USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1092 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 165 ASN :FLIP amide:sc= -1.12 F(o=-1.3!,f=-0.012) USER MOD Set 1.2: A 168 SER OG : rot -82:sc= 1.1 USER MOD Set 2.1: A 139 SER OG : rot 126:sc= -0.0933 USER MOD Set 2.2: A 140 SER OG : rot -107:sc= -0.261 USER MOD Set 3.1: A 106 CYS SG : rot -155:sc= -0.847 USER MOD Set 3.2: A 122 GLN : amide:sc= 0.00342 X(o=-0.84,f=-0.85) USER MOD Set 4.1: A 109 SER OG : rot 175:sc= -0.558 USER MOD Set 4.2: A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 43 GLN :FLIP amide:sc=-0.00558 F(o=-3.8,f=-3.1) USER MOD Set 5.2: A 150 TYR OH : rot 79:sc= -3.06! USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0885 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl -107:sc= -0.811 (180deg=-3.96!) USER MOD Single : A 54 THR OG1 : rot 93:sc= 1.28 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 13:sc= -1.9! USER MOD Single : A 66 GLN : amide:sc= -0.0174 X(o=-0.017,f=0.014) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0.366 K(o=0.37,f=-4!) USER MOD Single : A 76 GLN : amide:sc= -0.949 K(o=-0.95,f=-2.5!) USER MOD Single : A 79 THR OG1 : rot -91:sc= 0.0268 USER MOD Single : A 80 GLN :FLIP amide:sc= -0.116 F(o=-2.9!,f=-0.12) USER MOD Single : A 82 SER OG : rot 84:sc= -0.271 USER MOD Single : A 87 GLN :FLIP amide:sc= -0.138 F(o=-0.78,f=-0.14) USER MOD Single : A 91 ASN : amide:sc= -0.0154 K(o=-0.015,f=-0.57) USER MOD Single : A 111 ASN : amide:sc= -2.37! C(o=-2.4!,f=-4.4!) USER MOD Single : A 112 LYS NZ :NH3+ -151:sc= -0.193 (180deg=-0.966) USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 MET CE :methyl 161:sc= -2.89! (180deg=-3.22!) USER MOD Single : A 128 TYR OH : rot 180:sc= -0.144 USER MOD Single : A 131 THR OG1 : rot 66:sc= 0.949 USER MOD Single : A 138 HIS : no HD1:sc= -0.495 X(o=-0.5,f=-0.99!) USER MOD Single : A 147 THR OG1 : rot -34:sc= 0.226 USER MOD ----------------------------------------------------------------- ATOM 86 N ASP A 8 -12.899 8.616 12.390 1.00 0.00 N ATOM 87 CA ASP A 8 -11.691 9.420 12.272 1.00 0.00 C ATOM 88 C ASP A 8 -10.742 8.822 11.242 1.00 0.00 C ATOM 89 O ASP A 8 -10.877 7.657 10.868 1.00 0.00 O ATOM 90 CB ASP A 8 -10.996 9.524 13.629 1.00 0.00 C ATOM 91 CG ASP A 8 -11.565 10.641 14.479 1.00 0.00 C ATOM 92 OD1 ASP A 8 -12.568 10.400 15.183 1.00 0.00 O ATOM 93 OD2 ASP A 8 -11.011 11.760 14.437 1.00 0.00 O ATOM 0 HA ASP A 8 -11.974 10.419 11.939 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -11.097 8.578 14.161 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -9.930 9.692 13.477 1.00 0.00 H new ATOM 98 N THR A 9 -9.781 9.622 10.782 1.00 0.00 N ATOM 99 CA THR A 9 -8.814 9.156 9.790 1.00 0.00 C ATOM 100 C THR A 9 -8.276 7.780 10.163 1.00 0.00 C ATOM 101 O THR A 9 -8.169 6.894 9.317 1.00 0.00 O ATOM 102 CB THR A 9 -7.653 10.146 9.659 1.00 0.00 C ATOM 103 OG1 THR A 9 -8.091 11.479 9.865 1.00 0.00 O ATOM 104 CG2 THR A 9 -6.973 10.086 8.306 1.00 0.00 C ATOM 0 H THR A 9 -9.652 10.589 11.078 1.00 0.00 H new ATOM 0 HA THR A 9 -9.328 9.085 8.832 1.00 0.00 H new ATOM 0 HB THR A 9 -6.937 9.852 10.426 1.00 0.00 H new ATOM 0 HG1 THR A 9 -7.330 12.091 9.778 1.00 0.00 H new ATOM 0 HG21 THR A 9 -6.159 10.811 8.275 1.00 0.00 H new ATOM 0 HG22 THR A 9 -6.574 9.085 8.144 1.00 0.00 H new ATOM 0 HG23 THR A 9 -7.696 10.319 7.525 1.00 0.00 H new ATOM 112 N ARG A 10 -7.946 7.612 11.440 1.00 0.00 N ATOM 113 CA ARG A 10 -7.418 6.348 11.944 1.00 0.00 C ATOM 114 C ARG A 10 -8.380 5.194 11.674 1.00 0.00 C ATOM 115 O ARG A 10 -7.972 4.132 11.203 1.00 0.00 O ATOM 116 CB ARG A 10 -7.149 6.448 13.446 1.00 0.00 C ATOM 117 CG ARG A 10 -6.258 7.617 13.833 1.00 0.00 C ATOM 118 CD ARG A 10 -6.747 8.295 15.104 1.00 0.00 C ATOM 119 NE ARG A 10 -5.998 9.514 15.397 1.00 0.00 N ATOM 120 CZ ARG A 10 -4.735 9.526 15.821 1.00 0.00 C ATOM 121 NH1 ARG A 10 -4.077 8.388 16.004 1.00 0.00 N ATOM 122 NH2 ARG A 10 -4.128 10.680 16.063 1.00 0.00 N ATOM 0 H ARG A 10 -8.036 8.340 12.149 1.00 0.00 H new ATOM 0 HA ARG A 10 -6.485 6.147 11.418 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -8.100 6.539 13.971 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -6.685 5.522 13.785 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.237 7.265 13.977 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -6.233 8.342 13.019 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -7.805 8.535 15.002 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -6.656 7.604 15.942 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.470 10.409 15.269 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.538 7.497 15.820 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -3.110 8.404 16.329 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -4.628 11.558 15.925 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -3.161 10.689 16.388 1.00 0.00 H new ATOM 136 N ALA A 11 -9.656 5.405 11.983 1.00 0.00 N ATOM 137 CA ALA A 11 -10.674 4.379 11.779 1.00 0.00 C ATOM 138 C ALA A 11 -10.682 3.910 10.338 1.00 0.00 C ATOM 139 O ALA A 11 -10.548 2.722 10.051 1.00 0.00 O ATOM 140 CB ALA A 11 -12.045 4.914 12.153 1.00 0.00 C ATOM 0 H ALA A 11 -10.010 6.277 12.376 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.434 3.531 12.421 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.794 4.138 11.996 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -12.046 5.212 13.202 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.281 5.777 11.531 1.00 0.00 H new ATOM 146 N LEU A 12 -10.840 4.861 9.439 1.00 0.00 N ATOM 147 CA LEU A 12 -10.869 4.579 8.019 1.00 0.00 C ATOM 148 C LEU A 12 -9.653 3.763 7.594 1.00 0.00 C ATOM 149 O LEU A 12 -9.739 2.918 6.703 1.00 0.00 O ATOM 150 CB LEU A 12 -10.916 5.889 7.255 1.00 0.00 C ATOM 151 CG LEU A 12 -12.067 6.010 6.274 1.00 0.00 C ATOM 152 CD1 LEU A 12 -13.222 6.785 6.895 1.00 0.00 C ATOM 153 CD2 LEU A 12 -11.570 6.671 5.007 1.00 0.00 C ATOM 0 H LEU A 12 -10.952 5.848 9.672 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.757 3.988 7.795 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -10.979 6.709 7.970 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -9.979 6.011 6.712 1.00 0.00 H new ATOM 0 HG LEU A 12 -12.444 5.018 6.026 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -14.038 6.861 6.176 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -13.572 6.265 7.787 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -12.884 7.785 7.168 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -12.392 6.761 4.297 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.183 7.662 5.242 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -10.777 6.066 4.568 1.00 0.00 H new ATOM 165 N VAL A 13 -8.526 4.016 8.243 1.00 0.00 N ATOM 166 CA VAL A 13 -7.304 3.295 7.936 1.00 0.00 C ATOM 167 C VAL A 13 -7.450 1.833 8.349 1.00 0.00 C ATOM 168 O VAL A 13 -7.373 0.934 7.515 1.00 0.00 O ATOM 169 CB VAL A 13 -6.083 3.922 8.646 1.00 0.00 C ATOM 170 CG1 VAL A 13 -4.815 3.135 8.348 1.00 0.00 C ATOM 171 CG2 VAL A 13 -5.914 5.380 8.236 1.00 0.00 C ATOM 0 H VAL A 13 -8.434 4.713 8.982 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.136 3.358 6.861 1.00 0.00 H new ATOM 0 HB VAL A 13 -6.262 3.883 9.720 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.971 3.598 8.860 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.933 2.109 8.697 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.632 3.134 7.274 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.049 5.804 8.747 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -5.764 5.440 7.158 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.808 5.941 8.510 1.00 0.00 H new ATOM 181 N ALA A 14 -7.677 1.607 9.642 1.00 0.00 N ATOM 182 CA ALA A 14 -7.846 0.257 10.171 1.00 0.00 C ATOM 183 C ALA A 14 -9.028 -0.464 9.524 1.00 0.00 C ATOM 184 O ALA A 14 -9.057 -1.693 9.466 1.00 0.00 O ATOM 185 CB ALA A 14 -8.023 0.302 11.682 1.00 0.00 C ATOM 0 H ALA A 14 -7.748 2.344 10.343 1.00 0.00 H new ATOM 0 HA ALA A 14 -6.944 -0.305 9.930 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -8.148 -0.711 12.064 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -7.143 0.756 12.138 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -8.905 0.894 11.928 1.00 0.00 H new ATOM 191 N ASP A 15 -10.004 0.301 9.044 1.00 0.00 N ATOM 192 CA ASP A 15 -11.185 -0.280 8.408 1.00 0.00 C ATOM 193 C ASP A 15 -10.810 -0.982 7.108 1.00 0.00 C ATOM 194 O ASP A 15 -10.973 -2.195 6.975 1.00 0.00 O ATOM 195 CB ASP A 15 -12.235 0.801 8.138 1.00 0.00 C ATOM 196 CG ASP A 15 -13.567 0.491 8.793 1.00 0.00 C ATOM 197 OD1 ASP A 15 -13.568 0.095 9.977 1.00 0.00 O ATOM 198 OD2 ASP A 15 -14.609 0.644 8.121 1.00 0.00 O ATOM 0 H ASP A 15 -10.002 1.320 9.082 1.00 0.00 H new ATOM 0 HA ASP A 15 -11.607 -1.018 9.090 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -11.868 1.760 8.504 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -12.378 0.904 7.062 1.00 0.00 H new ATOM 203 N PHE A 16 -10.306 -0.210 6.150 1.00 0.00 N ATOM 204 CA PHE A 16 -9.908 -0.759 4.859 1.00 0.00 C ATOM 205 C PHE A 16 -8.897 -1.887 5.033 1.00 0.00 C ATOM 206 O PHE A 16 -8.919 -2.867 4.292 1.00 0.00 O ATOM 207 CB PHE A 16 -9.317 0.340 3.974 1.00 0.00 C ATOM 208 CG PHE A 16 -8.960 -0.129 2.591 1.00 0.00 C ATOM 209 CD1 PHE A 16 -7.699 -0.634 2.321 1.00 0.00 C ATOM 210 CD2 PHE A 16 -9.887 -0.062 1.563 1.00 0.00 C ATOM 211 CE1 PHE A 16 -7.368 -1.065 1.050 1.00 0.00 C ATOM 212 CE2 PHE A 16 -9.562 -0.492 0.290 1.00 0.00 C ATOM 213 CZ PHE A 16 -8.301 -0.994 0.033 1.00 0.00 C ATOM 0 H PHE A 16 -10.164 0.796 6.243 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.797 -1.166 4.377 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.033 1.158 3.898 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.425 0.741 4.454 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -6.966 -0.692 3.112 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -10.874 0.330 1.759 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -6.381 -1.457 0.852 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -10.293 -0.436 -0.503 1.00 0.00 H new ATOM 0 HZ PHE A 16 -8.045 -1.330 -0.961 1.00 0.00 H new ATOM 223 N VAL A 17 -8.012 -1.743 6.019 1.00 0.00 N ATOM 224 CA VAL A 17 -6.995 -2.755 6.289 1.00 0.00 C ATOM 225 C VAL A 17 -7.617 -4.013 6.891 1.00 0.00 C ATOM 226 O VAL A 17 -7.542 -5.093 6.306 1.00 0.00 O ATOM 227 CB VAL A 17 -5.903 -2.229 7.246 1.00 0.00 C ATOM 228 CG1 VAL A 17 -4.805 -3.269 7.435 1.00 0.00 C ATOM 229 CG2 VAL A 17 -5.319 -0.918 6.735 1.00 0.00 C ATOM 0 H VAL A 17 -7.980 -0.936 6.642 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.536 -2.998 5.331 1.00 0.00 H new ATOM 0 HB VAL A 17 -6.365 -2.040 8.215 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.046 -2.878 8.113 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.234 -4.178 7.856 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.349 -3.496 6.471 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -4.552 -0.568 7.426 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -4.877 -1.076 5.751 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.110 -0.171 6.662 1.00 0.00 H new ATOM 239 N GLY A 18 -8.228 -3.865 8.065 1.00 0.00 N ATOM 240 CA GLY A 18 -8.852 -4.999 8.730 1.00 0.00 C ATOM 241 C GLY A 18 -9.739 -5.802 7.799 1.00 0.00 C ATOM 242 O GLY A 18 -9.618 -7.023 7.713 1.00 0.00 O ATOM 0 H GLY A 18 -8.302 -2.981 8.568 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.077 -5.648 9.138 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.444 -4.641 9.572 1.00 0.00 H new ATOM 246 N TYR A 19 -10.627 -5.110 7.097 1.00 0.00 N ATOM 247 CA TYR A 19 -11.531 -5.764 6.164 1.00 0.00 C ATOM 248 C TYR A 19 -10.747 -6.426 5.033 1.00 0.00 C ATOM 249 O TYR A 19 -11.132 -7.485 4.536 1.00 0.00 O ATOM 250 CB TYR A 19 -12.530 -4.751 5.599 1.00 0.00 C ATOM 251 CG TYR A 19 -13.958 -5.252 5.577 1.00 0.00 C ATOM 252 CD1 TYR A 19 -14.240 -6.580 5.293 1.00 0.00 C ATOM 253 CD2 TYR A 19 -15.023 -4.395 5.831 1.00 0.00 C ATOM 254 CE1 TYR A 19 -15.540 -7.044 5.259 1.00 0.00 C ATOM 255 CE2 TYR A 19 -16.328 -4.852 5.802 1.00 0.00 C ATOM 256 CZ TYR A 19 -16.580 -6.178 5.515 1.00 0.00 C ATOM 257 OH TYR A 19 -17.878 -6.636 5.478 1.00 0.00 O ATOM 0 H TYR A 19 -10.739 -4.098 7.157 1.00 0.00 H new ATOM 0 HA TYR A 19 -12.082 -6.538 6.699 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -12.484 -3.838 6.193 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -12.231 -4.487 4.585 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -13.428 -7.264 5.095 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -14.828 -3.356 6.054 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -15.740 -8.081 5.033 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -17.145 -4.175 6.003 1.00 0.00 H new ATOM 0 HH TYR A 19 -18.491 -5.899 5.682 1.00 0.00 H new ATOM 267 N LYS A 20 -9.640 -5.799 4.636 1.00 0.00 N ATOM 268 CA LYS A 20 -8.801 -6.333 3.567 1.00 0.00 C ATOM 269 C LYS A 20 -8.296 -7.725 3.918 1.00 0.00 C ATOM 270 O LYS A 20 -8.122 -8.566 3.042 1.00 0.00 O ATOM 271 CB LYS A 20 -7.612 -5.409 3.294 1.00 0.00 C ATOM 272 CG LYS A 20 -7.504 -4.975 1.841 1.00 0.00 C ATOM 273 CD LYS A 20 -6.278 -5.573 1.169 1.00 0.00 C ATOM 274 CE LYS A 20 -6.230 -5.234 -0.313 1.00 0.00 C ATOM 275 NZ LYS A 20 -4.922 -4.638 -0.703 1.00 0.00 N ATOM 0 H LYS A 20 -9.305 -4.923 5.038 1.00 0.00 H new ATOM 0 HA LYS A 20 -9.413 -6.396 2.668 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.697 -4.524 3.924 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.692 -5.918 3.582 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.401 -5.280 1.302 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.455 -3.887 1.788 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -5.377 -5.201 1.657 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.285 -6.656 1.295 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.407 -6.137 -0.898 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.033 -4.537 -0.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -4.929 -4.421 -1.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -4.764 -3.763 -0.