new ATOM 0 HD22 LEU A 30 12.470 1.655 1.190 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.827 2.335 1.267 1.00 0.00 H new ATOM 503 N ARG A 31 10.899 2.384 6.192 1.00 0.00 N ATOM 504 CA ARG A 31 10.746 1.625 7.467 1.00 0.00 C ATOM 505 C ARG A 31 9.357 0.984 7.537 1.00 0.00 C ATOM 506 O ARG A 31 9.221 -0.212 7.706 1.00 0.00 O ATOM 507 CB ARG A 31 10.911 2.673 8.570 1.00 0.00 C ATOM 508 CG ARG A 31 10.473 2.080 9.912 1.00 0.00 C ATOM 509 CD ARG A 31 10.299 3.204 10.936 1.00 0.00 C ATOM 510 NE ARG A 31 9.487 2.603 12.030 1.00 0.00 N ATOM 511 CZ ARG A 31 8.829 3.370 12.858 1.00 0.00 C ATOM 512 NH1 ARG A 31 8.878 4.669 12.732 1.00 0.00 N ATOM 513 NH2 ARG A 31 8.120 2.836 13.815 1.00 0.00 N ATOM 0 H ARG A 31 11.325 3.306 6.285 1.00 0.00 H new ATOM 0 HA ARG A 31 11.472 0.817 7.559 1.00 0.00 H new ATOM 0 HB2 ARG A 31 11.950 2.996 8.626 1.00 0.00 H new ATOM 0 HB3 ARG A 31 10.315 3.556 8.339 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.537 1.535 9.792 1.00 0.00 H new ATOM 0 HG3 ARG A 31 11.216 1.364 10.265 1.00 0.00 H new ATOM 0 HD2 ARG A 31 11.263 3.554 11.306 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.794 4.064 10.496 1.00 0.00 H new ATOM 0 HE ARG A 31 9.444 1.589 12.133 1.00 0.00 H new ATOM 0 HH11 ARG A 31 9.432 5.088 11.985 1.00 0.00 H new ATOM 0 HH12 ARG A 31 8.363 5.264 13.381 1.00 0.00 H new ATOM 0 HH21 ARG A 31 8.080 1.822 13.915 1.00 0.00 H new ATOM 0 HH22 ARG A 31 7.606 3.433 14.463 1.00 0.00 H new ATOM 527 N LYS A 32 8.323 1.771 7.413 1.00 0.00 N ATOM 528 CA LYS A 32 6.942 1.212 7.478 1.00 0.00 C ATOM 529 C LYS A 32 6.783 0.056 6.485 1.00 0.00 C ATOM 530 O LYS A 32 6.879 -1.101 6.845 1.00 0.00 O ATOM 531 CB LYS A 32 6.027 2.375 7.094 1.00 0.00 C ATOM 532 CG LYS A 32 6.059 3.435 8.196 1.00 0.00 C ATOM 533 CD LYS A 32 4.825 4.332 8.078 1.00 0.00 C ATOM 534 CE LYS A 32 4.505 4.944 9.443 1.00 0.00 C ATOM 535 NZ LYS A 32 4.469 6.415 9.204 1.00 0.00 N ATOM 0 H LYS A 32 8.375 2.779 7.269 1.00 0.00 H new ATOM 0 HA LYS A 32 6.708 0.813 8.465 1.00 0.00 H new ATOM 0 HB2 LYS A 32 6.350 2.809 6.148 1.00 0.00 H new ATOM 0 HB3 LYS A 32 5.008 2.017 6.949 1.00 0.00 H new ATOM 0 HG2 LYS A 32 6.081 2.956 9.175 1.00 0.00 H new ATOM 0 HG3 LYS A 32 6.966 4.034 8.113 1.00 0.00 H new ATOM 0 HD2 LYS A 32 5.004 5.121 7.347 1.00 0.00 H new ATOM 0 HD3 LYS A 32 3.974 3.753 7.719 1.00 0.00 H new ATOM 0 HE2 LYS A 32 3.550 4.582 9.824 1.00 0.00 H new ATOM 0 HE3 LYS A 32 5.263 4.682 10.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 4.255 6.906 10.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 5.393 6.732 8.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 3.734 6.635 8.502 1.00 0.00 H new ATOM 549 N GLY A 33 6.534 0.360 5.240 1.00 0.00 N ATOM 550 CA GLY A 33 6.363 -0.719 4.225 1.00 0.00 C ATOM 551 C GLY A 33 7.424 -1.800 4.434 1.00 0.00 C ATOM 552 O GLY A 33 7.117 -2.968 4.571 1.00 0.00 O ATOM 0 H GLY A 33 6.441 1.310 4.881 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.367 -1.154 4.307 1.00 0.00 H new ATOM 0 HA3 GLY A 33 6.447 -0.303 3.221 1.00 0.00 H new ATOM 556 N CYS A 34 8.672 -1.422 4.455 1.00 0.00 N ATOM 557 CA CYS A 34 9.755 -2.430 4.651 1.00 0.00 C ATOM 558 C CYS A 34 9.426 -3.344 5.837 1.00 0.00 C ATOM 559 O CYS A 34 9.592 -4.545 5.768 1.00 0.00 O ATOM 560 CB CYS A 34 11.012 -1.609 4.938 1.00 0.00 C ATOM 561 SG CYS A 34 12.429 -2.720 5.123 1.00 0.00 S ATOM 0 H CYS A 34 8.990 -0.459 4.345 1.00 0.00 H new ATOM 0 HA CYS A 34 9.879 -3.076 3.781 1.00 0.00 H new ATOM 0 HB2 CYS A 34 11.192 -0.904 4.126 1.00 0.00 H new ATOM 0 HB3 CYS A 34 10.876 -1.021 5.846 1.00 0.00 H new ATOM 0 HG CYS A 34 13.499 -2.022 5.365 1.00 0.00 H new ATOM 567 N LEU A 35 8.965 -2.785 6.923 1.00 0.00 N ATOM 568 CA LEU A 35 8.631 -3.629 8.108 1.00 0.00 C ATOM 569 C LEU A 35 7.538 -4.639 7.749 1.00 0.00 C ATOM 570 O LEU A 35 7.535 -5.757 8.225 1.00 0.00 O ATOM 571 CB LEU A 35 8.131 -2.647 9.168 1.00 0.00 C ATOM 572 CG LEU A 35 9.319 -1.895 9.766 1.00 0.00 C ATOM 573 CD1 LEU A 35 8.834 -0.588 10.395 1.00 0.00 C ATOM 574 CD2 LEU A 35 9.981 -2.761 10.841 1.00 0.00 C ATOM 0 H LEU A 35 8.805 -1.785 7.042 1.00 0.00 H new ATOM 0 HA LEU A 35 9.488 -4.204 8.459 1.00 0.00 H new ATOM 0 HB2 LEU A 35 7.427 -1.943 8.724 1.00 0.00 H new ATOM 0 HB3 LEU A 35 7.594 -3.183 9.951 1.00 0.00 H new ATOM 0 HG LEU A 35 10.040 -1.674 8.979 1.00 0.00 H new ATOM 0 HD11 LEU A 35 9.682 -0.053 10.821 1.00 0.00 H new ATOM 0 HD12 LEU A 35 8.361 0.030 9.631 1.00 0.00 H new ATOM 0 HD13 LEU A 35 8.112 -0.809 11.181 1.00 0.00 H new ATOM 0 HD21 LEU A 35 10.829 -2.226 11.268 1.00 0.00 H new ATOM 0 HD22 LEU A 35 9.258 -2.982 11.626 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.328 -3.693 10.395 1.00 0.00 H new ATOM 586 N ARG A 36 6.611 -4.258 6.913 1.00 0.00 N ATOM 587 CA ARG A 36 5.525 -5.203 6.528 1.00 0.00 C ATOM 588 C ARG A 36 6.114 -6.389 5.758 1.00 0.00 C ATOM 589 O ARG A 36 5.669 -7.512 5.892 1.00 0.00 O ATOM 590 CB ARG A 36 4.588 -4.392 5.632 1.00 0.00 C ATOM 591 CG ARG A 36 3.302 -5.184 5.388 1.00 0.00 C ATOM 592 CD ARG A 36 2.333 -4.954 6.550 1.00 0.00 C ATOM 593 NE ARG A 36 0.976 -5.097 5.953 1.00 0.00 N ATOM 594 CZ ARG A 36 -0.077 -5.165 6.725 1.00 0.00 C ATOM 595 NH1 ARG A 36 0.055 -5.110 8.022 1.00 0.00 N ATOM 596 NH2 ARG A 36 -1.264 -5.290 6.197 1.00 0.00 N ATOM 0 H ARG A 36 6.559 -3.336 6.481 1.00 0.00 H new ATOM 0 HA ARG A 36 5.003 -5.610 7.394 1.00 0.00 H new ATOM 0 HB2 ARG A 36 4.355 -3.436 6.102 1.00 0.00 H new ATOM 0 HB3 ARG A 36 5.077 -4.170 4.683 1.00 0.00 H new ATOM 0 HG2 ARG A 36 2.843 -4.872 4.450 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.529 -6.246 5.294 1.00 0.00 H new ATOM 0 HD2 ARG A 36 2.492 -5.681 7.347 1.00 0.00 H new ATOM 0 HD3 ARG A 36 2.469 -3.965 6.988 1.00 0.00 H new ATOM 0 HE ARG A 36 0.868 -5.142 4.940 1.00 0.00 H new ATOM 0 HH11 ARG A 36 0.982 -5.014 8.437 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -0.769 -5.163 8.621 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -1.369 -5.335 5.183 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -2.086 -5.343 6.798 1.00 0.00 H new ATOM 610 N PHE A 37 7.117 -6.148 4.959 1.00 0.00 N ATOM 611 CA PHE A 37 7.741 -7.252 4.186 1.00 0.00 C ATOM 612 C PHE A 37 8.606 -8.121 5.104 1.00 0.00 C ATOM 613 O PHE A 37 9.087 -9.165 4.712 1.00 0.00 O ATOM 614 CB PHE A 37 8.604 -6.543 3.144 1.00 0.00 C ATOM 615 CG PHE A 37 7.745 -6.102 1.980 1.00 0.00 C ATOM 616 CD1 PHE A 37 6.785 -6.971 1.449 1.00 0.00 C ATOM 617 CD2 PHE A 37 7.916 -4.827 1.429 1.00 0.00 C ATOM 618 CE1 PHE A 37 5.993 -6.563 0.368 1.00 0.00 C ATOM 619 CE2 PHE A 37 7.125 -4.421 0.346 1.00 0.00 C ATOM 620 CZ PHE A 37 6.164 -5.289 -0.183 1.00 0.00 C ATOM 0 H PHE A 37 7.531 -5.228 4.810 1.00 0.00 H new ATOM 0 HA PHE A 37 7.005 -7.916 3.732 1.00 0.00 H new ATOM 0 HB2 PHE A 37 9.096 -5.680 3.592 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.391 -7.212 2.794 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.655 -7.956 1.873 1.00 0.00 H new ATOM 0 HD2 PHE A 37 8.657 -4.156 1.838 1.00 0.00 H new ATOM 0 HE1 PHE A 37 5.250 -7.232 -0.040 1.00 0.00 H new ATOM 0 HE2 PHE A 37 7.257 -3.438 -0.080 1.00 0.00 H new ATOM 0 HZ PHE A 37 5.554 -4.975 -1.017 1.00 0.00 H new ATOM 630 N GLN A 38 8.809 -7.697 6.321 1.00 0.00 N ATOM 631 CA GLN A 38 9.643 -8.500 7.261 1.00 0.00 C ATOM 632 C GLN A 38 11.029 -8.747 6.657 1.00 0.00 C ATOM 633 O GLN A 38 11.367 -9.855 6.291 1.00 0.00 O ATOM 634 CB GLN A 38 8.890 -9.819 7.429 1.00 0.00 C ATOM 635 CG GLN A 38 7.464 -9.538 7.904 1.00 0.00 C ATOM 636 CD GLN A 38 6.668 -10.844 7.929 1.00 0.00 C ATOM 637 OE1 GLN A 38 7.096 -11.840 7.381 1.00 0.00 O ATOM 638 NE2 GLN A 38 5.520 -10.883 8.547 1.00 0.00 N ATOM 0 H GLN A 38 8.434 -6.830 6.706 1.00 0.00 H new ATOM 0 HA GLN A 38 9.796 -7.994 8.214 1.00 0.00 H new ATOM 0 HB2 GLN A 38 8.869 -10.361 6.483 1.00 0.00 H new ATOM 0 HB3 GLN A 38 9.405 -10.455 8.149 1.00 0.00 H new ATOM 0 HG2 GLN A 38 7.482 -9.091 8.898 1.00 0.00 H new ATOM 0 HG3 GLN A 38 6.983 -8.819 7.240 1.00 0.00 H new ATOM 0 HE21 GLN A 38 5.160 -10.047 9.007 1.00 0.00 H new ATOM 0 HE22 GLN A 38 4.982 -11.749 8.570 1.00 0.00 H new ATOM 647 N LEU A 39 11.830 -7.723 6.549 1.00 0.00 N ATOM 648 CA LEU A 39 13.192 -7.903 5.968 1.00 0.00 C ATOM 649 C LEU A 39 14.254 -7.332 6.913 1.00 0.00 C ATOM 650 O LEU A 39 14.167 -6.193 7.326 1.00 0.00 O ATOM 651 CB LEU A 39 13.169 -7.121 4.655 1.00 0.00 C ATOM 652 CG LEU A 39 12.379 -7.905 3.607 1.00 0.00 C ATOM 653 CD1 LEU A 39 12.125 -7.017 2.388 1.00 0.00 C ATOM 654 CD2 LEU A 39 13.182 -9.136 3.181 1.00 0.00 C ATOM 0 H LEU A 39 11.602 -6.771 6.837 1.00 0.00 H new ATOM 0 HA LEU A 39 13.438 -8.954 5.814 1.00 0.00 H new ATOM 0 HB2 LEU A 39 12.715 -6.142 4.810 1.00 0.00 H new ATOM 0 HB3 LEU A 39 14.187 -6.948 4.305 1.00 0.00 H new ATOM 0 HG LEU A 39 11.426 -8.220 4.032 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.562 -7.577 1.641 1.00 0.00 H new ATOM 0 HD12 LEU A 39 11.554 -6.139 2.690 1.00 0.00 H new ATOM 0 HD13 LEU A 39 13.078 -6.702 1.963 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.620 -9.696 2.434 1.00 0.00 H new ATOM 0 HD22 LEU A 39 14.135 -8.820 2.757 1.00 0.00 H new ATOM 0 HD23 LEU A 39 13.364 -9.770 4.049 1.00 0.00 H new ATOM 666 N PRO A 40 15.228 -8.147 7.220 1.00 0.00 N ATOM 667 CA PRO A 40 16.323 -7.717 8.123 1.00 0.00 C ATOM 668 C PRO A 40 17.246 -6.730 7.403 1.00 0.00 C ATOM 669 O PRO A 40 17.107 -6.483 6.222 1.00 0.00 O ATOM 670 CB PRO A 40 17.058 -9.017 8.439 1.00 0.00 C ATOM 671 CG PRO A 40 16.757 -9.921 7.286 1.00 0.00 C ATOM 672 CD PRO A 40 15.399 -9.531 6.762 1.00 0.00 C ATOM 0 HA PRO A 40 15.968 -7.207 9.018 1.00 0.00 H new ATOM 0 HB2 PRO A 40 18.130 -8.850 8.540 1.00 0.00 H new ATOM 0 HB3 PRO A 40 16.713 -9.447 9.379 1.00 0.00 H new ATOM 0 HG2 PRO A 40 17.514 -9.819 6.508 1.00 0.00 H new ATOM 0 HG3 PRO A 40 16.763 -10.964 7.602 1.00 0.00 H new ATOM 0 HD2 PRO A 40 15.355 -9.600 5.675 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.617 -10.181 7.155 1.00 0.00 H new ATOM 680 N GLU A 41 18.188 -6.165 8.106 1.00 0.00 N ATOM 681 CA GLU A 41 19.120 -5.196 7.460 1.00 0.00 C ATOM 682 C GLU A 41 20.078 -5.932 6.522 1.00 0.00 C ATOM 683 O GLU A 41 19.910 -5.936 5.320 1.00 0.00 O ATOM 684 CB GLU A 41 19.892 -4.561 8.616 1.00 0.00 C ATOM 685 CG GLU A 41 21.120 -3.828 8.071 1.00 0.00 C ATOM 686 CD GLU A 41 21.218 -2.445 8.717 1.00 0.00 C ATOM 687 OE1 GLU A 41 20.186 -1.818 8.888 1.00 0.00 O ATOM 688 OE2 GLU A 41 22.325 -2.036 9.028 1.00 0.00 O ATOM 0 H GLU A 41 18.353 -6.331 9.099 1.00 0.00 H new ATOM 0 HA GLU A 41 18.594 -4.453 6.861 1.00 0.00 H new ATOM 0 HB2 GLU A 41 19.250 -3.865 9.156 1.00 0.00 H new ATOM 0 HB3 GLU A 41 20.199 -5.328 9.326 1.00 0.00 H new ATOM 0 HG2 GLU A 41 22.022 -4.403 8.280 1.00 0.00 H new ATOM 0 HG3 GLU A 41 21.047 -3.731 6.988 1.00 0.00 H new ATOM 695 N ARG A 42 21.083 -6.556 7.068 1.00 0.00 N ATOM 696 CA ARG A 42 22.059 -7.295 6.216 1.00 0.00 C ATOM 697 C ARG A 42 21.351 -8.408 5.438 1.00 0.00 C ATOM 698 O ARG A 42 21.544 -8.566 4.248 1.00 0.00 O ATOM 699 CB ARG A 42 23.067 -7.887 7.202 1.00 0.00 C ATOM 700 CG ARG A 42 24.231 -8.514 6.432 1.00 0.00 C ATOM 701 CD ARG A 42 25.138 -9.269 7.407 1.00 0.00 C ATOM 702 NE ARG A 42 26.503 -9.170 6.818 1.00 0.00 N ATOM 703 CZ ARG A 42 27.156 -8.039 6.864 1.00 0.00 C ATOM 704 NH1 ARG A 42 26.617 -6.991 7.427 1.00 0.00 N ATOM 705 NH2 ARG A 42 28.351 -7.958 6.346 1.00 0.00 N ATOM 0 H ARG A 42 21.272 -6.587 8.070 1.00 0.00 H new ATOM 0 HA ARG A 42 22.536 -6.650 5.478 1.00 0.00 H new ATOM 0 HB2 ARG A 42 23.437 -7.109 7.870 1.00 0.00 H new ATOM 0 HB3 ARG A 42 22.583 -8.639 7.825 1.00 0.00 H new ATOM 0 HG2 ARG A 42 23.852 -9.194 5.669 1.00 0.00 H new ATOM 0 HG3 ARG A 42 24.798 -7.740 5.915 1.00 0.00 H new ATOM 0 HD2 ARG A 42 25.104 -8.825 8.402 1.00 0.00 H new ATOM 0 HD3 ARG A 42 24.827 -10.309 7.511 1.00 0.00 H new ATOM 0 HE ARG A 42 26.928 -9.986 6.378 1.00 0.00 H new ATOM 0 HH11 ARG A 42 25.683 -7.054 7.833 1.00 0.00 H new ATOM 0 HH12 ARG A 42 27.130 -6.110 7.461 1.00 0.00 H new ATOM 0 HH21 ARG A 42 28.773 -8.776 5.907 1.00 0.00 H new ATOM 0 HH22 ARG A 42 28.863 -7.077 6.380 1.00 0.00 H new ATOM 719 N GLY A 43 20.535 -9.182 6.100 1.00 0.00 N ATOM 720 CA GLY A 43 19.820 -10.288 5.402 1.00 0.00 C ATOM 721 C GLY A 43 19.018 -9.728 4.225 1.00 0.00 C ATOM 722 O GLY A 43 18.945 -10.330 3.172 1.00 0.00 O ATOM 0 H GLY A 43 20.332 -9.096 7.096 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.536 -11.028 5.046 1.00 0.00 H new ATOM 0 HA3 GLY A 43 19.154 -10.798 6.098 1.00 0.00 H new ATOM 726 N SER A 44 18.412 -8.585 4.393 1.00 0.00 N ATOM 727 CA SER A 44 17.614 -7.996 3.279 1.00 0.00 C ATOM 728 C SER A 44 17.988 -6.525 3.074 1.00 0.00 C ATOM 729 O SER A 44 17.996 -5.742 4.003 1.00 0.00 O ATOM 730 CB SER A 44 16.158 -8.121 3.724 1.00 0.00 C ATOM 731 OG SER A 44 15.307 -7.669 2.680 1.00 0.00 O ATOM 0 H SER A 44 18.434 -8.034 5.251 1.00 0.00 H new ATOM 0 HA SER A 44 17.796 -8.503 2.331 1.00 0.00 H new ATOM 0 HB2 SER A 44 15.929 -9.157 3.972 1.00 0.00 H new ATOM 0 HB3 SER A 44 15.990 -7.533 4.626 1.00 0.00 H new ATOM 0 HG SER A 44 15.368 -6.694 2.607 1.00 0.00 H new ATOM 737 N ARG A 45 18.294 -6.146 1.863 1.00 0.00 N ATOM 738 CA ARG A 45 18.664 -4.726 1.599 1.00 0.00 C ATOM 739 C ARG A 45 17.651 -4.085 0.647 1.00 0.00 C ATOM 740 O ARG A 45 17.149 -4.719 -0.260 1.00 0.00 O ATOM 741 CB ARG A 45 20.045 -4.791 0.946 1.00 0.00 C ATOM 742 CG ARG A 45 20.639 -3.384 0.868 1.00 0.00 C ATOM 743 CD ARG A 45 21.742 -3.352 -0.194 1.00 0.00 C ATOM 744 NE ARG A 45 23.009 -3.197 0.572 1.00 0.00 N ATOM 745 CZ ARG A 45 23.303 -2.052 1.128 1.00 0.00 C ATOM 746 NH1 ARG A 45 22.489 -1.038 1.017 1.00 0.00 N ATOM 747 NH2 ARG A 45 24.416 -1.922 1.798 1.00 0.00 N ATOM 0 H ARG A 45 18.304 -6.757 1.046 1.00 0.00 H new ATOM 0 HA ARG A 45 18.671 -4.125 2.508 1.00 0.00 H new ATOM 0 HB2 ARG A 45 20.701 -5.443 1.523 1.00 0.00 H new ATOM 0 HB3 ARG A 45 19.967 -5.220 -0.053 1.00 0.00 H new ATOM 0 HG2 ARG A 45 19.860 -2.663 0.620 1.00 0.00 H new ATOM 0 HG3 ARG A 45 21.045 -3.095 1.838 1.00 0.00 H new ATOM 0 HD2 ARG A 45 21.748 -4.268 -0.785 1.00 0.00 H new ATOM 0 HD3 ARG A 45 21.597 -2.525 -0.889 1.00 0.00 H new ATOM 0 HE ARG A 45 23.649 -3.986 0.663 1.00 0.00 H new ATOM 0 HH11 ARG A 45 21.619 -1.137 0.494 1.00 0.00 H new ATOM 0 HH12 ARG A 45 22.723 -0.146 1.453 1.00 0.00 H new ATOM 0 HH21 ARG A 45 25.054 -2.713 1.886 1.00 0.00 H new ATOM 0 HH22 ARG A 45 24.648 -1.029 2.233 1.00 0.00 H new ATOM 761 N LEU A 46 17.348 -2.831 0.845 1.00 0.00 N ATOM 762 CA LEU A 46 16.368 -2.150 -0.050 1.00 0.00 C ATOM 763 C LEU A 46 17.101 -1.485 -1.220 1.00 0.00 C ATOM 764 O LEU A 46 18.116 -0.842 -1.044 1.00 0.00 O ATOM 765 CB LEU A 46 15.695 -1.100 0.836 1.00 0.00 C ATOM 766 CG LEU A 46 14.455 -0.545 0.131 1.00 0.00 C ATOM 767 CD1 LEU A 46 14.888 0.337 -1.040 1.00 0.00 C ATOM 768 CD2 LEU A 46 13.601 -1.701 -0.393 1.00 0.00 C ATOM 0 H LEU A 46 17.736 -2.249 1.587 1.00 0.00 H new ATOM 0 HA LEU A 46 15.644 -2.841 -0.483 1.00 0.00 H new ATOM 0 HB2 LEU A 46 15.414 -1.543 1.791 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.394 -0.292 1.053 1.00 0.00 H new ATOM 0 HG LEU A 46 13.871 0.045 0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 46 14.006 0.733 -1.543 1.00 0.00 H new ATOM 0 HD12 LEU A 46 15.495 1.163 -0.669 1.00 0.00 H new ATOM 0 HD13 LEU A 46 15.472 -0.255 -1.745 1.00 0.00 H new ATOM 0 HD21 LEU A 46 12.719 -1.303 -0.895 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.184 -2.293 -1.099 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.291 -2.331 0.440 1.00 0.00 H new ATOM 780 N CYS A 47 16.596 -1.639 -2.414 1.00 0.00 N ATOM 781 CA CYS A 47 17.266 -1.021 -3.595 1.00 0.00 C ATOM 782 C CYS A 47 16.225 -0.401 -4.533 1.00 0.00 C ATOM 783 O CYS A 47 15.036 -0.497 -4.305 1.00 0.00 O ATOM 784 CB CYS A 47 18.004 -2.169 -4.288 1.00 0.00 C ATOM 785 SG CYS A 47 18.916 -3.134 -3.058 1.00 0.00 S ATOM 0 H CYS A 47 15.748 -2.166 -2.623 1.00 0.00 H new ATOM 0 HA CYS A 47 17.947 -0.220 -3.307 1.00 0.00 H new ATOM 0 HB2 CYS A 47 17.293 -2.808 -4.812 1.00 0.00 H new ATOM 0 HB3 CYS A 47 18.690 -1.774 -5.037 1.00 0.00 H new ATOM 0 HG CYS A 47 19.540 -4.110 -3.648 1.00 0.00 H new ATOM 791 N LEU A 48 16.665 0.247 -5.579 1.00 0.00 N ATOM 792 CA LEU A 48 15.699 0.885 -6.522 1.00 0.00 C ATOM 793 C LEU A 48 15.092 -0.158 -7.464 1.00 0.00 C ATOM 794 O LEU A 48 15.394 -1.333 -7.389 1.00 0.00 O ATOM 795 CB LEU A 48 16.529 1.895 -7.314 1.00 0.00 C ATOM 796 CG LEU A 48 16.869 3.091 -6.425 1.00 0.00 C ATOM 797 CD1 LEU A 48 17.913 3.964 -7.124 1.00 0.00 C ATOM 798 CD2 LEU A 48 15.603 3.914 -6.173 1.00 0.00 C ATOM 0 H LEU A 48 17.649 0.362 -5.821 1.00 0.00 H new ATOM 0 HA LEU A 48 14.868 1.354 -5.996 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.444 1.425 -7.674 1.00 0.00 H new ATOM 0 HB3 LEU A 48 15.975 2.228 -8.192 1.00 0.00 H new ATOM 0 HG LEU A 48 17.268 2.737 -5.475 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.156 4.817 -6.491 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.814 3.378 -7.306 1.00 0.00 H new ATOM 0 HD13 LEU A 48 17.513 4.319 -8.074 1.00 0.00 H new ATOM 0 HD21 LEU A 48 15.844 4.767 -5.539 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.205 4.269 -7.123 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.858 3.292 -5.677 1.00 0.00 H new ATOM 810 N TYR A 49 14.230 0.268 -8.348 1.00 0.00 N ATOM 811 CA TYR A 49 13.586 -0.688 -9.296 1.00 0.00 C ATOM 812 C TYR A 49 14.409 -0.812 -10.582 1.00 0.00 C ATOM 813 O TYR A 49 14.945 -1.858 -10.890 1.00 0.00 O ATOM 814 CB TYR A 49 12.217 -0.074 -9.596 1.00 0.00 C ATOM 815 CG TYR A 49 11.382 -1.044 -10.396 1.00 0.00 C ATOM 816 CD1 TYR A 49 11.773 -1.411 -11.691 1.00 0.00 C ATOM 817 CD2 TYR A 49 10.211 -1.577 -9.844 1.00 0.00 C ATOM 818 CE1 TYR A 49 10.994 -2.308 -12.430 1.00 0.00 C ATOM 819 CE2 TYR A 49 9.432 -2.474 -10.584 1.00 0.00 C ATOM 820 CZ TYR A 49 9.823 -2.840 -11.877 1.00 0.00 C ATOM 821 OH TYR A 49 9.056 -3.725 -12.606 1.00 0.00 O ATOM 0 H TYR A 49 13.943 1.241 -8.455 1.00 0.00 H new ATOM 0 HA TYR A 49 13.509 -1.692 -8.878 1.00 0.00 H new ATOM 0 HB2 TYR A 49 11.708 0.175 -8.665 1.00 0.00 H new ATOM 0 HB3 TYR A 49 12.340 0.856 -10.150 1.00 0.00 H new ATOM 0 HD1 TYR A 49 12.676 -1.001 -12.119 1.00 0.00 H new ATOM 0 HD2 TYR A 49 9.908 -1.296 -8.846 1.00 0.00 H new ATOM 0 HE1 TYR A 49 11.296 -2.590 -13.428 1.00 0.00 H new ATOM 0 HE2 TYR A 49 8.529 -2.884 -10.157 1.00 0.00 H new ATOM 0 HH TYR A 49 9.632 -4.232 -13.215 1.00 0.00 H new ATOM 831 N GLU A 50 14.504 0.246 -11.340 1.00 0.00 N ATOM 832 CA GLU A 50 15.281 0.188 -12.613 1.00 0.00 C ATOM 833 C GLU A 50 16.726 -0.235 -12.338 1.00 0.00 C ATOM 834 O GLU A 50 17.164 -1.291 -12.752 1.00 0.00 O ATOM 835 CB GLU A 50 15.237 1.612 -13.168 1.00 0.00 C ATOM 836 CG GLU A 50 15.438 1.576 -14.684 1.00 0.00 C ATOM 837 CD GLU A 50 14.423 2.502 -15.355 1.00 0.00 C ATOM 838 OE1 GLU A 50 13.659 3.130 -14.640 1.00 0.00 O ATOM 839 OE2 GLU A 50 14.426 2.569 -16.573 1.00 0.00 O ATOM 0 H GLU A 50 14.077 1.149 -11.134 1.00 0.00 H new ATOM 0 HA GLU A 50 14.868 -0.538 -13.314 1.00 0.00 H new ATOM 0 HB2 GLU A 50 14.281 2.078 -12.928 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.013 2.219 -12.702 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.452 1.888 -14.935 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.317 0.558 -15.054 1.00 0.00 H new ATOM 846 N ASP A 51 17.470 0.579 -11.644 1.00 0.00 N ATOM 847 CA ASP A 51 18.882 0.222 -11.345 1.00 0.00 C ATOM 848 C ASP A 51 18.935 -0.765 -10.178 1.00 0.00 C ATOM 849 O ASP A 51 19.635 -1.758 -10.221 1.00 0.00 O ATOM 850 CB ASP A 51 19.541 1.546 -10.962 1.00 0.00 C ATOM 851 CG ASP A 51 19.238 2.595 -12.034 1.00 0.00 C ATOM 852 OD1 ASP A 51 19.900 2.577 -13.058 1.00 0.00 O ATOM 853 OD2 ASP A 51 18.347 3.399 -11.812 1.00 0.00 O ATOM 0 H ASP A 51 17.160 1.476 -11.271 1.00 0.00 H new ATOM 0 HA ASP A 51 19.383 -0.256 -12.187 1.00 0.00 H new ATOM 0 HB2 ASP A 51 19.170 1.882 -9.994 1.00 0.00 H new ATOM 0 HB3 ASP A 51 20.618 1.413 -10.862 1.00 0.00 H new ATOM 858 N GLY A 52 18.198 -0.499 -9.135 1.00 0.00 N ATOM 859 CA GLY A 52 18.200 -1.419 -7.962 1.00 0.00 C ATOM 860 C GLY A 52 19.622 -1.550 -7.411 1.00 0.00 C ATOM 861 O GLY A 52 19.913 -2.430 -6.627 1.00 0.00 O ATOM 0 H GLY A 52 17.593 0.317 -9.044 1.00 0.00 H new ATOM 0 HA2 GLY A 52 17.533 -1.038 -7.188 1.00 0.00 H new ATOM 0 HA3 GLY A 52 17.822 -2.398 -8.255 1.00 0.00 H new ATOM 865 N THR A 53 20.510 -0.683 -7.814 1.00 0.00 N ATOM 866 CA THR A 53 21.912 -0.768 -7.308 1.00 0.00 C ATOM 867 C THR A 53 21.949 -0.586 -5.782 1.00 0.00 C ATOM 868 O THR A 53 22.121 -1.539 -5.048 1.00 0.00 O ATOM 869 CB THR A 53 22.690 0.338 -8.038 1.00 0.00 C ATOM 870 OG1 THR A 53 23.909 0.588 -7.353 1.00 0.00 O ATOM 871 CG2 THR A 53 21.865 1.627 -8.117 1.00 0.00 C ATOM 0 H THR A 53 20.328 0.078 -8.469 1.00 0.00 H new ATOM 0 HA THR A 53 22.357 -1.744 -7.503 1.00 0.00 H new ATOM 0 HB THR A 53 22.899 0.004 -9.054 1.00 0.00 H new ATOM 0 HG1 THR A 53 24.407 1.292 -7.818 1.00 0.00 H new ATOM 0 HG21 THR A 53 22.438 2.394 -8.638 1.00 0.00 H new ATOM 0 HG22 THR A 53 20.939 1.434 -8.659 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.630 1.971 -7.110 1.00 0.00 H new ATOM 879 N GLU A 54 21.786 0.613 -5.289 1.00 0.00 N ATOM 880 CA GLU A 54 21.813 0.816 -3.813 1.00 0.00 C ATOM 881 C GLU A 54 20.750 1.838 -3.401 1.00 0.00 C ATOM 882 O GLU A 54 20.546 2.836 -4.061 1.00 0.00 O ATOM 883 CB GLU A 54 23.216 1.343 -3.507 1.00 0.00 C ATOM 884 CG GLU A 54 23.352 2.773 -4.035 1.00 0.00 C ATOM 885 CD GLU A 54 24.681 3.368 -3.566 1.00 0.00 C ATOM 886 OE1 GLU A 54 25.702 2.737 -3.787 1.00 0.00 O ATOM 887 OE2 GLU A 54 24.656 4.444 -2.992 1.00 0.00 O ATOM 0 H GLU A 54 21.636 1.457 -5.843 1.00 0.00 H new ATOM 0 HA GLU A 54 21.598 -0.102 -3.266 1.00 0.00 H new ATOM 0 HB2 GLU A 54 23.397 1.322 -2.432 1.00 0.00 H new ATOM 0 HB3 GLU A 54 23.966 0.701 -3.969 1.00 0.00 H new ATOM 0 HG2 GLU A 54 23.305 2.776 -5.124 1.00 0.00 H new ATOM 0 HG3 GLU A 54 22.522 3.384 -3.679 1.00 0.00 H new ATOM 894 N LEU A 55 20.070 1.595 -2.314 1.00 0.00 N ATOM 895 CA LEU A 55 19.021 2.553 -1.860 1.00 0.00 C ATOM 896 C LEU A 55 19.064 2.699 -0.336 1.00 0.00 C ATOM 897 O LEU A 55 18.726 1.789 0.393 1.00 0.00 O ATOM 898 CB LEU A 55 17.697 1.929 -2.304 1.00 0.00 C ATOM 899 CG LEU A 55 16.567 2.948 -2.145 1.00 0.00 C ATOM 900 CD1 LEU A 55 16.328 3.226 -0.659 1.00 0.00 C ATOM 901 CD2 LEU A 55 16.954 4.251 -2.847 1.00 0.00 C ATOM 0 H LEU A 55 20.195 0.775 -1.720 1.00 0.00 H new ATOM 0 HA LEU A 55 19.161 3.550 -2.278 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.766 1.607 -3.343 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.485 1.041 -1.709 1.00 0.00 H new ATOM 0 HG LEU A 55 15.656 2.548 -2.590 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.523 3.952 -0.550 1.00 0.00 H new ATOM 0 HD12 LEU A 55 16.052 2.300 -0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.239 3.625 -0.212 1.00 0.00 H new ATOM 0 HD21 LEU A 55 16.150 4.978 -2.734 1.00 0.00 H new ATOM 0 HD22 LEU A 55 17.866 4.647 -2.401 1.00 0.00 H new ATOM 0 HD23 LEU A 55 17.122 4.057 -3.906 1.00 0.00 H new ATOM 913 N THR A 56 19.478 3.838 0.150 1.00 0.00 N ATOM 914 CA THR A 56 19.541 4.039 1.626 1.00 0.00 C ATOM 915 C THR A 56 18.179 4.489 2.158 1.00 0.00 C ATOM 916 O THR A 56 17.422 5.151 1.475 1.00 0.00 O ATOM 917 CB THR A 56 20.586 5.136 1.833 1.00 0.00 C ATOM 918 OG1 THR A 56 20.616 5.506 3.205 1.00 0.00 O ATOM 919 CG2 THR A 56 20.225 6.355 0.983 1.00 0.00 C ATOM 0 H THR A 56 19.775 4.637 -0.410 1.00 0.00 H new ATOM 0 HA THR A 56 19.801 3.123 2.156 1.00 0.00 H new ATOM 0 HB THR A 56 21.566 4.765 1.534 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.286 6.208 3.340 1.00 0.00 H new ATOM 0 HG21 THR A 56 20.971 7.136 1.132 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.202 6.071 -0.069 1.00 0.00 H new ATOM 0 HG23 THR A 56 19.245 6.728 1.280 1.00 0.00 H new ATOM 927 N GLU A 57 17.859 4.136 3.374 1.00 0.00 N ATOM 928 CA GLU A 57 16.546 4.546 3.948 1.00 0.00 C ATOM 929 C GLU A 57 16.584 6.025 4.342 1.00 0.00 C ATOM 930 O GLU A 57 15.564 6.681 4.426 1.00 0.00 O ATOM 931 CB GLU A 57 16.360 3.667 5.185 1.00 0.00 C ATOM 932 CG GLU A 57 16.207 2.206 4.756 1.00 0.00 C ATOM 933 CD GLU A 57 15.670 1.383 5.928 1.00 0.00 C ATOM 934 OE1 GLU A 57 14.596 1.704 6.408 1.00 0.00 O ATOM 935 OE2 GLU A 57 16.343 0.447 6.326 1.00 0.00 O ATOM 0 H GLU A 57 18.450 3.582 3.994 1.00 0.00 H new ATOM 0 HA GLU A 57 15.728 4.425 3.237 1.00 0.00 H new ATOM 0 HB2 GLU A 57 17.216 3.773 5.852 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.480 3.987 5.743 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.528 2.135 3.906 1.00 0.00 H new ATOM 0 HG3 GLU A 57 17.168 1.809 4.430 1.00 0.00 H new ATOM 942 N ASP A 58 17.752 6.553 4.583 1.00 0.00 N ATOM 943 CA ASP A 58 17.855 7.989 4.971 1.00 0.00 C ATOM 944 C ASP A 58 17.042 8.857 4.007 1.00 0.00 C ATOM 945 O ASP A 58 16.087 9.503 4.393 1.00 0.00 O ATOM 946 CB ASP A 58 19.344 8.322 4.866 1.00 0.00 C ATOM 947 CG ASP A 58 19.661 9.528 5.752 1.00 0.00 C ATOM 948 OD1 ASP A 58 19.332 9.480 6.926 1.00 0.00 O ATOM 949 OD2 ASP A 58 20.228 10.480 5.242 1.00 0.00 O ATOM 0 H ASP A 58 18.639 6.053 4.528 1.00 0.00 H new ATOM 0 HA ASP A 58 17.465 8.175 5.972 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.942 7.464 5.174 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.607 8.539 3.831 1.00 0.00 H new ATOM 954 N TYR A 59 17.412 8.880 2.756 1.00 0.00 N ATOM 955 CA TYR A 59 16.660 9.709 1.771 1.00 0.00 C ATOM 956 C TYR A 59 16.515 8.961 0.441 1.00 0.00 C ATOM 957 O TYR A 59 17.092 7.911 0.241 1.00 0.00 O ATOM 958 CB TYR A 59 17.508 10.966 1.585 1.00 0.00 C ATOM 959 CG TYR A 59 16.842 11.876 0.582 1.00 0.00 C ATOM 960 CD1 TYR A 59 15.613 12.472 0.887 1.00 0.00 C ATOM 961 CD2 TYR A 59 17.454 12.124 -0.653 1.00 0.00 C ATOM 962 CE1 TYR A 59 14.995 13.317 -0.043 1.00 0.00 C ATOM 963 CE2 TYR A 59 16.837 12.969 -1.583 1.00 0.00 C ATOM 964 CZ TYR A 59 15.607 13.565 -1.278 1.00 0.00 C ATOM 965 OH TYR A 59 14.998 14.398 -2.194 1.00 0.00 O ATOM 0 H TYR A 59 18.202 8.361 2.373 1.00 0.00 H new ATOM 0 HA TYR A 59 15.652 9.940 2.115 1.00 0.00 H new ATOM 0 HB2 TYR A 59 17.627 11.482 2.538 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.507 10.697 1.241 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.141 12.280 1.839 1.00 0.00 H new ATOM 0 HD2 TYR A 59 18.402 11.663 -0.888 1.00 0.00 H new ATOM 0 HE1 TYR A 59 14.047 13.777 0.192 1.00 0.00 H new ATOM 0 HE2 TYR A 59 17.309 13.161 -2.535 1.00 0.00 H new ATOM 0 HH TYR A 59 15.555 14.464 -2.997 1.00 0.00 H new ATOM 975 N PHE A 60 15.751 9.499 -0.471 1.00 0.00 N ATOM 976 CA PHE A 60 15.572 8.824 -1.790 1.00 0.00 C ATOM 977 C PHE A 60 16.662 9.280 -2.766 1.00 0.00 C ATOM 978 O PHE A 60 17.259 10.323 -2.586 1.00 0.00 O ATOM 979 CB PHE A 60 14.191 9.267 -2.276 1.00 0.00 C ATOM 980 CG PHE A 60 13.133 8.756 -1.326 1.00 0.00 C ATOM 981 CD1 PHE A 60 13.252 7.479 -0.765 1.00 0.00 C ATOM 982 CD2 PHE A 60 12.032 9.560 -1.007 1.00 0.00 C ATOM 983 CE1 PHE A 60 12.272 7.006 0.116 1.00 0.00 C ATOM 984 CE2 PHE A 60 11.052 9.087 -0.126 1.00 0.00 C ATOM 985 CZ PHE A 60 11.172 7.809 0.435 1.00 0.00 C ATOM 0 H PHE A 60 15.243 10.377 -0.360 1.00 0.00 H new ATOM 0 HA PHE A 60 15.647 7.739 -1.716 1.00 0.00 H new ATOM 0 HB2 PHE A 60 14.147 10.354 -2.335 1.00 0.00 H new ATOM 0 HB3 PHE A 60 14.008 8.885 -3.280 1.00 0.00 H new ATOM 0 HD1 PHE A 60 14.100 6.858 -1.012 1.00 0.00 H new ATOM 0 HD2 PHE A 60 11.939 10.545 -1.440 1.00 0.00 H new ATOM 0 HE1 PHE A 60 12.365 6.021 0.549 1.00 0.00 H new ATOM 0 HE2 PHE A 60 10.203 9.708 0.121 1.00 0.00 H new ATOM 0 HZ PHE A 60 10.415 7.444 1.114 1.00 0.00 H new ATOM 995 N PRO A 61 16.889 8.473 -3.767 1.00 0.00 N ATOM 996 CA PRO A 61 17.922 8.790 -4.782 1.00 0.00 C ATOM 997 C PRO A 61 17.438 9.898 -5.721 1.00 0.00 C ATOM 998 O PRO A 61 17.142 9.662 -6.876 1.00 0.00 O ATOM 999 CB PRO A 61 18.100 7.476 -5.534 1.00 0.00 C ATOM 1000 CG PRO A 61 16.809 6.741 -5.349 1.00 0.00 C ATOM 1001 CD PRO A 61 16.210 7.203 -4.044 1.00 0.00 C ATOM 0 HA PRO A 61 18.851 9.155 -4.344 1.00 0.00 H new ATOM 0 HB2 PRO A 61 18.306 7.651 -6.590 1.00 0.00 H new ATOM 0 HB3 PRO A 61 18.939 6.905 -5.136 1.00 0.00 H new ATOM 0 HG2 PRO A 61 16.129 6.945 -6.177 1.00 0.00 H new ATOM 0 HG3 PRO A 61 16.979 5.664 -5.334 1.00 0.00 H new ATOM 0 HD2 PRO A 61 15.131 7.338 -4.126 1.00 0.00 H new ATOM 0 HD3 PRO A 61 16.381 6.478 -3.248 1.00 0.00 H new ATOM 1009 N SER A 62 17.364 11.107 -5.237 1.00 0.00 N ATOM 1010 CA SER A 62 16.908 12.233 -6.102 1.00 0.00 C ATOM 1011 C SER A 62 15.574 11.892 -6.774 1.00 0.00 C ATOM 1012 O SER A 62 15.210 12.471 -7.779 1.00 0.00 O ATOM 1013 CB SER A 62 18.008 12.396 -7.149 1.00 0.00 C ATOM 1014 OG SER A 62 17.862 13.653 -7.794 1.00 0.00 O ATOM 0 H SER A 62 17.600 11.365 -4.279 1.00 0.00 H new ATOM 0 HA SER A 62 16.745 13.147 -5.531 1.00 0.00 H new ATOM 0 HB2 SER A 62 18.988 12.329 -6.677 1.00 0.00 H new ATOM 0 HB3 SER A 62 17.951 11.590 -7.881 1.00 0.00 H new ATOM 0 HG SER A 62 16.923 13.786 -8.042 1.00 0.00 H new ATOM 1020 N VAL A 63 14.839 10.962 -6.227 1.00 0.00 N ATOM 1021 CA VAL A 63 13.528 10.597 -6.840 1.00 0.00 C ATOM 1022 C VAL A 63 