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -4.158 -5.313 -0.498 1.00 0.00 H new ATOM 289 N LEU A 21 -8.058 -7.956 5.204 1.00 0.00 N ATOM 290 CA LEU A 21 -7.569 -9.247 5.670 1.00 0.00 C ATOM 291 C LEU A 21 -8.711 -10.249 5.789 1.00 0.00 C ATOM 292 O LEU A 21 -8.553 -11.428 5.473 1.00 0.00 O ATOM 293 CB LEU A 21 -6.868 -9.092 7.019 1.00 0.00 C ATOM 294 CG LEU A 21 -5.355 -9.288 6.980 1.00 0.00 C ATOM 295 CD1 LEU A 21 -4.726 -8.828 8.283 1.00 0.00 C ATOM 296 CD2 LEU A 21 -5.014 -10.743 6.704 1.00 0.00 C ATOM 0 H LEU A 21 -8.196 -7.266 5.942 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.854 -9.624 4.938 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -7.081 -8.098 7.411 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.295 -9.810 7.719 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.948 -8.682 6.171 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -3.647 -8.975 8.238 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -4.942 -7.771 8.438 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -5.137 -9.407 9.110 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.931 -10.865 6.680 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.432 -11.370 7.491 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.434 -11.039 5.743 1.00 0.00 H new ATOM 308 N ARG A 22 -9.860 -9.772 6.250 1.00 0.00 N ATOM 309 CA ARG A 22 -11.027 -10.625 6.417 1.00 0.00 C ATOM 310 C ARG A 22 -11.567 -11.079 5.066 1.00 0.00 C ATOM 311 O ARG A 22 -11.701 -12.276 4.816 1.00 0.00 O ATOM 312 CB ARG A 22 -12.115 -9.893 7.198 1.00 0.00 C ATOM 313 CG ARG A 22 -12.933 -10.807 8.095 1.00 0.00 C ATOM 314 CD ARG A 22 -14.366 -10.323 8.230 1.00 0.00 C ATOM 315 NE ARG A 22 -15.325 -11.409 8.050 1.00 0.00 N ATOM 316 CZ ARG A 22 -15.682 -11.885 6.861 1.00 0.00 C ATOM 317 NH1 ARG A 22 -15.158 -11.377 5.756 1.00 0.00 N ATOM 318 NH2 ARG A 22 -16.560 -12.874 6.776 1.00 0.00 N ATOM 0 H ARG A 22 -10.008 -8.798 6.515 1.00 0.00 H new ATOM 0 HA ARG A 22 -10.722 -11.508 6.980 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.654 -9.116 7.808 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.782 -9.393 6.496 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -12.927 -11.818 7.687 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -12.471 -10.858 9.081 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -14.507 -9.873 9.213 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -14.557 -9.543 7.493 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.744 -11.825 8.882 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.479 -10.619 5.816 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -15.434 -11.744 4.845 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -16.964 -13.272 7.624 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -16.832 -13.237 5.863 1.00 0.00 H new ATOM 332 N GLN A 23 -11.868 -10.122 4.188 1.00 0.00 N ATOM 333 CA GLN A 23 -12.385 -10.442 2.859 1.00 0.00 C ATOM 334 C GLN A 23 -11.293 -11.030 1.963 1.00 0.00 C ATOM 335 O GLN A 23 -11.419 -11.023 0.740 1.00 0.00 O ATOM 336 CB GLN A 23 -12.987 -9.198 2.193 1.00 0.00 C ATOM 337 CG GLN A 23 -14.283 -8.729 2.832 1.00 0.00 C ATOM 338 CD GLN A 23 -15.383 -8.465 1.821 1.00 0.00 C ATOM 339 OE1 GLN A 23 -15.685 -7.313 1.506 1.00 0.00 O ATOM 340 NE2 GLN A 23 -15.995 -9.529 1.316 1.00 0.00 N ATOM 0 H GLN A 23 -11.763 -9.124 4.372 1.00 0.00 H new ATOM 0 HA GLN A 23 -13.167 -11.190 2.987 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -12.259 -8.388 2.232 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -13.169 -9.413 1.140 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -14.624 -9.482 3.543 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -14.093 -7.818 3.399 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -15.712 -10.465 1.605 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -16.748 -9.410 0.638 1.00 0.00 H new ATOM 349 N LYS A 24 -10.229 -11.548 2.572 1.00 0.00 N ATOM 350 CA LYS A 24 -9.130 -12.147 1.824 1.00 0.00 C ATOM 351 C LYS A 24 -8.808 -13.539 2.361 1.00 0.00 C ATOM 352 O LYS A 24 -7.696 -14.038 2.189 1.00 0.00 O ATOM 353 CB LYS A 24 -7.893 -11.261 1.913 1.00 0.00 C ATOM 354 CG LYS A 24 -7.489 -10.640 0.589 1.00 0.00 C ATOM 355 CD LYS A 24 -6.043 -10.177 0.622 1.00 0.00 C ATOM 356 CE LYS A 24 -5.768 -9.120 -0.434 1.00 0.00 C ATOM 357 NZ LYS A 24 -4.901 -9.644 -1.524 1.00 0.00 N ATOM 0 H LYS A 24 -10.106 -11.564 3.584 1.00 0.00 H new ATOM 0 HA LYS A 24 -9.434 -12.238 0.781 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.078 -10.466 2.635 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -7.061 -11.852 2.296 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -7.624 -11.366 -0.213 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -8.140 -9.795 0.366 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.812 -9.775 1.608 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.384 -11.030 0.463 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.711 -8.772 -0.855 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.289 -8.258 0.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -4.735 -8.895 -2.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -3.991 -9.953 -1.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.370 -10.451 -1.983 1.00 0.00 H new ATOM 589 N GLN A 43 -15.367 2.945 -1.985 1.00 0.00 N ATOM 590 CA GLN A 43 -15.163 3.066 -3.425 1.00 0.00 C ATOM 591 C GLN A 43 -13.816 3.708 -3.736 1.00 0.00 C ATOM 592 O GLN A 43 -12.993 3.132 -4.447 1.00 0.00 O ATOM 593 CB GLN A 43 -16.288 3.892 -4.050 1.00 0.00 C ATOM 594 CG GLN A 43 -16.354 3.776 -5.563 1.00 0.00 C ATOM 595 CD GLN A 43 -15.720 4.960 -6.267 1.00 0.00 C ATOM 596 OE1 GLN A 43 -14.420 4.867 -6.526 1.00 0.00 O flip ATOM 597 NE2 GLN A 43 -16.389 5.946 -6.574 1.00 0.00 N flip ATOM 0 HA GLN A 43 -15.172 2.063 -3.852 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -17.241 3.573 -3.627 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -16.153 4.939 -3.779 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -15.852 2.861 -5.876 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -17.396 3.690 -5.872 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -17.385 5.975 -6.356 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -15.948 6.735 -7.047 1.00 0.00 H new ATOM 606 N ALA A 44 -13.598 4.906 -3.202 1.00 0.00 N ATOM 607 CA ALA A 44 -12.351 5.628 -3.424 1.00 0.00 C ATOM 608 C ALA A 44 -11.153 4.805 -2.964 1.00 0.00 C ATOM 609 O ALA A 44 -10.097 4.816 -3.594 1.00 0.00 O ATOM 610 CB ALA A 44 -12.389 6.967 -2.702 1.00 0.00 C ATOM 0 H ALA A 44 -14.270 5.397 -2.612 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.242 5.807 -4.494 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -11.453 7.499 -2.873 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -13.220 7.562 -3.082 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.521 6.800 -1.633 1.00 0.00 H new ATOM 616 N MET A 45 -11.330 4.094 -1.857 1.00 0.00 N ATOM 617 CA MET A 45 -10.272 3.260 -1.295 1.00 0.00 C ATOM 618 C MET A 45 -9.995 2.045 -2.173 1.00 0.00 C ATOM 619 O MET A 45 -8.845 1.738 -2.480 1.00 0.00 O ATOM 620 CB MET A 45 -10.660 2.799 0.109 1.00 0.00 C ATOM 621 CG MET A 45 -9.661 3.202 1.177 1.00 0.00 C ATOM 622 SD MET A 45 -10.445 3.981 2.595 1.00 0.00 S ATOM 623 CE MET A 45 -10.476 5.677 2.030 1.00 0.00 C ATOM 0 H MET A 45 -12.201 4.078 -1.327 1.00 0.00 H new ATOM 0 HA MET A 45 -9.364 3.861 -1.247 1.00 0.00 H new ATOM 0 HB2 MET A 45 -11.636 3.213 0.362 1.00 0.00 H new ATOM 0 HB3 MET A 45 -10.763 1.714 0.111 1.00 0.00 H new ATOM 0 HG2 MET A 45 -9.113 2.320 1.508 1.00 0.00 H new ATOM 0 HG3 MET A 45 -8.931 3.888 0.747 1.00 0.00 H new ATOM 0 HE1 MET A 45 -9.732 6.256 2.577 1.00 0.00 H new ATOM 0 HE2 MET A 45 -10.250 5.710 0.964 1.00 0.00 H new ATOM 0 HE3 MET A 45 -11.465 6.101 2.204 1.00 0.00 H new ATOM 633 N ARG A 46 -11.060 1.352 -2.564 1.00 0.00 N ATOM 634 CA ARG A 46 -10.936 0.164 -3.400 1.00 0.00 C ATOM 635 C ARG A 46 -10.420 0.526 -4.783 1.00 0.00 C ATOM 636 O ARG A 46 -9.626 -0.206 -5.375 1.00 0.00 O ATOM 637 CB ARG A 46 -12.288 -0.537 -3.533 1.00 0.00 C ATOM 638 CG ARG A 46 -12.174 -2.040 -3.722 1.00 0.00 C ATOM 639 CD ARG A 46 -13.262 -2.571 -4.643 1.00 0.00 C ATOM 640 NE ARG A 46 -12.708 -3.185 -5.850 1.00 0.00 N ATOM 641 CZ ARG A 46 -12.356 -4.466 -5.940 1.00 0.00 C ATOM 642 NH1 ARG A 46 -12.477 -5.274 -4.893 1.00 0.00 N ATOM 643 NH2 ARG A 46 -11.880 -4.941 -7.083 1.00 0.00 N ATOM 0 H ARG A 46 -12.019 1.593 -2.315 1.00 0.00 H new ATOM 0 HA ARG A 46 -10.224 -0.508 -2.921 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.883 -0.335 -2.642 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.827 -0.112 -4.380 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.195 -2.282 -4.136 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -12.242 -2.536 -2.754 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -13.864 -3.305 -4.107 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -13.928 -1.756 -4.924 1.00 0.00 H new ATOM 0 HE ARG A 46 -12.584 -2.596 -6.673 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -12.842 -4.915 -4.011 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -12.205 -6.254 -4.971 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -11.784 -4.325 -7.891 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -11.610 -5.922 -7.154 1.00 0.00 H new ATOM 657 N ALA A 47 -10.890 1.656 -5.294 1.00 0.00 N ATOM 658 CA ALA A 47 -10.490 2.118 -6.610 1.00 0.00 C ATOM 659 C ALA A 47 -8.984 2.351 -6.674 1.00 0.00 C ATOM 660 O ALA A 47 -8.315 1.824 -7.557 1.00 0.00 O ATOM 661 CB ALA A 47 -11.268 3.371 -6.982 1.00 0.00 C ATOM 0 H ALA A 47 -11.550 2.268 -4.814 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.726 1.344 -7.340 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -10.961 3.710 -7.971 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -12.335 3.148 -6.990 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -11.067 4.154 -6.251 1.00 0.00 H new ATOM 667 N ALA A 48 -8.449 3.123 -5.725 1.00 0.00 N ATOM 668 CA ALA A 48 -7.011 3.393 -5.680 1.00 0.00 C ATOM 669 C ALA A 48 -6.225 2.087 -5.632 1.00 0.00 C ATOM 670 O ALA A 48 -5.319 1.857 -6.433 1.00 0.00 O ATOM 671 CB ALA A 48 -6.669 4.248 -4.468 1.00 0.00 C ATOM 0 H ALA A 48 -8.987 3.569 -4.982 1.00 0.00 H new ATOM 0 HA ALA A 48 -6.736 3.936 -6.584 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -5.596 4.440 -4.449 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.206 5.195 -4.527 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -6.960 3.723 -3.558 1.00 0.00 H new ATOM 677 N GLY A 49 -6.593 1.240 -4.679 1.00 0.00 N ATOM 678 CA GLY A 49 -5.938 -0.044 -4.510 1.00 0.00 C ATOM 679 C GLY A 49 -5.890 -0.848 -5.794 1.00 0.00 C ATOM 680 O GLY A 49 -4.813 -1.157 -6.314 1.00 0.00 O ATOM 0 H GLY A 49 -7.343 1.423 -4.012 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.922 0.115 -4.147 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -6.463 -0.618 -3.746 1.00 0.00 H new ATOM 684 N ASP A 50 -7.068 -1.181 -6.303 1.00 0.00 N ATOM 685 CA ASP A 50 -7.186 -1.952 -7.533 1.00 0.00 C ATOM 686 C ASP A 50 -6.688 -1.153 -8.737 1.00 0.00 C ATOM 687 O ASP A 50 -6.509 -1.704 -9.824 1.00 0.00 O ATOM 688 CB ASP A 50 -8.641 -2.366 -7.750 1.00 0.00 C ATOM 689 CG ASP A 50 -8.788 -3.444 -8.803 1.00 0.00 C ATOM 690 OD1 ASP A 50 -7.930 -4.351 -8.848 1.00 0.00 O ATOM 691 OD2 ASP A 50 -9.761 -3.384 -9.583 1.00 0.00 O ATOM 0 H ASP A 50 -7.961 -0.927 -5.880 1.00 0.00 H new ATOM 0 HA ASP A 50 -6.565 -2.842 -7.436 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -9.058 -2.724 -6.808 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -9.223 -1.493 -8.045 1.00 0.00 H new ATOM 696 N GLU A 51 -6.466 0.145 -8.542 1.00 0.00 N ATOM 697 CA GLU A 51 -5.991 1.006 -9.617 1.00 0.00 C ATOM 698 C GLU A 51 -4.544 0.684 -9.969 1.00 0.00 C ATOM 699 O GLU A 51 -4.222 0.452 -11.132 1.00 0.00 O ATOM 700 CB GLU A 51 -6.116 2.479 -9.221 1.00 0.00 C ATOM 701 CG GLU A 51 -6.863 3.317 -10.241 1.00 0.00 C ATOM 702 CD GLU A 51 -8.314 2.911 -10.393 1.00 0.00 C ATOM 703 OE1 GLU A 51 -8.644 1.751 -10.070 1.00 0.00 O ATOM 704 OE2 GLU A 51 -9.122 3.756 -10.834 1.00 0.00 O ATOM 0 H GLU A 51 -6.608 0.621 -7.651 1.00 0.00 H new ATOM 0 HA GLU A 51 -6.612 0.823 -10.494 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.628 2.547 -8.261 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.119 2.895 -9.080 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -6.814 4.366 -9.947 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -6.365 3.233 -11.207 1.00 0.00 H new ATOM 711 N PHE A 52 -3.674 0.674 -8.958 1.00 0.00 N ATOM 712 CA PHE A 52 -2.261 0.381 -9.180 1.00 0.00 C ATOM 713 C PHE A 52 -2.048 -1.090 -9.471 1.00 0.00 C ATOM 714 O PHE A 52 -1.134 -1.463 -10.209 1.00 0.00 O ATOM 715 CB PHE A 52 -1.412 0.770 -7.971 1.00 0.00 C ATOM 716 CG PHE A 52 -1.894 0.214 -6.662 1.00 0.00 C ATOM 717 CD1 PHE A 52 -1.846 -1.147 -6.410 1.00 0.00 C ATOM 718 CD2 PHE A 52 -2.371 1.058 -5.673 1.00 0.00 C ATOM 719 CE1 PHE A 52 -2.268 -1.656 -5.197 1.00 0.00 C ATOM 720 CE2 PHE A 52 -2.790 0.554 -4.458 1.00 0.00 C ATOM 721 CZ PHE A 52 -2.740 -0.806 -4.221 1.00 0.00 C ATOM 0 H PHE A 52 -3.921 0.864 -7.987 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.950 0.972 -10.041 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.389 0.433 -8.139 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -1.382 1.857 -7.900 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -1.474 -1.818 -7.170 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.416 2.122 -5.854 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -2.228 -2.720 -5.014 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.157 1.223 -3.693 1.00 0.00 H new ATOM 0 HZ PHE A 52 -3.070 -1.202 -3.272 1.00 0.00 H new ATOM 731 N GLU A 53 -2.878 -1.925 -8.870 1.00 0.00 N ATOM 732 CA GLU A 53 -2.760 -3.361 -9.049 1.00 0.00 C ATOM 733 C GLU A 53 -3.075 -3.758 -10.483 1.00 0.00 C ATOM 734 O GLU A 53 -2.416 -4.622 -11.058 1.00 0.00 O ATOM 735 CB GLU A 53 -3.685 -4.089 -8.079 1.00 0.00 C ATOM 736 CG GLU A 53 -2.970 -5.130 -7.238 1.00 0.00 C ATOM 737 CD GLU A 53 -3.044 -6.518 -7.843 1.00 0.00 C ATOM 738 OE1 GLU A 53 -3.781 -6.695 -8.835 1.00 0.00 O ATOM 739 OE2 GLU A 53 -2.363 -7.428 -7.326 1.00 0.00 O ATOM 0 H GLU A 53 -3.639 -1.634 -8.256 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.730 -3.650 -8.838 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -4.156 -3.360 -7.420 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -4.484 -4.572 -8.642 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.925 -4.843 -7.122 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -3.408 -5.149 -6.240 1.00 0.00 H new ATOM 746 N THR A 54 -4.082 -3.116 -11.056 1.00 0.00 N ATOM 747 CA THR A 54 -4.480 -3.394 -12.427 1.00 0.00 C ATOM 748 C THR A 54 -3.681 -2.543 -13.394 1.00 0.00 C ATOM 749 O THR A 54 -3.428 -2.937 -14.534 1.00 0.00 O ATOM 750 CB THR A 54 -5.965 -3.108 -12.613 1.00 0.00 C ATOM 751 OG1 THR A 54 -6.719 -3.649 -11.541 1.00 0.00 O ATOM 752 CG2 THR A 54 -6.514 -3.660 -13.912 1.00 0.00 C ATOM 0 H THR A 54 -4.639 -2.398 -10.592 1.00 0.00 H new ATOM 0 HA THR A 54 -4.285 -4.447 -12.631 1.00 0.00 H new ATOM 0 HB THR A 54 -6.058 -2.022 -12.637 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.839 -2.966 -10.848 1.00 0.00 H new ATOM 0 HG21 THR A 54 -7.576 -3.425 -13.987 1.00 0.00 H new ATOM 0 HG22 THR A 54 -5.982 -3.212 -14.751 1.00 0.00 H new ATOM 0 HG23 THR A 54 -6.380 -4.741 -13.933 1.00 0.00 H new ATOM 760 N ARG A 55 -3.294 -1.366 -12.930 1.00 0.00 N ATOM 761 CA ARG A 55 -2.533 -0.437 -13.736 1.00 0.00 C ATOM 762 C ARG A 55 -1.322 -1.117 -14.388 1.00 0.00 C ATOM 763 O ARG A 55 -1.152 -1.054 -15.605 1.00 0.00 O ATOM 764 CB ARG A 55 -2.123 0.744 -12.860 1.00 0.00 C ATOM 765 CG ARG A 55 -2.944 1.992 -13.134 1.00 0.00 C ATOM 766 CD ARG A 55 -2.823 3.013 -12.015 1.00 0.00 C ATOM 767 NE ARG A 55 -4.059 3.775 -11.775 1.00 0.00 N ATOM 768 CZ ARG A 55 -4.781 4.398 -12.717 1.00 0.00 C ATOM 769 NH1 ARG A 55 -4.465 4.316 -14.004 1.00 0.00 N ATOM 770 NH2 ARG A 55 -5.832 5.126 -12.362 1.00 0.00 N ATOM 0 H ARG A 55 -3.499 -1.033 -11.988 1.00 0.00 H new ATOM 0 HA ARG A 55 -3.151 -0.074 -14.557 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -2.230 0.467 -11.811 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.068 0.965 -13.025 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -2.617 2.442 -14.071 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -3.991 1.716 -13.261 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -2.538 2.500 -11.096 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -2.018 3.708 -12.255 1.00 0.00 H new ATOM 0 HE ARG A 55 -4.394 3.834 -10.813 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -3.655 3.769 -14.297 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -5.032 4.800 -14.700 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -6.086 5.209 -11.378 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -6.386 5.603 -13.073 1.00 0.00 H new ATOM 784 N PHE A 56 -0.496 -1.781 -13.583 1.00 0.00 N ATOM 785 CA PHE A 56 0.676 -2.479 -14.100 1.00 0.00 C ATOM 786 C PHE A 56 0.328 -3.934 -14.448 1.00 0.00 C ATOM 787 O PHE A 56 -0.733 -4.206 -15.006 1.00 0.00 O ATOM 788 CB PHE A 56 1.818 -2.404 -13.081 1.00 0.00 C ATOM 789 CG PHE A 56 3.194 -2.596 -13.665 1.00 0.00 C ATOM 790 CD1 PHE A 56 3.461 -2.319 -15.001 1.00 0.00 C ATOM 791 CD2 PHE A 56 4.229 -3.051 -12.868 1.00 0.00 C ATOM 792 CE1 PHE A 56 4.730 -2.496 -15.520 1.00 0.00 C ATOM 793 CE2 PHE A 56 5.497 -3.227 -13.385 1.00 0.00 C ATOM 794 CZ PHE A 56 5.747 -2.951 -14.710 1.00 0.00 C ATOM 0 H PHE A 56 -0.617 -1.850 -12.573 1.00 0.00 H new ATOM 0 HA PHE A 56 1.006 -1.993 -15.018 