12.392 10.848 -5.842 1.00 0.00 C ATOM 1023 O VAL A 63 11.900 9.932 -5.214 1.00 0.00 O ATOM 1024 CB VAL A 63 13.641 9.107 -7.166 1.00 0.00 C ATOM 1025 CG1 VAL A 63 13.762 8.302 -5.871 1.00 0.00 C ATOM 1026 CG2 VAL A 63 12.393 8.657 -7.928 1.00 0.00 C ATOM 0 H VAL A 63 15.087 10.441 -5.386 1.00 0.00 H new ATOM 0 HA VAL A 63 13.307 11.189 -7.728 1.00 0.00 H new ATOM 0 HB VAL A 63 14.526 8.939 -7.779 1.00 0.00 H new ATOM 0 HG11 VAL A 63 13.842 7.241 -6.108 1.00 0.00 H new ATOM 0 HG12 VAL A 63 14.651 8.620 -5.326 1.00 0.00 H new ATOM 0 HG13 VAL A 63 12.879 8.470 -5.254 1.00 0.00 H new ATOM 0 HG21 VAL A 63 12.472 7.595 -8.161 1.00 0.00 H new ATOM 0 HG22 VAL A 63 11.510 8.829 -7.313 1.00 0.00 H new ATOM 0 HG23 VAL A 63 12.307 9.226 -8.854 1.00 0.00 H new ATOM 1036 N PRO A 64 12.016 12.093 -5.731 1.00 0.00 N ATOM 1037 CA PRO A 64 10.930 12.481 -4.803 1.00 0.00 C ATOM 1038 C PRO A 64 9.558 12.184 -5.416 1.00 0.00 C ATOM 1039 O PRO A 64 8.657 11.719 -4.747 1.00 0.00 O ATOM 1040 CB PRO A 64 11.128 13.983 -4.634 1.00 0.00 C ATOM 1041 CG PRO A 64 11.835 14.435 -5.876 1.00 0.00 C ATOM 1042 CD PRO A 64 12.568 13.245 -6.450 1.00 0.00 C ATOM 0 HA PRO A 64 10.963 11.936 -3.860 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.172 14.494 -4.518 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.718 14.204 -3.744 1.00 0.00 H new ATOM 0 HG2 PRO A 64 11.121 14.829 -6.600 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.534 15.239 -5.646 1.00 0.00 H new ATOM 0 HD2 PRO A 64 12.404 13.158 -7.524 1.00 0.00 H new ATOM 0 HD3 PRO A 64 13.644 13.330 -6.297 1.00 0.00 H new ATOM 1050 N ASP A 65 9.388 12.459 -6.681 1.00 0.00 N ATOM 1051 CA ASP A 65 8.068 12.203 -7.328 1.00 0.00 C ATOM 1052 C ASP A 65 7.533 10.825 -6.929 1.00 0.00 C ATOM 1053 O ASP A 65 6.481 10.710 -6.330 1.00 0.00 O ATOM 1054 CB ASP A 65 8.348 12.253 -8.831 1.00 0.00 C ATOM 1055 CG ASP A 65 9.081 13.551 -9.172 1.00 0.00 C ATOM 1056 OD1 ASP A 65 8.592 14.602 -8.792 1.00 0.00 O ATOM 1057 OD2 ASP A 65 10.119 13.473 -9.808 1.00 0.00 O ATOM 0 H ASP A 65 10.104 12.849 -7.294 1.00 0.00 H new ATOM 0 HA ASP A 65 7.316 12.932 -7.026 1.00 0.00 H new ATOM 0 HB2 ASP A 65 8.950 11.394 -9.128 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.413 12.194 -9.388 1.00 0.00 H new ATOM 1062 N ASN A 66 8.243 9.779 -7.253 1.00 0.00 N ATOM 1063 CA ASN A 66 7.766 8.415 -6.886 1.00 0.00 C ATOM 1064 C ASN A 66 8.940 7.537 -6.448 1.00 0.00 C ATOM 1065 O ASN A 66 9.757 7.131 -7.251 1.00 0.00 O ATOM 1066 CB ASN A 66 7.127 7.860 -8.160 1.00 0.00 C ATOM 1067 CG ASN A 66 8.055 8.109 -9.350 1.00 0.00 C ATOM 1068 OD1 ASN A 66 9.102 7.501 -9.456 1.00 0.00 O ATOM 1069 ND2 ASN A 66 7.714 8.982 -10.257 1.00 0.00 N ATOM 0 H ASN A 66 9.131 9.809 -7.755 1.00 0.00 H new ATOM 0 HA ASN A 66 7.063 8.438 -6.053 1.00 0.00 H new ATOM 0 HB2 ASN A 66 6.940 6.792 -8.049 1.00 0.00 H new ATOM 0 HB3 ASN A 66 6.162 8.337 -8.332 1.00 0.00 H new ATOM 0 HD21 ASN A 66 8.326 9.154 -11.055 1.00 0.00 H new ATOM 0 HD22 ASN A 66 6.835 9.493 -10.169 1.00 0.00 H new ATOM 1076 N ALA A 67 9.030 7.234 -5.182 1.00 0.00 N ATOM 1077 CA ALA A 67 10.149 6.375 -4.703 1.00 0.00 C ATOM 1078 C ALA A 67 9.715 4.907 -4.703 1.00 0.00 C ATOM 1079 O ALA A 67 9.449 4.328 -3.668 1.00 0.00 O ATOM 1080 CB ALA A 67 10.442 6.851 -3.281 1.00 0.00 C ATOM 0 H ALA A 67 8.379 7.543 -4.460 1.00 0.00 H new ATOM 0 HA ALA A 67 11.030 6.449 -5.340 1.00 0.00 H new ATOM 0 HB1 ALA A 67 11.258 6.263 -2.861 1.00 0.00 H new ATOM 0 HB2 ALA A 67 10.726 7.903 -3.301 1.00 0.00 H new ATOM 0 HB3 ALA A 67 9.551 6.727 -2.665 1.00 0.00 H new ATOM 1086 N GLU A 68 9.640 4.303 -5.857 1.00 0.00 N ATOM 1087 CA GLU A 68 9.223 2.873 -5.928 1.00 0.00 C ATOM 1088 C GLU A 68 10.432 1.960 -5.703 1.00 0.00 C ATOM 1089 O GLU A 68 11.170 1.658 -6.619 1.00 0.00 O ATOM 1090 CB GLU A 68 8.672 2.693 -7.342 1.00 0.00 C ATOM 1091 CG GLU A 68 7.620 3.768 -7.621 1.00 0.00 C ATOM 1092 CD GLU A 68 6.804 3.377 -8.854 1.00 0.00 C ATOM 1093 OE1 GLU A 68 7.370 2.760 -9.742 1.00 0.00 O ATOM 1094 OE2 GLU A 68 5.629 3.699 -8.889 1.00 0.00 O ATOM 0 H GLU A 68 9.850 4.738 -6.755 1.00 0.00 H new ATOM 0 HA GLU A 68 8.485 2.618 -5.167 1.00 0.00 H new ATOM 0 HB2 GLU A 68 9.480 2.763 -8.070 1.00 0.00 H new ATOM 0 HB3 GLU A 68 8.231 1.702 -7.448 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.963 3.881 -6.758 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.103 4.731 -7.783 1.00 0.00 H new ATOM 1101 N LEU A 69 10.641 1.521 -4.492 1.00 0.00 N ATOM 1102 CA LEU A 69 11.805 0.631 -4.217 1.00 0.00 C ATOM 1103 C LEU A 69 11.366 -0.834 -4.183 1.00 0.00 C ATOM 1104 O LEU A 69 10.317 -1.168 -3.666 1.00 0.00 O ATOM 1105 CB LEU A 69 12.323 1.059 -2.842 1.00 0.00 C ATOM 1106 CG LEU A 69 12.922 2.465 -2.924 1.00 0.00 C ATOM 1107 CD1 LEU A 69 13.821 2.573 -4.158 1.00 0.00 C ATOM 1108 CD2 LEU A 69 11.791 3.489 -3.023 1.00 0.00 C ATOM 0 H LEU A 69 10.059 1.739 -3.684 1.00 0.00 H new ATOM 0 HA LEU A 69 12.570 0.716 -4.989 1.00 0.00 H new ATOM 0 HB2 LEU A 69 11.510 1.043 -2.116 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.076 0.353 -2.492 1.00 0.00 H new ATOM 0 HG LEU A 69 13.516 2.660 -2.031 1.00 0.00 H new ATOM 0 HD11 LEU A 69 14.245 3.576 -4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 69 14.626 1.842 -4.087 1.00 0.00 H new ATOM 0 HD13 LEU A 69 13.233 2.379 -5.055 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.213 4.492 -3.082 1.00 0.00 H new ATOM 0 HD22 LEU A 69 11.199 3.292 -3.916 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.154 3.414 -2.142 1.00 0.00 H new ATOM 1120 N VAL A 70 12.167 -1.709 -4.720 1.00 0.00 N ATOM 1121 CA VAL A 70 11.811 -3.156 -4.712 1.00 0.00 C ATOM 1122 C VAL A 70 12.646 -3.880 -3.656 1.00 0.00 C ATOM 1123 O VAL A 70 13.849 -3.995 -3.779 1.00 0.00 O ATOM 1124 CB VAL A 70 12.164 -3.656 -6.112 1.00 0.00 C ATOM 1125 CG1 VAL A 70 11.674 -5.095 -6.279 1.00 0.00 C ATOM 1126 CG2 VAL A 70 11.492 -2.763 -7.157 1.00 0.00 C ATOM 0 H VAL A 70 13.056 -1.485 -5.166 1.00 0.00 H new ATOM 0 HA VAL A 70 10.762 -3.332 -4.474 1.00 0.00 H new ATOM 0 HB VAL A 70 13.245 -3.623 -6.247 1.00 0.00 H new ATOM 0 HG11 VAL A 70 11.926 -5.452 -7.278 1.00 0.00 H new ATOM 0 HG12 VAL A 70 12.153 -5.731 -5.535 1.00 0.00 H new ATOM 0 HG13 VAL A 70 10.593 -5.129 -6.143 1.00 0.00 H new ATOM 0 HG21 VAL A 70 11.744 -3.119 -8.156 1.00 0.00 H new ATOM 0 HG22 VAL A 70 10.411 -2.795 -7.022 1.00 0.00 H new ATOM 0 HG23 VAL A 70 11.842 -1.738 -7.039 1.00 0.00 H new ATOM 1136 N LEU A 71 12.026 -4.361 -2.611 1.00 0.00 N ATOM 1137 CA LEU A 71 12.802 -5.063 -1.552 1.00 0.00 C ATOM 1138 C LEU A 71 13.816 -6.012 -2.196 1.00 0.00 C ATOM 1139 O LEU A 71 13.489 -6.779 -3.079 1.00 0.00 O ATOM 1140 CB LEU A 71 11.763 -5.829 -0.730 1.00 0.00 C ATOM 1141 CG LEU A 71 11.304 -7.081 -1.478 1.00 0.00 C ATOM 1142 CD1 LEU A 71 12.330 -8.201 -1.280 1.00 0.00 C ATOM 1143 CD2 LEU A 71 9.954 -7.527 -0.913 1.00 0.00 C ATOM 0 H LEU A 71 11.021 -4.298 -2.447 1.00 0.00 H new ATOM 0 HA LEU A 71 13.370 -4.377 -0.923 1.00 0.00 H new ATOM 0 HB2 LEU A 71 12.188 -6.110 0.234 1.00 0.00 H new ATOM 0 HB3 LEU A 71 10.907 -5.186 -0.526 1.00 0.00 H new ATOM 0 HG LEU A 71 11.210 -6.862 -2.542 1.00 0.00 H new ATOM 0 HD11 LEU A 71 12.002 -9.093 -1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 71 13.297 -7.881 -1.668 1.00 0.00 H new ATOM 0 HD13 LEU A 71 12.422 -8.427 -0.218 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.616 -8.420 -1.439 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.060 -7.750 0.149 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.223 -6.730 -1.045 1.00 0.00 H new ATOM 1155 N LEU A 72 15.049 -5.954 -1.772 1.00 0.00 N ATOM 1156 CA LEU A 72 16.086 -6.843 -2.374 1.00 0.00 C ATOM 1157 C LEU A 72 16.799 -7.649 -1.288 1.00 0.00 C ATOM 1158 O LEU A 72 17.505 -7.108 -0.461 1.00 0.00 O ATOM 1159 CB LEU A 72 17.064 -5.887 -3.065 1.00 0.00 C ATOM 1160 CG LEU A 72 18.235 -6.672 -3.670 1.00 0.00 C ATOM 1161 CD1 LEU A 72 19.220 -7.064 -2.565 1.00 0.00 C ATOM 1162 CD2 LEU A 72 17.713 -7.937 -4.358 1.00 0.00 C ATOM 0 H LEU A 72 15.384 -5.331 -1.037 1.00 0.00 H new ATOM 0 HA LEU A 72 15.657 -7.567 -3.067 1.00 0.00 H new ATOM 0 HB2 LEU A 72 16.548 -5.330 -3.847 1.00 0.00 H new ATOM 0 HB3 LEU A 72 17.438 -5.157 -2.347 1.00 0.00 H new ATOM 0 HG LEU A 72 18.742 -6.045 -4.403 1.00 0.00 H new ATOM 0 HD11 LEU A 72 20.050 -7.621 -2.999 1.00 0.00 H new ATOM 0 HD12 LEU A 72 19.600 -6.165 -2.081 1.00 0.00 H new ATOM 0 HD13 LEU A 72 18.711 -7.685 -1.828 1.00 0.00 H new ATOM 0 HD21 LEU A 72 18.549 -8.490 -4.786 1.00 0.00 H new ATOM 0 HD22 LEU A 72 17.200 -8.563 -3.628 1.00 0.00 H new ATOM 0 HD23 LEU A 72 17.018 -7.660 -5.151 1.00 0.00 H new ATOM 1174 N THR A 73 16.629 -8.943 -1.291 1.00 0.00 N ATOM 1175 CA THR A 73 17.309 -9.785 -0.267 1.00 0.00 C ATOM 1176 C THR A 73 17.738 -11.116 -0.886 1.00 0.00 C ATOM 1177 O THR A 73 17.084 -12.127 -0.729 1.00 0.00 O ATOM 1178 CB THR A 73 16.259 -10.013 0.821 1.00 0.00 C ATOM 1179 OG1 THR A 73 16.682 -11.071 1.669 1.00 0.00 O ATOM 1180 CG2 THR A 73 14.921 -10.377 0.175 1.00 0.00 C ATOM 0 H THR A 73 16.049 -9.453 -1.958 1.00 0.00 H new ATOM 0 HA THR A 73 18.207 -9.312 0.129 1.00 0.00 H new ATOM 0 HB THR A 73 16.139 -9.102 1.407 1.00 0.00 H new ATOM 0 HG1 THR A 73 17.460 -10.782 2.190 1.00 0.00 H new ATOM 0 HG21 THR A 73 14.174 -10.539 0.952 1.00 0.00 H new ATOM 0 HG22 THR A 73 14.598 -9.564 -0.475 1.00 0.00 H new ATOM 0 HG23 THR A 73 15.037 -11.288 -0.413 1.00 0.00 H new ATOM 1188 N LEU A 74 18.839 -11.121 -1.586 1.00 0.00 N ATOM 1189 CA LEU A 74 19.320 -12.384 -2.215 1.00 0.00 C ATOM 1190 C LEU A 74 20.848 -12.413 -2.226 1.00 0.00 C ATOM 1191 O LEU A 74 21.498 -11.428 -1.935 1.00 0.00 O ATOM 1192 CB LEU A 74 18.772 -12.350 -3.643 1.00 0.00 C ATOM 1193 CG LEU A 74 18.799 -13.762 -4.232 1.00 0.00 C ATOM 1194 CD1 LEU A 74 18.057 -14.721 -3.298 1.00 0.00 C ATOM 1195 CD2 LEU A 74 18.114 -13.754 -5.601 1.00 0.00 C ATOM 0 H LEU A 74 19.427 -10.304 -1.750 1.00 0.00 H new ATOM 0 HA LEU A 74 18.988 -13.270 -1.675 1.00 0.00 H new ATOM 0 HB2 LEU A 74 17.753 -11.963 -3.644 1.00 0.00 H new ATOM 0 HB3 LEU A 74 19.369 -11.676 -4.257 1.00 0.00 H new ATOM 0 HG LEU A 74 19.833 -14.090 -4.342 1.00 0.00 H new ATOM 0 HD11 LEU A 74 18.077 -15.726 -3.718 1.00 0.00 H new ATOM 0 HD12 LEU A 74 18.542 -14.726 -2.322 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.023 -14.394 -3.188 1.00 0.00 H new ATOM 0 HD21 LEU A 74 18.132 -14.759 -6.023 1.00 0.00 H new ATOM 0 HD22 LEU A 74 17.081 -13.426 -5.489 1.00 0.00 H new ATOM 0 HD23 LEU A 74 18.641 -13.071 -6.268 1.00 0.00 H new ATOM 1207 N GLY A 75 21.430 -13.529 -2.567 1.00 0.00 N ATOM 1208 CA GLY A 75 22.916 -13.609 -2.601 1.00 0.00 C ATOM 1209 C GLY A 75 23.457 -12.518 -3.527 1.00 0.00 C ATOM 1210 O GLY A 75 24.606 -12.134 -3.448 1.00 0.00 O ATOM 0 H GLY A 75 20.942 -14.387 -2.823 1.00 0.00 H new ATOM 0 HA2 GLY A 75 23.322 -13.485 -1.597 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.231 -14.591 -2.953 1.00 0.00 H new ATOM 1214 N GLN A 76 22.633 -12.016 -4.406 1.00 0.00 N ATOM 1215 CA GLN A 76 23.092 -10.949 -5.341 1.00 0.00 C ATOM 1216 C GLN A 76 22.140 -9.750 -5.283 1.00 0.00 C ATOM 1217 O GLN A 76 20.999 -9.869 -4.882 1.00 0.00 O ATOM 1218 CB GLN A 76 23.064 -11.599 -6.729 1.00 0.00 C ATOM 1219 CG GLN A 76 21.625 -11.642 -7.252 1.00 0.00 C ATOM 1220 CD GLN A 76 21.510 -12.701 -8.350 1.00 0.00 C ATOM 1221 OE1 GLN A 76 21.832 -12.445 -9.493 1.00 0.00 O ATOM 1222 NE2 GLN A 76 21.060 -13.889 -8.049 1.00 0.00 N ATOM 0 H GLN A 76 21.659 -12.299 -4.517 1.00 0.00 H new ATOM 0 HA GLN A 76 24.084 -10.575 -5.089 1.00 0.00 H new ATOM 0 HB2 GLN A 76 23.694 -11.036 -7.417 1.00 0.00 H new ATOM 0 HB3 GLN A 76 23.472 -12.608 -6.676 1.00 0.00 H new ATOM 0 HG2 GLN A 76 20.938 -11.872 -6.438 1.00 0.00 H new ATOM 0 HG3 GLN A 76 21.340 -10.665 -7.643 1.00 0.00 H new ATOM 0 HE21 GLN A 76 20.790 -14.104 -7.089 1.00 0.00 H new ATOM 0 HE22 GLN A 76 20.979 -14.602 -8.774 1.00 0.00 H new ATOM 1231 N ALA A 77 22.597 -8.598 -5.686 1.00 0.00 N ATOM 1232 CA ALA A 77 21.717 -7.395 -5.659 1.00 0.00 C ATOM 1233 C ALA A 77 20.784 -7.404 -6.871 1.00 0.00 C ATOM 1234 O ALA A 77 20.988 -8.140 -7.817 1.00 0.00 O ATOM 1235 CB ALA A 77 22.669 -6.201 -5.723 1.00 0.00 C ATOM 0 H ALA A 77 23.542 -8.436 -6.033 1.00 0.00 H new ATOM 0 HA ALA A 77 21.088 -7.362 -4.770 1.00 0.00 H new ATOM 0 HB1 ALA A 77 22.093 -5.275 -5.707 1.00 0.00 H new ATOM 0 HB2 ALA A 77 23.341 -6.225 -4.865 1.00 0.00 H new ATOM 0 HB3 ALA A 77 23.253 -6.250 -6.642 1.00 0.00 H new ATOM 1241 N TRP A 78 19.760 -6.598 -6.853 1.00 0.00 N ATOM 1242 CA TRP A 78 18.815 -6.571 -8.008 1.00 0.00 C ATOM 1243 C TRP A 78 19.365 -5.693 -9.134 1.00 0.00 C ATOM 1244 O TRP A 78 19.994 -4.681 -8.899 1.00 0.00 O ATOM 1245 CB TRP A 78 17.523 -5.973 -7.454 1.00 0.00 C ATOM 1246 CG TRP A 78 16.508 -5.890 -8.548 1.00 0.00 C ATOM 1247 CD1 TRP A 78 16.076 -4.743 -9.122 1.00 0.00 C ATOM 1248 CD2 TRP A 78 15.795 -6.974 -9.211 1.00 0.00 C ATOM 1249 NE1 TRP A 78 15.142 -5.054 -10.093 1.00 0.00 N ATOM 1250 CE2 TRP A 78 14.934 -6.417 -10.187 1.00 0.00 C ATOM 1251 CE3 TRP A 78 15.809 -8.372 -9.062 1.00 0.00 C ATOM 1252 CZ2 TRP A 78 14.117 -7.218 -10.985 1.00 0.00 C ATOM 1253 CZ3 TRP A 78 14.989 -9.182 -9.865 1.00 0.00 C ATOM 1254 CH2 TRP A 78 14.144 -8.606 -10.824 1.00 0.00 C ATOM 0 H TRP A 78 19.535 -5.958 -6.092 1.00 0.00 H new ATOM 0 HA TRP A 78 18.661 -7.565 -8.428 1.00 0.00 H new ATOM 0 HB2 TRP A 78 17.145 -6.588 -6.637 1.00 0.00 H new ATOM 0 HB3 TRP A 78 17.714 -4.981 -7.044 1.00 0.00 H new ATOM 0 HD1 TRP A 78 16.407 -3.748 -8.864 1.00 0.00 H new ATOM 0 HE1 TRP A 78 14.664 -4.361 -10.670 1.00 0.00 H new ATOM 0 HE3 TRP A 78 16.455 -8.826 -8.325 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 13.468 -6.769 -11.