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.781 -1.435 -12.584 1.00 0.00 H new ATOM 0 HB3 PHE A 56 1.654 -3.162 -12.315 1.00 0.00 H new ATOM 0 HD1 PHE A 56 2.668 -1.961 -15.641 1.00 0.00 H new ATOM 0 HD2 PHE A 56 4.043 -3.272 -11.827 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.924 -2.278 -16.560 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.294 -3.582 -12.749 1.00 0.00 H new ATOM 0 HZ PHE A 56 6.739 -3.091 -15.114 1.00 0.00 H new ATOM 804 N ARG A 57 1.221 -4.867 -14.124 1.00 0.00 N ATOM 805 CA ARG A 57 0.996 -6.280 -14.412 1.00 0.00 C ATOM 806 C ARG A 57 1.466 -7.150 -13.254 1.00 0.00 C ATOM 807 O ARG A 57 0.657 -7.705 -12.508 1.00 0.00 O ATOM 808 CB ARG A 57 1.738 -6.682 -15.689 1.00 0.00 C ATOM 809 CG ARG A 57 1.440 -8.099 -16.147 1.00 0.00 C ATOM 810 CD ARG A 57 0.467 -8.109 -17.311 1.00 0.00 C ATOM 811 NE ARG A 57 0.151 -9.467 -17.746 1.00 0.00 N ATOM 812 CZ ARG A 57 0.150 -9.863 -19.018 1.00 0.00 C ATOM 813 NH1 ARG A 57 0.451 -9.009 -19.993 1.00 0.00 N ATOM 814 NH2 ARG A 57 -0.152 -11.117 -19.316 1.00 0.00 N ATOM 0 H ARG A 57 2.108 -4.668 -13.661 1.00 0.00 H new ATOM 0 HA ARG A 57 -0.074 -6.432 -14.552 1.00 0.00 H new ATOM 0 HB2 ARG A 57 1.473 -5.988 -16.487 1.00 0.00 H new ATOM 0 HB3 ARG A 57 2.811 -6.581 -15.523 1.00 0.00 H new ATOM 0 HG2 ARG A 57 2.367 -8.591 -16.441 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.024 -8.672 -15.318 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.451 -7.598 -17.021 1.00 0.00 H new ATOM 0 HD3 ARG A 57 0.893 -7.551 -18.145 1.00 0.00 H new ATOM 0 HE ARG A 57 -0.084 -10.155 -17.031 1.00 0.00 H new ATOM 0 HH11 ARG A 57 0.685 -8.042 -19.769 1.00 0.00 H new ATOM 0 HH12 ARG A 57 0.448 -9.322 -20.964 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -0.383 -11.776 -18.573 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.154 -11.424 -20.289 1.00 0.00 H new ATOM 828 N ARG A 58 2.780 -7.263 -13.112 1.00 0.00 N ATOM 829 CA ARG A 58 3.370 -8.061 -12.050 1.00 0.00 C ATOM 830 C ARG A 58 4.312 -7.215 -11.208 1.00 0.00 C ATOM 831 O ARG A 58 5.500 -7.516 -11.104 1.00 0.00 O ATOM 832 CB ARG A 58 4.135 -9.248 -12.640 1.00 0.00 C ATOM 833 CG ARG A 58 3.439 -9.900 -13.822 1.00 0.00 C ATOM 834 CD ARG A 58 3.259 -11.394 -13.611 1.00 0.00 C ATOM 835 NE ARG A 58 2.852 -12.069 -14.839 1.00 0.00 N ATOM 836 CZ ARG A 58 3.633 -12.199 -15.907 1.00 0.00 C ATOM 837 NH1 ARG A 58 4.874 -11.728 -15.892 1.00 0.00 N ATOM 838 NH2 ARG A 58 3.175 -12.806 -16.993 1.00 0.00 N ATOM 0 H ARG A 58 3.459 -6.809 -13.723 1.00 0.00 H new ATOM 0 HA ARG A 58 2.565 -8.433 -11.416 1.00 0.00 H new ATOM 0 HB2 ARG A 58 5.124 -8.912 -12.953 1.00 0.00 H new ATOM 0 HB3 ARG A 58 4.284 -9.995 -11.861 1.00 0.00 H new ATOM 0 HG2 ARG A 58 2.466 -9.434 -13.974 1.00 0.00 H new ATOM 0 HG3 ARG A 58 4.020 -9.727 -14.728 1.00 0.00 H new ATOM 0 HD2 ARG A 58 4.193 -11.826 -13.251 1.00 0.00 H new ATOM 0 HD3 ARG A 58 2.510 -11.564 -12.837 1.00 0.00 H new ATOM 0 HE ARG A 58 1.913 -12.465 -14.880 1.00 0.00 H new ATOM 0 HH11 ARG A 58 5.233 -11.263 -15.058 1.00 0.00 H new ATOM 0 HH12 ARG A 58 5.468 -11.831 -16.714 1.00 0.00 H new ATOM 0 HH21 ARG A 58 2.224 -13.173 -17.009 1.00 0.00 H new ATOM 0 HH22 ARG A 58 3.774 -12.906 -17.812 1.00 0.00 H new ATOM 852 N THR A 59 3.780 -6.149 -10.607 1.00 0.00 N ATOM 853 CA THR A 59 4.585 -5.255 -9.775 1.00 0.00 C ATOM 854 C THR A 59 5.577 -6.046 -8.925 1.00 0.00 C ATOM 855 O THR A 59 6.667 -5.576 -8.632 1.00 0.00 O ATOM 856 CB THR A 59 3.691 -4.407 -8.866 1.00 0.00 C ATOM 857 OG1 THR A 59 2.661 -5.193 -8.294 1.00 0.00 O ATOM 858 CG2 THR A 59 3.042 -3.241 -9.580 1.00 0.00 C ATOM 0 H THR A 59 2.798 -5.885 -10.681 1.00 0.00 H new ATOM 0 HA THR A 59 5.141 -4.595 -10.442 1.00 0.00 H new ATOM 0 HB THR A 59 4.356 -4.014 -8.097 1.00 0.00 H new ATOM 0 HG1 THR A 59 2.104 -4.631 -7.716 1.00 0.00 H new ATOM 0 HG21 THR A 59 2.423 -2.683 -8.877 1.00 0.00 H new ATOM 0 HG22 THR A 59 3.814 -2.586 -9.983 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.421 -3.613 -10.395 1.00 0.00 H new ATOM 866 N PHE A 60 5.187 -7.260 -8.554 1.00 0.00 N ATOM 867 CA PHE A 60 6.037 -8.128 -7.751 1.00 0.00 C ATOM 868 C PHE A 60 7.343 -8.453 -8.477 1.00 0.00 C ATOM 869 O PHE A 60 8.407 -8.012 -8.064 1.00 0.00 O ATOM 870 CB PHE A 60 5.298 -9.415 -7.389 1.00 0.00 C ATOM 871 CG PHE A 60 4.636 -9.354 -6.044 1.00 0.00 C ATOM 872 CD1 PHE A 60 5.329 -8.885 -4.938 1.00 0.00 C ATOM 873 CD2 PHE A 60 3.321 -9.758 -5.883 1.00 0.00 C ATOM 874 CE1 PHE A 60 4.723 -8.820 -3.698 1.00 0.00 C ATOM 875 CE2 PHE A 60 2.709 -9.697 -4.645 1.00 0.00 C ATOM 876 CZ PHE A 60 3.411 -9.227 -3.552 1.00 0.00 C ATOM 0 H PHE A 60 4.284 -7.666 -8.798 1.00 0.00 H new ATOM 0 HA PHE A 60 6.285 -7.594 -6.833 1.00 0.00 H new ATOM 0 HB2 PHE A 60 4.545 -9.621 -8.149 1.00 0.00 H new ATOM 0 HB3 PHE A 60 6.001 -10.248 -7.404 1.00 0.00 H new ATOM 0 HD1 PHE A 60 6.355 -8.567 -5.047 1.00 0.00 H new ATOM 0 HD2 PHE A 60 2.767 -10.125 -6.735 1.00 0.00 H new ATOM 0 HE1 PHE A 60 5.274 -8.452 -2.845 1.00 0.00 H new ATOM 0 HE2 PHE A 60 1.683 -10.016 -4.532 1.00 0.00 H new ATOM 0 HZ PHE A 60 2.934 -9.178 -2.584 1.00 0.00 H new ATOM 886 N SER A 61 7.260 -9.239 -9.546 1.00 0.00 N ATOM 887 CA SER A 61 8.451 -9.632 -10.307 1.00 0.00 C ATOM 888 C SER A 61 9.365 -8.440 -10.606 1.00 0.00 C ATOM 889 O SER A 61 10.570 -8.500 -10.368 1.00 0.00 O ATOM 890 CB SER A 61 8.046 -10.316 -11.615 1.00 0.00 C ATOM 891 OG SER A 61 6.880 -9.729 -12.161 1.00 0.00 O ATOM 0 H SER A 61 6.385 -9.618 -9.908 1.00 0.00 H new ATOM 0 HA SER A 61 9.011 -10.332 -9.687 1.00 0.00 H new ATOM 0 HB2 SER A 61 8.863 -10.245 -12.333 1.00 0.00 H new ATOM 0 HB3 SER A 61 7.872 -11.377 -11.435 1.00 0.00 H new ATOM 0 HG SER A 61 6.691 -8.885 -11.699 1.00 0.00 H new ATOM 897 N ASP A 62 8.789 -7.372 -11.142 1.00 0.00 N ATOM 898 CA ASP A 62 9.560 -6.176 -11.488 1.00 0.00 C ATOM 899 C ASP A 62 10.060 -5.460 -10.233 1.00 0.00 C ATOM 900 O ASP A 62 11.258 -5.452 -9.955 1.00 0.00 O ATOM 901 CB ASP A 62 8.718 -5.228 -12.340 1.00 0.00 C ATOM 902 CG ASP A 62 7.287 -5.141 -11.862 1.00 0.00 C ATOM 903 OD1 ASP A 62 7.041 -4.431 -10.866 1.00 0.00 O ATOM 904 OD2 ASP A 62 6.412 -5.779 -12.483 1.00 0.00 O ATOM 0 H ASP A 62 7.792 -7.305 -11.348 1.00 0.00 H new ATOM 0 HA ASP A 62 10.429 -6.491 -12.066 1.00 0.00 H new ATOM 0 HB2 ASP A 62 9.165 -4.234 -12.322 1.00 0.00 H new ATOM 0 HB3 ASP A 62 8.732 -5.566 -13.376 1.00 0.00 H new ATOM 909 N LEU A 63 9.140 -4.851 -9.490 1.00 0.00 N ATOM 910 CA LEU A 63 9.484 -4.129 -8.270 1.00 0.00 C ATOM 911 C LEU A 63 10.426 -4.955 -7.400 1.00 0.00 C ATOM 912 O LEU A 63 11.208 -4.408 -6.637 1.00 0.00 O ATOM 913 CB LEU A 63 8.216 -3.777 -7.493 1.00 0.00 C ATOM 914 CG LEU A 63 8.415 -2.882 -6.271 1.00 0.00 C ATOM 915 CD1 LEU A 63 7.258 -1.900 -6.134 1.00 0.00 C ATOM 916 CD2 LEU A 63 8.547 -3.730 -5.015 1.00 0.00 C ATOM 0 H LEU A 63 8.145 -4.844 -9.714 1.00 0.00 H new ATOM 0 HA LEU A 63 9.996 -3.208 -8.547 1.00 0.00 H new ATOM 0 HB2 LEU A 63 7.521 -3.284 -8.172 1.00 0.00 H new ATOM 0 HB3 LEU A 63 7.742 -4.703 -7.169 1.00 0.00 H new ATOM 0 HG LEU A 63 9.334 -2.311 -6.403 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.417 -1.271 -5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.204 -1.275 -7.025 1.00 0.00 H new ATOM 0 HD13 LEU A 63 6.325 -2.451 -6.020 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.688 -3.081 -4.151 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.642 -4.323 -4.879 1.00 0.00 H new ATOM 0 HD23 LEU A 63 9.405 -4.395 -5.113 1.00 0.00 H new ATOM 928 N ALA A 64 10.344 -6.274 -7.525 1.00 0.00 N ATOM 929 CA ALA A 64 11.194 -7.168 -6.750 1.00 0.00 C ATOM 930 C ALA A 64 12.647 -7.053 -7.188 1.00 0.00 C ATOM 931 O ALA A 64 13.488 -6.555 -6.447 1.00 0.00 O ATOM 932 CB ALA A 64 10.717 -8.605 -6.885 1.00 0.00 C ATOM 0 H ALA A 64 9.697 -6.748 -8.156 1.00 0.00 H new ATOM 0 HA ALA A 64 11.128 -6.873 -5.703 1.00 0.00 H new ATOM 0 HB1 ALA A 64 11.363 -9.259 -6.300 1.00 0.00 H new ATOM 0 HB2 ALA A 64 9.693 -8.684 -6.519 1.00 0.00 H new ATOM 0 HB3 ALA A 64 10.752 -8.903 -7.933 1.00 0.00 H new ATOM 938 N ALA A 65 12.935 -7.523 -8.398 1.00 0.00 N ATOM 939 CA ALA A 65 14.291 -7.480 -8.935 1.00 0.00 C ATOM 940 C ALA A 65 14.870 -6.068 -8.880 1.00 0.00 C ATOM 941 O ALA A 65 15.935 -5.850 -8.302 1.00 0.00 O ATOM 942 CB ALA A 65 14.311 -8.002 -10.363 1.00 0.00 C ATOM 0 H ALA A 65 12.247 -7.938 -9.026 1.00 0.00 H new ATOM 0 HA ALA A 65 14.915 -8.121 -8.313 1.00 0.00 H new ATOM 0 HB1 ALA A 65 15.329 -7.964 -10.750 1.00 0.00 H new ATOM 0 HB2 ALA A 65 13.955 -9.032 -10.379 1.00 0.00 H new ATOM 0 HB3 ALA A 65 13.663 -7.385 -10.985 1.00 0.00 H new ATOM 948 N GLN A 66 14.166 -5.113 -9.480 1.00 0.00 N ATOM 949 CA GLN A 66 14.618 -3.724 -9.492 1.00 0.00 C ATOM 950 C GLN A 66 14.981 -3.263 -8.075 1.00 0.00 C ATOM 951 O GLN A 66 16.109 -2.839 -7.822 1.00 0.00 O ATOM 952 CB GLN A 66 13.538 -2.816 -10.099 1.00 0.00 C ATOM 953 CG GLN A 66 13.763 -2.499 -11.572 1.00 0.00 C ATOM 954 CD GLN A 66 12.608 -2.941 -12.453 1.00 0.00 C ATOM 955 OE1 GLN A 66 12.068 -4.035 -12.287 1.00 0.00 O ATOM 956 NE2 GLN A 66 12.224 -2.090 -13.399 1.00 0.00 N ATOM 0 H GLN A 66 13.282 -5.274 -9.963 1.00 0.00 H new ATOM 0 HA GLN A 66 15.513 -3.656 -10.111 1.00 0.00 H new ATOM 0 HB2 GLN A 66 12.566 -3.295 -9.984 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.502 -1.883 -9.537 1.00 0.00 H new ATOM 0 HG2 GLN A 66 13.913 -1.426 -11.689 1.00 0.00 H new ATOM 0 HG3 GLN A 66 14.678 -2.987 -11.908 1.00 0.00 H new ATOM 0 HE21 GLN A 66 12.699 -1.193 -13.502 1.00 0.00 H new ATOM 0 HE22 GLN A 66 11.454 -2.334 -14.022 1.00 0.00 H new ATOM 965 N LEU A 67 14.019 -3.356 -7.158 1.00 0.00 N ATOM 966 CA LEU A 67 14.234 -2.956 -5.768 1.00 0.00 C ATOM 967 C LEU A 67 15.308 -3.820 -5.109 1.00 0.00 C ATOM 968 O LEU A 67 15.957 -3.396 -4.151 1.00 0.00 O ATOM 969 CB LEU A 67 12.926 -3.065 -4.974 1.00 0.00 C ATOM 970 CG LEU A 67 12.242 -1.744 -4.596 1.00 0.00 C ATOM 971 CD1 LEU A 67 12.882 -1.151 -3.351 1.00 0.00 C ATOM 972 CD2 LEU A 67 12.277 -0.742 -5.747 1.00 0.00 C ATOM 0 H LEU A 67 13.081 -3.706 -7.353 1.00 0.00 H new ATOM 0 HA LEU A 67 14.572 -1.920 -5.766 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.222 -3.659 -5.556 1.00 0.00 H new ATOM 0 HB3 LEU A 67 13.129 -3.619 -4.057 1.00 0.00 H new ATOM 0 HG LEU A 67 11.196 -1.963 -4.383 1.00 0.00 H new ATOM 0 HD11 LEU A 67 12.385 -0.215 -3.097 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.782 -1.851 -2.522 1.00 0.00 H new ATOM 0 HD13 LEU A 67 13.939 -0.961 -3.540 1.00 0.00 H new ATOM 0 HD21 LEU A 67 11.783 0.180 -5.441 1.00 0.00 H new ATOM 0 HD22 LEU A 67 13.312 -0.529 -6.012 1.00 0.00 H new ATOM 0 HD23 LEU A 67 11.760 -1.161 -6.610 1.00 0.00 H new ATOM 984 N HIS A 68 15.499 -5.034 -5.625 1.00 0.00 N ATOM 985 CA HIS A 68 16.500 -5.937 -5.073 1.00 0.00 C ATOM 986 C HIS A 68 17.889 -5.325 -5.215 1.00 0.00 C ATOM 987 O HIS A 68 18.457 -4.840 -4.234 1.00 0.00 O ATOM 988 CB HIS A 68 16.435 -7.311 -5.752 1.00 0.00 C ATOM 989 CG HIS A 68 16.962 -8.417 -4.890 1.00 0.00 C ATOM 990 ND1 HIS A 68 16.157 -9.377 -4.312 1.00 0.00 N ATOM 991 CD2 HIS A 68 18.223 -8.700 -4.493 1.00 0.00 C ATOM 992 CE1 HIS A 68 16.901 -10.202 -3.597 1.00 0.00 C ATOM 993 NE2 HIS A 68 18.159 -9.814 -3.692 1.00 0.00 N ATOM 0 H HIS A 68 14.977 -5.409 -6.417 1.00 0.00 H new ATOM 0 HA HIS A 68 16.290 -6.083 -4.013 1.00 0.00 H new ATOM 0 HB2 HIS A 68 15.401 -7.529 -6.020 1.00 0.00 H new ATOM 0 HB3 HIS A 68 17.005 -7.278 -6.680 1.00 0.00 H new ATOM 0 HD2 HIS A 68 19.115 -8.152 -4.757 1.00 0.00 H new ATOM 0 HE1 HIS A 68 16.541 -11.049 -3.032 1.00 0.00 H new ATOM 0 HE2 HIS A 68 18.955 -10.268 -3.243 1.00 0.00 H new ATOM 1001 N VAL A 69 18.429 -5.338 -6.440 1.00 0.00 N ATOM 1002 CA VAL A 69 19.758 -4.763 -6.711 1.00 0.00 C ATOM 1003 C VAL A 69 20.087 -3.575 -5.783 1.00 0.00 C ATOM 1004 O VAL A 69 21.107 -3.598 -5.104 1.00 0.00 O ATOM 1005 CB VAL A 69 19.887 -4.324 -8.190 1.00 0.00 C ATOM 1006 CG1 VAL A 69 21.145 -3.490 -8.414 1.00 0.00 C ATOM 1007 CG2 VAL A 69 19.889 -5.539 -9.106 1.00 0.00 C ATOM 0 H VAL A 69 17.970 -5.738 -7.258 1.00 0.00 H new ATOM 0 HA VAL A 69 20.480 -5.554 -6.508 1.00 0.00 H new ATOM 0 HB VAL A 69 19.025 -3.702 -8.430 1.00 0.00 H new ATOM 0 HG11 VAL A 69 21.206 -3.198 -9.462 1.00 0.00 H new ATOM 0 HG12 VAL A 69 21.105 -2.597 -7.790 1.00 0.00 H new ATOM 0 HG13 VAL A 69 22.024 -4.079 -8.150 1.00 0.00 H new ATOM 0 HG21 VAL A 69 19.980 -5.213 -10.142 1.00 0.00 H new ATOM 0 HG22 VAL A 69 20.730 -6.184 -8.853 1.00 0.00 H new ATOM 0 HG23 VAL A 69 18.958 -6.091 -8.980 1.00 0.00 H new ATOM 1017 N THR A 70 19.228 -2.555 -5.756 1.00 0.00 N ATOM 1018 CA THR A 70 19.437 -1.385 -4.905 1.00 0.00 C ATOM 1019 C THR A 70 19.210 -1.749 -3.436 1.00 0.00 C ATOM 1020 O THR A 70 18.076 -1.974 -3.019 1.00 0.00 O ATOM 1021 CB THR A 70 18.484 -0.261 -5.315 1.00 0.00 C ATOM 1022 OG1 THR A 70 18.463 0.763 -4.337 1.00 0.00 O ATOM 1023 CG2 THR A 70 17.059 -0.731 -5.519 1.00 0.00 C ATOM 0 H THR A 70 18.377 -2.517 -6.317 1.00 0.00 H new ATOM 0 HA THR A 70 20.465 -1.044 -5.028 1.00 0.00 H new ATOM 0 HB THR A 70 18.868 0.110 -6.265 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.849 1.472 -4.619 1.00 0.00 H new ATOM 0 HG21 THR A 70 16.435 0.115 -5.808 1.00 0.00 H new ATOM 0 HG22 THR A 70 17.034 -1.486 -6.305 1.00 0.00 H new ATOM 0 HG23 THR A 70 16.681 -1.160 -4.591 1.00 0.00 H new ATOM 1031 N PRO A 71 20.285 -1.816 -2.629 1.00 0.00 N ATOM 1032 CA PRO A 71 20.182 -2.162 -1.205 1.00 0.00 C ATOM 1033 C PRO A 71 19.232 -1.235 -0.453 1.00 0.00 C ATOM 1034 O PRO A 71 19.639 -0.187 0.050 1.00 0.00 O ATOM 1035 CB PRO A 71 21.616 -1.996 -0.689 1.00 0.00 C ATOM 1036 CG PRO A 71 22.474 -2.141 -1.898 1.00 0.00 C ATOM 1037 CD PRO A 71 21.678 -1.567 -3.036 1.00 0.00 C ATOM 0 HA PRO A 71 19.779 -3.164 -1.058 1.00 0.00 H new ATOM 0 HB2 PRO A 71 21.757 -1.023 -0.218 1.00 0.00 H new ATOM 0 HB3 PRO A 71 21.857 -2.750 0.060 1.00 0.00 H new ATOM 0 HG2 PRO A 71 23.418 -1.610 -1.774 1.00 0.00 H new ATOM 0 HG3 PRO A 71 22.719 -3.187 -2.081 1.00 0.00 H new ATOM 0 HD2 PRO A 71 21.875 -0.503 -3.169 1.00 0.00 H new ATOM 0 HD3 PRO A 71 21.915 -2.056 -3.981 1.00 0.00 H new ATOM 1045 N GLY A 72 17.962 -1.624 -0.382 1.00 0.00 N ATOM 1046 CA GLY A 72 16.975 -0.812 0.305 1.00 0.00 C ATOM 1047 C GLY A 72 16.498 -1.438 1.601 1.00 0.00 C ATOM 1048 O GLY A 72 16.370 -2.657 1.702 1.00 0.00 O ATOM 0 H GLY A 72 17.600 -2.487 -0.788 1.00 0.00 H new ATOM 0 HA2 GLY A 72 17.401 0.169 0.516 1.00 0.00 H new ATOM 0 HA3 GLY A 72 16.120 -0.653 -0.353 1.00 0.00 H new ATOM 1052 N SER A 73 16.213 -0.592 2.588 1.00 0.00 N ATOM 1053 CA SER A 73 15.724 -1.055 3.883 1.00 0.00 C ATOM 1054 C SER A 73 14.292 -1.577 3.766 1.00 0.00 C ATOM 1055 O SER A 73 13.763 -1.729 2.665 1.00 0.00 O ATOM 1056 CB SER A 73 15.795 0.081 4.914 1.00 0.00 C ATOM 1057 OG SER A 73 16.137 -0.406 6.203 1.00 0.00 O ATOM 0 H SER A 73 16.313 0.420 2.515 1.00 0.00 H new ATOM 0 HA SER A 73 16.360 -1.874 4.218 1.00 0.00 H new ATOM 0 HB2 SER A 73 16.532 0.818 4.595 1.00 0.00 H new ATOM 0 HB3 SER A 73 14.833 0.592 4.960 1.00 0.00 H new ATOM 0 HG SER A 73 16.176 0.342 6.835 1.00 0.00 H new ATOM 1063 N ALA A 74 13.677 -1.864 4.910 1.00 0.00 N ATOM 1064 CA ALA A 74 12.313 -2.387 4.952 1.00 0.00 C ATOM 1065 C ALA A 74 11.283 -1.352 4.484 1.00 0.00 C ATOM 1066 O ALA A 74 11.623 -0.399 3.786 1.00 0.00 O ATOM 1067 CB ALA A 74 11.991 -2.855 6.362 1.00 0.00 C ATOM 0 H ALA A 74 14.105 -1.742 5.828 1.00 0.00 H new ATOM 0 HA ALA A 74 12.255 -3.229 4.262 1.00 0.00 H new ATOM 0 HB1 ALA A 74 10.974 -3.245 6.393 1.00 0.00 H new ATOM 0 HB2 ALA A 74 12.689 -3.640 6.653 1.00 0.00 H new ATOM 0 HB3 ALA A 74 12.079 -2.016 7.053 1.00 0.00 H new ATOM 1073 N GLN A 75 10.021 -1.561 4.876 1.00 0.00 N ATOM 1074 CA GLN A 75 8.923 -0.659 4.505 1.00 0.00 C ATOM 1075 C GLN A 75 9.341 0.798 4.638 1.00 0.00 C ATOM 1076 O GLN A 75 9.168 1.595 3.712 1.00 0.00 O ATOM 1077 CB GLN A 75 7.705 -0.920 5.392 1.00 0.00 C ATOM 1078 CG GLN A 75 6.956 -2.191 5.040 1.00 0.00 C ATOM 1079 CD GLN A 75 7.304 -3.346 5.958 1.00 0.00 C ATOM 1080 OE1 GLN A 75 8.442 -3.814 5.983 1.00 0.00 O ATOM 1081 NE2 GLN A 75 6.321 -3.813 6.718 1.00 0.00 N ATOM 0 H GLN A 75 9.733 -2.351 5.453 1.00 0.00 H new ATOM 0 HA GLN A 75 8.667 -0.854 3.464 1.00 0.00 H new ATOM 0 HB2 GLN A 75 8.029 -0.975 6.431 1.00 0.00 H new ATOM 0 HB3 GLN A 75 7.023 -0.073 5.315 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.884 -2.002 5.090 1.00 0.00 H new ATOM 0 HG3 GLN A 75 7.183 -2.469 4.011 1.00 0.00 H new ATOM 0 HE21 GLN A 75 5.392 -3.394 6.665 1.00 0.00 H new ATOM 0 HE22 GLN A 75 6.494 -4.590 7.355 1.00 0.00 H new ATOM 1090 N GLN A 76 9.884 1.141 5.799 1.00 0.00 N ATOM 1091 CA GLN A 76 10.320 2.506 6.062 1.00 0.00 C ATOM 1092 C GLN A 76 11.145 3.039 4.895 1.00 0.00 C ATOM 1093 O GLN A 76 11.162 4.240 4.633 1.00 0.00 O ATOM 1094 CB GLN A 76 11.130 2.574 7.358 1.00 0.00 C ATOM 1095 CG GLN A 76 10.531 1.766 8.500 1.00 0.00 C ATOM 1096 CD GLN A 76 11.506 0.763 9.085 1.00 0.00 C ATOM 1097 OE1 GLN A 76 11.442 -0.429 8.785 1.00 0.00 O ATOM 1098 NE2 GLN A 76 12.416 1.242 9.924 1.00 0.00 N ATOM 0 H GLN A 76 10.033 0.493 6.573 1.00 0.00 H new ATOM 0 HA GLN A 76 9.434 3.130 6.175 1.00 0.00 H new ATOM 0 HB2 GLN A 76 12.141 2.216 7.163 1.00 0.00 H new ATOM 0 HB3 GLN A 76 11.215 3.616 7.668 1.00 0.00 H new ATOM 0 HG2 GLN A 76 10.201 2.446 9.286 1.00 0.00 H new ATOM 0 HG3 GLN A 76 9.647 1.239 8.142 1.00 0.00 H new ATOM 0 HE21 GLN A 76 12.432 2.238 10.144 1.00 0.00 H new ATOM 0 HE22 GLN A 76 13.099 0.614 10.348 1.00 0.00 H new ATOM 1107 N ARG A 77 11.823 2.136 4.190 1.00 0.00 N ATOM 1108 CA ARG A 77 12.640 2.522 3.047 1.00 0.00 C ATOM 1109 C ARG A 77 11.784 2.964 1.879 1.00 0.00 C ATOM 1110 O ARG A 77 12.081 3.956 1.218 1.00 0.00 O ATOM 1111 CB ARG A 77 13.522 1.370 2.575 1.00 0.00 C ATOM 1112 CG ARG A 77 14.448 1.772 1.441 1.00 0.00 C ATOM 1113 CD ARG A 77 15.433 2.836 1.892 1.00 0.00 C ATOM 1114 NE ARG A 77 16.462 3.094 0.891 1.00 0.00 N ATOM 1115 CZ ARG A 77 17.388 4.042 1.007 1.00 0.00 C ATOM 1116 NH1 ARG A 77 17.427 4.814 2.087 1.00 0.00 N ATOM 1117 NH2 ARG A 77 18.277 4.220 0.040 1.00 0.00 N ATOM 0 H ARG A 77 11.822 1.136 4.391 1.00 0.00 H new ATOM 0 HA ARG A 77 13.263 3.350 3.384 1.00 0.00 H new ATOM 0 HB2 ARG A 77 14.116 1.005 3.413 1.00 0.00 H new ATOM 0 HB3 ARG A 77 12.891 0.544 2.248 1.00 0.00 H new ATOM 0 HG2 ARG A 77 14.991 0.897 1.083 1.00 0.00 H new ATOM 0 HG3 ARG A 77 13.861 2.147 0.603 1.00 0.00 H new ATOM 0 HD2 ARG A 77 14.895 3.760 2.104 1.00 0.00 H new ATOM 0 HD3 ARG A 77 15.905 2.521 2.823 1.00 0.00 H new ATOM 0 HE ARG A 77 16.472 2.513 0.053 1.00 0.00 H new ATOM 0 HH11 ARG A 77 16.744 4.682 2.833 1.00 0.00 H new ATOM 0 HH12 ARG A 77 18.139 5.539 2.170 1.00 0.00 H new ATOM 0 HH21 ARG A 77 18.251 3.630 -0.792 1.00 0.00 H new ATOM 0 HH22 ARG A 77 18.987 4.947 0.128 1.00 0.00 H new ATOM 1131 N PHE A 78 10.722 2.215 1.619 1.00 0.00 N ATOM 1132 CA PHE A 78 9.828 2.516 0.513 1.00 0.00 C ATOM 1133 C PHE A 78 9.233 3.911 0.649 1.00 0.00 C ATOM 1134 O PHE A 78 9.324 4.725 -0.269 1.00 0.00 O ATOM 1135 CB PHE A 78 8.713 1.471 0.443 1.00 0.00 C ATOM 1136 CG PHE A 78 9.019 0.324 -0.475 1.00 0.00 C ATOM 1137 CD1 PHE A 78 9.634 0.537 -1.696 1.00 0.00 C ATOM 1138 CD2 PHE A 78 8.682 -0.966 -0.117 1.00 0.00 C ATOM 1139 CE1 PHE A 78 9.904 -0.522 -2.544 1.00 0.00 C ATOM 1140 CE2 PHE A 78 8.949 -2.028 -0.956 1.00 0.00 C ATOM 1141 CZ PHE A 78 9.559 -1.805 -2.170 1.00 0.00 C ATOM 0 H PHE A 78 10.459 1.392 2.161 1.00 0.00 H new ATOM 0 HA PHE A 78 10.407 2.486 -0.410 1.00 0.00 H new ATOM 0 HB2 PHE A 78 8.527 1.084 1.445 1.00 0.00 H new ATOM 0 HB3 PHE A 78 7.794 1.955 0.112 1.00 0.00 H new ATOM 0 HD1 PHE A 78 9.906 1.540 -1.990 1.00 0.00 H new ATOM 0 HD2 PHE A 78 8.202 -1.146 0.834 1.00 0.00 H new ATOM 0 HE1 PHE A 78 10.383 -0.345 -3.496 1.00 0.00 H new ATOM 0 HE2 PHE A 78 8.680 -3.032 -0.661 1.00 0.00 H new ATOM 0 HZ PHE A 78 9.768 -2.634 -2.830 1.00 0.00 H new ATOM 1151 N THR A 79 8.634 4.184 1.799 1.00 0.00 N ATOM 1152 CA THR A 79 8.036 5.490 2.048 1.00 0.00 C ATOM 1153 C THR A 79 9.064 6.595 1.809 1.00 0.00 C ATOM 1154 O THR A 79 8.868 7.476 0.966 1.00 0.00 O ATOM 1155 CB THR A 79 7.492 5.563 3.479 1.00 0.00 C ATOM 1156 OG1 THR A 79 8.313 4.828 4.368 1.00 0.00 O ATOM 1157 CG2 THR A 79 6.081 5.025 3.610 1.00 0.00 C ATOM 0 H THR A 79 8.549 3.523 2.571 1.00 0.00 H new ATOM 0 HA THR A 79 7.206 5.633 1.356 1.00 0.00 H new ATOM 0 HB THR A 79 7.487 6.623 3.731 1.00 0.00 H new ATOM 0 HG1 THR A 79 7.983 3.907 4.432 1.00 0.00 H new ATOM 0 HG21 THR A 79 5.756 5.106 4.647 1.00 0.00 H new ATOM 0 HG22 THR A 79 5.411 5.603 2.974 1.00 0.00 H new ATOM 0 HG23 THR A 79 6.060 3.979 3.303 1.00 0.00 H new ATOM 1165 N GLN A 80 10.171 6.529 2.552 1.00 0.00 N ATOM 1166 CA GLN A 80 11.248 7.509 2.430 1.00 0.00 C ATOM 1167 C GLN A 80 11.550 7.820 0.957 1.00 0.00 C ATOM 1168 O GLN A 80 11.807 8.970 0.599 1.00 0.00 O ATOM 1169 CB GLN A 80 12.513 6.998 3.131 1.00 0.00 C ATOM 1170 CG GLN A 80 12.401 6.966 4.650 1.00 0.00 C ATOM 1171 CD GLN A 80 13.608 6.336 5.320 1.00 0.00 C ATOM 1172 OE1 GLN A 80 14.046 5.196 4.802 1.00 0.00 O flip ATOM 1173 NE2 GLN A 80 14.138 6.866 6.296 1.00 0.00 N flip ATOM 0 H GLN A 80 10.344 5.803 3.247 1.00 0.00 H new ATOM 0 HA GLN A 80 10.921 8.431 2.912 1.00 0.00 H new ATOM 0 HB2 GLN A 80 12.737 5.994 2.771 1.00 0.00 H new ATOM 0 HB3 GLN A 80 13.354 7.632 2.851 1.00 0.00 H new ATOM 0 HG2 GLN A 80 12.276 7.983 5.021 1.00 0.00 H new ATOM 0 HG3 GLN A 80 11.506 6.412 4.931 1.00 0.00 H new ATOM 0 HE21 GLN A 80 13.769 7.743 6.663 1.00 0.00 H new ATOM 0 HE22 GLN A 80 14.946 6.428 6.738 1.00 0.00 H new ATOM 1182 N VAL A 81 11.497 6.792 0.106 1.00 0.00 N ATOM 1183 CA VAL A 81 11.746 6.966 -1.326 1.00 0.00 C ATOM 1184 C VAL A 81 10.689 7.884 -1.946 1.00 0.00 C ATOM 1185 O VAL A 81 11.017 8.821 -2.676 1.00 0.00 O ATOM 1186 CB VAL A 81 11.754 5.603 -2.069 1.00 0.00 C ATOM 1187 CG1 VAL A 81 11.796 5.786 -3.582 1.00 0.00 C ATOM 1188 CG2 VAL A 81 12.932 4.752 -1.614 1.00 0.00 C ATOM 0 H VAL A 81 11.285 5.834 0.383 1.00 0.00 H new ATOM 0 HA VAL A 81 12.730 7.423 -1.435 1.00 0.00 H new ATOM 0 HB VAL A 81 10.825 5.091 -1.818 1.00 0.00 H new ATOM 0 HG11 VAL A 81 11.800 4.810 -4.067 1.00 0.00 H new ATOM 0 HG12 VAL A 81 10.919 6.347 -3.905 1.00 0.00 H new ATOM 0 HG13 VAL A 81 12.698 6.332 -3.858 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.921 3.801 -2.146 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.864 5.276 -1.828 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.856 4.569 -0.542 1.00 0.00 H new ATOM 1198 N SER A 82 9.419 7.609 -1.647 1.00 0.00 N ATOM 1199 CA SER A 82 8.312 8.410 -2.171 1.00 0.00 C ATOM 1200 C SER A 82 8.576 9.900 -1.978 1.00 0.00 C ATOM 1201 O SER A 82 8.475 10.688 -2.918 1.00 0.00 O ATOM 1202 CB SER A 82 6.998 8.027 -1.480 1.00 0.00 C ATOM 1203 OG SER A 82 7.141 6.834 -0.729 1.00 0.00 O ATOM 0 H SER A 82 9.131 6.838 -1.045 1.00 0.00 H new ATOM 0 HA SER A 82 8.229 8.205 -3.238 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.680 8.837 -0.823 1.00 0.00 H new ATOM 0 HB3 SER A 82 6.216 7.897 -2.228 1.00 0.00 H new ATOM 0 HG SER A 82 7.511 7.045 0.153 1.00 0.00 H new ATOM 1209 N ASP A 83 8.907 10.275 -0.749 1.00 0.00 N ATOM 1210 CA ASP A 83 9.180 11.671 -0.424 1.00 0.00 C ATOM 1211 C ASP A 83 10.374 12.191 -1.216 1.00 0.00 C ATOM 1212 O ASP A 83 10.413 13.358 -1.619 1.00 0.00 O ATOM 1213 CB ASP A 83 9.445 11.821 1.073 1.00 0.00 C ATOM 1214 CG ASP A 83 8.367 11.174 1.917 1.00 0.00 C ATOM 1215 OD1 ASP A 83 7.302 11.799 2.100 1.00 0.00 O ATOM 1216 OD2 ASP A 83 8.586 10.040 2.395 1.00 0.00 O ATOM 0 H ASP A 83 8.993 9.633 0.039 1.00 0.00 H new ATOM 0 HA ASP A 83 8.304 12.260 -0.694 1.00 0.00 H new ATOM 0 HB2 ASP A 83 10.409 11.374 1.315 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.512 12.880 1.323 1.00 0.00 H new ATOM 1221 N GLU A 84 11.342 11.311 -1.445 1.00 0.00 N ATOM 1222 CA GLU A 84 12.537 11.675 -2.193 1.00 0.00 C ATOM 1223 C GLU A 84 12.159 12.317 -3.518 1.00 0.00 C ATOM 1224 O GLU A 84 12.551 13.446 -3.812 1.00 0.00 O ATOM 1225 CB GLU A 84 13.420 10.446 -2.436 1.00 0.00 C ATOM 1226 CG GLU A 84 14.832 10.594 -1.890 1.00 0.00 C ATOM 1227 CD GLU A 84 15.509 11.870 -2.355 1.00 0.00 C ATOM 1228 OE1 GLU A 84 15.133 12.384 -3.429 1.00 0.00 O ATOM 1229 OE2 GLU A 84 16.415 12.353 -1.645 1.00 0.00 O ATOM 0 H GLU A 84 11.322 10.343 -1.124 1.00 0.00 H new ATOM 0 HA GLU A 84 13.102 12.396 -1.602 1.00 0.00 H new ATOM 0 HB2 GLU A 84 12.951 9.576 -1.977 1.00 0.00 H new ATOM 0 HB3 GLU A 84 13.472 10.252 -3.507 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.799 10.581 -0.801 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.429 9.737 -2.201 1.00 0.00 H new ATOM 1236 N LEU A 85 11.400 11.585 -4.318 1.00 0.00 N ATOM 1237 CA LEU A 85 10.976 12.081 -5.613 1.00 0.00 C ATOM 1238 C LEU A 85 9.878 13.127 -5.474 1.00 0.00 C ATOM 1239 O LEU A 85 9.975 14.213 -6.046 1.00 0.00 O ATOM 1240 CB LEU A 85 10.504 10.930 -6.487 1.00 0.00 C ATOM 1241 CG LEU A 85 11.158 10.900 -7.859 1.00 0.00 C ATOM 1242 CD1 LEU A 85 10.802 9.618 -8.591 1.00 0.00 C ATOM 1243 CD2 LEU A 85 10.740 12.127 -8.651 1.00 0.00 C ATOM 0 H LEU A 85 11.067 10.648 -4.092 1.00 0.00 H new ATOM 0 HA LEU A 85 11.833 12.559 -6.088 1.00 0.00 H new ATOM 0 HB2 LEU A 85 10.708 9.989 -5.976 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.423 10.998 -6.610 1.00 0.00 H new ATOM 0 HG LEU A 85 12.242 10.919 -7.743 1.00 0.00 H new ATOM 0 HD11 LEU A 85 11.279 9.614 -9.571 1.00 0.00 H new ATOM 0 HD12 LEU A 85 11.150 8.761 -8.015 1.00 0.00 H new ATOM 0 HD13 LEU A 85 9.721 9.557 -8.714 1.00 0.00 H new ATOM 0 HD21 LEU A 85 11.210 12.103 -9.634 1.00 0.00 H new ATOM 0 HD22 LEU A 85 9.656 12.133 -8.767 1.00 0.00 H new ATOM 0 HD23 LEU A 85 11.053 13.026 -8.121 1.00 0.00 H new ATOM 1255 N PHE A 86 8.832 12.801 -4.718 1.00 0.00 N ATOM 1256 CA PHE A 86 7.714 13.722 -4.516 1.00 0.00 C ATOM 1257 C PHE A 86 8.190 15.100 -4.044 1.00 0.00 C ATOM 1258 O PHE A 86 7.416 16.050 -4.035 1.00 0.00 O ATOM 1259 CB PHE A 86 6.751 13.126 -3.494 1.00 0.00 C ATOM 1260 CG PHE A 86 5.542 13.971 -3.222 1.00 0.00 C ATOM 1261 CD1 PHE A 86 5.601 15.016 -2.316 1.00 0.00 C ATOM 1262 CD2 PHE A 86 4.343 13.708 -3.862 1.00 0.00 C ATOM 1263 CE1 PHE A 86 4.485 15.788 -2.056 1.00 0.00 C ATOM 1264 CE2 PHE A 86 3.222 14.474 -3.604 1.00 0.00 C ATOM 1265 CZ PHE A 86 3.294 15.515 -2.700 1.00 0.00 C ATOM 0 H PHE A 86 8.734 11.908 -4.236 1.00 0.00 H new ATOM 0 HA PHE A 86 7.209 13.860 -5.472 1.00 0.00 H new ATOM 0 HB2 PHE A 86 6.425 12.148 -3.847 1.00 0.00 H new ATOM 0 HB3 PHE A 86 7.286 12.965 -2.558 1.00 0.00 H new ATOM 0 HD1 PHE A 86 6.529 15.230 -1.807 1.00 0.00 H new ATOM 0 HD2 PHE A 86 4.283 12.895 -4.571 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.544 16.604 -1.350 1.00 0.00 H new ATOM 0 HE2 PHE A 86 2.292 14.259 -4.108 1.00 0.00 H new ATOM 0 HZ PHE A 86 2.420 16.115 -2.497 1.00 0.00 H new ATOM 1275 N GLN A 87 9.464 15.196 -3.669 1.00 0.00 N ATOM 1276 CA GLN A 87 10.062 16.449 -3.216 1.00 0.00 C ATOM 1277 C GLN A 87 9.678 17.620 -4.128 1.00 0.00 C ATOM 1278 O GLN A 87 10.440 17.997 -5.018 1.00 0.00 O ATOM 1279 CB GLN A 87 11.583 16.303 -3.160 1.00 0.00 C ATOM 1280 CG GLN A 87 12.291 17.450 -2.456 1.00 0.00 C ATOM 1281 CD GLN A 87 13.464 18.011 -3.247 1.00 0.00 C ATOM 1282 OE1 GLN A 87 14.131 17.163 -4.022 1.00 0.00 O flip ATOM 1283 NE2 GLN A 87 13.769 19.200 -3.156 1.00 0.00 N flip ATOM 0 H GLN A 87 10.110 14.407 -3.671 1.00 0.00 H new ATOM 0 HA GLN A 87 9.678 16.667 -2.219 1.00 0.00 H new ATOM 0 HB2 GLN A 87 11.829 15.371 -2.651 1.00 0.00 H new ATOM 0 HB3 GLN A 87 11.967 16.222 -4.177 1.00 0.00 H new ATOM 0 HG2 GLN A 87 11.574 18.249 -2.267 1.00 0.00 H new ATOM 0 HG3 GLN A 87 12.648 17.106 -1.485 1.00 0.00 H new ATOM 0 HE21 GLN A 87 13.231 19.819 -2.550 1.00 0.00 H new ATOM 0 HE22 GLN A 87 14.559 19.566 -3.687 1.00 0.00 H new ATOM 1292 N GLY A 88 8.496 18.187 -3.909 1.00 0.00 N ATOM 1293 CA GLY A 88 8.033 19.300 -4.725 1.00 0.00 C ATOM 1294 C GLY A 88 7.211 18.854 -5.920 1.00 0.00 C ATOM 1295 O GLY A 88 7.155 19.538 -6.940 1.00 0.00 O ATOM 0 H GLY A 88 7.847 17.896 -3.178 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.435 19.971 -4.109 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.894 19.870 -5.075 1.00 0.00 H new ATOM 1299 N GLY A 89 6.569 17.699 -5.779 1.00 0.00 N ATOM 1300 CA GLY A 89 5.741 17.158 -6.839 1.00 0.00 C ATOM 1301 C GLY A 89 4.416 16.642 -6.309 1.00 0.00 C ATOM 1302 O GLY A 89 4.233 15.432 -6.165 1.00 0.00 O ATOM 0 H GLY A 89 6.609 17.123 -4.938 1.00 0.00 H new ATOM 0 HA2 GLY A 89 5.558 17.929 -7.587 1.00 0.00 H new ATOM 0 HA3 GLY A 89 6.273 16.349 -7.339 1.00 0.00 H new ATOM 1306 N PRO A 90 3.466 17.542 -5.997 1.00 0.00 N ATOM 1307 CA PRO A 90 2.147 17.160 -5.465 1.00 0.00 C ATOM 1308 C PRO A 90 1.281 16.450 -6.499 1.00 0.00 C ATOM 1309 O PRO A 90 0.137 16.833 -6.733 1.00 0.00 O ATOM 1310 CB PRO A 90 1.519 18.499 -5.074 1.00 0.00 C ATOM 1311 CG PRO A 90 2.207 19.510 -5.921 1.00 0.00 C ATOM 1312 CD PRO A 90 3.606 19.004 -6.129 1.00 0.00 C ATOM 0 HA PRO A 90 2.235 16.455 -4.638 1.00 0.00 H new ATOM 0 HB2 PRO A 90 0.444 18.498 -5.255 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.664 18.708 -4.014 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.693 19.634 -6.874 1.00 0.00 H new ATOM 0 HG3 PRO A 90 2.215 20.485 -5.434 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.992 19.283 -7.109 1.00 0.00 H new ATOM 0 HD3 PRO A 90 4.294 19.410 -5.388 1.00 0.00 H new ATOM 1320 N ASN A 91 1.833 15.413 -7.116 1.00 0.00 N ATOM 1321 CA ASN A 91 1.112 14.652 -8.127 1.00 0.00 C ATOM 1322 C ASN A 91 0.346 13.490 -7.501 1.00 0.00 C ATOM 1323 O ASN A 91 0.630 13.075 -6.379 1.00 0.00 O ATOM 1324 CB ASN A 91 2.085 14.126 -9.185 1.00 0.00 C ATOM 1325 CG ASN A 91 3.180 15.125 -9.517 1.00 0.00 C ATOM 1326 OD1 ASN A 91 4.273 15.076 -8.951 1.00 0.00 O ATOM 1327 ND2 ASN A 91 2.890 16.040 -10.436 1.00 0.00 N ATOM 0 H ASN A 91 2.779 15.080 -6.933 1.00 0.00 H new ATOM 0 HA ASN A 91 0.392 15.319 -8.600 1.00 0.00 H new ATOM 0 HB2 ASN A 91 2.538 13.201 -8.829 1.00 0.00 H new ATOM 0 HB3 ASN A 91 1.533 13.882 -10.093 1.00 0.00 H new ATOM 0 HD21 ASN A 91 3.586 16.738 -10.698 1.00 0.00 H new ATOM 0 HD22 ASN A 91 1.972 16.044 -10.880 1.00 0.00 H new ATOM 1334 N TRP A 92 -0.617 12.963 -8.248 1.00 0.00 N ATOM 1335 CA TRP A 92 -1.424 11.835 -7.781 1.00 0.00 C ATOM 1336 C TRP A 92 -0.588 10.560 -7.757 1.00 0.00 C ATOM 1337 O TRP A 92 -0.846 9.652 -6.974 1.00 0.00 O ATOM 1338 CB TRP A 92 -2.663 11.643 -8.668 1.00 0.00 C ATOM 1339 CG TRP A 92 -2.917 12.798 -9.585 1.00 0.00 C ATOM 1340 CD1 TRP A 92 -3.370 14.040 -9.238 1.00 0.00 C ATOM 1341 CD2 TRP A 92 -2.704 12.829 -11.000 1.00 0.00 C ATOM 1342 NE1 TRP A 92 -3.458 14.837 -10.350 1.00 0.00 N ATOM 1343 CE2 TRP A 92 -3.055 14.116 -11.446 1.00 0.00 C ATOM 1344 CE3 TRP A 92 -2.254 11.891 -11.934 1.00 0.00 C ATOM 1345 CZ2 TRP A 92 -2.968 14.488 -12.784 1.00 0.00 C ATOM 1346 CZ3 TRP A 92 -2.169 12.262 -13.262 1.00 0.00 C ATOM 1347 CH2 TRP A 92 -2.523 13.551 -13.676 1.00 0.00 C ATOM 0 H TRP A 92 -0.860 13.297 -9.181 1.00 0.00 H new ATOM 0 HA TRP A 92 -1.761 12.054 -6.768 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -2.540 10.737 -9.261 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -3.536 11.493 -8.033 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -3.622 14.349 -8.234 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -3.772 15.807 -10.361 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -1.978 10.894 -11.623 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -3.242 15.481 -13.