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 15.010 -10.255 -9.743 1.00 0.00 H new ATOM 0 HH2 TRP A 78 13.515 -9.234 -11.437 1.00 0.00 H new ATOM 1265 N GLN A 79 19.124 -6.075 -10.357 1.00 0.00 N ATOM 1266 CA GLN A 79 19.621 -5.267 -11.509 1.00 0.00 C ATOM 1267 C GLN A 79 18.589 -5.292 -12.641 1.00 0.00 C ATOM 1268 O GLN A 79 18.836 -5.821 -13.707 1.00 0.00 O ATOM 1269 CB GLN A 79 20.918 -5.951 -11.945 1.00 0.00 C ATOM 1270 CG GLN A 79 21.590 -5.122 -13.043 1.00 0.00 C ATOM 1271 CD GLN A 79 23.110 -5.278 -12.946 1.00 0.00 C ATOM 1272 OE1 GLN A 79 23.678 -5.145 -11.880 1.00 0.00 O ATOM 1273 NE2 GLN A 79 23.797 -5.554 -14.021 1.00 0.00 N ATOM 0 H GLN A 79 18.603 -6.914 -10.611 1.00 0.00 H new ATOM 0 HA GLN A 79 19.786 -4.222 -11.247 1.00 0.00 H new ATOM 0 HB2 GLN A 79 21.589 -6.057 -11.093 1.00 0.00 H new ATOM 0 HB3 GLN A 79 20.706 -6.955 -12.311 1.00 0.00 H new ATOM 0 HG2 GLN A 79 21.243 -5.448 -14.023 1.00 0.00 H new ATOM 0 HG3 GLN A 79 21.315 -4.072 -12.940 1.00 0.00 H new ATOM 0 HE21 GLN A 79 23.321 -5.666 -14.916 1.00 0.00 H new ATOM 0 HE22 GLN A 79 24.810 -5.658 -13.966 1.00 0.00 H new ATOM 1282 N GLY A 80 17.433 -4.730 -12.415 1.00 0.00 N ATOM 1283 CA GLY A 80 16.384 -4.728 -13.474 1.00 0.00 C ATOM 1284 C GLY A 80 16.680 -3.624 -14.491 1.00 0.00 C ATOM 1285 O GLY A 80 16.039 -2.590 -14.506 1.00 0.00 O ATOM 0 H GLY A 80 17.170 -4.272 -11.543 1.00 0.00 H new ATOM 0 HA2 GLY A 80 16.355 -5.697 -13.973 1.00 0.00 H new ATOM 0 HA3 GLY A 80 15.403 -4.570 -13.027 1.00 0.00 H new ATOM 1416 N LYS B 19 -12.200 13.007 4.253 1.00 0.00 N ATOM 1417 CA LYS B 19 -12.238 12.900 2.765 1.00 0.00 C ATOM 1418 C LYS B 19 -13.187 11.774 2.344 1.00 0.00 C ATOM 1419 O LYS B 19 -12.908 10.613 2.565 1.00 0.00 O ATOM 1420 CB LYS B 19 -10.802 12.572 2.355 1.00 0.00 C ATOM 1421 CG LYS B 19 -10.642 12.773 0.847 1.00 0.00 C ATOM 1422 CD LYS B 19 -9.193 12.489 0.444 1.00 0.00 C ATOM 1423 CE LYS B 19 -8.323 13.703 0.776 1.00 0.00 C ATOM 1424 NZ LYS B 19 -8.619 14.694 -0.295 1.00 0.00 N ATOM 0 HA LYS B 19 -12.597 13.814 2.292 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -10.104 13.212 2.894 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -10.562 11.543 2.623 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -11.317 12.109 0.307 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -10.913 13.793 0.575 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -8.824 11.609 0.971 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -9.137 12.269 -0.622 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -8.563 14.103 1.761 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -7.265 13.439 0.788 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -8.522 15.657 0.086 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -7.951 14.565 -1.082 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -9.590 14.554 -0.639 1.00 0.00 H new ATOM 1438 N PRO B 20 -14.282 12.160 1.745 1.00 0.00 N ATOM 1439 CA PRO B 20 -15.286 11.172 1.285 1.00 0.00 C ATOM 1440 C PRO B 20 -14.769 10.420 0.054 1.00 0.00 C ATOM 1441 O PRO B 20 -14.913 10.870 -1.065 1.00 0.00 O ATOM 1442 CB PRO B 20 -16.498 12.030 0.932 1.00 0.00 C ATOM 1443 CG PRO B 20 -15.939 13.383 0.627 1.00 0.00 C ATOM 1444 CD PRO B 20 -14.682 13.539 1.443 1.00 0.00 C ATOM 0 HA PRO B 20 -15.514 10.411 2.032 1.00 0.00 H new ATOM 0 HB2 PRO B 20 -17.034 11.622 0.075 1.00 0.00 H new ATOM 0 HB3 PRO B 20 -17.206 12.073 1.760 1.00 0.00 H new ATOM 0 HG2 PRO B 20 -15.722 13.479 -0.437 1.00 0.00 H new ATOM 0 HG3 PRO B 20 -16.659 14.162 0.877 1.00 0.00 H new ATOM 0 HD2 PRO B 20 -13.907 14.066 0.886 1.00 0.00 H new ATOM 0 HD3 PRO B 20 -14.865 14.110 2.353 1.00 0.00 H new ATOM 1452 N CYS B 21 -14.167 9.281 0.255 1.00 0.00 N ATOM 1453 CA CYS B 21 -13.639 8.501 -0.901 1.00 0.00 C ATOM 1454 C CYS B 21 -14.671 7.467 -1.359 1.00 0.00 C ATOM 1455 O CYS B 21 -15.711 7.303 -0.752 1.00 0.00 O ATOM 1456 CB CYS B 21 -12.383 7.807 -0.373 1.00 0.00 C ATOM 1457 SG CYS B 21 -11.350 9.012 0.498 1.00 0.00 S ATOM 0 H CYS B 21 -14.017 8.856 1.170 1.00 0.00 H new ATOM 0 HA CYS B 21 -13.423 9.135 -1.761 1.00 0.00 H new ATOM 0 HB2 CYS B 21 -12.659 6.995 0.299 1.00 0.00 H new ATOM 0 HB3 CYS B 21 -11.826 7.363 -1.198 1.00 0.00 H new ATOM 0 HG CYS B 21 -12.064 9.631 1.390 1.00 0.00 H new ATOM 1463 N LEU B 22 -14.391 6.767 -2.424 1.00 0.00 N ATOM 1464 CA LEU B 22 -15.358 5.745 -2.919 1.00 0.00 C ATOM 1465 C LEU B 22 -14.754 4.342 -2.798 1.00 0.00 C ATOM 1466 O LEU B 22 -13.581 4.137 -3.037 1.00 0.00 O ATOM 1467 CB LEU B 22 -15.598 6.103 -4.385 1.00 0.00 C ATOM 1468 CG LEU B 22 -16.474 7.353 -4.469 1.00 0.00 C ATOM 1469 CD1 LEU B 22 -15.920 8.294 -5.538 1.00 0.00 C ATOM 1470 CD2 LEU B 22 -17.904 6.949 -4.838 1.00 0.00 C ATOM 0 H LEU B 22 -13.536 6.858 -2.973 1.00 0.00 H new ATOM 0 HA LEU B 22 -16.285 5.741 -2.345 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -14.647 6.278 -4.888 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -16.082 5.272 -4.899 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.476 7.860 -3.504 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -16.545 9.185 -5.598 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -14.902 8.582 -5.277 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -15.918 7.787 -6.503 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -18.530 7.840 -4.898 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -17.901 6.442 -5.803 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -18.301 6.278 -4.076 1.00 0.00 H new ATOM 1482 N LEU B 23 -15.550 3.378 -2.427 1.00 0.00 N ATOM 1483 CA LEU B 23 -15.029 1.988 -2.286 1.00 0.00 C ATOM 1484 C LEU B 23 -15.853 1.031 -3.147 1.00 0.00 C ATOM 1485 O LEU B 23 -16.816 1.424 -3.776 1.00 0.00 O ATOM 1486 CB LEU B 23 -15.190 1.654 -0.804 1.00 0.00 C ATOM 1487 CG LEU B 23 -14.426 2.681 0.033 1.00 0.00 C ATOM 1488 CD1 LEU B 23 -14.416 2.243 1.499 1.00 0.00 C ATOM 1489 CD2 LEU B 23 -12.988 2.781 -0.479 1.00 0.00 C ATOM 0 H LEU B 23 -16.541 3.492 -2.215 1.00 0.00 H new ATOM 0 HA LEU B 23 -13.993 1.897 -2.612 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -16.245 1.659 -0.531 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -14.813 0.651 -0.603 1.00 0.00 H new ATOM 0 HG LEU B 23 -14.913 3.653 -0.050 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -13.871 2.976 2.094 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -15.441 2.169 1.864 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -13.929 1.272 1.585 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -12.440 3.512 0.115 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -12.503 1.808 -0.395 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -12.994 3.094 -1.523 1.00 0.00 H new ATOM 1501 N ARG B 24 -15.481 -0.219 -3.195 1.00 0.00 N ATOM 1502 CA ARG B 24 -16.254 -1.189 -4.023 1.00 0.00 C ATOM 1503 C ARG B 24 -16.350 -2.544 -3.316 1.00 0.00 C ATOM 1504 O ARG B 24 -15.679 -2.796 -2.336 1.00 0.00 O ATOM 1505 CB ARG B 24 -15.469 -1.313 -5.328 1.00 0.00 C ATOM 1506 CG ARG B 24 -16.327 -2.021 -6.378 1.00 0.00 C ATOM 1507 CD ARG B 24 -15.578 -2.052 -7.713 1.00 0.00 C ATOM 1508 NE ARG B 24 -16.295 -1.076 -8.578 1.00 0.00 N ATOM 1509 CZ ARG B 24 -15.874 -0.843 -9.793 1.00 0.00 C ATOM 1510 NH1 ARG B 24 -14.821 -1.464 -10.254 1.00 0.00 N ATOM 1511 NH2 ARG B 24 -16.507 0.013 -10.548 1.00 0.00 N ATOM 0 H ARG B 24 -14.679 -0.610 -2.700 1.00 0.00 H new ATOM 0 HA ARG B 24 -17.278 -0.856 -4.195 1.00 0.00 H new ATOM 0 HB2 ARG B 24 -15.180 -0.325 -5.686 1.00 0.00 H new ATOM 0 HB3 ARG B 24 -14.549 -1.872 -5.159 1.00 0.00 H new ATOM 0 HG2 ARG B 24 -16.554 -3.036 -6.053 1.00 0.00 H new ATOM 0 HG3 ARG B 24 -17.279 -1.503 -6.495 1.00 0.00 H new ATOM 0 HD2 ARG B 24 -14.532 -1.773 -7.586 1.00 0.00 H new ATOM 0 HD3 ARG B 24 -15.591 -3.051 -8.150 1.00 0.00 H new ATOM 0 HE ARG B 24 -17.117 -0.588 -8.222 1.00 0.00 H new ATOM 0 HH11 ARG B 24 -14.325 -2.133 -9.665 1.00 0.00 H new ATOM 0 HH12 ARG B 24 -14.495 -1.280 -11.203 1.00 0.00 H new ATOM 0 HH21 ARG B 24 -17.329 0.499 -10.189 1.00 0.00 H new ATOM 0 HH22 ARG B 24 -16.180 0.196 -11.497 1.00 0.00 H new ATOM 1525 N ARG B 25 -17.180 -3.417 -3.818 1.00 0.00 N ATOM 1526 CA ARG B 25 -17.327 -4.762 -3.191 1.00 0.00 C ATOM 1527 C ARG B 25 -16.913 -5.846 -4.193 1.00 0.00 C ATOM 1528 O ARG B 25 -17.309 -5.826 -5.341 1.00 0.00 O ATOM 1529 CB ARG B 25 -18.813 -4.872 -2.850 1.00 0.00 C ATOM 1530 CG ARG B 25 -19.112 -6.254 -2.267 1.00 0.00 C ATOM 1531 CD ARG B 25 -20.623 -6.492 -2.284 1.00 0.00 C ATOM 1532 NE ARG B 25 -21.023 -6.547 -0.850 1.00 0.00 N ATOM 1533 CZ ARG B 25 -22.264 -6.797 -0.526 1.00 0.00 C ATOM 1534 NH1 ARG B 25 -23.157 -7.000 -1.458 1.00 0.00 N ATOM 1535 NH2 ARG B 25 -22.613 -6.845 0.730 1.00 0.00 N ATOM 0 H ARG B 25 -17.765 -3.256 -4.638 1.00 0.00 H new ATOM 0 HA ARG B 25 -16.701 -4.890 -2.308 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -19.089 -4.098 -2.134 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -19.414 -4.707 -3.745 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -18.604 -7.024 -2.847 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -18.733 -6.321 -1.247 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -21.143 -5.690 -2.808 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -20.870 -7.421 -2.798 1.00 0.00 H new ATOM 0 HE ARG B 25 -20.328 -6.389 -0.121 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -22.886 -6.964 -2.441 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -24.125 -7.195 -1.203 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -21.917 -6.687 1.459 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -23.582 -7.040 0.983 1.00 0.00 H new ATOM 1549 N ASN B 26 -16.112 -6.785 -3.771 1.00 0.00 N ATOM 1550 CA ASN B 26 -15.663 -7.861 -4.704 1.00 0.00 C ATOM 1551 C ASN B 26 -16.863 -8.646 -5.246 1.00 0.00 C ATOM 1552 O ASN B 26 -16.887 -9.039 -6.395 1.00 0.00 O ATOM 1553 CB ASN B 26 -14.767 -8.766 -3.859 1.00 0.00 C ATOM 1554 CG ASN B 26 -14.178 -9.868 -4.742 1.00 0.00 C ATOM 1555 OD1 ASN B 26 -13.354 -9.604 -5.594 1.00 0.00 O ATOM 1556 ND2 ASN B 26 -14.567 -11.102 -4.572 1.00 0.00 N ATOM 0 H ASN B 26 -15.748 -6.855 -2.821 1.00 0.00 H new ATOM 0 HA ASN B 26 -15.140 -7.457 -5.571 1.00 0.00 H new ATOM 0 HB2 ASN B 26 -13.966 -8.182 -3.405 1.00 0.00 H new ATOM 0 HB3 ASN B 26 -15.342 -9.206 -3.044 1.00 0.00 H new ATOM 0 HD21 ASN B 26 -14.179 -11.844 -5.155 1.00 0.00 H new ATOM 0 HD22 ASN B 26 -15.259 -11.325 -3.857 1.00 0.00 H new ATOM 1563 N TYR B 27 -17.852 -8.883 -4.430 1.00 0.00 N ATOM 1564 CA TYR B 27 -19.040 -9.650 -4.906 1.00 0.00 C ATOM 1565 C TYR B 27 -19.908 -8.783 -5.826 1.00 0.00 C ATOM 1566 O TYR B 27 -20.543 -9.275 -6.738 1.00 0.00 O ATOM 1567 CB TYR B 27 -19.810 -10.020 -3.638 1.00 0.00 C ATOM 1568 CG TYR B 27 -18.868 -10.643 -2.636 1.00 0.00 C ATOM 1569 CD1 TYR B 27 -18.271 -11.880 -2.909 1.00 0.00 C ATOM 1570 CD2 TYR B 27 -18.592 -9.984 -1.431 1.00 0.00 C ATOM 1571 CE1 TYR B 27 -17.399 -12.458 -1.977 1.00 0.00 C ATOM 1572 CE2 TYR B 27 -17.720 -10.562 -0.501 1.00 0.00 C ATOM 1573 CZ TYR B 27 -17.124 -11.798 -0.774 1.00 0.00 C ATOM 1574 OH TYR B 27 -16.264 -12.368 0.144 1.00 0.00 O ATOM 0 H TYR B 27 -17.890 -8.580 -3.457 1.00 0.00 H new ATOM 0 HA TYR B 27 -18.753 -10.530 -5.482 1.00 0.00 H new ATOM 0 HB2 TYR B 27 -20.275 -9.132 -3.211 1.00 0.00 H new ATOM 0 HB3 TYR B 27 -20.613 -10.716 -3.879 1.00 0.00 H new ATOM 0 HD1 TYR B 27 -18.483 -12.388 -3.838 1.00 0.00 H new ATOM 0 HD2 TYR B 27 -19.052 -9.030 -1.220 1.00 0.00 H new ATOM 0 HE1 TYR B 27 -16.939 -13.412 -2.187 1.00 0.00 H new ATOM 0 HE2 TYR B 27 -17.507 -10.054 0.428 1.00 0.00 H new ATOM 0 HH TYR B 27 -15.759 -13.090 -0.285 1.00 0.00 H new ATOM 1584 N SER B 28 -19.944 -7.499 -5.593 1.00 0.00 N ATOM 1585 CA SER B 28 -20.779 -6.609 -6.456 1.00 0.00 C ATOM 1586 C SER B 28 -19.906 -5.881 -7.483 1.00 0.00 C ATOM 1587 O SER B 28 -18.815 -5.440 -7.184 1.00 0.00 O ATOM 1588 CB SER B 28 -21.415 -5.608 -5.493 1.00 0.00 C ATOM 1589 OG SER B 28 -22.412 -4.865 -6.181 1.00 0.00 O ATOM 0 H SER B 28 -19.434 -7.027 -4.846 1.00 0.00 H new ATOM 0 HA SER B 28 -21.525 -7.170 -7.019 1.00 0.00 H new ATOM 0 HB2 SER B 28 -21.856 -6.131 -4.644 1.00 0.00 H new ATOM 0 HB3 SER B 28 -20.655 -4.936 -5.094 1.00 0.00 H new ATOM 0 HG SER B 28 -22.824 -4.223 -5.566 1.00 0.00 H new ATOM 1595 N ARG B 29 -20.382 -5.752 -8.692 1.00 0.00 N ATOM 1596 CA ARG B 29 -19.584 -5.051 -9.739 1.00 0.00 C ATOM 1597 C ARG B 29 -19.916 -3.554 -9.749 1.00 0.00 C ATOM 1598 O ARG B 29 -19.322 -2.783 -10.476 1.00 0.00 O ATOM 1599 CB ARG B 29 -20.005 -5.701 -11.057 1.00 0.00 C ATOM 1600 CG ARG B 29 -19.427 -4.905 -12.228 1.00 0.00 C ATOM 1601 CD ARG B 29 -20.496 -3.959 -12.780 1.00 0.00 C ATOM 1602 NE ARG B 29 -20.017 -3.590 -14.140 1.00 0.00 N ATOM 1603 CZ ARG B 29 -19.061 -2.711 -14.282 1.00 0.00 C ATOM 1604 NH1 ARG B 29 -18.520 -2.152 -13.232 1.00 0.00 N ATOM 1605 NH2 ARG B 29 -18.644 -2.390 -15.476 1.00 0.00 N ATOM 0 H ARG B 29 -21.289 -6.102 -9.000 1.00 0.00 H new ATOM 0 HA ARG B 29 -18.511 -5.136 -9.565 1.00 0.00 H new ATOM 0 HB2 ARG B 29 -19.652 -6.732 -11.095 1.00 0.00 H new ATOM 0 HB3 ARG B 29 -21.092 -5.733 -11.127 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -18.557 -4.336 -11.900 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -19.088 -5.584 -13.011 1.00 0.00 H new ATOM 0 HD2 ARG B 29 -21.470 -4.446 -12.823 1.00 0.00 H new ATOM 0 HD3 ARG B 29 -20.608 -3.078 -12.148 1.00 0.00 H new ATOM 0 HE ARG B 29 -20.436 -4.024 -14.963 1.00 0.00 H new ATOM 0 HH11 ARG B 29 -18.844 -2.402 -12.298 1.00 0.00 H new ATOM 0 HH12 ARG B 29 -17.774 -1.466 -13.347 1.00 0.00 H new ATOM 0 HH21 ARG B 29 -19.064 -2.825 -16.297 1.00 0.00 H new ATOM 0 HH22 ARG B 29 -17.898 -1.704 -15.588 1.00 0.00 H new ATOM 1619 N GLU B 30 -20.862 -3.139 -8.952 1.00 0.00 N ATOM 1620 CA GLU B 30 -21.231 -1.692 -8.920 1.00 0.00 C ATOM 1621 C GLU B 30 -20.235 -0.910 -8.061 1.00 0.00 C ATOM 1622 O GLU B 30 -19.475 -1.478 -7.304 1.00 0.00 O ATOM 1623 CB GLU B 30 -22.625 -1.654 -8.292 1.00 0.00 C ATOM 1624 CG GLU B 30 -23.156 -0.220 -8.311 1.00 0.00 C ATOM 1625 CD GLU B 30 -24.478 -0.154 -7.545 1.00 0.00 C ATOM 1626 OE1 GLU B 30 -24.433 -0.092 -6.328 1.00 0.00 O ATOM 1627 OE2 GLU B 30 -25.514 -0.166 -8.190 1.00 0.00 O ATOM 0 H GLU B 30 -21.396 -3.737 -8.322 1.00 0.00 H new ATOM 0 HA GLU B 30 -21.217 -1.240 -9.912 1.00 0.00 H new ATOM 0 HB2 GLU B 30 -23.300 -2.310 -8.841 1.00 0.00 H new ATOM 0 HB3 GLU B 30 -22.584 -2.024 -7.268 1.00 0.00 H new ATOM 0 HG2 GLU B 30 -22.428 0.454 -7.860 1.00 0.00 H new ATOM 0 HG3 GLU B 30 -23.303 0.111 -9.339 1.00 0.00 H new ATOM 1634 N GLN B 31 -20.230 0.392 -8.173 1.00 0.00 N ATOM 1635 CA GLN B 31 -19.281 1.201 -7.356 1.00 0.00 C ATOM 1636 C GLN B 31 -19.936 1.610 -6.035 1.00 0.00 C ATOM 1637 O GLN B 31 -21.119 1.881 -5.973 1.00 0.00 O ATOM 1638 CB GLN B 31 -18.972 2.433 -8.208 1.00 0.00 C ATOM 1639 CG GLN B 31 -17.738 3.143 -7.646 1.00 0.00 C ATOM 1640 CD GLN B 31 -17.419 4.370 -8.502 1.00 0.00 C ATOM 1641 OE1 GLN B 31 -16.539 4.329 -9.340 1.00 0.00 O ATOM 1642 NE2 GLN B 31 -18.102 5.468 -8.326 1.00 0.00 N ATOM 0 H GLN B 31 -20.839 0.927 -8.792 1.00 0.00 H new ATOM 0 HA GLN B 31 -18.378 0.646 -7.103 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -18.796 2.139 -9.243 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -19.826 3.111 -8.210 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -17.917 3.444 -6.614 