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -1.824 11.546 -13.993 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -2.443 13.811 -14.721 1.00 0.00 H new ATOM 1358 N GLY A 93 0.413 10.501 -8.627 1.00 0.00 N ATOM 1359 CA GLY A 93 1.279 9.336 -8.690 1.00 0.00 C ATOM 1360 C GLY A 93 1.657 8.833 -7.307 1.00 0.00 C ATOM 1361 O GLY A 93 1.450 7.665 -6.981 1.00 0.00 O ATOM 0 H GLY A 93 0.642 11.240 -9.292 1.00 0.00 H new ATOM 0 HA2 GLY A 93 0.777 8.540 -9.241 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.183 9.586 -9.245 1.00 0.00 H new ATOM 1365 N ARG A 94 2.191 9.736 -6.489 1.00 0.00 N ATOM 1366 CA ARG A 94 2.587 9.402 -5.121 1.00 0.00 C ATOM 1367 C ARG A 94 1.423 8.823 -4.334 1.00 0.00 C ATOM 1368 O ARG A 94 1.627 8.102 -3.362 1.00 0.00 O ATOM 1369 CB ARG A 94 3.141 10.636 -4.406 1.00 0.00 C ATOM 1370 CG ARG A 94 4.287 10.320 -3.453 1.00 0.00 C ATOM 1371 CD ARG A 94 3.929 10.626 -2.004 1.00 0.00 C ATOM 1372 NE ARG A 94 2.618 10.098 -1.635 1.00 0.00 N ATOM 1373 CZ ARG A 94 2.242 9.833 -0.385 1.00 0.00 C ATOM 1374 NH1 ARG A 94 3.063 10.069 0.629 1.00 0.00 N ATOM 1375 NH2 ARG A 94 1.036 9.335 -0.151 1.00 0.00 N ATOM 0 H ARG A 94 2.360 10.708 -6.749 1.00 0.00 H new ATOM 0 HA ARG A 94 3.369 8.644 -5.179 1.00 0.00 H new ATOM 0 HB2 ARG A 94 3.485 11.354 -5.150 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.336 11.115 -3.848 1.00 0.00 H new ATOM 0 HG2 ARG A 94 4.555 9.267 -3.545 1.00 0.00 H new ATOM 0 HG3 ARG A 94 5.165 10.899 -3.739 1.00 0.00 H new ATOM 0 HD2 ARG A 94 4.688 10.201 -1.347 1.00 0.00 H new ATOM 0 HD3 ARG A 94 3.941 11.705 -1.849 1.00 0.00 H new ATOM 0 HE ARG A 94 1.947 9.921 -2.383 1.00 0.00 H new ATOM 0 HH11 ARG A 94 3.990 10.456 0.455 1.00 0.00 H new ATOM 0 HH12 ARG A 94 2.767 9.863 1.583 1.00 0.00 H new ATOM 0 HH21 ARG A 94 0.399 9.156 -0.927 1.00 0.00 H new ATOM 0 HH22 ARG A 94 0.745 9.131 0.805 1.00 0.00 H new ATOM 1389 N LEU A 95 0.202 9.136 -4.748 1.00 0.00 N ATOM 1390 CA LEU A 95 -0.977 8.630 -4.060 1.00 0.00 C ATOM 1391 C LEU A 95 -1.164 7.141 -4.333 1.00 0.00 C ATOM 1392 O LEU A 95 -1.234 6.340 -3.407 1.00 0.00 O ATOM 1393 CB LEU A 95 -2.233 9.400 -4.486 1.00 0.00 C ATOM 1394 CG LEU A 95 -2.743 10.419 -3.472 1.00 0.00 C ATOM 1395 CD1 LEU A 95 -1.676 11.463 -3.184 1.00 0.00 C ATOM 1396 CD2 LEU A 95 -4.014 11.075 -3.987 1.00 0.00 C ATOM 0 H LEU A 95 0.003 9.733 -5.551 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.825 8.776 -2.990 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.023 9.917 -5.423 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.029 8.683 -4.689 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.972 9.903 -2.539 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -2.057 12.182 -2.459 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.789 10.975 -2.780 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.416 11.982 -4.107 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.371 11.801 -3.256 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.806 11.581 -4.930 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.778 10.314 -4.145 1.00 0.00 H new ATOM 1408 N VAL A 96 -1.247 6.781 -5.610 1.00 0.00 N ATOM 1409 CA VAL A 96 -1.436 5.390 -6.002 1.00 0.00 C ATOM 1410 C VAL A 96 -0.239 4.525 -5.603 1.00 0.00 C ATOM 1411 O VAL A 96 -0.407 3.376 -5.193 1.00 0.00 O ATOM 1412 CB VAL A 96 -1.685 5.265 -7.525 1.00 0.00 C ATOM 1413 CG1 VAL A 96 -2.274 3.909 -7.874 1.00 0.00 C ATOM 1414 CG2 VAL A 96 -2.601 6.378 -8.013 1.00 0.00 C ATOM 0 H VAL A 96 -1.186 7.434 -6.391 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.316 5.029 -5.470 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.723 5.359 -8.028 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.438 3.850 -8.950 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.584 3.123 -7.568 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.223 3.780 -7.354 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.763 6.272 -9.086 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.557 6.316 -7.494 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.140 7.344 -7.810 1.00 0.00 H new ATOM 1424 N ALA A 97 0.967 5.078 -5.720 1.00 0.00 N ATOM 1425 CA ALA A 97 2.184 4.346 -5.366 1.00 0.00 C ATOM 1426 C ALA A 97 2.314 4.177 -3.858 1.00 0.00 C ATOM 1427 O ALA A 97 2.209 3.075 -3.333 1.00 0.00 O ATOM 1428 CB ALA A 97 3.411 5.059 -5.912 1.00 0.00 C ATOM 0 H ALA A 97 1.128 6.027 -6.056 1.00 0.00 H new ATOM 0 HA ALA A 97 2.114 3.355 -5.815 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.307 4.501 -5.640 1.00 0.00 H new ATOM 0 HB2 ALA A 97 3.340 5.125 -6.998 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.466 6.063 -5.490 1.00 0.00 H new ATOM 1434 N PHE A 98 2.551 5.277 -3.162 1.00 0.00 N ATOM 1435 CA PHE A 98 2.699 5.247 -1.714 1.00 0.00 C ATOM 1436 C PHE A 98 1.605 4.391 -1.066 1.00 0.00 C ATOM 1437 O PHE A 98 1.820 3.778 -0.019 1.00 0.00 O ATOM 1438 CB PHE A 98 2.660 6.673 -1.169 1.00 0.00 C ATOM 1439 CG PHE A 98 2.654 6.750 0.324 1.00 0.00 C ATOM 1440 CD1 PHE A 98 1.506 6.457 1.034 1.00 0.00 C ATOM 1441 CD2 PHE A 98 3.796 7.116 1.014 1.00 0.00 C ATOM 1442 CE1 PHE A 98 1.495 6.527 2.409 1.00 0.00 C ATOM 1443 CE2 PHE A 98 3.792 7.188 2.389 1.00 0.00 C ATOM 1444 CZ PHE A 98 2.640 6.892 3.086 1.00 0.00 C ATOM 0 H PHE A 98 2.645 6.204 -3.576 1.00 0.00 H new ATOM 0 HA PHE A 98 3.660 4.795 -1.468 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.523 7.220 -1.548 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.771 7.174 -1.553 1.00 0.00 H new ATOM 0 HD1 PHE A 98 0.609 6.170 0.506 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.699 7.347 0.469 1.00 0.00 H new ATOM 0 HE1 PHE A 98 0.593 6.297 2.956 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.688 7.475 2.919 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.634 6.946 4.165 1.00 0.00 H new ATOM 1454 N PHE A 99 0.435 4.352 -1.698 1.00 0.00 N ATOM 1455 CA PHE A 99 -0.688 3.570 -1.190 1.00 0.00 C ATOM 1456 C PHE A 99 -0.430 2.074 -1.343 1.00 0.00 C ATOM 1457 O PHE A 99 -0.431 1.333 -0.359 1.00 0.00 O ATOM 1458 CB PHE A 99 -1.976 3.950 -1.923 1.00 0.00 C ATOM 1459 CG PHE A 99 -3.190 3.978 -1.042 1.00 0.00 C ATOM 1460 CD1 PHE A 99 -3.283 4.881 0.005 1.00 0.00 C ATOM 1461 CD2 PHE A 99 -4.241 3.105 -1.264 1.00 0.00 C ATOM 1462 CE1 PHE A 99 -4.402 4.911 0.814 1.00 0.00 C ATOM 1463 CE2 PHE A 99 -5.363 3.130 -0.459 1.00 0.00 C ATOM 1464 CZ PHE A 99 -5.444 4.034 0.582 1.00 0.00 C ATOM 0 H PHE A 99 0.240 4.854 -2.564 1.00 0.00 H new ATOM 0 HA PHE A 99 -0.798 3.795 -0.129 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.847 4.932 -2.379 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.144 3.241 -2.734 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -2.471 5.569 0.190 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -4.183 2.396 -2.076 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.462 5.619 1.627 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -6.176 2.443 -0.643 1.00 0.00 H new ATOM 0 HZ PHE A 99 -6.320 4.055 1.213 1.00 0.00 H new ATOM 1474 N VAL A 100 -0.213 1.630 -2.584 1.00 0.00 N ATOM 1475 CA VAL A 100 0.039 0.213 -2.852 1.00 0.00 C ATOM 1476 C VAL A 100 1.116 -0.328 -1.931 1.00 0.00 C ATOM 1477 O VAL A 100 1.082 -1.488 -1.541 1.00 0.00 O ATOM 1478 CB VAL A 100 0.470 -0.046 -4.313 1.00 0.00 C ATOM 1479 CG1 VAL A 100 1.689 0.779 -4.677 1.00 0.00 C ATOM 1480 CG2 VAL A 100 0.739 -1.530 -4.542 1.00 0.00 C ATOM 0 H VAL A 100 -0.207 2.226 -3.412 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.906 -0.300 -2.672 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.350 0.259 -4.963 1.00 0.00 H new ATOM 0 HG11 VAL A 100 1.970 0.577 -5.711 1.00 0.00 H new ATOM 0 HG12 VAL A 100 1.458 1.838 -4.564 1.00 0.00 H new ATOM 0 HG13 VAL A 100 2.516 0.516 -4.018 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.041 -1.690 -5.577 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.536 -1.862 -3.876 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -0.167 -2.100 -4.336 1.00 0.00 H new ATOM 1490 N PHE A 101 2.070 0.518 -1.582 1.00 0.00 N ATOM 1491 CA PHE A 101 3.144 0.101 -0.704 1.00 0.00 C ATOM 1492 C PHE A 101 2.633 -0.067 0.724 1.00 0.00 C ATOM 1493 O PHE A 101 2.657 -1.167 1.270 1.00 0.00 O ATOM 1494 CB PHE A 101 4.313 1.094 -0.748 1.00 0.00 C ATOM 1495 CG PHE A 101 5.356 0.758 -1.775 1.00 0.00 C ATOM 1496 CD1 PHE A 101 5.729 -0.556 -2.009 1.00 0.00 C ATOM 1497 CD2 PHE A 101 5.969 1.764 -2.502 1.00 0.00 C ATOM 1498 CE1 PHE A 101 6.694 -0.857 -2.950 1.00 0.00 C ATOM 1499 CE2 PHE A 101 6.934 1.468 -3.443 1.00 0.00 C ATOM 1500 CZ PHE A 101 7.298 0.157 -3.667 1.00 0.00 C ATOM 0 H PHE A 101 2.121 1.489 -1.891 1.00 0.00 H new ATOM 0 HA PHE A 101 3.512 -0.863 -1.056 1.00 0.00 H new ATOM 0 HB2 PHE A 101 3.923 2.091 -0.953 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.783 1.131 0.235 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.260 -1.352 -1.450 1.00 0.00 H new ATOM 0 HD2 PHE A 101 5.689 2.793 -2.331 1.00 0.00 H new ATOM 0 HE1 PHE A 101 6.976 -1.885 -3.125 1.00 0.00 H new ATOM 0 HE2 PHE A 101 7.404 2.263 -4.004 1.00 0.00 H new ATOM 0 HZ PHE A 101 8.054 -0.076 -4.402 1.00 0.00 H new ATOM 1510 N GLY A 102 2.151 1.021 1.318 1.00 0.00 N ATOM 1511 CA GLY A 102 1.631 0.960 2.670 1.00 0.00 C ATOM 1512 C GLY A 102 0.667 -0.190 2.882 1.00 0.00 C ATOM 1513 O GLY A 102 0.802 -0.943 3.839 1.00 0.00 O ATOM 0 H GLY A 102 2.112 1.944 0.886 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.462 0.864 3.369 1.00 0.00 H new ATOM 0 HA3 GLY A 102 1.126 1.898 2.902 1.00 0.00 H new ATOM 1517 N ALA A 103 -0.312 -0.320 1.993 1.00 0.00 N ATOM 1518 CA ALA A 103 -1.306 -1.385 2.104 1.00 0.00 C ATOM 1519 C ALA A 103 -0.687 -2.768 1.902 1.00 0.00 C ATOM 1520 O ALA A 103 -0.743 -3.613 2.795 1.00 0.00 O ATOM 1521 CB ALA A 103 -2.438 -1.161 1.111 1.00 0.00 C ATOM 0 H ALA A 103 -0.440 0.296 1.190 1.00 0.00 H new ATOM 0 HA ALA A 103 -1.708 -1.351 3.117 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.170 -1.963 1.207 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.919 -0.205 1.317 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -2.037 -1.155 0.097 1.00 0.00 H new ATOM 1527 N ALA A 104 -0.111 -3.003 0.726 1.00 0.00 N ATOM 1528 CA ALA A 104 0.496 -4.297 0.421 1.00 0.00 C ATOM 1529 C ALA A 104 1.505 -4.710 1.483 1.00 0.00 C ATOM 1530 O ALA A 104 1.391 -5.783 2.075 1.00 0.00 O ATOM 1531 CB ALA A 104 1.155 -4.276 -0.952 1.00 0.00 C ATOM 0 H ALA A 104 -0.051 -2.319 -0.028 1.00 0.00 H new ATOM 0 HA ALA A 104 -0.305 -5.036 0.415 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.600 -5.250 -1.157 1.00 0.00 H new ATOM 0 HB2 ALA A 104 0.406 -4.052 -1.712 1.00 0.00 H new ATOM 0 HB3 ALA A 104 1.931 -3.511 -0.971 1.00 0.00 H new ATOM 1537 N LEU A 105 2.494 -3.862 1.718 1.00 0.00 N ATOM 1538 CA LEU A 105 3.520 -4.156 2.708 1.00 0.00 C ATOM 1539 C LEU A 105 2.906 -4.457 4.058 1.00 0.00 C ATOM 1540 O LEU A 105 3.020 -5.573 4.565 1.00 0.00 O ATOM 1541 CB LEU A 105 4.479 -2.991 2.848 1.00 0.00 C ATOM 1542 CG LEU A 105 5.634 -2.999 1.863 1.00 0.00 C ATOM 1543 CD1 LEU A 105 6.367 -1.674 1.922 1.00 0.00 C ATOM 1544 CD2 LEU A 105 6.566 -4.166 2.162 1.00 0.00 C ATOM 0 H LEU A 105 2.609 -2.968 1.240 1.00 0.00 H new ATOM 0 HA LEU A 105 4.064 -5.035 2.361 1.00 0.00 H new ATOM 0 HB2 LEU A 105 3.922 -2.062 2.726 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.883 -2.990 3.861 1.00 0.00 H new ATOM 0 HG LEU A 105 5.251 -3.129 0.851 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.195 -1.684 1.213 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.681 -0.867 1.666 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.753 -1.516 2.929 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.392 -4.164 1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.959 -4.068 3.174 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.015 -5.103 2.076 1.00 0.00 H new ATOM 1556 N CYS A 106 2.257 -3.453 4.647 1.00 0.00 N ATOM 1557 CA CYS A 106 1.627 -3.624 5.946 1.00 0.00 C ATOM 1558 C CYS A 106 0.926 -4.973 6.017 1.00 0.00 C ATOM 1559 O CYS A 106 1.238 -5.794 6.872 1.00 0.00 O ATOM 1560 CB CYS A 106 0.627 -2.502 6.227 1.00 0.00 C ATOM 1561 SG CYS A 106 1.250 -1.215 7.333 1.00 0.00 S ATOM 0 H CYS A 106 2.157 -2.521 4.245 1.00 0.00 H new ATOM 0 HA CYS A 106 2.408 -3.584 6.706 1.00 0.00 H new ATOM 0 HB2 CYS A 106 0.337 -2.044 5.282 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -0.274 -2.934 6.662 1.00 0.00 H new ATOM 0 HG CYS A 106 0.251 -0.630 7.924 1.00 0.00 H new ATOM 1567 N ALA A 107 0.003 -5.203 5.088 1.00 0.00 N ATOM 1568 CA ALA A 107 -0.731 -6.465 5.031 1.00 0.00 C ATOM 1569 C ALA A 107 0.210 -7.665 5.115 1.00 0.00 C ATOM 1570 O ALA A 107 0.076 -8.509 5.998 1.00 0.00 O ATOM 1571 CB ALA A 107 -1.563 -6.532 3.760 1.00 0.00 C ATOM 0 H ALA A 107 -0.255 -4.533 4.364 1.00 0.00 H new ATOM 0 HA ALA A 107 -1.396 -6.505 5.894 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -2.105 -7.477 3.729 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -2.274 -5.706 3.746 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -0.908 -6.461 2.892 1.00 0.00 H new ATOM 1577 N GLU A 108 1.154 -7.743 4.184 1.00 0.00 N ATOM 1578 CA GLU A 108 2.107 -8.850 4.164 1.00 0.00 C ATOM 1579 C GLU A 108 2.804 -8.983 5.511 1.00 0.00 C ATOM 1580 O GLU A 108 2.898 -10.074 6.072 1.00 0.00 O ATOM 1581 CB GLU A 108 3.141 -8.653 3.054 1.00 0.00 C ATOM 1582 CG GLU A 108 2.802 -9.406 1.779 1.00 0.00 C ATOM 1583 CD GLU A 108 3.802 -10.498 1.461 1.00 0.00 C ATOM 1584 OE1 GLU A 108 5.018 -10.259 1.627 1.00 0.00 O ATOM 1585 OE2 GLU A 108 3.374 -11.596 1.046 1.00 0.00 O ATOM 0 H GLU A 108 1.281 -7.059 3.438 1.00 0.00 H new ATOM 0 HA GLU A 108 1.554 -9.768 3.965 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.225 -7.590 2.829 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.117 -8.980 3.413 1.00 0.00 H new ATOM 0 HG2 GLU A 108 1.809 -9.845 1.875 1.00 0.00 H new ATOM 0 HG3 GLU A 108 2.761 -8.703 0.947 1.00 0.00 H new ATOM 1592 N SER A 109 3.285 -7.860 6.023 1.00 0.00 N ATOM 1593 CA SER A 109 3.972 -7.834 7.304 1.00 0.00 C ATOM 1594 C SER A 109 3.002 -8.109 8.466 1.00 0.00 C ATOM 1595 O SER A 109 3.432 -8.383 9.585 1.00 0.00 O ATOM 1596 CB SER A 109 4.662 -6.477 7.482 1.00 0.00 C ATOM 1597 OG SER A 109 4.821 -6.157 8.850 1.00 0.00 O ATOM 0 H SER A 109 3.211 -6.950 5.567 1.00 0.00 H new ATOM 0 HA SER A 109 4.722 -8.625 7.315 1.00 0.00 H new ATOM 0 HB2 SER A 109 5.637 -6.496 6.995 1.00 0.00 H new ATOM 0 HB3 SER A 109 4.075 -5.701 6.991 1.00 0.00 H new ATOM 0 HG SER A 109 5.332 -5.325 8.934 1.00 0.00 H new ATOM 1603 N VAL A 110 1.694 -8.046 8.194 1.00 0.00 N ATOM 1604 CA VAL A 110 0.679 -8.297 9.225 1.00 0.00 C ATOM 1605 C VAL A 110 0.532 -9.798 9.490 1.00 0.00 C ATOM 1606 O VAL A 110 0.733 -10.257 10.612 1.00 0.00 O ATOM 1607 CB VAL A 110 -0.703 -7.701 8.841 1.00 0.00 C ATOM 1608 CG1 VAL A 110 -1.812 -8.267 9.721 1.00 0.00 C ATOM 1609 CG2 VAL A 110 -0.692 -6.181 8.943 1.00 0.00 C ATOM 0 H VAL A 110 1.314 -7.825 7.274 1.00 0.00 H new ATOM 0 HA VAL A 110 1.023 -7.800 10.132 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.900 -7.983 7.807 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.767 -7.831 9.428 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.855 -9.349 9.601 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.608 -8.026 10.764 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.672 -5.791 8.669 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.458 -5.887 9.966 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.062 -5.776 8.267 1.00 0.00 H new ATOM 1619 N ASN A 111 0.148 -10.551 8.459 1.00 0.00 N ATOM 1620 CA ASN A 111 -0.046 -11.998 8.589 1.00 0.00 C ATOM 1621 C ASN A 111 1.101 -12.655 9.346 1.00 0.00 C ATOM 1622 O ASN A 111 0.895 -13.590 10.121 1.00 0.00 O ATOM 1623 CB ASN A 111 -0.196 -12.645 7.210 1.00 0.00 C ATOM 1624 CG ASN A 111 -1.609 -13.131 6.954 1.00 0.00 C ATOM 1625 OD1 ASN A 111 -2.545 -12.339 6.894 1.00 0.00 O ATOM 1626 ND2 ASN A 111 -1.769 -14.441 6.806 1.00 0.00 N ATOM 0 H ASN A 111 -0.035 -10.185 7.525 1.00 0.00 H new ATOM 0 HA ASN A 111 -0.961 -12.153 9.161 1.00 0.00 H new ATOM 0 HB2 ASN A 111 0.083 -11.925 6.441 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.495 -13.484 7.127 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -2.698 -14.825 6.635 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -0.963 -15.063 6.863 1.00 0.00 H new ATOM 1633 N LYS A 112 2.311 -12.158 9.122 1.00 0.00 N ATOM 1634 CA LYS A 112 3.498 -12.692 9.781 1.00 0.00 C ATOM 1635 C LYS A 112 3.564 -12.268 11.254 1.00 0.00 C ATOM 1636 O LYS A 112 4.565 -12.508 11.930 1.00 0.00 O ATOM 1637 CB LYS A 112 4.752 -12.222 9.038 1.00 0.00 C ATOM 1638 CG LYS A 112 5.538 -13.342 8.369 1.00 0.00 C ATOM 1639 CD LYS A 112 7.034 -13.046 8.391 1.00 0.00 C ATOM 1640 CE LYS A 112 7.863 -14.219 8.904 1.00 0.00 C ATOM 1641 NZ LYS A 112 7.368 -14.760 10.204 1.00 0.00 N ATOM 0 H LYS A 112 2.497 -11.382 8.486 1.00 0.00 H new ATOM 0 HA LYS A 112 3.443 -13.780 9.754 1.00 0.00 H new ATOM 0 HB2 LYS A 112 4.460 -11.495 8.280 1.00 0.00 H new ATOM 0 HB3 LYS A 112 5.405 -11.705 9.741 1.00 0.00 H new ATOM 0 HG2 LYS A 112 5.342 -14.285 8.880 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.202 -13.462 7.339 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.363 -12.788 7.385 1.00 0.00 H new ATOM 0 HD3 LYS A 112 7.218 -12.175 9.020 1.00 0.00 H new ATOM 0 HE2 LYS A 112 7.856 -15.015 8.159 1.00 0.00 H new ATOM 0 HE3 LYS A 112 8.899 -13.901 9.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 8.163 -15.168 10.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 6.938 -13.992 10.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.657 -15.497 10.025 1.00 0.00 H new ATOM 1655 N GLU A 113 2.498 -11.638 11.747 1.00 0.00 N ATOM 1656 CA GLU A 113 2.435 -11.184 13.137 1.00 0.00 C ATOM 1657 C GLU A 113 3.482 -10.107 13.403 1.00 0.00 C ATOM 1658 O GLU A 113 3.975 -9.960 14.520 1.00 0.00 O ATOM 1659 CB GLU A 113 2.621 -12.371 14.086 1.00 0.00 C ATOM 1660 CG GLU A 113 2.477 -12.019 15.558 1.00 0.00 C ATOM 1661 CD GLU A 113 3.167 -13.022 16.460 1.00 0.00 C ATOM 1662 OE1 GLU A 113 4.377 -12.853 16.718 1.00 0.00 O ATOM 1663 OE2 GLU A 113 2.499 -13.978 16.905 1.00 0.00 O ATOM 0 H GLU A 113 1.662 -11.429 11.201 1.00 0.00 H new ATOM 0 HA GLU A 113 1.453 -10.746 13.316 1.00 0.00 H new ATOM 0 HB2 GLU A 113 1.891 -13.141 13.835 1.00 0.00 H new ATOM 0 HB3 GLU A 113 3.609 -12.802 13.922 1.00 0.00 H new ATOM 0 HG2 GLU A 113 2.894 -11.028 15.735 1.00 0.00 H new ATOM 0 HG3 GLU A 113 1.419 -11.970 15.816 1.00 0.00 H new ATOM 1670 N MET A 114 3.816 -9.349 12.367 1.00 0.00 N ATOM 1671 CA MET A 114 4.799 -8.288 12.493 1.00 0.00 C ATOM 1672 C MET A 114 4.108 -6.931 12.616 1.00 0.00 C ATOM 1673 O MET A 114 4.539 -5.945 12.018 1.00 0.00 O ATOM 1674 CB MET A 114 5.747 -8.301 11.299 1.00 0.00 C ATOM 1675 CG MET A 114 7.117 -7.715 11.601 1.00 0.00 C ATOM 1676 SD MET A 114 8.413 -8.383 10.539 1.00 0.00 S ATOM 1677 CE MET A 114 8.469 -7.138 9.251 1.00 0.00 C ATOM 0 H MET A 114 3.420 -9.451 11.433 1.00 0.00 H new ATOM 0 HA MET A 114 5.381 -8.459 13.399 1.00 0.00 H new ATOM 0 HB2 MET A 114 5.869 -9.328 10.954 1.00 0.00 H new ATOM 0 HB3 MET A 114 5.294 -7.741 10.481 1.00 0.00 H new ATOM 0 HG2 MET A 114 7.078 -6.632 11.482 1.00 0.00 H new ATOM 0 HG3 MET A 114 7.370 -7.912 12.643 1.00 0.00 H new ATOM 0 HE1 MET A 114 9.226 -7.410 8.515 1.00 0.00 H new ATOM 0 HE2 MET A 114 7.496 -7.074 8.764 1.00 0.00 H new ATOM 0 HE3 MET A 114 8.719 -6.172 9.689 1.00 0.00 H new ATOM 1687 N GLU A 115 3.032 -6.900 13.400 1.00 0.00 N ATOM 1688 CA GLU A 115 2.271 -5.675 13.616 1.00 0.00 C ATOM 1689 C GLU A 115 3.123 -4.629 14.326 1.00 0.00 C ATOM 1690 O GLU A 115 2.932 -3.428 14.136 1.00 0.00 O ATOM 1691 CB GLU A 115 1.006 -5.968 14.432 1.00 0.00 C ATOM 1692 CG GLU A 115 -0.259 -6.031 13.592 1.00 0.00 C ATOM 1693 CD GLU A 115 -1.170 -7.176 13.993 1.00 0.00 C ATOM 1694 OE1 GLU A 115 -1.883 -7.039 15.009 1.00 0.00 O ATOM 1695 OE2 GLU A 115 -1.170 -8.208 13.290 1.00 0.00 O ATOM 0 H GLU A 115 2.668 -7.713 13.897 1.00 0.00 H new ATOM 0 HA GLU A 115 1.978 -5.280 12.643 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.133 -6.916 14.955 1.00 0.00 H new ATOM 0 HB3 GLU A 115 0.888 -5.197 15.194 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.801 -5.090 13.687 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.012 -6.138 12.542 1.00 0.00 H new ATOM 1702 N VAL A 116 4.069 -5.094 15.143 1.00 0.00 N ATOM 1703 CA VAL A 116 4.962 -4.201 15.881 1.00 0.00 C ATOM 1704 C VAL A 116 5.414 -3.032 15.007 1.00 0.00 C ATOM 1705 O VAL A 116 5.280 -1.872 15.392 1.00 0.00 O ATOM 1706 CB VAL A 116 6.203 -4.959 16.406 1.00 0.00 C ATOM 1707 CG1 VAL A 116 7.183 -4.010 17.084 1.00 0.00 C ATOM 1708 CG2 VAL A 116 5.786 -6.064 17.364 1.00 0.00 C ATOM 0 H VAL A 116 4.236 -6.086 15.310 1.00 0.00 H new ATOM 0 HA VAL A 116 4.399 -3.814 16.731 1.00 0.00 H new ATOM 0 HB VAL A 116 6.707 -5.409 15.551 1.00 0.00 H new ATOM 0 HG11 VAL A 116 8.045 -4.572 17.443 1.00 0.00 H new ATOM 0 HG12 VAL A 116 7.513 -3.256 16.369 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.693 -3.521 17.926 1.00 0.00 H new ATOM 0 HG21 VAL A 116 6.672 -6.587 17.724 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.252 -5.630 18.210 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.134 -6.768 16.846 1.00 0.00 H new ATOM 1718 N LEU A 117 5.941 -3.350 13.828 1.00 0.00 N ATOM 1719 CA LEU A 117 6.406 -2.328 12.898 1.00 0.00 C ATOM 1720 C LEU A 117 5.231 -1.617 12.226 1.00 0.00 C ATOM 1721 O LEU A 117 5.309 -0.428 11.920 1.00 0.00 O ATOM 1722 CB LEU A 117 7.313 -2.953 11.836 1.00 0.00 C ATOM 1723 CG LEU A 117 7.876 -1.968 10.807 1.00 0.00 C ATOM 1724 CD1 LEU A 117 9.395 -2.035 10.773 1.00 0.00 C ATOM 1725 CD2 LEU A 117 7.299 -2.249 9.427 1.00 0.00 C ATOM 0 H LEU A 117 6.056 -4.307 13.495 1.00 0.00 H new ATOM 0 HA LEU A 117 6.973 -1.590 13.466 1.00 0.00 H new ATOM 0 HB2 LEU A 117 8.145 -3.449 12.336 1.00 0.00 H new ATOM 0 HB3 LEU A 117 6.752 -3.725 11.309 1.00 0.00 H new ATOM 0 HG LEU A 117 7.585 -0.961 11.104 1.00 0.00 H new ATOM 0 HD11 LEU A 117 9.774 -1.327 10.036 1.00 0.00 H new ATOM 0 HD12 LEU A 117 9.792 -1.782 11.756 1.00 0.00 H new ATOM 0 HD13 LEU A 117 9.709 -3.043 10.503 1.00 0.00 H new ATOM 0 HD21 LEU A 117 7.710 -1.539 8.709 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.558 -3.263 9.124 1.00 0.00 H new ATOM 0 HD23 LEU A 117 6.214 -2.146 9.458 1.00 0.00 H new ATOM 1737 N VAL A 118 4.142 -2.353 12.002 1.00 0.00 N ATOM 1738 CA VAL A 118 2.949 -1.790 11.367 1.00 0.00 C ATOM 1739 C VAL A 118 2.503 -0.509 12.072 1.00 0.00 C ATOM 1740 O VAL A 118 2.513 0.571 11.480 1.00 0.00 O ATOM 1741 CB VAL A 118 1.788 -2.813 11.357 1.00 0.00 C ATOM 1742 CG1 VAL A 118 0.487 -2.181 10.878 1.00 0.00 C ATOM 1743 CG2 VAL A 118 2.152 -4.006 10.486 1.00 0.00 C ATOM 0 H VAL A 118 4.061 -3.339 12.250 1.00 0.00 H new ATOM 0 HA VAL A 118 3.212 -1.549 10.337 1.00 0.00 H new ATOM 0 HB VAL A 118 1.630 -3.152 12.381 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.305 -2.930 10.884 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.216 -1.360 11.541 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.619 -1.801 9.865 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.329 -4.721 10.485 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.341 -3.668 9.467 1.00 0.00 H new ATOM 0 HG23 VAL A 118 3.048 -4.485 10.881 1.00 0.00 H new ATOM 1753 N GLY A 119 2.116 -0.636 13.338 1.00 0.00 N ATOM 1754 CA GLY A 119 1.676 0.521 14.101 1.00 0.00 C ATOM 1755 C GLY A 119 2.622 1.701 13.970 1.00 0.00 C ATOM 1756 O GLY A 119 2.197 2.857 14.025 1.00 0.00 O ATOM 0 H GLY A 119 2.099 -1.518 13.850 1.00 0.00 H new ATOM 0 HA2 GLY A 119 0.683 0.817 13.764 1.00 0.00 H new ATOM 0 HA3 GLY A 119 1.587 0.246 15.152 1.00 0.00 H new ATOM 1760 N GLN A 120 3.905 1.406 13.791 1.00 0.00 N ATOM 1761 CA GLN A 120 4.917 2.447 13.647 1.00 0.00 C ATOM 1762 C GLN A 120 4.839 3.098 12.270 1.00 0.00 C ATOM 1763 O GLN A 120 4.971 4.315 12.142 1.00 0.00 O ATOM 1764 CB GLN A 120 6.314 1.860 13.868 1.00 0.00 C ATOM 1765 CG GLN A 120 6.415 0.996 15.113 1.00 0.00 C ATOM 1766 CD GLN A 120 7.807 0.990 15.710 1.00 0.00 C ATOM 1767 OE1 GLN A 120 8.534 0.002 15.606 1.00 0.00 O ATOM 1768 NE2 GLN A 120 8.185 2.095 16.342 1.00 0.00 N ATOM 0 H GLN A 120 4.269 0.454 13.742 1.00 0.00 H new ATOM 0 HA GLN A 120 4.726 3.212 14.400 1.00 0.00 H new ATOM 0 HB2 GLN A 120 6.592 1.265 12.998 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.035 2.674 13.940 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.706 1.356 15.859 1.00 0.00 H new ATOM 0 HG3 GLN A 120 6.126 -0.025 14.866 1.00 0.00 H new ATOM 0 HE21 GLN A 120 7.549 2.890 16.404 1.00 0.00 H new ATOM 0 HE22 GLN A 120 9.111 2.149 16.766 1.00 0.00 H new ATOM 1777 N VAL A 121 4.622 2.283 11.242 1.00 0.00 N ATOM 1778 CA VAL A 121 4.527 2.788 9.878 1.00 0.00 C ATOM 1779 C VAL A 121 3.380 3.788 9.741 1.00 0.00 C ATOM 1780 O VAL A 121 3.506 4.801 9.053 1.00 0.00 O ATOM 1781 CB VAL A 121 4.323 1.647 8.862 1.00 0.00 C ATOM 1782 CG1 VAL A 121 4.432 2.174 7.438 1.00 0.00 C ATOM 1783 CG2 VAL A 121 5.326 0.526 9.101 1.00 0.00 C ATOM 0 H VAL A 121 4.509 1.273 11.328 1.00 0.00 H new ATOM 0 HA VAL A 121 5.472 3.287 9.662 1.00 0.00 H new ATOM 0 HB VAL A 121 3.321 1.240 9.001 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.285 1.354 6.735 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.670 2.935 7.272 1.00 0.00 H new ATOM 0 HG13 VAL A 121 5.419 2.610 7.286 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.164 -0.269 8.373 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.339 0.915 8.994 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.194 0.128 10.107 1.00 0.00 H new ATOM 1793 N GLN A 122 2.262 3.496 10.400 1.00 0.00 N ATOM 1794 CA GLN A 122 1.095 4.370 10.348 1.00 0.00 C ATOM 1795 C GLN A 122 1.367 5.687 11.073 1.00 0.00 C ATOM 1796 O GLN A 122 1.195 6.765 10.504 1.00 0.00 O ATOM 1797 CB GLN A 122 -0.123 3.665 10.955 1.00 0.00 C ATOM 1798 CG GLN A 122 -1.156 3.248 9.919 1.00 0.00 C ATOM 1799 CD GLN A 122 -1.358 1.746 9.863 1.00 0.00 C ATOM 1800 OE1 GLN A 122 -0.450 1.000 9.495 1.00 0.00 O ATOM 1801 NE2 GLN A 122 -2.552 1.295 10.227 1.00 0.00 N ATOM 0 H GLN A 122 2.140 2.662 10.975 1.00 0.00 H new ATOM 0 HA GLN A 122 0.884 4.597 9.303 1.00 0.00 H new ATOM 0 HB2 GLN A 122 0.211 2.782 11.500 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -0.594 4.328 11.681 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -2.107 3.730 10.146 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -0.844 3.605 8.937 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -3.275 1.950 10.525 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -2.746 0.294 10.209 1.00 0.00 H new ATOM 1810 N GLU A 123 1.773 5.591 12.338 1.00 0.00 N ATOM 1811 CA GLU A 123 2.057 6.779 13.147 1.00 0.00 C ATOM 1812 C GLU A 123 2.894 7.793 12.369 1.00 0.00 C ATOM 1813 O GLU A 123 2.564 8.979 12.321 1.00 0.00 O ATOM 1814 CB GLU A 123 2.781 6.385 14.438 1.00 0.00 C ATOM 1815 CG GLU A 123 1.917 6.516 15.682 1.00 0.00 C ATOM 1816 CD GLU A 123 0.990 5.332 15.876 1.00 0.00 C ATOM 1817 OE1 GLU A 123 -0.120 5.346 15.304 1.00 0.00 O ATOM 1818 OE2 GLU A 123 1.376 4.389 16.599 1.00 0.00 O ATOM 0 H GLU A 123 1.913 4.706 12.825 1.00 0.00 H new ATOM 0 HA GLU A 123 1.104 7.245 13.399 1.00 0.00 H new ATOM 0 HB2 GLU A 123 3.126 5.355 14.352 1.00 0.00 H new ATOM 0 HB3 GLU A 123 3.667 7.009 14.553 1.00 0.00 H new ATOM 0 HG2 GLU A 123 2.559 6.617 16.557 1.00 0.00 H new ATOM 0 HG3 GLU A 123 1.325 7.429 15.614 1.00 0.00 H new ATOM 1825 N TRP A 124 3.973 7.317 11.761 1.00 0.00 N ATOM 1826 CA TRP A 124 4.856 8.175 10.982 1.00 0.00 C ATOM 1827 C TRP A 124 4.115 8.765 9.790 1.00 0.00 C ATOM 1828 O TRP A 124 4.309 9.929 9.437 1.00 0.00 O ATOM 1829 CB TRP A 124 6.068 7.379 10.502 1.00 0.00 C ATOM 1830 CG TRP A 124 6.870 6.785 11.622 1.00 0.00 C ATOM 1831 CD1 TRP A 124 6.650 6.937 12.961 1.00 0.00 C ATOM 1832 CD2 TRP A 124 8.021 5.945 11.497 1.00 0.00 C ATOM 1833 NE1 TRP A 124 7.595 6.243 13.676 1.00 0.00 N ATOM 1834 CE2 TRP A 124 8.448 5.625 12.799 1.00 0.00 C ATOM 1835 CE3 TRP A 124 8.732 5.432 10.409 1.00 0.00 C ATOM 1836 CZ2 TRP A 124 9.554 4.815 13.042 1.00 0.00 C ATOM 1837 CZ3 TRP A 124 9.829 4.628 10.651 1.00 0.00 C ATOM 1838 CH2 TRP A 124 10.231 4.327 11.959 1.00 0.00 C ATOM 0 H TRP A 124 4.258 6.338 11.793 1.00 0.00 H new ATOM 0 HA TRP A 124 5.195 8.993 11.618 1.00 0.00 H new ATOM 0 HB2 TRP A 124 5.731 6.580 9.842 1.00 0.00 H new ATOM 0 HB3 TRP A 124 6.711 8.031 9.910 1.00 0.00 H new ATOM 0 HD1 TRP A 124 5.850 7.518 13.395 1.00 0.00 H new ATOM 0 HE1 TRP A 124 7.653 6.195 14.693 1.00 0.00 H new ATOM 0 HE3 TRP A 124 8.430 5.660 9.398 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 9.866 4.581 14.049 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 10.386 4.225 9.818 1.00 0.00 H new ATOM 0 HH2 TRP A 124 11.094 3.696 12.115 1.00 0.00 H new ATOM 1849 N MET A 125 3.266 7.949 9.174 1.00 0.00 N ATOM 1850 CA MET A 125 2.488 8.376 8.019 1.00 0.00 C ATOM 1851 C MET A 125 1.722 9.661 8.316 1.00 0.00 C ATOM 1852 O MET A 125 1.896 10.674 7.639 1.00 0.00 O ATOM 1853 CB MET A 125 1.509 7.274 7.611 1.00 0.00 C ATOM 1854 CG MET A 125 1.473 7.036 6.116 1.00 0.00 C ATOM 1855 SD MET A 125 1.132 5.316 5.688 1.00 0.00 S ATOM 1856 CE MET A 125 2.794 4.663 5.523 1.00 0.00 C ATOM 0 H MET A 125 3.100 6.984 9.458 1.00 0.00 H new ATOM 0 HA MET A 125 3.180 8.571 7.199 1.00 0.00 H new ATOM 0 HB2 MET A 125 1.784 6.347 8.114 1.00 0.00 H new ATOM 0 HB3 MET A 125 0.509 7.539 7.955 1.00 0.00 H new ATOM 0 HG2 MET A 125 0.711 7.674 5.670 1.00 0.00 H new ATOM 0 HG3 MET A 125 2.429 7.330 5.683 1.00 0.00 H new ATOM 0 HE1 MET A 125 2.767 3.576 5.597 1.00 0.00 H new ATOM 0 HE2 MET A 125 3.203 4.951 4.555 1.00 0.00 H new ATOM 0 HE3 MET A 125 3.423 5.065 6.317 1.00 0.00 H new ATOM 1866 N VAL A 126 0.875 9.605 9.333 1.00 0.00 N ATOM 1867 CA VAL A 126 0.077 10.756 9.729 1.00 0.00 C ATOM 1868 C VAL A 126 0.964 11.910 10.184 1.00 0.00 C ATOM 1869 O VAL A 126 0.581 13.076 10.084 1.00 0.00 O ATOM 1870 CB VAL A 126 -0.897 10.392 10.862 1.00 0.00 C ATOM 1871 CG1 VAL A 126 -1.863 11.535 11.128 1.00 0.00 C ATOM 1872 CG2 VAL A 126 -1.651 9.113 10.528 1.00 0.00 C ATOM 0 H VAL A 126 0.722 8.772 9.901 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.493 11.067 8.853 1.00 0.00 H new ATOM 0 HB VAL A 126 -0.319 10.220 11.770 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -2.543 11.257 11.933 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -1.303 12.425 11.417 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -2.436 11.745 10.225 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.335 8.871 11.341 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -2.217 9.254 9.607 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -0.941 8.296 10.396 1.00 0.00 H new ATOM 1882 N ALA A 127 2.151 11.577 10.685 1.00 0.00 N ATOM 1883 CA ALA A 127 3.092 12.586 11.155 1.00 0.00 C ATOM 1884 C ALA A 127 3.483 13.537 10.034 1.00 0.00 C ATOM 1885 O ALA A 127 3.178 14.729 10.081 1.00 0.00 O ATOM 1886 CB ALA A 127 4.331 11.922 11.741 1.00 0.00 C ATOM 0 H ALA A 127 2.482 10.617 10.775 1.00 0.00 H new ATOM 0 HA ALA A 127 2.601 13.168 11.935 1.00 0.00 H new ATOM 0 HB1 ALA A 127 5.025 12.688 12.088 1.00 0.00 H new ATOM 0 HB2 ALA A 127 4.042 11.288 12.579 1.00 0.00 H new ATOM 0 HB3 ALA A 127 4.814 11.314 10.976 1.00 0.00 H new ATOM 1892 N TYR A 128 4.147 13.000 9.015 1.00 0.00 N ATOM 1893 CA TYR A 128 4.570 13.801 7.878 1.00 0.00 C ATOM 1894 C TYR A 128 3.367 14.465 7.218 1.00 0.00 C ATOM 1895 O TYR A 128 3.473 15.567 6.682 1.00 0.00 O ATOM 1896 CB TYR A 128 5.310 12.925 6.860 1.00 0.00 C ATOM 1897 CG TYR A 128 6.050 13.713 5.799 1.00 0.00 C ATOM 1898 CD1 TYR A 128 5.386 14.208 4.684 1.00 0.00 C ATOM 1899 CD2 TYR A 128 7.414 13.963 5.913 1.00 0.00 C ATOM 1900 CE1 TYR A 128 6.056 14.927 3.715 1.00 0.00 C ATOM 1901 CE2 TYR A 128 8.090 14.684 4.945 1.00 0.00 C ATOM 1902 CZ TYR A 128 7.404 15.162 3.849 1.00 0.00 C ATOM 1903 OH TYR A 128 8.071 15.881 2.885 1.00 0.00 O ATOM 