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -16.887 2.462 -7.636 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -18.840 5.502 -7.623 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -17.898 6.292 -8.891 1.00 0.00 H new ATOM 1651 N HIS B 32 -19.174 1.651 -4.976 1.00 0.00 N ATOM 1652 CA HIS B 32 -19.748 2.034 -3.658 1.00 0.00 C ATOM 1653 C HIS B 32 -19.148 3.368 -3.205 1.00 0.00 C ATOM 1654 O HIS B 32 -18.226 3.880 -3.809 1.00 0.00 O ATOM 1655 CB HIS B 32 -19.351 0.910 -2.693 1.00 0.00 C ATOM 1656 CG HIS B 32 -19.651 -0.445 -3.292 1.00 0.00 C ATOM 1657 ND1 HIS B 32 -20.157 -1.477 -2.522 1.00 0.00 N ATOM 1658 CD2 HIS B 32 -19.527 -0.962 -4.564 1.00 0.00 C ATOM 1659 CE1 HIS B 32 -20.324 -2.544 -3.322 1.00 0.00 C ATOM 1660 NE2 HIS B 32 -19.955 -2.285 -4.576 1.00 0.00 N ATOM 0 H HIS B 32 -18.177 1.435 -4.968 1.00 0.00 H new ATOM 0 HA HIS B 32 -20.830 2.158 -3.699 1.00 0.00 H new ATOM 0 HB2 HIS B 32 -18.288 0.983 -2.461 1.00 0.00 H new ATOM 0 HB3 HIS B 32 -19.891 1.024 -1.753 1.00 0.00 H new ATOM 0 HD2 HIS B 32 -19.154 -0.421 -5.421 1.00 0.00 H new ATOM 0 HE1 HIS B 32 -20.710 -3.496 -2.989 1.00 0.00 H new ATOM 0 HE2 HIS B 32 -19.981 -2.921 -5.373 1.00 0.00 H new ATOM 1668 N GLY B 33 -19.662 3.939 -2.150 1.00 0.00 N ATOM 1669 CA GLY B 33 -19.113 5.240 -1.671 1.00 0.00 C ATOM 1670 C GLY B 33 -19.030 5.236 -0.144 1.00 0.00 C ATOM 1671 O GLY B 33 -19.944 4.816 0.537 1.00 0.00 O ATOM 0 H GLY B 33 -20.435 3.563 -1.601 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -18.124 5.407 -2.098 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -19.748 6.059 -2.008 1.00 0.00 H new ATOM 1675 N VAL B 34 -17.939 5.706 0.400 1.00 0.00 N ATOM 1676 CA VAL B 34 -17.798 5.734 1.885 1.00 0.00 C ATOM 1677 C VAL B 34 -17.112 7.031 2.326 1.00 0.00 C ATOM 1678 O VAL B 34 -16.637 7.800 1.514 1.00 0.00 O ATOM 1679 CB VAL B 34 -16.928 4.523 2.224 1.00 0.00 C ATOM 1680 CG1 VAL B 34 -16.941 4.295 3.736 1.00 0.00 C ATOM 1681 CG2 VAL B 34 -17.485 3.286 1.517 1.00 0.00 C ATOM 0 H VAL B 34 -17.140 6.071 -0.119 1.00 0.00 H new ATOM 0 HA VAL B 34 -18.762 5.697 2.393 1.00 0.00 H new ATOM 0 HB VAL B 34 -15.905 4.703 1.893 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -16.321 3.432 3.979 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -16.548 5.178 4.240 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.963 4.113 4.068 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -16.867 2.421 1.757 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -18.507 3.106 1.851 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -17.479 3.449 0.439 1.00 0.00 H new ATOM 1691 N ALA B 35 -17.060 7.279 3.606 1.00 0.00 N ATOM 1692 CA ALA B 35 -16.406 8.527 4.096 1.00 0.00 C ATOM 1693 C ALA B 35 -15.555 8.228 5.333 1.00 0.00 C ATOM 1694 O ALA B 35 -16.066 8.044 6.420 1.00 0.00 O ATOM 1695 CB ALA B 35 -17.561 9.463 4.455 1.00 0.00 C ATOM 0 H ALA B 35 -17.441 6.673 4.333 1.00 0.00 H new ATOM 0 HA ALA B 35 -15.741 8.965 3.351 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -17.162 10.407 4.825 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -18.168 9.648 3.569 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -18.177 9.002 5.227 1.00 0.00 H new ATOM 1701 N ALA B 36 -14.261 8.176 5.176 1.00 0.00 N ATOM 1702 CA ALA B 36 -13.381 7.887 6.346 1.00 0.00 C ATOM 1703 C ALA B 36 -12.123 8.757 6.293 1.00 0.00 C ATOM 1704 O ALA B 36 -11.657 9.129 5.234 1.00 0.00 O ATOM 1705 CB ALA B 36 -13.015 6.410 6.208 1.00 0.00 C ATOM 0 H ALA B 36 -13.775 8.321 4.291 1.00 0.00 H new ATOM 0 HA ALA B 36 -13.873 8.100 7.295 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -12.366 6.117 7.034 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -13.923 5.807 6.228 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -12.494 6.251 5.264 1.00 0.00 H new ATOM 1711 N SER B 37 -11.569 9.083 7.428 1.00 0.00 N ATOM 1712 CA SER B 37 -10.340 9.927 7.444 1.00 0.00 C ATOM 1713 C SER B 37 -9.090 9.045 7.397 1.00 0.00 C ATOM 1714 O SER B 37 -8.050 9.451 6.918 1.00 0.00 O ATOM 1715 CB SER B 37 -10.406 10.697 8.762 1.00 0.00 C ATOM 1716 OG SER B 37 -10.187 9.799 9.842 1.00 0.00 O ATOM 0 H SER B 37 -11.914 8.802 8.346 1.00 0.00 H new ATOM 0 HA SER B 37 -10.287 10.595 6.584 1.00 0.00 H new ATOM 0 HB2 SER B 37 -9.655 11.487 8.773 1.00 0.00 H new ATOM 0 HB3 SER B 37 -11.378 11.179 8.866 1.00 0.00 H new ATOM 0 HG SER B 37 -9.242 9.541 9.867 1.00 0.00 H new ATOM 1722 N CYS B 38 -9.181 7.840 7.892 1.00 0.00 N ATOM 1723 CA CYS B 38 -7.995 6.935 7.875 1.00 0.00 C ATOM 1724 C CYS B 38 -8.365 5.581 7.261 1.00 0.00 C ATOM 1725 O CYS B 38 -9.516 5.305 6.990 1.00 0.00 O ATOM 1726 CB CYS B 38 -7.604 6.768 9.343 1.00 0.00 C ATOM 1727 SG CYS B 38 -7.365 8.398 10.094 1.00 0.00 S ATOM 0 H CYS B 38 -10.024 7.443 8.307 1.00 0.00 H new ATOM 0 HA CYS B 38 -7.178 7.339 7.277 1.00 0.00 H new ATOM 0 HB2 CYS B 38 -8.380 6.220 9.877 1.00 0.00 H new ATOM 0 HB3 CYS B 38 -6.689 6.182 9.422 1.00 0.00 H new ATOM 0 HG CYS B 38 -7.034 8.256 11.343 1.00 0.00 H new ATOM 1733 N LEU B 39 -7.395 4.734 7.042 1.00 0.00 N ATOM 1734 CA LEU B 39 -7.691 3.397 6.448 1.00 0.00 C ATOM 1735 C LEU B 39 -8.587 2.586 7.387 1.00 0.00 C ATOM 1736 O LEU B 39 -9.712 2.259 7.063 1.00 0.00 O ATOM 1737 CB LEU B 39 -6.329 2.718 6.297 1.00 0.00 C ATOM 1738 CG LEU B 39 -5.520 3.421 5.206 1.00 0.00 C ATOM 1739 CD1 LEU B 39 -4.280 2.590 4.875 1.00 0.00 C ATOM 1740 CD2 LEU B 39 -6.382 3.572 3.951 1.00 0.00 C ATOM 0 H LEU B 39 -6.412 4.909 7.248 1.00 0.00 H new ATOM 0 HA LEU B 39 -8.216 3.479 5.496 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -5.788 2.752 7.243 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -6.462 1.666 6.044 1.00 0.00 H new ATOM 0 HG LEU B 39 -5.214 4.406 5.558 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -3.703 3.091 4.097 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -3.666 2.481 5.769 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -4.586 1.605 4.522 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -5.807 4.073 3.173 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -6.688 2.587 3.599 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -7.266 4.164 4.186 1.00 0.00 H new ATOM 1752 N GLU B 40 -8.094 2.257 8.549 1.00 0.00 N ATOM 1753 CA GLU B 40 -8.910 1.462 9.513 1.00 0.00 C ATOM 1754 C GLU B 40 -10.327 2.036 9.615 1.00 0.00 C ATOM 1755 O GLU B 40 -11.280 1.320 9.848 1.00 0.00 O ATOM 1756 CB GLU B 40 -8.181 1.595 10.850 1.00 0.00 C ATOM 1757 CG GLU B 40 -8.854 0.698 11.890 1.00 0.00 C ATOM 1758 CD GLU B 40 -8.308 1.029 13.279 1.00 0.00 C ATOM 1759 OE1 GLU B 40 -7.230 0.556 13.599 1.00 0.00 O ATOM 1760 OE2 GLU B 40 -8.976 1.751 14.001 1.00 0.00 O ATOM 0 H GLU B 40 -7.159 2.504 8.874 1.00 0.00 H new ATOM 0 HA GLU B 40 -9.013 0.422 9.204 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -7.134 1.314 10.735 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -8.198 2.633 11.184 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -9.934 0.844 11.868 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -8.670 -0.350 11.655 1.00 0.00 H new ATOM 1767 N ASP B 41 -10.473 3.321 9.444 1.00 0.00 N ATOM 1768 CA ASP B 41 -11.829 3.934 9.533 1.00 0.00 C ATOM 1769 C ASP B 41 -12.615 3.668 8.247 1.00 0.00 C ATOM 1770 O ASP B 41 -13.807 3.433 8.272 1.00 0.00 O ATOM 1771 CB ASP B 41 -11.576 5.432 9.711 1.00 0.00 C ATOM 1772 CG ASP B 41 -12.887 6.134 10.068 1.00 0.00 C ATOM 1773 OD1 ASP B 41 -13.580 6.552 9.155 1.00 0.00 O ATOM 1774 OD2 ASP B 41 -13.176 6.242 11.248 1.00 0.00 O ATOM 0 H ASP B 41 -9.713 3.973 9.247 1.00 0.00 H new ATOM 0 HA ASP B 41 -12.417 3.521 10.353 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -10.838 5.596 10.496 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -11.164 5.853 8.794 1.00 0.00 H new ATOM 1779 N LEU B 42 -11.956 3.701 7.120 1.00 0.00 N ATOM 1780 CA LEU B 42 -12.664 3.448 5.832 1.00 0.00 C ATOM 1781 C LEU B 42 -13.264 2.040 5.830 1.00 0.00 C ATOM 1782 O LEU B 42 -14.400 1.839 5.447 1.00 0.00 O ATOM 1783 CB LEU B 42 -11.584 3.574 4.758 1.00 0.00 C ATOM 1784 CG LEU B 42 -12.225 3.477 3.373 1.00 0.00 C ATOM 1785 CD1 LEU B 42 -12.964 4.778 3.058 1.00 0.00 C ATOM 1786 CD2 LEU B 42 -11.133 3.244 2.325 1.00 0.00 C ATOM 0 H LEU B 42 -10.958 3.892 7.036 1.00 0.00 H new ATOM 0 HA LEU B 42 -13.486 4.144 5.666 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -11.062 4.525 4.863 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -10.840 2.787 4.882 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.932 2.647 3.356 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -13.420 4.707 2.071 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -13.740 4.946 3.805 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.259 5.610 3.073 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -11.587 3.174 1.336 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -10.428 4.075 2.343 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -10.606 2.316 2.549 1.00 0.00 H new ATOM 1798 N ARG B 43 -12.511 1.066 6.259 1.00 0.00 N ATOM 1799 CA ARG B 43 -13.040 -0.327 6.286 1.00 0.00 C ATOM 1800 C ARG B 43 -14.222 -0.413 7.251 1.00 0.00 C ATOM 1801 O ARG B 43 -15.348 -0.642 6.858 1.00 0.00 O ATOM 1802 CB ARG B 43 -11.879 -1.178 6.798 1.00 0.00 C ATOM 1803 CG ARG B 43 -12.156 -2.653 6.502 1.00 0.00 C ATOM 1804 CD ARG B 43 -10.994 -3.506 7.018 1.00 0.00 C ATOM 1805 NE ARG B 43 -11.612 -4.444 7.995 1.00 0.00 N ATOM 1806 CZ ARG B 43 -10.858 -5.223 8.726 1.00 0.00 C ATOM 1807 NH1 ARG B 43 -9.559 -5.182 8.604 1.00 0.00 N ATOM 1808 NH2 ARG B 43 -11.407 -6.043 9.580 1.00 0.00 N ATOM 0 H ARG B 43 -11.553 1.174 6.592 1.00 0.00 H new ATOM 0 HA ARG B 43 -13.392 -0.658 5.309 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -10.949 -0.869 6.320 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -11.751 -1.029 7.870 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -13.087 -2.962 6.978 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -12.282 -2.802 5.430 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -10.509 -4.046 6.205 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -10.231 -2.889 7.491 1.00 0.00 H new ATOM 0 HE ARG B 43 -12.627 -4.479 8.094 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -9.129 -4.541 7.937 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -8.974 -5.791 9.176 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -12.422 -6.075 9.676 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -10.821 -6.652 10.151 1.00 0.00 H new ATOM 1822 N SER B 44 -13.966 -0.226 8.514 1.00 0.00 N ATOM 1823 CA SER B 44 -15.064 -0.292 9.521 1.00 0.00 C ATOM 1824 C SER B 44 -16.307 0.439 9.002 1.00 0.00 C ATOM 1825 O SER B 44 -17.364 -0.143 8.855 1.00 0.00 O ATOM 1826 CB SER B 44 -14.508 0.411 10.758 1.00 0.00 C ATOM 1827 OG SER B 44 -15.555 0.599 11.701 1.00 0.00 O ATOM 0 H SER B 44 -13.041 -0.029 8.896 1.00 0.00 H new ATOM 0 HA SER B 44 -15.366 -1.317 9.734 1.00 0.00 H new ATOM 0 HB2 SER B 44 -13.708 -0.183 11.199 1.00 0.00 H new ATOM 0 HB3 SER B 44 -14.076 1.372 10.481 1.00 0.00 H new ATOM 0 HG SER B 44 -15.202 1.048 12.497 1.00 0.00 H new ATOM 1833 N LYS B 45 -16.191 1.710 8.727 1.00 0.00 N ATOM 1834 CA LYS B 45 -17.367 2.474 8.222 1.00 0.00 C ATOM 1835 C LYS B 45 -17.878 1.863 6.915 1.00 0.00 C ATOM 1836 O LYS B 45 -19.068 1.776 6.684 1.00 0.00 O ATOM 1837 CB LYS B 45 -16.844 3.891 7.986 1.00 0.00 C ATOM 1838 CG LYS B 45 -16.789 4.644 9.316 1.00 0.00 C ATOM 1839 CD LYS B 45 -16.638 6.143 9.049 1.00 0.00 C ATOM 1840 CE LYS B 45 -17.843 6.889 9.628 1.00 0.00 C ATOM 1841 NZ LYS B 45 -17.978 8.111 8.787 1.00 0.00 N ATOM 0 H LYS B 45 -15.333 2.252 8.830 1.00 0.00 H new ATOM 0 HA LYS B 45 -18.202 2.458 8.923 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -15.852 3.853 7.536 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -17.492 4.417 7.285 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -17.696 4.456 9.890 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -15.952 4.285 9.915 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -15.717 6.513 9.500 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -16.564 6.327 7.977 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -18.744 6.278 9.584 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -17.683 7.146 10.675 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -17.882 8.956 9.385 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -17.235 8.116 8.060 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -18.911 8.115 8.328 1.00 0.00 H new ATOM 1855 N ALA B 46 -16.990 1.439 6.059 1.00 0.00 N ATOM 1856 CA ALA B 46 -17.431 0.833 4.769 1.00 0.00 C ATOM 1857 C ALA B 46 -18.095 -0.522 5.023 1.00 0.00 C ATOM 1858 O ALA B 46 -18.690 -1.108 4.141 1.00 0.00 O ATOM 1859 CB ALA B 46 -16.151 0.661 3.953 1.00 0.00 C ATOM 0 H ALA B 46 -15.980 1.485 6.195 1.00 0.00 H new ATOM 0 HA ALA B 46 -18.163 1.452 4.250 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -16.392 0.219 2.986 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -15.683 1.634 3.801 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -15.463 0.007 4.489 1.00 0.00 H new ATOM 1865 N CYS B 47 -17.999 -1.024 6.224 1.00 0.00 N ATOM 1866 CA CYS B 47 -18.627 -2.342 6.533 1.00 0.00 C ATOM 1867 C CYS B 47 -20.116 -2.156 6.839 1.00 0.00 C ATOM 1868 O CYS B 47 -20.950 -2.922 6.399 1.00 0.00 O ATOM 1869 CB CYS B 47 -17.886 -2.855 7.768 1.00 0.00 C ATOM 1870 SG CYS B 47 -18.231 -4.618 7.988 1.00 0.00 S ATOM 0 H CYS B 47 -17.514 -0.580 7.004 1.00 0.00 H new ATOM 0 HA CYS B 47 -18.557 -3.040 5.698 1.00 0.00 H new ATOM 0 HB2 CYS B 47 -16.814 -2.694 7.655 1.00 0.00 H new ATOM 0 HB3 CYS B 47 -18.200 -2.299 8.651 1.00 0.00 H new ATOM 0 HG CYS B 47 -17.600 -5.056 9.037 1.00 0.00 H new ATOM 1876 N ASP B 48 -20.456 -1.143 7.590 1.00 0.00 N ATOM 1877 CA ASP B 48 -21.891 -0.909 7.922 1.00 0.00 C ATOM 1878 C ASP B 48 -22.634 -0.373 6.695 1.00 0.00 C ATOM 1879 O ASP B 48 -23.829 -0.546 6.556 1.00 0.00 O ATOM 1880 CB ASP B 48 -21.875 0.133 9.040 1.00 0.00 C ATOM 1881 CG ASP B 48 -21.059 1.348 8.597 1.00 0.00 C ATOM 1882 OD1 ASP B 48 -21.347 1.877 7.536 1.00 0.00 O ATOM 1883 OD2 ASP B 48 -20.160 1.732 9.328 1.00 0.00 O ATOM 0 H ASP B 48 -19.803 -0.468 7.988 1.00 0.00 H new ATOM 0 HA ASP B 48 -22.400 -1.823 8.227 1.00 0.00 H new ATOM 0 HB2 ASP B 48 -22.893 0.435 9.284 1.00 0.00 H new ATOM 0 HB3 ASP B 48 -21.445 -0.296 9.945 1.00 0.00 H new ATOM 1888 N ILE B 49 -21.935 0.273 5.800 1.00 0.00 N ATOM 1889 CA ILE B 49 -22.601 0.816 4.582 1.00 0.00 C ATOM 1890 C ILE B 49 -22.642 -0.253 3.487 1.00 0.00 C ATOM 1891 O ILE B 49 -23.589 -0.349 2.732 1.00 0.00 O ATOM 1892 CB ILE B 49 -21.732 1.996 4.146 1.00 0.00 C ATOM 1893 CG1 ILE B 49 -22.446 2.772 3.037 1.00 0.00 C ATOM 1894 CG2 ILE B 49 -20.392 1.475 3.622 1.00 0.00 C ATOM 1895 CD1 ILE B 49 -21.648 4.034 2.701 1.00 0.00 C ATOM 0 H ILE B 49 -20.932 0.448 5.860 1.00 0.00 H new ATOM 0 HA ILE B 49 -23.631 1.119 4.773 1.00 0.00 H new ATOM 0 HB ILE B 49 -21.559 2.655 4.997 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -22.549 2.147 2.150 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -23.453 3.040 3.357 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -19.771 2.315 3.311 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -19.883 0.921 4.411 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -20.565 0.817 2.770 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -22.157 4.587 1.911 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -21.568 4.661 3.589 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -20.650 3.754 2.363 1.00 0.00 H new ATOM 1907 N LEU B 50 -21.619 -1.059 3.397 1.00 0.00 N ATOM 1908 CA LEU B 50 -21.595 -2.125 2.354 1.00 0.00 C ATOM 1909 C LEU B 50 -22.675 -3.171 2.641 1.00 0.00 C ATOM 1910 O LEU B 50 -23.124 -3.874 1.757 1.00 0.00 O ATOM 1911 CB LEU B 50 -20.203 -2.748 2.460 1.00 0.00 C ATOM 1912 CG LEU B 50 -20.045 -3.840 1.401 1.00 0.00 C ATOM 1913 CD1 LEU B 50 -19.850 -3.194 0.029 1.00 0.00 C ATOM 1914 CD2 LEU B 50 -18.823 -4.700 1.735 1.00 0.00 C ATOM 0 H LEU B 50 -20.798 -1.026 4.001 1.00 0.00 H new ATOM 0 HA LEU B 50 -21.792 -1.732 1.356 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -19.440 -1.982 2.323 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -20.057 -3.169 3.455 1.00 0.00 H new ATOM 0 HG LEU B 50 -20.938 -4.464 1.387 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -19.737 -3.972 -0.727 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -20.717 -2.579 -0.210 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -18.956 -2.571 0.044 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -18.709 -5.479 0.981 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -17.930 -4.074 1.748 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -18.958 -5.160 2.714 1.00 0.00 H new ATOM 1926 N ALA B 51 -23.097 -3.279 3.872 1.00 0.00 N ATOM 1927 CA ALA B 51 -24.148 -4.280 4.215 1.00 0.00 C ATOM 1928 C ALA B 51 -23.691 -5.686 3.821 1.00 0.00 C ATOM 1929 O ALA B 51 -24.362 -6.385 3.088 1.00 0.00 O ATOM 1930 CB ALA B 51 -25.373 -3.866 3.398 1.00 0.00 C ATOM 0 H ALA B 51 -22.760 -2.718 4.654 1.00 0.00 H new ATOM 0 HA ALA B 51 -24.360 -4.304 5.284 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -26.193 -4.557 3.596 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -25.673 -2.856 3.679 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -25.127 -3.890 2.336 1.00 0.00 H new ATOM 1936 N ILE B 52 -22.554 -6.108 4.304 1.00 0.00 N ATOM 1937 CA ILE B 52 -22.058 -7.472 3.958 1.00 0.00 C ATOM 1938 C ILE B 52 -22.108 -8.377 5.191 1.00 0.00 C ATOM 1939 O ILE B 52 -22.065 -7.916 6.314 1.00 0.00 O ATOM 1940 CB ILE B 52 -20.614 -7.264 3.499 1.00 0.00 C ATOM 1941 CG1 ILE B 52 -20.071 -8.570 2.917 1.00 0.00 C ATOM 1942 CG2 ILE B 52 -19.754 -6.842 4.693 1.00 0.00 C ATOM 1943 CD1 ILE B 52 -19.935 -8.436 1.398 1.00 0.00 C ATOM 0 H ILE B 52 -21.948 -5.569 4.922 1.00 0.00 H new ATOM 0 HA ILE B 52 -22.663 -7.951 3.188 1.00 0.00 H new ATOM 0 HB ILE B 52 -20.584 -6.486 2.737 1.00 0.00 H new ATOM 0 HG12 ILE B 52 -19.103 -8.803 3.360 1.00 0.00 H new ATOM 0 HG13 ILE B 52 -20.740 -9.395 3.161 1.00 0.00 H new ATOM 0 HG21 ILE B 52 -18.725 -6.694 4.366 1.00 0.00 H new ATOM 0 HG22 ILE B 52 -20.140 -5.911 5.109 1.00 0.00 H new ATOM 0 HG23 ILE B 52 -19.784 -7.620 5.456 1.00 0.00 H new ATOM 0 HD11 ILE B 52 -19.548 -9.367 0.984 1.00 0.00 H new ATOM 0 HD12 ILE B 52 -20.911 -8.223 0.963 1.00 0.00 H new ATOM 0 HD13 ILE B 52 -19.249 -7.622 1.165 1.00 0.00 H new ATOM 1955 N ASP B 53 -22.201 -9.664 4.992 1.00 0.00 N ATOM 1956 CA ASP B 53 -22.256 -10.596 6.154 1.00 0.00 C ATOM 1957 C ASP B 53 -20.900 -11.280 6.349 1.00 0.00 C ATOM 1958 O ASP B 53 -20.622 -11.844 7.389 1.00 0.00 O ATOM 1959 CB ASP B 53 -23.327 -11.623 5.790 1.00 0.00 C ATOM 1960 CG ASP B 53 -23.581 -12.541 6.986 1.00 0.00 C ATOM 1961 OD1 ASP B 53 -23.945 -12.030 8.033 1.00 0.00 O ATOM 1962 OD2 ASP B 53 -23.408 -13.739 6.835 1.00 0.00 O ATOM 0 H ASP B 53 -22.241 -10.110 4.075 1.00 0.00 H new ATOM 0 HA ASP B 53 -22.488 -10.080 7.086 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -24.249 -11.117 5.504 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -23.006 -12.210 4.929 1.00 0.00 H new ATOM 1967 N LYS B 54 -20.054 -11.235 5.356 1.00 0.00 N ATOM 1968 CA LYS B 54 -18.719 -11.883 5.484 1.00 0.00 C ATOM 1969 C LYS B 54 -17.703 -10.892 6.061 1.00 0.00 C ATOM 1970 O LYS B 54 -16.525 -10.954 5.769 1.00 0.00 O ATOM 1971 CB LYS B 54 -18.333 -12.282 4.060 1.00 0.00 C ATOM 1972 CG LYS B 54 -17.085 -13.167 4.097 1.00 0.00 C ATOM 1973 CD LYS B 54 -17.502 -14.636 4.209 1.00 0.00 C ATOM 1974 CE LYS B 54 -17.274 -15.335 2.867 1.00 0.00 C ATOM 1975 NZ LYS B 54 -16.852 -16.720 3.222 1.00 0.00 N ATOM 0 H LYS B 54 -20.230 -10.777 4.462 1.00 0.00 H new ATOM 0 HA LYS B 54 -18.739 -12.742 6.155 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -19.156 -12.816 3.585 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -18.143 -11.392 3.461 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -16.491 -13.014 3.196 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -16.456 -12.891 4.943 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -16.925 -15.130 4.991 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -18.552 -14.706 4.494 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -18.183 -15.341 2.265 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -16.508 -14.826 2.282 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -16.677 -17.263 2.353 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -15.981 -16.683 3.789 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -17.604 -17.182 3.773 1.00 0.00 H new ATOM 1989 N SER B 55 -18.153 -9.976 6.875 1.00 0.00 N ATOM 1990 CA SER B 55 -17.214 -8.979 7.468 1.00 0.00 C ATOM 1991 C SER B 55 -16.097 -9.690 8.237 1.00 0.00 C ATOM 1992 O SER B 55 -15.076 -9.108 8.544 1.00 0.00 O ATOM 1993 CB SER B 55 -18.074 -8.148 8.420 1.00 0.00 C ATOM 1994 OG SER B 55 -19.209 -7.654 7.720 1.00 0.00 O ATOM 0 H SER B 55 -19.128 -9.874 7.155 1.00 0.00 H new ATOM 0 HA SER B 55 -16.731 -8.364 6.708 1.00 0.00 H new ATOM 0 HB2 SER B 55 -18.391 -8.757 9.267 1.00 0.00 H new ATOM 0 HB3 SER B 55 -17.493 -7.319 8.824 1.00 0.00 H new ATOM 0 HG SER B 55 -19.156 -6.677 7.658 1.00 0.00 H new ATOM 2000 N LEU B 56 -16.287 -10.941 8.561 1.00 0.00 N ATOM 2001 CA LEU B 56 -15.246 -11.687 9.319 1.00 0.00 C ATOM 2002 C LEU B 56 -13.984 -11.923 8.475 1.00 0.00 C ATOM 2003 O LEU B 56 -13.040 -12.539 8.927 1.00 0.00 O ATOM 2004 CB LEU B 56 -15.922 -13.013 9.709 1.00 0.00 C ATOM 2005 CG LEU B 56 -15.963 -14.008 8.534 1.00 0.00 C ATOM 2006 CD1 LEU B 56 -16.457 -13.316 7.265 1.00 0.00 C ATOM 2007 CD2 LEU B 56 -14.571 -14.597 8.289 1.00 0.00 C ATOM 0 H LEU B 56 -17.123 -11.479 8.331 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.902 -11.130 10.191 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.385 -13.461 10.545 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -16.938 -12.815 10.052 1.00 0.00 H new ATOM 0 HG LEU B 56 -16.652 -14.812 8.791 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -16.480 -14.033 6.445 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -17.460 -12.923 7.432 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -15.784 -12.497 7.012 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -14.614 -15.299 7.456 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -13.873 -13.794 8.051 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.234 -15.118 9.185 1.00 0.00 H new ATOM 2019 N THR B 57 -13.951 -11.446 7.260 1.00 0.00 N ATOM 2020 CA THR B 57 -12.740 -11.659 6.415 1.00 0.00 C ATOM 2021 C THR B 57 -11.892 -10.385 6.372 1.00 0.00 C ATOM 2022 O THR B 57 -12.412 -9.290 6.440 1.00 0.00 O ATOM 2023 CB THR B 57 -13.282 -11.994 5.024 1.00 0.00 C ATOM 2024 OG1 THR B 57 -12.207 -12.378 4.179 1.00 0.00 O ATOM 2025 CG2 THR B 57 -13.983 -10.768 4.437 1.00 0.00 C ATOM 0 H THR B 57 -14.705 -10.921 6.818 1.00 0.00 H new ATOM 0 HA THR B 57 -12.099 -12.451 6.803 1.00 0.00 H new ATOM 0 HB THR B 57 -13.996 -12.814 5.100 1.00 0.00 H new ATOM 0 HG1 THR B 57 -11.766 -11.577 3.826 1.00 0.00 H new ATOM 0 HG21 THR B 57 -14.368 -11.009 3.446 1.00 0.00 H new ATOM 0 HG22 THR B 57 -14.808 -10.475 5.086 1.00 0.00 H new ATOM 0 HG23 THR B 57 -13.273 -9.945 4.360 1.00 0.00 H new ATOM 2033 N PRO B 58 -10.605 -10.577 6.261 1.00 0.00 N ATOM 2034 CA PRO B 58 -9.666 -9.431 6.209 1.00 0.00 C ATOM 2035 C PRO B 58 -9.772 -8.717 4.859 1.00 0.00 C ATOM 2036 O PRO B 58 -9.259 -9.179 3.860 1.00 0.00 O ATOM 2037 CB PRO B 58 -8.296 -10.083 6.373 1.00 0.00 C ATOM 2038 CG PRO B 58 -8.478 -11.490 5.898 1.00 0.00 C ATOM 2039 CD PRO B 58 -9.912 -11.866 6.173 1.00 0.00 C ATOM 0 HA PRO B 58 -9.867 -8.676 6.969 1.00 0.00 H new ATOM 0 HB2 PRO B 58 -7.539 -9.563 5.786 1.00 0.00 H new ATOM 0 HB3 PRO B 58 -7.968 -10.056 7.412 1.00 0.00 H new ATOM 0 HG2 PRO B 58 -8.256 -11.570 4.834 1.00 0.00 H new ATOM 0 HG3 PRO B 58 -7.796 -12.164 6.417 1.00 0.00 H new ATOM 0 HD2 PRO B 58 -10.322 -12.486 5.376 1.00 0.00 H new ATOM 0 HD3 PRO B 58 -10.005 -12.434 7.099 1.00 0.00 H new ATOM 2047 N VAL B 59 -10.439 -7.596 4.822 1.00 0.00 N ATOM 2048 CA VAL B 59 -10.580 -6.858 3.535 1.00 0.00 C ATOM 2049 C VAL B 59 -9.395 -5.911 3.332 1.00 0.00 C ATOM 2050 O VAL B 59 -9.175 -5.001 4.106 1.00 0.00 O ATOM 2051 CB VAL B 59 -11.878 -6.064 3.673 1.00 0.00 C ATOM 2052 CG1 VAL B 59 -12.254 -5.463 2.317 1.00 0.00 C ATOM 2053 CG2 VAL B 59 -12.999 -6.993 4.144 1.00 0.00 C ATOM 0 H VAL B 59 -10.892 -7.160 5.625 1.00 0.00 H new ATOM 0 HA VAL B 59 -10.600 -7.530 2.677 1.00 0.00 H new ATOM 0 HB VAL B 59 -11.738 -5.265 4.401 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -13.180 -4.896 2.414 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -11.457 -4.801 1.979 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -12.393 -6.263 1.590 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -13.925 -6.426 4.242 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -13.139 -7.792 3.416 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -12.733 -7.424 5.109 1.00 0.00 H new ATOM 2063 N THR B 60 -8.634 -6.118 2.295 1.00 0.00 N ATOM 2064 CA THR B 60 -7.466 -5.227 2.036 1.00 0.00 C ATOM 2065 C THR B 60 -7.883 -4.077 1.117 1.00 0.00 C ATOM 2066 O THR B 60 -8.976 -4.060 0.589 1.00 0.00 O ATOM 2067 CB THR B 60 -6.427 -6.118 1.352 1.00 0.00 C ATOM 2068 OG1 THR B 60 -5.229 -5.381 1.156 1.00 0.00 O ATOM 2069 CG2 THR B 60 -6.965 -6.589 -0.001 1.00 0.00 C ATOM 0 H THR B 60 -8.769 -6.866 1.614 1.00 0.00 H new ATOM 0 HA THR B 60 -7.073 -4.780 2.949 1.00 0.00 H new ATOM 0 HB THR B 60 -6.223 -6.985 1.980 1.00 0.00 H new ATOM 0 HG1 THR B 60 -4.562 -5.951 0.720 1.00 0.00 H new ATOM 0 HG21 THR B 60 -6.223 -7.223 -0.487 1.00 0.00 H new ATOM 0 HG22 THR B 60 -7.884 -7.155 0.150 1.00 0.00 H new ATOM 0 HG23 THR B 60 -7.171 -5.724 -0.632 1.00 0.00 H new ATOM 2077 N LEU B 61 -7.023 -3.115 0.920 1.00 0.00 N ATOM 2078 CA LEU B 61 -7.379 -1.970 0.034 1.00 0.00 C ATOM 2079 C LEU B 61 -6.382 -1.865 -1.122 1.00 0.00 C ATOM 2080 O LEU B 61 -5.186 -1.806 -0.919 1.00 0.00 O ATOM 2081 CB LEU B 61 -7.292 -0.733 0.926 1.00 0.00 C ATOM 2082 CG LEU B 61 -8.374 -0.799 2.003 1.00 0.00 C ATOM 2083 CD1 LEU B 61 -8.286 0.444 2.891 1.00 0.00 C ATOM 2084 CD2 LEU B 61 -9.753 -0.852 1.339 1.00 0.00 C ATOM 0 H LEU B 61 -6.091 -3.072 1.333 1.00 0.00 H new ATOM 0 HA LEU B 61 -8.369 -2.085 -0.408 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -6.307 -0.675 1.389 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -7.416 0.169 0.327 1.00 0.00 H new ATOM 0 HG LEU B 61 -8.227 -1.692 2.610 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -9.058 0.398 3.659 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -7.305 0.485 3.364 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -8.433 1.337 2.283 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -10.525 -0.899 2.107 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -9.899 0.041 0.732 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -9.818 -1.736 0.705 1.00 0.00 H new ATOM 2096 N VAL B 62 -6.865 -1.837 -2.334 1.00 0.00 N ATOM 2097 CA VAL B 62 -5.946 -1.730 -3.502 1.00 0.00 C ATOM 2098 C VAL B 62 -6.352 -0.544 -4.378 1.00 0.00 C ATOM 2099 O VAL B 62 -7.378 0.070 -4.171 1.00 0.00 O ATOM 2100 CB VAL B 62 -6.113 -3.045 -4.265 1.00 0.00 C ATOM 2101 CG1 VAL B 62 -5.416 -4.173 -3.501 1.00 0.00 C ATOM 2102 CG2 VAL B 62 -7.602 -3.367 -4.400 1.00 0.00 C ATOM 0 H VAL B 62 -7.857 -1.884 -2.566 1.00 0.00 H new ATOM 0 HA VAL B 62 -4.911 -1.567 -3.202 1.00 0.00 H new ATOM 0 HB VAL B 62 -5.668 -2.949 -5.255 1.00 0.00 H new ATOM 0 HG11 VAL B 62 -5.536 -5.110 -4.046 1.00 0.00 H new ATOM 0 HG12 VAL B 62 -4.355 -3.944 -3.402 1.00 0.00 H new ATOM 0 HG13 VAL B 62 -5.860 -4.270 -2.510 1.00 0.00 H new ATOM 0 HG21 VAL B 62 -7.724 -4.304 -4.944 1.00 0.00 H new ATOM 0 HG22 VAL B 62 -8.045 -3.462 -3.409 1.00 0.00 H new ATOM 0 HG23 VAL B 62 -8.100 -2.564 -4.944 1.00 0.00 H new ATOM 2112 N LEU B 63 -5.555 -0.217 -5.356 1.00 0.00 N ATOM 2113 CA LEU B 63 -5.898 0.931 -6.242 1.00 0.00 C ATOM 2114 C LEU B 63 -6.355 0.423 -7.613 1.00 0.00 C ATOM 2115 O LEU B 63 -5.641 -0.282 -8.293 1.00 0.00 O ATOM 2116 CB LEU B 63 -4.600 1.730 -6.371 1.00 0.00 C ATOM 2117 CG LEU B 63 -4.272 2.405 -5.038 1.00 0.00 C ATOM 2118 CD1 LEU B 63 -3.168 3.442 -5.250 1.00 0.00 C ATOM 2119 CD2 LEU B 63 -5.522 3.099 -4.492 1.00 0.00 C ATOM 0 H LEU B 63 -4.682 -0.694 -5.581 1.00 0.00 H new ATOM 0 HA LEU B 63 -6.712 1.535 -5.841 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -3.784 1.070 -6.665 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -4.701 2.481 -7.154 1.00 0.00 H new ATOM 0 HG LEU B 63 -3.935 1.652 -4.326 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -2.934 3.923 -4.301 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -2.276 2.950 -5.637 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -3.506 4.193 -5.964 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.286 3.579 -3.542 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -5.861 3.851 -5.204 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -6.310 2.362 -4.340 1.00 0.00 H new ATOM 