0 H TYR A 128 4.402 12.014 8.956 1.00 0.00 H new ATOM 0 HA TYR A 128 5.246 14.578 8.234 1.00 0.00 H new ATOM 0 HB2 TYR A 128 6.020 12.290 7.389 1.00 0.00 H new ATOM 0 HB3 TYR A 128 4.592 12.264 6.374 1.00 0.00 H new ATOM 0 HD1 TYR A 128 4.327 14.027 4.573 1.00 0.00 H new ATOM 0 HD2 TYR A 128 7.953 13.588 6.770 1.00 0.00 H new ATOM 0 HE1 TYR A 128 5.523 15.304 2.854 1.00 0.00 H new ATOM 0 HE2 TYR A 128 9.149 14.871 5.047 1.00 0.00 H new ATOM 0 HH TYR A 128 9.017 15.959 3.130 1.00 0.00 H new ATOM 1913 N LEU A 129 2.221 13.789 7.261 1.00 0.00 N ATOM 1914 CA LEU A 129 1.001 14.320 6.664 1.00 0.00 C ATOM 1915 C LEU A 129 0.703 15.726 7.174 1.00 0.00 C ATOM 1916 O LEU A 129 0.537 16.655 6.387 1.00 0.00 O ATOM 1917 CB LEU A 129 -0.193 13.403 6.933 1.00 0.00 C ATOM 1918 CG LEU A 129 -0.957 12.982 5.674 1.00 0.00 C ATOM 1919 CD1 LEU A 129 -1.567 11.601 5.845 1.00 0.00 C ATOM 1920 CD2 LEU A 129 -2.029 14.007 5.330 1.00 0.00 C ATOM 0 H LEU A 129 2.113 12.876 7.702 1.00 0.00 H new ATOM 0 HA LEU A 129 1.164 14.369 5.587 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.159 12.509 7.447 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.881 13.910 7.610 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.249 12.936 4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.104 11.325 4.937 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.776 10.875 6.033 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -2.259 11.611 6.687 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.561 13.690 4.433 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.732 14.090 6.159 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.562 14.976 5.152 1.00 0.00 H new ATOM 1932 N GLU A 130 0.631 15.872 8.488 1.00 0.00 N ATOM 1933 CA GLU A 130 0.339 17.165 9.099 1.00 0.00 C ATOM 1934 C GLU A 130 1.583 18.053 9.142 1.00 0.00 C ATOM 1935 O GLU A 130 1.488 19.255 9.398 1.00 0.00 O ATOM 1936 CB GLU A 130 -0.224 16.967 10.506 1.00 0.00 C ATOM 1937 CG GLU A 130 -1.736 16.830 10.529 1.00 0.00 C ATOM 1938 CD GLU A 130 -2.349 17.350 11.813 1.00 0.00 C ATOM 1939 OE1 GLU A 130 -2.475 18.585 11.953 1.00 0.00 O ATOM 1940 OE2 GLU A 130 -2.706 16.523 12.677 1.00 0.00 O ATOM 0 H GLU A 130 0.770 15.112 9.154 1.00 0.00 H new ATOM 0 HA GLU A 130 -0.408 17.668 8.485 1.00 0.00 H new ATOM 0 HB2 GLU A 130 0.222 16.076 10.947 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.068 17.812 11.130 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -2.159 17.372 9.683 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -2.004 15.781 10.402 1.00 0.00 H new ATOM 1947 N THR A 131 2.749 17.451 8.912 1.00 0.00 N ATOM 1948 CA THR A 131 4.013 18.184 8.935 1.00 0.00 C ATOM 1949 C THR A 131 4.250 18.951 7.629 1.00 0.00 C ATOM 1950 O THR A 131 4.169 20.180 7.600 1.00 0.00 O ATOM 1951 CB THR A 131 5.172 17.213 9.182 1.00 0.00 C ATOM 1952 OG1 THR A 131 4.962 16.461 10.367 1.00 0.00 O ATOM 1953 CG2 THR A 131 6.516 17.901 9.310 1.00 0.00 C ATOM 0 H THR A 131 2.844 16.456 8.707 1.00 0.00 H new ATOM 0 HA THR A 131 3.960 18.912 9.745 1.00 0.00 H new ATOM 0 HB THR A 131 5.192 16.567 8.304 1.00 0.00 H new ATOM 0 HG1 THR A 131 4.185 15.876 10.250 1.00 0.00 H new ATOM 0 HG21 THR A 131 7.292 17.155 9.484 1.00 0.00 H new ATOM 0 HG22 THR A 131 6.735 18.445 8.391 1.00 0.00 H new ATOM 0 HG23 THR A 131 6.489 18.598 10.147 1.00 0.00 H new ATOM 1961 N ARG A 132 4.546 18.224 6.550 1.00 0.00 N ATOM 1962 CA ARG A 132 4.803 18.846 5.245 1.00 0.00 C ATOM 1963 C ARG A 132 3.685 18.561 4.242 1.00 0.00 C ATOM 1964 O ARG A 132 3.589 19.223 3.206 1.00 0.00 O ATOM 1965 CB ARG A 132 6.141 18.356 4.678 1.00 0.00 C ATOM 1966 CG ARG A 132 6.624 19.152 3.474 1.00 0.00 C ATOM 1967 CD ARG A 132 8.104 18.919 3.198 1.00 0.00 C ATOM 1968 NE ARG A 132 8.833 20.167 2.965 1.00 0.00 N ATOM 1969 CZ ARG A 132 9.480 20.845 3.914 1.00 0.00 C ATOM 1970 NH1 ARG A 132 9.459 20.431 5.175 1.00 0.00 N ATOM 1971 NH2 ARG A 132 10.148 21.946 3.600 1.00 0.00 N ATOM 0 H ARG A 132 4.614 17.206 6.551 1.00 0.00 H new ATOM 0 HA ARG A 132 4.842 19.924 5.404 1.00 0.00 H new ATOM 0 HB2 ARG A 132 6.897 18.405 5.462 1.00 0.00 H new ATOM 0 HB3 ARG A 132 6.043 17.308 4.394 1.00 0.00 H new ATOM 0 HG2 ARG A 132 6.042 18.872 2.596 1.00 0.00 H new ATOM 0 HG3 ARG A 132 6.449 20.214 3.647 1.00 0.00 H new ATOM 0 HD2 ARG A 132 8.550 18.394 4.043 1.00 0.00 H new ATOM 0 HD3 ARG A 132 8.211 18.271 2.328 1.00 0.00 H new ATOM 0 HE ARG A 132 8.847 20.542 2.016 1.00 0.00 H new ATOM 0 HH11 ARG A 132 8.945 19.587 5.426 1.00 0.00 H new ATOM 0 HH12 ARG A 132 9.957 20.957 5.893 1.00 0.00 H new ATOM 0 HH21 ARG A 132 10.167 22.273 2.634 1.00 0.00 H new ATOM 0 HH22 ARG A 132 10.643 22.466 4.324 1.00 0.00 H new ATOM 1985 N LEU A 133 2.837 17.584 4.553 1.00 0.00 N ATOM 1986 CA LEU A 133 1.726 17.222 3.679 1.00 0.00 C ATOM 1987 C LEU A 133 0.470 17.999 4.062 1.00 0.00 C ATOM 1988 O LEU A 133 -0.581 17.833 3.454 1.00 0.00 O ATOM 1989 CB LEU A 133 1.436 15.727 3.792 1.00 0.00 C ATOM 1990 CG LEU A 133 1.683 14.904 2.529 1.00 0.00 C ATOM 1991 CD1 LEU A 133 3.173 14.759 2.278 1.00 0.00 C ATOM 1992 CD2 LEU A 133 1.022 13.537 2.651 1.00 0.00 C ATOM 0 H LEU A 133 2.899 17.028 5.406 1.00 0.00 H new ATOM 0 HA LEU A 133 2.005 17.468 2.654 1.00 0.00 H new ATOM 0 HB2 LEU A 133 2.048 15.317 4.595 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.395 15.600 4.088 1.00 0.00 H new ATOM 0 HG LEU A 133 1.241 15.424 1.679 1.00 0.00 H new ATOM 0 HD11 LEU A 133 3.334 14.170 1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 133 3.619 15.746 2.152 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.638 14.257 3.126 1.00 0.00 H new ATOM 0 HD21 LEU A 133 1.206 12.961 1.744 1.00 0.00 H new ATOM 0 HD22 LEU A 133 1.438 13.007 3.508 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -0.052 13.663 2.789 1.00 0.00 H new ATOM 2004 N ALA A 134 0.589 18.854 5.066 1.00 0.00 N ATOM 2005 CA ALA A 134 -0.538 19.650 5.521 1.00 0.00 C ATOM 2006 C ALA A 134 -0.839 20.784 4.556 1.00 0.00 C ATOM 2007 O ALA A 134 -1.943 21.329 4.551 1.00 0.00 O ATOM 2008 CB ALA A 134 -0.275 20.203 6.911 1.00 0.00 C ATOM 0 H ALA A 134 1.455 19.014 5.581 1.00 0.00 H new ATOM 0 HA ALA A 134 -1.410 18.997 5.560 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -1.130 20.796 7.234 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -0.121 19.379 7.607 1.00 0.00 H new ATOM 0 HB3 ALA A 134 0.615 20.831 6.890 1.00 0.00 H new ATOM 2014 N ASP A 135 0.142 21.136 3.734 1.00 0.00 N ATOM 2015 CA ASP A 135 -0.026 22.203 2.759 1.00 0.00 C ATOM 2016 C ASP A 135 -0.709 21.679 1.500 1.00 0.00 C ATOM 2017 O ASP A 135 -1.854 22.027 1.212 1.00 0.00 O ATOM 2018 CB ASP A 135 1.335 22.806 2.411 1.00 0.00 C ATOM 2019 CG ASP A 135 1.227 24.231 1.910 1.00 0.00 C ATOM 2020 OD1 ASP A 135 0.144 24.607 1.415 1.00 0.00 O ATOM 2021 OD2 ASP A 135 2.229 24.970 2.007 1.00 0.00 O ATOM 0 H ASP A 135 1.063 20.697 3.724 1.00 0.00 H new ATOM 0 HA ASP A 135 -0.659 22.977 3.193 1.00 0.00 H new ATOM 0 HB2 ASP A 135 1.976 22.782 3.293 1.00 0.00 H new ATOM 0 HB3 ASP A 135 1.817 22.192 1.650 1.00 0.00 H new ATOM 2026 N TRP A 136 -0.001 20.841 0.743 1.00 0.00 N ATOM 2027 CA TRP A 136 -0.549 20.277 -0.489 1.00 0.00 C ATOM 2028 C TRP A 136 -1.935 19.676 -0.253 1.00 0.00 C ATOM 2029 O TRP A 136 -2.771 19.644 -1.155 1.00 0.00 O ATOM 2030 CB TRP A 136 0.403 19.218 -1.059 1.00 0.00 C ATOM 2031 CG TRP A 136 -0.199 18.408 -2.168 1.00 0.00 C ATOM 2032 CD1 TRP A 136 -0.079 17.061 -2.355 1.00 0.00 C ATOM 2033 CD2 TRP A 136 -1.020 18.890 -3.239 1.00 0.00 C ATOM 2034 NE1 TRP A 136 -0.774 16.677 -3.477 1.00 0.00 N ATOM 2035 CE2 TRP A 136 -1.363 17.781 -4.035 1.00 0.00 C ATOM 2036 CE3 TRP A 136 -1.500 20.152 -3.602 1.00 0.00 C ATOM 2037 CZ2 TRP A 136 -2.161 17.896 -5.170 1.00 0.00 C ATOM 2038 CZ3 TRP A 136 -2.293 20.265 -4.729 1.00 0.00 C ATOM 2039 CH2 TRP A 136 -2.618 19.142 -5.500 1.00 0.00 C ATOM 0 H TRP A 136 0.949 20.539 0.960 1.00 0.00 H new ATOM 0 HA TRP A 136 -0.652 21.085 -1.213 1.00 0.00 H new ATOM 0 HB2 TRP A 136 1.303 19.710 -1.427 1.00 0.00 H new ATOM 0 HB3 TRP A 136 0.711 18.548 -0.256 1.00 0.00 H new ATOM 0 HD1 TRP A 136 0.480 16.395 -1.715 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -0.840 15.725 -3.836 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -1.256 21.023 -3.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -2.410 17.032 -5.768 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -2.668 21.235 -5.019 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -3.242 19.262 -6.373 1.00 0.00 H new ATOM 2050 N ILE A 137 -2.171 19.204 0.967 1.00 0.00 N ATOM 2051 CA ILE A 137 -3.457 18.607 1.323 1.00 0.00 C ATOM 2052 C ILE A 137 -4.511 19.686 1.576 1.00 0.00 C ATOM 2053 O ILE A 137 -5.622 19.608 1.055 1.00 0.00 O ATOM 2054 CB ILE A 137 -3.330 17.678 2.562 1.00 0.00 C ATOM 2055 CG1 ILE A 137 -2.459 16.466 2.217 1.00 0.00 C ATOM 2056 CG2 ILE A 137 -4.698 17.221 3.061 1.00 0.00 C ATOM 2057 CD1 ILE A 137 -3.073 15.552 1.180 1.00 0.00 C ATOM 0 H ILE A 137 -1.490 19.222 1.726 1.00 0.00 H new ATOM 0 HA ILE A 137 -3.777 18.000 0.476 1.00 0.00 H new ATOM 0 HB ILE A 137 -2.858 18.246 3.364 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -1.493 16.816 1.854 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.270 15.895 3.126 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -4.571 16.573 3.928 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -5.292 18.091 3.342 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -5.209 16.672 2.270 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -2.400 14.717 0.987 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -4.026 15.172 1.548 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -3.236 16.107 0.256 1.00 0.00 H new ATOM 2069 N HIS A 138 -4.160 20.695 2.372 1.00 0.00 N ATOM 2070 CA HIS A 138 -5.088 21.784 2.678 1.00 0.00 C ATOM 2071 C HIS A 138 -5.583 22.463 1.403 1.00 0.00 C ATOM 2072 O HIS A 138 -6.708 22.959 1.349 1.00 0.00 O ATOM 2073 CB HIS A 138 -4.420 22.818 3.591 1.00 0.00 C ATOM 2074 CG HIS A 138 -5.087 22.963 4.925 1.00 0.00 C ATOM 2075 ND1 HIS A 138 -6.231 22.279 5.274 1.00 0.00 N ATOM 2076 CD2 HIS A 138 -4.767 23.724 5.998 1.00 0.00 C ATOM 2077 CE1 HIS A 138 -6.588 22.612 6.501 1.00 0.00 C ATOM 2078 NE2 HIS A 138 -5.713 23.487 6.963 1.00 0.00 N ATOM 0 H HIS A 138 -3.245 20.782 2.815 1.00 0.00 H new ATOM 0 HA HIS A 138 -5.946 21.353 3.194 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -3.378 22.536 3.744 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -4.417 23.785 3.089 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -3.923 24.394 6.079 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -7.447 22.234 7.035 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -5.737 23.917 7.888 1.00 0.00 H new ATOM 2086 N SER A 139 -4.732 22.490 0.384 1.00 0.00 N ATOM 2087 CA SER A 139 -5.077 23.117 -0.889 1.00 0.00 C ATOM 2088 C SER A 139 -6.126 22.299 -1.635 1.00 0.00 C ATOM 2089 O SER A 139 -7.230 22.776 -1.897 1.00 0.00 O ATOM 2090 CB SER A 139 -3.828 23.278 -1.754 1.00 0.00 C ATOM 2091 OG SER A 139 -3.040 22.100 -1.738 1.00 0.00 O ATOM 0 H SER A 139 -3.796 22.085 0.413 1.00 0.00 H new ATOM 0 HA SER A 139 -5.496 24.101 -0.679 1.00 0.00 H new ATOM 0 HB2 SER A 139 -4.119 23.510 -2.778 1.00 0.00 H new ATOM 0 HB3 SER A 139 -3.237 24.119 -1.392 1.00 0.00 H new ATOM 0 HG SER A 139 -2.874 21.805 -2.658 1.00 0.00 H new ATOM 2097 N SER A 140 -5.772 21.068 -1.979 1.00 0.00 N ATOM 2098 CA SER A 140 -6.681 20.182 -2.699 1.00 0.00 C ATOM 2099 C SER A 140 -7.777 19.650 -1.775 1.00 0.00 C ATOM 2100 O SER A 140 -8.736 19.027 -2.225 1.00 0.00 O ATOM 2101 CB SER A 140 -5.895 19.020 -3.310 1.00 0.00 C ATOM 2102 OG SER A 140 -4.653 18.841 -2.651 1.00 0.00 O ATOM 0 H SER A 140 -4.861 20.659 -1.771 1.00 0.00 H new ATOM 0 HA SER A 140 -7.160 20.752 -3.495 1.00 0.00 H new ATOM 0 HB2 SER A 140 -6.482 18.104 -3.241 1.00 0.00 H new ATOM 0 HB3 SER A 140 -5.724 19.210 -4.370 1.00 0.00 H new ATOM 0 HG SER A 140 -3.927 19.155 -3.230 1.00 0.00 H new ATOM 2108 N GLY A 141 -7.625 19.905 -0.481 1.00 0.00 N ATOM 2109 CA GLY A 141 -8.603 19.454 0.491 1.00 0.00 C ATOM 2110 C GLY A 141 -8.335 18.041 0.956 1.00 0.00 C ATOM 2111 O GLY A 141 -8.568 17.699 2.112 1.00 0.00 O ATOM 0 H GLY A 141 -6.837 20.419 -0.086 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -8.595 20.125 1.350 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -9.600 19.508 0.053 1.00 0.00 H new ATOM 2115 N GLY A 142 -7.835 17.214 0.046 1.00 0.00 N ATOM 2116 CA GLY A 142 -7.534 15.849 0.360 1.00 0.00 C ATOM 2117 C GLY A 142 -7.700 14.956 -0.842 1.00 0.00 C ATOM 2118 O GLY A 142 -7.290 15.297 -1.949 1.00 0.00 O ATOM 0 H GLY A 142 -7.633 17.480 -0.918 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -6.511 15.777 0.730 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -8.188 15.506 1.162 1.00 0.00 H new ATOM 2122 N TRP A 143 -8.311 13.818 -0.608 1.00 0.00 N ATOM 2123 CA TRP A 143 -8.564 12.836 -1.645 1.00 0.00 C ATOM 2124 C TRP A 143 -9.593 13.348 -2.658 1.00 0.00 C ATOM 2125 O TRP A 143 -9.665 12.849 -3.776 1.00 0.00 O ATOM 2126 CB TRP A 143 -9.054 11.539 -1.002 1.00 0.00 C ATOM 2127 CG TRP A 143 -8.071 10.940 -0.038 1.00 0.00 C ATOM 2128 CD1 TRP A 143 -8.030 11.147 1.310 1.00 0.00 C ATOM 2129 CD2 TRP A 143 -6.987 10.045 -0.339 1.00 0.00 C ATOM 2130 NE1 TRP A 143 -7.000 10.430 1.868 1.00 0.00 N ATOM 2131 CE2 TRP A 143 -6.346 9.747 0.880 1.00 0.00 C ATOM 2132 CE3 TRP A 143 -6.496 9.462 -1.514 1.00 0.00 C ATOM 2133 CZ2 TRP A 143 -5.246 8.895 0.957 1.00 0.00 C ATOM 2134 CZ3 TRP A 143 -5.403 8.616 -1.433 1.00 0.00 C ATOM 2135 CH2 TRP A 143 -4.791 8.339 -0.205 1.00 0.00 C ATOM 0 H TRP A 143 -8.650 13.542 0.314 1.00 0.00 H new ATOM 0 HA TRP A 143 -7.635 12.651 -2.184 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -9.991 11.733 -0.480 1.00 0.00 H new ATOM 0 HB3 TRP A 143 -9.270 10.813 -1.786 1.00 0.00 H new ATOM 0 HD1 TRP A 143 -8.709 11.783 1.859 1.00 0.00 H new ATOM 0 HE1 TRP A 143 -6.761 10.410 2.859 1.00 0.00 H new ATOM 0 HE3 TRP A 143 -6.962 9.669 -2.466 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 -4.770 8.682 1.