2131 N ALA B 64 -7.540 0.778 -8.027 1.00 0.00 N ATOM 2132 CA ALA B 64 -8.025 0.312 -9.356 1.00 0.00 C ATOM 2133 C ALA B 64 -7.053 0.761 -10.451 1.00 0.00 C ATOM 2134 O ALA B 64 -6.984 0.178 -11.514 1.00 0.00 O ATOM 2135 CB ALA B 64 -9.388 0.981 -9.541 1.00 0.00 C ATOM 0 H ALA B 64 -8.190 1.367 -7.506 1.00 0.00 H new ATOM 0 HA ALA B 64 -8.097 -0.774 -9.415 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -9.811 0.686 -10.501 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -10.057 0.671 -8.739 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -9.268 2.064 -9.515 1.00 0.00 H new ATOM 2141 N GLU B 65 -6.300 1.797 -10.194 1.00 0.00 N ATOM 2142 CA GLU B 65 -5.330 2.289 -11.214 1.00 0.00 C ATOM 2143 C GLU B 65 -3.970 1.605 -11.033 1.00 0.00 C ATOM 2144 O GLU B 65 -3.518 0.866 -11.884 1.00 0.00 O ATOM 2145 CB GLU B 65 -5.214 3.791 -10.952 1.00 0.00 C ATOM 2146 CG GLU B 65 -4.551 4.470 -12.152 1.00 0.00 C ATOM 2147 CD GLU B 65 -5.542 4.531 -13.316 1.00 0.00 C ATOM 2148 OE1 GLU B 65 -6.308 5.480 -13.366 1.00 0.00 O ATOM 2149 OE2 GLU B 65 -5.520 3.629 -14.137 1.00 0.00 O ATOM 0 H GLU B 65 -6.315 2.324 -9.321 1.00 0.00 H new ATOM 0 HA GLU B 65 -5.657 2.074 -12.231 1.00 0.00 H new ATOM 0 HB2 GLU B 65 -6.202 4.218 -10.779 1.00 0.00 H new ATOM 0 HB3 GLU B 65 -4.628 3.969 -10.050 1.00 0.00 H new ATOM 0 HG2 GLU B 65 -4.229 5.476 -11.882 1.00 0.00 H new ATOM 0 HG3 GLU B 65 -3.659 3.918 -12.448 1.00 0.00 H new ATOM 2156 N ASP B 66 -3.314 1.850 -9.930 1.00 0.00 N ATOM 2157 CA ASP B 66 -1.983 1.216 -9.697 1.00 0.00 C ATOM 2158 C ASP B 66 -2.158 -0.195 -9.130 1.00 0.00 C ATOM 2159 O ASP B 66 -1.321 -1.057 -9.310 1.00 0.00 O ATOM 2160 CB ASP B 66 -1.289 2.121 -8.677 1.00 0.00 C ATOM 2161 CG ASP B 66 0.194 1.754 -8.595 1.00 0.00 C ATOM 2162 OD1 ASP B 66 0.805 1.604 -9.640 1.00 0.00 O ATOM 2163 OD2 ASP B 66 0.693 1.629 -7.489 1.00 0.00 O ATOM 0 H ASP B 66 -3.641 2.461 -9.181 1.00 0.00 H new ATOM 0 HA ASP B 66 -1.406 1.117 -10.617 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -1.401 3.166 -8.967 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -1.757 2.010 -7.699 1.00 0.00 H new ATOM 2168 N GLY B 67 -3.243 -0.437 -8.450 1.00 0.00 N ATOM 2169 CA GLY B 67 -3.483 -1.791 -7.875 1.00 0.00 C ATOM 2170 C GLY B 67 -2.506 -2.057 -6.729 1.00 0.00 C ATOM 2171 O GLY B 67 -2.277 -3.191 -6.354 1.00 0.00 O ATOM 0 H GLY B 67 -3.977 0.247 -8.267 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -4.509 -1.864 -7.513 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -3.363 -2.549 -8.649 1.00 0.00 H new ATOM 2175 N THR B 68 -1.932 -1.033 -6.159 1.00 0.00 N ATOM 2176 CA THR B 68 -0.981 -1.262 -5.031 1.00 0.00 C ATOM 2177 C THR B 68 -1.725 -1.134 -3.700 1.00 0.00 C ATOM 2178 O THR B 68 -2.531 -0.245 -3.513 1.00 0.00 O ATOM 2179 CB THR B 68 0.095 -0.178 -5.163 1.00 0.00 C ATOM 2180 OG1 THR B 68 1.221 -0.538 -4.375 1.00 0.00 O ATOM 2181 CG2 THR B 68 -0.449 1.163 -4.666 1.00 0.00 C ATOM 0 H THR B 68 -2.077 -0.058 -6.421 1.00 0.00 H new ATOM 0 HA THR B 68 -0.537 -2.257 -5.061 1.00 0.00 H new ATOM 0 HB THR B 68 0.382 -0.087 -6.210 1.00 0.00 H new ATOM 0 HG1 THR B 68 0.954 -1.203 -3.707 1.00 0.00 H new ATOM 0 HG21 THR B 68 0.322 1.927 -4.763 1.00 0.00 H new ATOM 0 HG22 THR B 68 -1.318 1.446 -5.261 1.00 0.00 H new ATOM 0 HG23 THR B 68 -0.740 1.072 -3.619 1.00 0.00 H new ATOM 2189 N ILE B 69 -1.468 -2.018 -2.779 1.00 0.00 N ATOM 2190 CA ILE B 69 -2.172 -1.943 -1.468 1.00 0.00 C ATOM 2191 C ILE B 69 -1.529 -0.878 -0.579 1.00 0.00 C ATOM 2192 O ILE B 69 -0.323 -0.788 -0.468 1.00 0.00 O ATOM 2193 CB ILE B 69 -2.016 -3.333 -0.852 1.00 0.00 C ATOM 2194 CG1 ILE B 69 -0.535 -3.605 -0.573 1.00 0.00 C ATOM 2195 CG2 ILE B 69 -2.557 -4.383 -1.824 1.00 0.00 C ATOM 2196 CD1 ILE B 69 -0.363 -5.042 -0.082 1.00 0.00 C ATOM 0 H ILE B 69 -0.804 -2.786 -2.875 1.00 0.00 H new ATOM 0 HA ILE B 69 -3.220 -1.666 -1.578 1.00 0.00 H new ATOM 0 HB ILE B 69 -2.574 -3.383 0.083 1.00 0.00 H new ATOM 0 HG12 ILE B 69 0.051 -3.446 -1.478 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -0.161 -2.907 0.176 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -2.447 -5.375 -1.386 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -3.611 -4.188 -2.020 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -1.999 -4.335 -2.759 1.00 0.00 H new ATOM 0 HD11 ILE B 69 0.691 -5.235 0.116 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -0.937 -5.185 0.834 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -0.721 -5.733 -0.846 1.00 0.00 H new ATOM 2208 N VAL B 70 -2.333 -0.068 0.052 1.00 0.00 N ATOM 2209 CA VAL B 70 -1.783 1.001 0.935 1.00 0.00 C ATOM 2210 C VAL B 70 -2.077 0.671 2.400 1.00 0.00 C ATOM 2211 O VAL B 70 -3.171 0.878 2.886 1.00 0.00 O ATOM 2212 CB VAL B 70 -2.517 2.274 0.511 1.00 0.00 C ATOM 2213 CG1 VAL B 70 -2.090 3.436 1.409 1.00 0.00 C ATOM 2214 CG2 VAL B 70 -2.170 2.602 -0.943 1.00 0.00 C ATOM 0 H VAL B 70 -3.351 -0.100 -0.005 1.00 0.00 H new ATOM 0 HA VAL B 70 -0.702 1.105 0.843 1.00 0.00 H new ATOM 0 HB VAL B 70 -3.592 2.119 0.604 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -2.614 4.342 1.105 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -2.336 3.204 2.445 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -1.015 3.591 1.317 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -2.693 3.509 -1.246 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -1.095 2.755 -1.035 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -2.475 1.776 -1.585 1.00 0.00 H new ATOM 2224 N ASP B 71 -1.109 0.157 3.107 1.00 0.00 N ATOM 2225 CA ASP B 71 -1.333 -0.189 4.539 1.00 0.00 C ATOM 2226 C ASP B 71 -1.360 1.080 5.394 1.00 0.00 C ATOM 2227 O ASP B 71 -1.736 1.054 6.548 1.00 0.00 O ATOM 2228 CB ASP B 71 -0.141 -1.065 4.923 1.00 0.00 C ATOM 2229 CG ASP B 71 1.160 -0.357 4.539 1.00 0.00 C ATOM 2230 OD1 ASP B 71 1.466 -0.324 3.358 1.00 0.00 O ATOM 2231 OD2 ASP B 71 1.827 0.140 5.430 1.00 0.00 O ATOM 0 H ASP B 71 -0.172 -0.039 2.755 1.00 0.00 H new ATOM 0 HA ASP B 71 -2.284 -0.698 4.696 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -0.155 -1.267 5.994 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -0.206 -2.028 4.417 1.00 0.00 H new ATOM 2236 N ASP B 72 -0.961 2.189 4.837 1.00 0.00 N ATOM 2237 CA ASP B 72 -0.959 3.456 5.620 1.00 0.00 C ATOM 2238 C ASP B 72 -1.966 4.448 5.033 1.00 0.00 C ATOM 2239 O ASP B 72 -2.221 4.458 3.844 1.00 0.00 O ATOM 2240 CB ASP B 72 0.464 3.997 5.487 1.00 0.00 C ATOM 2241 CG ASP B 72 1.439 3.051 6.191 1.00 0.00 C ATOM 2242 OD1 ASP B 72 1.328 2.907 7.397 1.00 0.00 O ATOM 2243 OD2 ASP B 72 2.278 2.485 5.511 1.00 0.00 O ATOM 0 H ASP B 72 -0.636 2.273 3.874 1.00 0.00 H new ATOM 0 HA ASP B 72 -1.243 3.298 6.660 1.00 0.00 H new ATOM 0 HB2 ASP B 72 0.731 4.093 4.435 1.00 0.00 H new ATOM 0 HB3 ASP B 72 0.528 4.993 5.925 1.00 0.00 H new ATOM 2248 N ASP B 73 -2.533 5.288 5.856 1.00 0.00 N ATOM 2249 CA ASP B 73 -3.516 6.286 5.345 1.00 0.00 C ATOM 2250 C ASP B 73 -2.798 7.347 4.506 1.00 0.00 C ATOM 2251 O ASP B 73 -3.415 8.220 3.930 1.00 0.00 O ATOM 2252 CB ASP B 73 -4.129 6.917 6.597 1.00 0.00 C ATOM 2253 CG ASP B 73 -3.082 7.788 7.294 1.00 0.00 C ATOM 2254 OD1 ASP B 73 -2.967 8.947 6.931 1.00 0.00 O ATOM 2255 OD2 ASP B 73 -2.412 7.281 8.179 1.00 0.00 O ATOM 0 H ASP B 73 -2.358 5.326 6.860 1.00 0.00 H new ATOM 0 HA ASP B 73 -4.274 5.832 4.706 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -4.996 7.519 6.326 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -4.480 6.139 7.275 1.00 0.00 H new ATOM 2260 N ASP B 74 -1.497 7.274 4.436 1.00 0.00 N ATOM 2261 CA ASP B 74 -0.730 8.269 3.635 1.00 0.00 C ATOM 2262 C ASP B 74 -1.452 8.562 2.316 1.00 0.00 C ATOM 2263 O ASP B 74 -2.066 9.598 2.150 1.00 0.00 O ATOM 2264 CB ASP B 74 0.614 7.595 3.372 1.00 0.00 C ATOM 2265 CG ASP B 74 1.409 7.519 4.677 1.00 0.00 C ATOM 2266 OD1 ASP B 74 1.620 8.558 5.281 1.00 0.00 O ATOM 2267 OD2 ASP B 74 1.794 6.423 5.050 1.00 0.00 O ATOM 0 H ASP B 74 -0.930 6.565 4.901 1.00 0.00 H new ATOM 0 HA ASP B 74 -0.620 9.223 4.150 1.00 0.00 H new ATOM 0 HB2 ASP B 74 0.459 6.594 2.969 1.00 0.00 H new ATOM 0 HB3 ASP B 74 1.174 8.156 2.624 1.00 0.00 H new ATOM 2272 N TYR B 75 -1.388 7.657 1.380 1.00 0.00 N ATOM 2273 CA TYR B 75 -2.072 7.875 0.081 1.00 0.00 C ATOM 2274 C TYR B 75 -3.584 8.003 0.288 1.00 0.00 C ATOM 2275 O TYR B 75 -4.276 8.624 -0.495 1.00 0.00 O ATOM 2276 CB TYR B 75 -1.733 6.633 -0.734 1.00 0.00 C ATOM 2277 CG TYR B 75 -0.566 6.925 -1.643 1.00 0.00 C ATOM 2278 CD1 TYR B 75 -0.588 8.056 -2.468 1.00 0.00 C ATOM 2279 CD2 TYR B 75 0.532 6.060 -1.673 1.00 0.00 C ATOM 2280 CE1 TYR B 75 0.487 8.319 -3.323 1.00 0.00 C ATOM 2281 CE2 TYR B 75 1.610 6.323 -2.526 1.00 0.00 C ATOM 2282 CZ TYR B 75 1.586 7.453 -3.353 1.00 0.00 C ATOM 2283 OH TYR B 75 2.644 7.708 -4.200 1.00 0.00 O ATOM 0 H TYR B 75 -0.888 6.772 1.462 1.00 0.00 H new ATOM 0 HA TYR B 75 -1.755 8.792 -0.415 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -1.490 5.805 -0.069 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -2.597 6.326 -1.323 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -1.435 8.725 -2.444 1.00 0.00 H new ATOM 0 HD2 TYR B 75 0.548 5.187 -1.037 1.00 0.00 H new ATOM 0 HE1 TYR B 75 0.469 9.191 -3.960 1.00 0.00 H new ATOM 0 HE2 TYR B 75 2.459 5.656 -2.546 1.00 0.00 H new ATOM 0 HH TYR B 75 3.209 6.910 -4.267 1.00 0.00 H new ATOM 2293 N PHE B 76 -4.103 7.425 1.336 1.00 0.00 N ATOM 2294 CA PHE B 76 -5.570 7.522 1.588 1.00 0.00 C ATOM 2295 C PHE B 76 -5.978 8.989 1.735 1.00 0.00 C ATOM 2296 O PHE B 76 -7.102 9.363 1.462 1.00 0.00 O ATOM 2297 CB PHE B 76 -5.800 6.767 2.898 1.00 0.00 C ATOM 2298 CG PHE B 76 -7.278 6.739 3.211 1.00 0.00 C ATOM 2299 CD1 PHE B 76 -8.197 6.373 2.219 1.00 0.00 C ATOM 2300 CD2 PHE B 76 -7.729 7.079 4.492 1.00 0.00 C ATOM 2301 CE1 PHE B 76 -9.566 6.347 2.510 1.00 0.00 C ATOM 2302 CE2 PHE B 76 -9.098 7.053 4.782 1.00 0.00 C ATOM 2303 CZ PHE B 76 -10.017 6.687 3.790 1.00 0.00 C ATOM 0 H PHE B 76 -3.577 6.891 2.028 1.00 0.00 H new ATOM 0 HA PHE B 76 -6.160 7.105 0.772 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -5.415 5.750 2.816 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -5.255 7.250 3.709 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.850 6.111 1.231 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.020 7.361 5.257 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.275 6.064 1.746 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -9.446 7.315 5.770 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.073 6.667 4.013 1.00 0.00 H new ATOM 2313 N LEU B 77 -5.072 9.825 2.163 1.00 0.00 N ATOM 2314 CA LEU B 77 -5.404 11.269 2.327 1.00 0.00 C ATOM 2315 C LEU B 77 -4.686 12.099 1.259 1.00 0.00 C ATOM 2316 O LEU B 77 -5.118 13.177 0.902 1.00 0.00 O ATOM 2317 CB LEU B 77 -4.899 11.635 3.723 1.00 0.00 C ATOM 2318 CG LEU B 77 -5.791 10.977 4.776 1.00 0.00 C ATOM 2319 CD1 LEU B 77 -5.148 11.126 6.156 1.00 0.00 C ATOM 2320 CD2 LEU B 77 -7.162 11.657 4.779 1.00 0.00 C ATOM 0 H LEU B 77 -4.115 9.570 2.407 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.471 11.464 2.217 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.868 11.305 3.847 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.904 12.717 3.851 1.00 0.00 H new ATOM 0 HG LEU B 77 -5.908 9.919 4.542 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -5.784 10.657 6.906 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.171 10.644 6.156 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.030 12.184 6.390 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.799 11.189 5.529 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -7.043 12.715 5.013 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.622 11.553 3.796 1.00 0.00 H new ATOM 2332 N CYS B 78 -3.593 11.603 0.745 1.00 0.00 N ATOM 2333 CA CYS B 78 -2.850 12.363 -0.301 1.00 0.00 C ATOM 2334 C CYS B 78 -3.705 12.485 -1.566 1.00 0.00 C ATOM 2335 O CYS B 78 -3.503 13.363 -2.382 1.00 0.00 O ATOM 2336 CB CYS B 78 -1.596 11.534 -0.580 1.00 0.00 C ATOM 2337 SG CYS B 78 -0.461 12.486 -1.619 1.00 0.00 S ATOM 0 H CYS B 78 -3.183 10.706 1.004 1.00 0.00 H new ATOM 0 HA CYS B 78 -2.604 13.376 0.019 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -1.109 11.265 0.357 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -1.866 10.602 -1.077 1.00 0.00 H new ATOM 0 HG CYS B 78 -1.142 13.285 -2.386 1.00 0.00 H new ATOM 2343 N LEU B 79 -4.659 11.610 -1.733 1.00 0.00 N ATOM 2344 CA LEU B 79 -5.528 11.673 -2.943 1.00 0.00 C ATOM 2345 C LEU B 79 -6.651 12.693 -2.732 1.00 0.00 C ATOM 2346 O LEU B 79 -6.899 13.123 -1.623 1.00 0.00 O ATOM 2347 CB LEU B 79 -6.102 10.264 -3.086 1.00 0.00 C ATOM 2348 CG LEU B 79 -4.991 9.302 -3.507 1.00 0.00 C ATOM 2349 CD1 LEU B 79 -5.452 7.860 -3.283 1.00 0.00 C ATOM 2350 CD2 LEU B 79 -4.672 9.510 -4.990 1.00 0.00 C ATOM 0 H LEU B 79 -4.874 10.854 -1.083 1.00 0.00 H new ATOM 0 HA LEU B 79 -4.981 11.983 -3.833 1.00 0.00 H new ATOM 0 HB2 LEU B 79 -6.540 9.940 -2.142 1.00 0.00 H new ATOM 0 HB3 LEU B 79 -6.902 10.259 -3.826 1.00 0.00 H new ATOM 0 HG LEU B 79 -4.099 9.495 -2.912 1.00 0.00 H new ATOM 0 HD11 LEU B 79 -4.660 7.174 -3.583 1.00 0.00 H new ATOM 0 HD12 LEU B 79 -5.681 7.711 -2.228 1.00 0.00 H new ATOM 0 HD13 LEU B 79 -6.344 7.667 -3.878 1.00 0.00 H new ATOM 0 HD21 LEU B 79 -3.880 8.825 -5.291 1.00 0.00 H new ATOM 0 HD22 LEU B 79 -5.565 9.317 -5.585 1.00 0.00 H new ATOM 0 HD23 LEU B 79 -4.344 10.537 -5.151 1.00 0.00 H new ATOM 2362 N PRO B 80 -7.294 13.046 -3.812 1.00 0.00 N ATOM 2363 CA PRO B 80 -8.406 14.026 -3.749 1.00 0.00 C ATOM 2364 C PRO B 80 -9.635 13.402 -3.081 1.00 0.00 C ATOM 2365 O PRO B 80 -9.661 12.224 -2.783 1.00 0.00 O ATOM 2366 CB PRO B 80 -8.683 14.349 -5.216 1.00 0.00 C ATOM 2367 CG PRO B 80 -8.193 13.156 -5.972 1.00 0.00 C ATOM 2368 CD PRO B 80 -7.052 12.572 -5.180 1.00 0.00 C ATOM 0 HA PRO B 80 -8.164 14.912 -3.163 1.00 0.00 H new ATOM 0 HB2 PRO B 80 -9.746 14.517 -5.390 1.00 0.00 H new ATOM 0 HB3 PRO B 80 -8.162 15.255 -5.526 1.00 0.00 H new ATOM 0 HG2 PRO B 80 -8.991 12.424 -6.097 1.00 0.00 H new ATOM 0 HG3 PRO B 80 -7.863 13.441 -6.971 1.00 0.00 H new ATOM 0 HD2 PRO B 80 -7.046 11.483 -5.231 1.00 0.00 H new ATOM 0 HD3 PRO B 80 -6.088 12.914 -5.557 1.00 0.00 H new ATOM 2376 N SER B 81 -10.651 14.186 -2.841 1.00 0.00 N ATOM 2377 CA SER B 81 -11.877 13.644 -2.186 1.00 0.00 C ATOM 2378 C SER B 81 -12.490 12.545 -3.049 1.00 0.00 C ATOM 2379 O SER B 81 -12.782 11.460 -2.586 1.00 0.00 O ATOM 2380 CB SER B 81 -12.829 14.832 -2.115 1.00 0.00 C ATOM 2381 OG SER B 81 -13.870 14.549 -1.188 1.00 0.00 O ATOM 0 H SER B 81 -10.685 15.179 -3.070 1.00 0.00 H new ATOM 0 HA SER B 81 -11.668 13.212 -1.207 1.00 0.00 H new ATOM 0 HB2 SER B 81 -12.288 15.728 -1.809 1.00 0.00 H new ATOM 0 HB3 SER B 81 -13.249 15.034 -3.100 1.00 0.00 H new ATOM 0 HG SER B 81 -14.482 15.313 -1.140 1.00 0.00 H new ATOM 2387 N ASN B 82 -12.691 12.828 -4.301 1.00 0.00 N ATOM 2388 CA ASN B 82 -13.294 11.812 -5.211 1.00 0.00 C ATOM 2389 C ASN B 82 -12.237 10.797 -5.655 1.00 0.00 C ATOM 2390 O ASN B 82 -11.455 11.050 -6.550 1.00 0.00 O ATOM 2391 CB ASN B 82 -13.807 12.611 -6.410 1.00 0.00 C ATOM 2392 CG ASN B 82 -14.591 11.686 -7.343 1.00 0.00 C ATOM 2393 OD1 ASN B 82 -15.341 10.843 -6.894 1.00 0.00 O ATOM 2394 ND2 ASN B 82 -14.447 11.809 -8.635 1.00 0.00 N ATOM 0 H ASN B 82 -12.464 13.721 -4.739 1.00 0.00 H new ATOM 0 HA ASN B 82 -14.089 11.246 -4.726 1.00 0.00 H new ATOM 0 HB2 ASN B 82 -14.444 13.427 -6.070 1.00 0.00 H new ATOM 0 HB3 ASN B 82 -12.971 13.061 -6.945 1.00 0.00 H new ATOM 0 HD21 ASN B 82 -14.964 11.197 -9.266 1.00 0.00 H new ATOM 0 HD22 ASN B 82 -13.817 12.517 -9.013 1.00 0.00 H new ATOM 2401 N THR B 83 -12.211 9.648 -5.037 1.00 0.00 N ATOM 2402 CA THR B 83 -11.210 8.612 -5.422 1.00 0.00 C ATOM 2403 C THR B 83 -11.857 7.224 -5.396 1.00 0.00 C ATOM 2404 O THR B 83 -12.592 6.889 -4.487 1.00 0.00 O ATOM 2405 CB THR B 83 -10.107 8.714 -4.369 1.00 0.00 C ATOM 2406 OG1 THR B 83 -9.055 7.817 -4.699 1.00 0.00 O ATOM 2407 CG2 THR B 83 -10.674 8.357 -2.995 1.00 0.00 C ATOM 0 H THR B 83 -12.841 9.381 -4.280 1.00 0.00 H new ATOM 0 HA THR B 83 -10.821 8.763 -6.429 1.00 0.00 H new ATOM 0 HB THR B 83 -9.721 9.733 -4.345 1.00 0.00 H new ATOM 0 HG1 THR B 83 -9.227 6.945 -4.286 1.00 0.00 H new ATOM 0 HG21 THR B 83 -9.886 8.430 -2.246 1.00 0.00 H new ATOM 0 HG22 THR B 83 -11.479 9.047 -2.743 1.00 0.00 H new ATOM 0 HG23 THR B 83 -11.062 7.339 -3.015 1.00 0.00 H new ATOM 2415 N LYS B 84 -11.596 6.416 -6.387 1.00 0.00 N ATOM 2416 CA LYS B 84 -12.202 5.055 -6.419 1.00 0.00 C ATOM 2417 C LYS B 84 -11.244 4.022 -5.816 1.00 0.00 C ATOM 2418 O LYS B 84 -10.065 4.009 -6.109 1.00 0.00 O ATOM 2419 CB LYS B 84 -12.430 4.763 -7.902 1.00 0.00 C ATOM 2420 CG LYS B 84 -13.060 5.982 -8.577 1.00 0.00 C ATOM 2421 CD LYS B 84 -13.112 5.754 -10.089 1.00 0.00 C ATOM 2422 CE LYS B 84 -13.549 7.043 -10.787 1.00 0.00 C ATOM 2423 NZ LYS B 84 -14.467 6.599 -11.873 1.00 0.00 N ATOM 0 H LYS B 84 -10.989 6.640 -7.176 1.00 0.00 H new ATOM 0 HA LYS B 84 -13.124 5.005 -5.839 1.00 0.00 H new ATOM 0 HB2 LYS B 84 -11.484 4.517 -8.384 1.00 0.00 H new ATOM 0 HB3 LYS B 84 -13.080 3.896 -8.016 1.00 0.00 H new ATOM 0 HG2 LYS B 84 -14.065 6.148 -8.188 1.00 0.00 H new ATOM 0 HG3 LYS B 84 -12.479 6.877 -8.353 1.00 0.00 H new ATOM 0 HD2 LYS B 84 -12.133 5.445 -10.454 1.00 0.00 H new ATOM 0 HD3 LYS B 84 -13.808 4.948 -10.322 1.00 0.00 H new ATOM 0 HE2 LYS B 84 -14.054 7.716 -10.094 1.00 0.00 H new ATOM 0 HE3 LYS B 84 -12.693 7.584 -11.190 1.00 0.00 H new ATOM 0 HZ1 LYS B 84 -14.810 7.428 -12.399 1.00 0.00 H new ATOM 0 HZ2 LYS B 84 -13.957 5.965 -12.521 1.00 0.00 H new ATOM 0 HZ3 LYS B 84 -15.276 6.093 -11.459 1.00 0.00 H new ATOM 2437 N PHE B 85 -11.746 3.153 -4.981 1.00 0.00 N ATOM 2438 CA PHE B 85 -10.872 2.115 -4.364 1.00 0.00 C ATOM 2439 C PHE B 85 -11.527 0.735 -4.466 1.00 0.00 C ATOM 2440 O PHE B 85 -12.682 0.606 -4.819 1.00 0.00 O ATOM 2441 CB PHE B 85 -10.733 2.530 -2.900 1.00 0.00 C ATOM 2442 CG PHE B 85 -9.585 3.501 -2.754 1.00 0.00 C ATOM 2443 CD1 PHE B 85 -8.290 3.018 -2.533 1.00 0.00 C ATOM 2444 CD2 PHE B 85 -9.814 4.880 -2.836 1.00 0.00 C ATOM 2445 CE1 PHE B 85 -7.223 3.913 -2.392 1.00 0.00 C ATOM 2446 CE2 PHE B 85 -8.746 5.775 -2.695 1.00 0.00 C ATOM 2447 CZ PHE B 85 -7.450 5.291 -2.473 1.00 0.00 C ATOM 0 H PHE B 85 -12.726 3.117 -4.699 1.00 0.00 H new ATOM 0 HA PHE B 85 -9.906 2.045 -4.864 1.00 0.00 H new ATOM 0 HB2 PHE B 85 -11.658 2.990 -2.553 1.00 0.00 H new ATOM 0 HB3 PHE B 85 -10.561 1.652 -2.278 1.00 0.00 H new ATOM 0 HD1 PHE B 85 -8.114 1.954 -2.471 1.00 0.00 H new ATOM 0 HD2 PHE B 85 -10.813 5.253 -3.008 1.00 0.00 H new ATOM 0 HE1 PHE B 85 -6.224 3.540 -2.221 1.00 0.00 H new ATOM 0 HE2 PHE B 85 -8.921 6.839 -2.757 1.00 0.00 H new ATOM 0 HZ PHE B 85 -6.627 5.981 -2.364 1.00 0.00 H new ATOM 2457 N VAL B 86 -10.793 -0.297 -4.152 1.00 0.00 N ATOM 2458 CA VAL B 86 -11.362 -1.672 -4.223 1.00 0.00 C ATOM 2459 C VAL B 86 -10.865 -2.503 -3.037 1.00 0.00 C ATOM 2460 O VAL B 86 -9.715 -2.423 -2.652 1.00 0.00 O ATOM 2461 CB VAL B 86 -10.842 -2.250 -5.539 1.00 0.00 C ATOM 2462 CG1 VAL B 86 -11.164 -3.744 -5.605 1.00 0.00 C ATOM 2463 CG2 VAL B 86 -11.517 -1.531 -6.711 1.00 0.00 C ATOM 0 H VAL B 86 -9.821 -0.247 -3.848 1.00 0.00 H new ATOM 0 HA VAL B 86 -12.451 -1.674 -4.183 1.00 0.00 H new ATOM 0 HB VAL B 86 -9.763 -2.109 -5.596 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -10.793 -4.155 -6.544 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -10.686 -4.256 -4.770 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -12.243 -3.886 -5.548 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -11.148 -1.941 -7.651 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -12.596 -1.673 -6.652 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -11.288 -0.466 -6.665 1.00 0.00 H new ATOM 2473 N ALA B 87 -11.720 -3.295 -2.448 1.00 0.00 N ATOM 2474 CA ALA B 87 -11.286 -4.119 -1.284 1.00 0.00 C ATOM 2475 C ALA B 87 -11.556 -5.604 -1.547 1.00 0.00 C ATOM 2476 O ALA B 87 -12.627 -5.983 -1.981 1.00 0.00 O ATOM 2477 CB ALA B 87 -12.130 -3.621 -0.111 1.00 0.00 C ATOM 0 H ALA B 87 -12.696 -3.407 -2.721 1.00 0.00 H new ATOM 0 HA ALA B 87 -10.218 -4.024 -1.090 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -11.870 -4.180 0.788 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -11.937 -2.561 0.052 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -13.187 -3.767 -0.335 1.00 0.00 H new ATOM 2483 N LEU B 88 -10.594 -6.447 -1.285 1.00 0.00 N ATOM 2484 CA LEU B 88 -10.796 -7.904 -1.517 1.00 0.00 C ATOM 2485 C LEU B 88 -11.327 -8.578 -0.251 1.00 0.00 C ATOM 2486 O LEU B 88 -10.699 -8.562 0.789 1.00 0.00 O ATOM 2487 CB LEU B 88 -9.414 -8.452 -1.863 1.00 0.00 C ATOM 2488 CG LEU B 88 -8.958 -7.905 -3.218 1.00 0.00 C ATOM 2489 CD1 LEU B 88 -10.102 -8.005 -4.230 1.00 0.00 C ATOM 2490 CD2 LEU B 88 -8.542 -6.440 -3.066 1.00 0.00 C ATOM 0 H LEU B 88 -9.677 -6.189 -0.920 1.00 0.00 H new ATOM 0 HA LEU B 88 -11.522 -8.091 -2.309 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -8.699 -8.172 -1.089 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -9.443 -9.541 -1.892 1.00 0.00 H new ATOM 0 HG LEU B 88 -8.110 -8.491 -3.572 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -9.772 -7.614 -5.192 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -10.397 -9.048 -4.344 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -10.953 -7.424 -3.875 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -8.218 -6.052 -4.031 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -9.390 -5.856 -2.707 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -7.722 -6.367 -2.351 1.00 0.00 H new ATOM 2502 N ALA B 89 -12.473 -9.182 -0.345 1.00 0.00 N ATOM 2503 CA ALA B 89 -13.061 -9.882 0.833 1.00 0.00 C ATOM 2504 C ALA B 89 -12.528 -11.313 0.884 1.00 0.00 C ATOM 2505 O ALA B 89 -11.640 -11.666 0.132 1.00 0.00 O ATOM 2506 CB ALA B 89 -14.570 -9.876 0.595 1.00 0.00 C ATOM 0 H ALA B 89 -13.036 -9.223 -1.194 1.00 0.00 H new ATOM 0 HA ALA B 89 -12.808 -9.402 1.778 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -15.071 -10.376 1.424 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -14.923 -8.847 0.525 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -14.794 -10.401 -0.334 1.00 0.00 H new ATOM 2512 N SER B 90 -13.054 -12.133 1.762 1.00 0.00 N ATOM 2513 CA SER B 90 -12.576 -13.549 1.856 1.00 0.00 C ATOM 2514 C SER B 90 -12.209 -14.071 0.465 1.00 0.00 C ATOM 2515 O SER B 90 -11.303 -14.865 0.304 1.00 0.00 O ATOM 2516 CB SER B 90 -13.759 -14.330 2.427 1.00 0.00 C ATOM 2517 OG SER B 90 -13.381 -15.688 2.608 1.00 0.00 O ATOM 0 H SER B 90 -13.794 -11.883 2.418 1.00 0.00 H new ATOM 0 HA SER B 90 -11.687 -13.646 2.479 1.00 0.00 H new ATOM 0 HB2 SER B 90 -14.071 -13.897 3.378 1.00 0.00 H new ATOM 0 HB3 SER B 90 -14.613 -14.265 1.752 1.00 0.00 H new ATOM 0 HG SER B 90 -14.137 -16.192 2.976 1.00 0.00 H new ATOM 2523 N ASN B 91 -12.895 -13.606 -0.546 1.00 0.00 N ATOM 2524 CA ASN B 91 -12.576 -14.047 -1.932 1.00 0.00 C ATOM 2525 C ASN B 91 -11.385 -13.239 -2.457 1.00 0.00 C ATOM 2526 O ASN B 91 -11.524 -12.104 -2.869 1.00 0.00 O ATOM 2527 CB ASN B 91 -13.835 -13.743 -2.745 1.00 0.00 C ATOM 2528 CG ASN B 91 -13.680 -14.311 -4.156 1.00 0.00 C ATOM 2529 OD1 ASN B 91 -12.708 -14.979 -4.452 1.00 0.00 O ATOM 2530 ND2 ASN B 91 -14.604 -14.074 -5.047 1.00 0.00 N ATOM 0 H ASN B 91 -13.663 -12.939 -0.470 1.00 0.00 H new ATOM 0 HA ASN B 91 -12.308 -15.102 -1.990 1.00 0.00 H new ATOM 0 HB2 ASN B 91 -14.708 -14.179 -2.260 1.00 0.00 H new ATOM 0 HB3 ASN B 91 -14.000 -12.667 -2.791 1.00 0.00 H new ATOM 0 HD21 ASN B 91 -14.510 -14.449 -5.991 1.00 0.00 H new ATOM 0 HD22 ASN B 91 -15.420 -13.514 -4.799 1.00 0.00 H new ATOM 2537 N GLU B 92 -10.213 -13.813 -2.431 1.00 0.00 N ATOM 2538 CA GLU B 92 -8.999 -13.089 -2.910 1.00 0.00 C ATOM 2539 C GLU B 92 -9.095 -12.706 -4.397 1.00 0.00 C ATOM 2540 O GLU B 92 -8.186 -12.114 -4.941 1.00 0.00 O ATOM 2541 CB GLU B 92 -7.860 -14.079 -2.694 1.00 0.00 C ATOM 2542 CG GLU B 92 -7.879 -14.576 -1.247 1.00 0.00 C ATOM 2543 CD GLU B 92 -6.511 -15.159 -0.889 1.00 0.00 C ATOM 2544 OE1 GLU B 92 -5.926 -15.813 -1.736 1.00 0.00 O ATOM 2545 OE2 GLU B 92 -6.070 -14.939 0.227 1.00 0.00 O ATOM 0 H GLU B 92 -10.042 -14.761 -2.096 1.00 0.00 H new ATOM 0 HA GLU B 92 -8.862 -12.149 -2.375 1.00 0.00 H new ATOM 0 HB2 GLU B 92 -7.961 -14.920 -3.379 1.00 0.00 H new ATOM 0 HB3 GLU B 92 -6.904 -13.603 -2.913 1.00 0.00 H new ATOM 0 HG2 GLU B 92 -8.124 -13.755 -0.573 1.00 0.00 H new ATOM 0 HG3 GLU B 92 -8.653 -15.333 -1.122 1.00 0.00 H new ATOM 2552 N LYS B 93 -10.168 -13.038 -5.066 1.00 0.00 N ATOM 2553 CA LYS B 93 -10.274 -12.685 -6.511 1.00 0.00 C ATOM 2554 C LYS B 93 -10.027 -11.185 -6.709 1.00 0.00 C ATOM 2555 O LYS B 93 -10.941 -10.386 -6.703 1.00 0.00 O ATOM 2556 CB LYS B 93 -11.706 -13.049 -6.905 1.00 0.00 C ATOM 2557 CG LYS B 93 -11.883 -12.868 -8.414 1.00 0.00 C ATOM 2558 CD LYS B 93 -13.371 -12.743 -8.743 1.00 0.00 C ATOM 2559 CE LYS B 93 -13.965 -14.137 -8.963 1.00 0.00 C ATOM 2560 NZ LYS B 93 -14.521 -14.103 -10.345 1.00 0.00 N ATOM 0 H LYS B 93 -10.970 -13.535 -4.677 1.00 0.00 H new ATOM 0 HA LYS B 93 -9.538 -13.211 -7.119 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -11.921 -14.080 -6.624 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -12.414 -12.418 -6.367 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -11.350 -11.978 -8.749 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -11.452 -13.717 -8.946 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -13.893 -12.238 -7.930 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -13.507 -12.133 -9.636 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -13.204 -14.911 -8.862 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -14.741 -14.356 -8.230 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -14.947 -15.025 -10.571 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -15.247 -13.361 -10.409 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -13.758 -13.899 -11.021 1.00 0.00 H new ATOM 2574 N TRP B 94 -8.791 -10.806 -6.885 1.00 0.00 N ATOM 2575 CA TRP B 94 -8.460 -9.367 -7.084 1.00 0.00 C ATOM 2576 C TRP B 94 -8.124 -9.109 -8.556 1.00 0.00 C ATOM 2577 O TRP B 94 -7.875 -10.026 -9.313 1.00 0.00 O ATOM 2578 CB TRP B 94 -7.235 -9.135 -6.194 1.00 0.00 C ATOM 2579 CG TRP B 94 -6.690 -7.760 -6.413 1.00 0.00 C ATOM 2580 CD1 TRP B 94 -7.395 -6.611 -6.288 1.00 0.00 C ATOM 2581 CD2 TRP B 94 -5.334 -7.371 -6.780 1.00 0.00 C ATOM 2582 NE1 TRP B 94 -6.558 -5.543 -6.563 1.00 0.00 N ATOM 2583 CE2 TRP B 94 -5.278 -5.961 -6.870 1.00 0.00 C ATOM 2584 CE3 TRP B 94 -4.161 -8.099 -7.045 1.00 0.00 C ATOM 2585 CZ2 TRP B 94 -4.098 -5.296 -7.209 1.00 0.00 C ATOM 2586 CZ3 TRP B 94 -2.972 -7.434 -7.385 1.00 0.00 C ATOM 2587 CH2 TRP B 94 -2.941 -6.035 -7.466 1.00 0.00 C ATOM 0 H TRP B 94 -7.990 -11.437 -6.900 1.00 0.00 H new ATOM 0 HA TRP B 94 -9.283 -8.700 -6.829 1.00 0.00 H new ATOM 0 HB2 TRP B 94 -7.508 -9.263 -5.147 1.00 0.00 H new ATOM 0 HB3 TRP B 94 -6.469 -9.877 -6.417 1.00 0.00 H new ATOM 0 HD1 TRP B 94 -8.438 -6.539 -6.018 1.00 0.00 H new ATOM 0 HE1 TRP B 94 -6.851 -4.566 -6.541 1.00 0.00 H new ATOM 0 HE3 TRP B 94 -4.174 -9.177 -6.987 1.00 0.00 H new ATOM 0 HZ2 TRP B 94 -4.080 -4.218 -7.272 1.00 0.00 H new ATOM 0 HZ3 TRP B 94 -2.076 -8.004 -7.585 1.00 0.00 H new ATOM 0 HH2 TRP B 94 -2.023 -5.529 -7.727 1.00 0.00 H new ATOM 2598 N ALA B 95 -8.118 -7.871 -8.970 1.00 0.00 N ATOM 2599 CA ALA B 95 -7.801 -7.565 -10.394 1.00 0.00 C ATOM 2600 C ALA B 95 -6.312 -7.247 -10.548 1.00 0.00 C ATOM 2601 O ALA B 95 -5.862 -6.161 -10.238 1.00 0.00 O ATOM 2602 CB ALA B 95 -8.650 -6.339 -10.735 1.00 0.00 C ATOM 0 H ALA B 95 -8.318 -7.060 -8.385 1.00 0.00 H new ATOM 0 HA ALA B 95 -8.016 -8.405 -11.054 1.00 0.00 H new ATOM 0 HB1 ALA B 95 -8.472 -6.050 -11.771 1.00 0.00 H new ATOM 0 HB2 ALA B 95 -9.705 -6.578 -10.601 1.00 0.00 H new ATOM 0 HB3 ALA B 95 -8.378 -5.514 -10.077 1.00 0.00 H new ATOM 2608 N TYR B 96 -5.543 -8.188 -11.024 1.00 0.00 N ATOM 2609 CA TYR B 96 -4.083 -7.945 -11.199 1.00 0.00 C ATOM 2610 C TYR B 96 -3.718 -7.977 -12.685 1.00 0.00 C ATOM 2611 O TYR B 96 -4.542 -8.265 -13.530 1.00 0.00 O ATOM 2612 CB TYR B 96 -3.400 -9.093 -10.454 1.00 0.00 C ATOM 2613 CG TYR B 96 -1.903 -8.891 -10.474 1.00 0.00 C ATOM 2614 CD1 TYR B 96 -1.343 -7.735 -9.915 1.00 0.00 C ATOM 2615 CD2 TYR B 96 -1.074 -9.861 -11.052 1.00 0.00 C ATOM 2616 CE1 TYR B 96 0.044 -7.550 -9.933 1.00 0.00 C ATOM 2617 CE2 TYR B 96 0.314 -9.676 -11.070 1.00 0.00 C ATOM 2618 CZ TYR B 96 0.873 -8.521 -10.510 1.00 0.00 C ATOM 2619 OH TYR B 96 2.241 -8.339 -10.528 1.00 0.00 O ATOM 0 H TYR B 96 -5.864 -9.116 -11.300 1.00 0.00 H new ATOM 0 HA TYR B 96 -3.776 -6.971 -10.817 1.00 0.00 H new ATOM 0 HB2 TYR B 96 -3.758 -9.136 -9.425 1.00 0.00 H new ATOM 0 HB3 TYR B 96 -3.655 -10.045 -10.920 1.00 0.00 H new ATOM 0 HD1 TYR B 96 -1.982 -6.986 -9.470 1.00 0.00 H new ATOM 0 HD2 TYR B 96 -1.505 -10.752 -11.484 1.00 0.00 H new ATOM 0 HE1 TYR B 96 0.475 -6.659 -9.502 1.00 0.00 H new ATOM 0 HE2 TYR B 96 0.953 -10.424 -11.516 1.00 0.00 H new ATOM 0 HH TYR B 96 2.667 -9.106 -10.964 1.00 0.00 H new