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 -5.016 8.162 -2.333 1.00 0.00 H new ATOM 0 HH2 TRP A 143 -3.942 7.672 -0.176 1.00 0.00 H new ATOM 2146 N ALA A 144 -10.378 14.349 -2.257 1.00 0.00 N ATOM 2147 CA ALA A 144 -11.401 14.932 -3.127 1.00 0.00 C ATOM 2148 C ALA A 144 -10.883 15.124 -4.548 1.00 0.00 C ATOM 2149 O ALA A 144 -11.468 14.618 -5.509 1.00 0.00 O ATOM 2150 CB ALA A 144 -11.884 16.259 -2.564 1.00 0.00 C ATOM 0 H ALA A 144 -10.325 14.774 -1.332 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.238 14.235 -3.165 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -12.644 16.679 -3.223 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -12.310 16.100 -1.573 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -11.045 16.951 -2.492 1.00 0.00 H new ATOM 2156 N GLU A 145 -9.782 15.854 -4.674 1.00 0.00 N ATOM 2157 CA GLU A 145 -9.188 16.104 -5.977 1.00 0.00 C ATOM 2158 C GLU A 145 -8.829 14.789 -6.654 1.00 0.00 C ATOM 2159 O GLU A 145 -8.923 14.670 -7.869 1.00 0.00 O ATOM 2160 CB GLU A 145 -7.947 16.990 -5.843 1.00 0.00 C ATOM 2161 CG GLU A 145 -8.245 18.473 -6.005 1.00 0.00 C ATOM 2162 CD GLU A 145 -7.777 19.018 -7.341 1.00 0.00 C ATOM 2163 OE1 GLU A 145 -6.773 18.501 -7.874 1.00 0.00 O ATOM 2164 OE2 GLU A 145 -8.414 19.964 -7.850 1.00 0.00 O ATOM 0 H GLU A 145 -9.285 16.281 -3.892 1.00 0.00 H new ATOM 0 HA GLU A 145 -9.918 16.627 -6.594 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -7.493 16.822 -4.866 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -7.213 16.690 -6.591 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -9.318 18.638 -5.905 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -7.761 19.027 -5.201 1.00 0.00 H new ATOM 2171 N PHE A 146 -8.425 13.801 -5.854 1.00 0.00 N ATOM 2172 CA PHE A 146 -8.060 12.489 -6.380 1.00 0.00 C ATOM 2173 C PHE A 146 -9.286 11.752 -6.899 1.00 0.00 C ATOM 2174 O PHE A 146 -9.329 11.340 -8.057 1.00 0.00 O ATOM 2175 CB PHE A 146 -7.361 11.649 -5.295 1.00 0.00 C ATOM 2176 CG PHE A 146 -7.907 10.250 -5.131 1.00 0.00 C ATOM 2177 CD1 PHE A 146 -7.606 9.252 -6.047 1.00 0.00 C ATOM 2178 CD2 PHE A 146 -8.720 9.938 -4.056 1.00 0.00 C ATOM 2179 CE1 PHE A 146 -8.108 7.970 -5.889 1.00 0.00 C ATOM 2180 CE2 PHE A 146 -9.226 8.661 -3.892 1.00 0.00 C ATOM 2181 CZ PHE A 146 -8.920 7.675 -4.807 1.00 0.00 C ATOM 0 H PHE A 146 -8.343 13.886 -4.841 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.370 12.639 -7.210 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -6.299 11.585 -5.532 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -7.443 12.171 -4.342 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -6.973 9.477 -6.893 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -8.963 10.703 -3.334 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -7.866 7.202 -6.609 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -9.861 8.436 -3.048 1.00 0.00 H new ATOM 0 HZ PHE A 146 -9.312 6.677 -4.680 1.00 0.00 H new ATOM 2191 N THR A 147 -10.272 11.568 -6.027 1.00 0.00 N ATOM 2192 CA THR A 147 -11.488 10.858 -6.393 1.00 0.00 C ATOM 2193 C THR A 147 -12.026 11.337 -7.733 1.00 0.00 C ATOM 2194 O THR A 147 -12.581 10.560 -8.511 1.00 0.00 O ATOM 2195 CB THR A 147 -12.559 11.006 -5.315 1.00 0.00 C ATOM 2196 OG1 THR A 147 -11.973 11.067 -4.024 1.00 0.00 O ATOM 2197 CG2 THR A 147 -13.549 9.862 -5.317 1.00 0.00 C ATOM 0 H THR A 147 -10.251 11.901 -5.063 1.00 0.00 H new ATOM 0 HA THR A 147 -11.231 9.803 -6.483 1.00 0.00 H new ATOM 0 HB THR A 147 -13.085 11.932 -5.546 1.00 0.00 H new ATOM 0 HG1 THR A 147 -11.176 10.498 -3.999 1.00 0.00 H new ATOM 0 HG21 THR A 147 -14.288 10.019 -4.531 1.00 0.00 H new ATOM 0 HG22 THR A 147 -14.051 9.817 -6.283 1.00 0.00 H new ATOM 0 HG23 THR A 147 -13.022 8.925 -5.138 1.00 0.00 H new ATOM 2205 N ALA A 148 -11.849 12.621 -7.997 1.00 0.00 N ATOM 2206 CA ALA A 148 -12.308 13.219 -9.242 1.00 0.00 C ATOM 2207 C ALA A 148 -11.226 13.160 -10.317 1.00 0.00 C ATOM 2208 O ALA A 148 -11.523 13.015 -11.503 1.00 0.00 O ATOM 2209 CB ALA A 148 -12.749 14.655 -9.003 1.00 0.00 C ATOM 0 H ALA A 148 -11.388 13.273 -7.362 1.00 0.00 H new ATOM 0 HA ALA A 148 -13.162 12.644 -9.600 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -13.090 15.092 -9.942 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -13.563 14.670 -8.279 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -11.910 15.234 -8.617 1.00 0.00 H new ATOM 2215 N LEU A 149 -9.968 13.280 -9.896 1.00 0.00 N ATOM 2216 CA LEU A 149 -8.843 13.247 -10.825 1.00 0.00 C ATOM 2217 C LEU A 149 -8.773 11.915 -11.553 1.00 0.00 C ATOM 2218 O LEU A 149 -8.677 11.869 -12.780 1.00 0.00 O ATOM 2219 CB LEU A 149 -7.522 13.498 -10.090 1.00 0.00 C ATOM 2220 CG LEU A 149 -6.523 14.384 -10.834 1.00 0.00 C ATOM 2221 CD1 LEU A 149 -6.320 13.891 -12.259 1.00 0.00 C ATOM 2222 CD2 LEU A 149 -6.986 15.833 -10.827 1.00 0.00 C ATOM 0 H LEU A 149 -9.704 13.401 -8.918 1.00 0.00 H new ATOM 0 HA LEU A 149 -9.001 14.039 -11.557 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -7.742 13.956 -9.126 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -7.050 12.537 -9.886 1.00 0.00 H new ATOM 0 HG LEU A 149 -5.565 14.327 -10.317 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -5.605 14.537 -12.769 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -5.938 12.870 -12.240 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -7.271 13.912 -12.790 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -6.262 16.449 -11.361 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -7.957 15.907 -11.317 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -7.071 16.183 -9.798 1.00 0.00 H new ATOM 2234 N TYR A 150 -8.805 10.830 -10.792 1.00 0.00 N ATOM 2235 CA TYR A 150 -8.732 9.495 -11.364 1.00 0.00 C ATOM 2236 C TYR A 150 -10.124 8.961 -11.694 1.00 0.00 C ATOM 2237 O TYR A 150 -10.353 7.752 -11.687 1.00 0.00 O ATOM 2238 CB TYR A 150 -8.016 8.549 -10.390 1.00 0.00 C ATOM 2239 CG TYR A 150 -8.931 7.920 -9.359 1.00 0.00 C ATOM 2240 CD1 TYR A 150 -10.040 8.604 -8.870 1.00 0.00 C ATOM 2241 CD2 TYR A 150 -8.690 6.641 -8.883 1.00 0.00 C ATOM 2242 CE1 TYR A 150 -10.876 8.029 -7.938 1.00 0.00 C ATOM 2243 CE2 TYR A 150 -9.524 6.061 -7.948 1.00 0.00 C ATOM 2244 CZ TYR A 150 -10.614 6.762 -7.480 1.00 0.00 C ATOM 2245 OH TYR A 150 -11.441 6.193 -6.546 1.00 0.00 O ATOM 0 H TYR A 150 -8.881 10.849 -9.775 1.00 0.00 H new ATOM 0 HA TYR A 150 -8.165 9.550 -12.293 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -7.529 7.758 -10.960 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -7.230 9.101 -9.875 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.249 9.602 -9.227 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -7.837 6.089 -9.249 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -11.733 8.573 -7.570 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.323 5.064 -7.586 1.00 0.00 H new ATOM 0 HH TYR A 150 -12.250 5.858 -6.986 1.00 0.00 H new ATOM 2255 N GLY A 151 -11.055 9.869 -11.976 1.00 0.00 N ATOM 2256 CA GLY A 151 -12.411 9.463 -12.292 1.00 0.00 C ATOM 2257 C GLY A 151 -12.476 8.558 -13.504 1.00 0.00 C ATOM 2258 O GLY A 151 -13.016 7.455 -13.435 1.00 0.00 O ATOM 0 H GLY A 151 -10.894 10.876 -11.991 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -12.842 8.948 -11.434 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -13.020 10.349 -12.471 1.00 0.00 H new ATOM 2262 N ASP A 152 -11.920 9.022 -14.616 1.00 0.00 N ATOM 2263 CA ASP A 152 -11.916 8.241 -15.846 1.00 0.00 C ATOM 2264 C ASP A 152 -10.617 8.441 -16.617 1.00 0.00 C ATOM 2265 O ASP A 152 -10.126 9.562 -16.751 1.00 0.00 O ATOM 2266 CB ASP A 152 -13.110 8.627 -16.721 1.00 0.00 C ATOM 2267 CG ASP A 152 -13.227 7.759 -17.959 1.00 0.00 C ATOM 2268 OD1 ASP A 152 -12.433 6.804 -18.094 1.00 0.00 O ATOM 2269 OD2 ASP A 152 -14.112 8.036 -18.796 1.00 0.00 O ATOM 0 H ASP A 152 -11.467 9.933 -14.691 1.00 0.00 H new ATOM 0 HA ASP A 152 -11.995 7.187 -15.578 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -14.026 8.546 -16.136 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -13.015 9.671 -17.021 1.00 0.00 H new ATOM 2274 N GLY A 153 -10.064 7.344 -17.124 1.00 0.00 N ATOM 2275 CA GLY A 153 -8.826 7.416 -17.878 1.00 0.00 C ATOM 2276 C GLY A 153 -8.123 6.078 -17.962 1.00 0.00 C ATOM 2277 O GLY A 153 -8.231 5.254 -17.053 1.00 0.00 O ATOM 0 H GLY A 153 -10.452 6.406 -17.026 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -9.037 7.776 -18.885 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -8.162 8.144 -17.412 1.00 0.00 H new ATOM 2281 N ALA A 154 -7.403 5.858 -19.058 1.00 0.00 N ATOM 2282 CA ALA A 154 -6.680 4.608 -19.264 1.00 0.00 C ATOM 2283 C ALA A 154 -5.875 4.227 -18.031 1.00 0.00 C ATOM 2284 O ALA A 154 -5.056 5.006 -17.546 1.00 0.00 O ATOM 2285 CB ALA A 154 -5.764 4.722 -20.473 1.00 0.00 C ATOM 0 H ALA A 154 -7.305 6.531 -19.818 1.00 0.00 H new ATOM 0 HA ALA A 154 -7.413 3.822 -19.445 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -5.231 3.782 -20.615 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -6.358 4.940 -21.360 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -5.046 5.526 -20.311 1.00 0.00 H new ATOM 2291 N LEU A 155 -6.114 3.023 -17.526 1.00 0.00 N ATOM 2292 CA LEU A 155 -5.407 2.545 -16.348 1.00 0.00 C ATOM 2293 C LEU A 155 -3.902 2.556 -16.586 1.00 0.00 C ATOM 2294 O LEU A 155 -3.143 3.139 -15.816 1.00 0.00 O ATOM 2295 CB LEU A 155 -5.880 1.137 -15.972 1.00 0.00 C ATOM 2296 CG LEU A 155 -6.549 1.027 -14.597 1.00 0.00 C ATOM 2297 CD1 LEU A 155 -7.567 2.143 -14.402 1.00 0.00 C ATOM 2298 CD2 LEU A 155 -7.212 -0.332 -14.433 1.00 0.00 C ATOM 0 H LEU A 155 -6.789 2.363 -17.913 1.00 0.00 H new ATOM 0 HA LEU A 155 -5.629 3.216 -15.518 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -6.582 0.791 -16.730 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -5.024 0.463 -15.999 1.00 0.00 H new ATOM 0 HG LEU A 155 -5.778 1.130 -13.834 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -8.030 2.046 -13.420 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -7.066 3.109 -14.473 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -8.334 2.074 -15.173 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -7.682 -0.392 -13.451 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -7.969 -0.463 -15.206 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -6.461 -1.117 -14.524 1.00 0.00 H new ATOM 2310 N GLU A 156 -3.476 1.921 -17.670 1.00 0.00 N ATOM 2311 CA GLU A 156 -2.060 1.864 -18.018 1.00 0.00 C ATOM 2312 C GLU A 156 -1.394 3.243 -17.928 1.00 0.00 C ATOM 2313 O GLU A 156 -0.178 3.341 -17.776 1.00 0.00 O ATOM 2314 CB GLU A 156 -1.892 1.274 -19.422 1.00 0.00 C ATOM 2315 CG GLU A 156 -1.224 -0.086 -19.417 1.00 0.00 C ATOM 2316 CD GLU A 156 -2.191 -1.213 -19.117 1.00 0.00 C ATOM 2317 OE1 GLU A 156 -3.383 -1.078 -19.459 1.00 0.00 O ATOM 2318 OE2 GLU A 156 -1.755 -2.229 -18.536 1.00 0.00 O ATOM 0 H GLU A 156 -4.091 1.437 -18.325 1.00 0.00 H new ATOM 0 HA GLU A 156 -1.562 1.218 -17.295 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -2.871 1.190 -19.894 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -1.302 1.960 -20.030 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -0.759 -0.261 -20.387 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -0.426 -0.091 -18.675 1.00 0.00 H new ATOM 2325 N GLU A 157 -2.200 4.298 -18.018 1.00 0.00 N ATOM 2326 CA GLU A 157 -1.691 5.668 -17.942 1.00 0.00 C ATOM 2327 C GLU A 157 -0.968 5.929 -16.614 1.00 0.00 C ATOM 2328 O GLU A 157 0.256 6.062 -16.584 1.00 0.00 O ATOM 2329 CB GLU A 157 -2.841 6.660 -18.122 1.00 0.00 C ATOM 2330 CG GLU A 157 -2.390 8.091 -18.366 1.00 0.00 C ATOM 2331 CD GLU A 157 -3.344 8.855 -19.266 1.00 0.00 C ATOM 2332 OE1 GLU A 157 -4.465 8.357 -19.502 1.00 0.00 O ATOM 2333 OE2 GLU A 157 -2.969 9.950 -19.734 1.00 0.00 O ATOM 0 H GLU A 157 -3.210 4.232 -18.144 1.00 0.00 H new ATOM 0 HA GLU A 157 -0.966 5.803 -18.745 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -3.459 6.337 -18.960 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -3.471 6.635 -17.233 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -2.303 8.609 -17.411 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -1.397 8.084 -18.816 1.00 0.00 H new ATOM 2340 N ALA A 158 -1.728 6.010 -15.518 1.00 0.00 N ATOM 2341 CA ALA A 158 -1.149 6.268 -14.198 1.00 0.00 C ATOM 2342 C ALA A 158 -0.014 5.297 -13.882 1.00 0.00 C ATOM 2343 O ALA A 158 1.012 5.694 -13.333 1.00 0.00 O ATOM 2344 CB ALA A 158 -2.217 6.203 -13.123 1.00 0.00 C ATOM 0 H ALA A 158 -2.742 5.901 -15.519 1.00 0.00 H new ATOM 0 HA ALA A 158 -0.730 7.274 -14.215 1.00 0.00 H new ATOM 0 HB1 ALA A 158 -1.766 6.397 -12.150 1.00 0.00 H new ATOM 0 HB2 ALA A 158 -2.982 6.953 -13.325 1.00 0.00 H new ATOM 0 HB3 ALA A 158 -2.671 5.212 -13.121 1.00 0.00 H new ATOM 2350 N ARG A 159 -0.189 4.029 -14.250 1.00 0.00 N ATOM 2351 CA ARG A 159 0.840 3.013 -14.021 1.00 0.00 C ATOM 2352 C ARG A 159 2.181 3.515 -14.533 1.00 0.00 C ATOM 2353 O ARG A 159 3.025 3.955 -13.758 1.00 0.00 O ATOM 2354 CB ARG A 159 0.455 1.714 -14.736 1.00 0.00 C ATOM 2355 CG ARG A 159 1.601 0.738 -14.963 1.00 0.00 C ATOM 2356 CD ARG A 159 1.613 0.241 -16.397 1.00 0.00 C ATOM 2357 NE ARG A 159 2.724 0.792 -17.163 1.00 0.00 N ATOM 2358 CZ ARG A 159 2.795 0.750 -18.489 1.00 0.00 C ATOM 2359 NH1 ARG A 159 1.864 0.117 -19.185 1.00 0.00 N ATOM 2360 NH2 ARG A 159 3.811 1.318 -19.116 1.00 0.00 N ATOM 0 H ARG A 159 -1.031 3.680 -14.707 1.00 0.00 H new ATOM 0 HA ARG A 159 0.921 2.817 -12.952 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -0.319 1.213 -14.154 1.00 0.00 H new ATOM 0 HB3 ARG A 159 0.016 1.965 -15.701 1.00 0.00 H new ATOM 0 HG2 ARG A 159 2.549 1.225 -14.735 1.00 0.00 H new ATOM 0 HG3 ARG A 159 1.504 -0.107 -14.282 1.00 0.00 H new ATOM 0 HD2 ARG A 159 1.675 -0.847 -16.402 1.00 0.00 H new ATOM 0 HD3 ARG A 159 0.673 0.509 -16.880 1.00 0.00 H new ATOM 0 HE ARG A 159 3.489 1.234 -16.653 1.00 0.00 H new ATOM 0 HH11 ARG A 159 1.090 -0.340 -18.703 1.00 0.00 H new ATOM 0 HH12 ARG A 159 1.921 0.086 -20.203 1.00 0.00 H new ATOM 0 HH21 ARG A 159 4.541 1.789 -18.582 1.00 0.00 H new ATOM 0 HH22 ARG A 159 3.865 1.285 -20.134 1.00 0.00 H new ATOM 2374 N ARG A 160 2.362 3.443 -15.850 1.00 0.00 N ATOM 2375 CA ARG A 160 3.593 3.890 -16.488 1.00 0.00 C ATOM 2376 C ARG A 160 4.108 5.167 -15.841 1.00 0.00 C ATOM 2377 O ARG A 160 5.310 5.394 -15.758 1.00 0.00 O ATOM 2378 CB ARG A 160 3.362 4.126 -17.974 1.00 0.00 C ATOM 2379 CG ARG A 160 4.651 4.282 -18.756 1.00 0.00 C ATOM 2380 CD ARG A 160 4.504 5.282 -19.883 1.00 0.00 C ATOM 2381 NE ARG A 160 4.967 6.608 -19.487 1.00 0.00 N ATOM 2382 CZ ARG A 160 6.248 6.917 -19.306 1.00 0.00 C ATOM 2383 NH1 ARG A 160 7.192 6.006 -19.516 1.00 0.00 N ATOM 2384 NH2 ARG A 160 6.587 8.137 -18.915 1.00 0.00 N ATOM 0 H ARG A 160 1.665 3.076 -16.498 1.00 0.00 H new ATOM 0 HA ARG A 160 4.342 3.108 -16.360 1.00 0.00 H new ATOM 0 HB2 ARG A 160 2.793 3.292 -18.385 1.00 0.00 H new ATOM 0 HB3 ARG A 160 2.754 5.021 -18.104 1.00 0.00 H new ATOM 0 HG2 ARG A 160 5.447 4.604 -18.085 1.00 0.00 H new ATOM 0 HG3 ARG A 160 4.949 3.316 -19.163 1.00 0.00 H new ATOM 0 HD2 ARG A 160 5.071 4.941 -20.749 1.00 0.00 H new ATOM 0 HD3 ARG A 160 3.459 5.337 -20.188 1.00 0.00 H new ATOM 0 HE ARG A 160 4.270 7.338 -19.341 1.00 0.00 H new ATOM 0 HH11 ARG A 160 6.935 5.066 -19.817 1.00 0.00 H new ATOM 0 HH12 ARG A 160 8.173 6.247 -19.376 1.00 0.00 H new ATOM 0 HH21 ARG A 160 5.865 8.839 -18.753 1.00 0.00 H new ATOM 0 HH22 ARG A 160 7.569 8.374 -18.776 1.00 0.00 H new ATOM 2398 N LEU A 161 3.185 5.984 -15.364 1.00 0.00 N ATOM 2399 CA LEU A 161 3.543 7.224 -14.703 1.00 0.00 C ATOM 2400 C LEU A 161 4.196 6.934 -13.360 1.00 0.00 C ATOM 2401 O LEU A 161 5.298 7.400 -13.080 1.00 0.00 O ATOM 2402 CB LEU A 161 2.307 8.098 -14.498 1.00 0.00 C ATOM 2403 CG LEU A 161 2.561 9.599 -14.593 1.00 0.00 C ATOM 2404 CD1 LEU A 161 1.276 10.325 -14.953 1.00 0.00 C ATOM 2405 CD2 LEU A 161 3.129 10.127 -13.281 1.00 0.00 C ATOM 0 H LEU A 161 2.182 5.810 -15.423 1.00 0.00 H new ATOM 0 HA LEU A 161 4.251 7.759 -15.337 1.00 0.00 H new ATOM 0 HB2 LEU A 161 1.558 7.823 -15.240 1.00 0.00 H new ATOM 0 HB3 LEU A 161 1.882 7.877 -13.519 1.00 0.00 H new ATOM 0 HG LEU A 161 3.294 9.782 -15.379 1.00 0.00 H new ATOM 0 HD11 LEU A 161 1.469 11.396 -15.018 1.00 0.00 H new ATOM 0 HD12 LEU A 161 0.911 9.963 -15.914 1.00 0.00 H new ATOM 0 HD13 LEU A 161 0.525 10.138 -14.185 1.00 0.00 H new ATOM 0 HD21 LEU A 161 3.304 11.199 -13.366 1.00 0.00 H new ATOM 0 HD22 LEU A 161 2.420 9.938 -12.475 1.00 0.00 H new ATOM 0 HD23 LEU A 161 4.070 9.622 -13.062 1.00 0.00 H new ATOM 2417 N ARG A 162 3.505 6.161 -12.527 1.00 0.00 N ATOM 2418 CA ARG A 162 4.028 5.824 -11.215 1.00 0.00 C ATOM 2419 C ARG A 162 5.185 4.840 -11.321 1.00 0.00 C ATOM 2420 O ARG A 162 6.293 5.135 -10.880 1.00 0.00 O ATOM 2421 CB ARG A 162 2.932 5.285 -10.289 1.00 0.00 C ATOM 2422 CG ARG A 162 2.542 6.260 -9.184 1.00 0.00 C ATOM 2423 CD ARG A 162 3.761 6.787 -8.429 1.00 0.00 C ATOM 2424 NE ARG A 162 4.390 7.929 -9.107 1.00 0.00 N ATOM 2425 CZ ARG A 162 4.855 9.016 -8.499 1.00 0.00 C ATOM 2426 NH1 ARG A 162 4.668 9.200 -7.207 1.00 0.00 N ATOM 2427 NH2 ARG A 162 5.500 9.934 -9.202 1.00 0.00 N ATOM 0 H ARG A 162 2.591 5.761 -12.738 1.00 0.00 H new ATOM 0 HA ARG A 162 4.407 6.745 -10.771 1.00 0.00 H new ATOM 0 HB2 ARG A 162 2.049 5.047 -10.882 1.00 0.00 H new ATOM 0 HB3 ARG A 162 3.273 4.353 -9.838 1.00 0.00 H new ATOM 0 HG2 ARG A 162 1.993 7.097 -9.616 1.00 0.00 H new ATOM 0 HG3 ARG A 162 1.869 5.765 -8.485 1.00 0.00 H new ATOM 0 HD2 ARG A 162 3.462 7.085 -7.424 1.00 0.00 H new ATOM 0 HD3 ARG A 162 4.492 5.986 -8.320 1.00 0.00 H new ATOM 0 HE ARG A 162 4.476 7.884 -10.122 1.00 0.00 H new ATOM 0 HH11 ARG A 162 4.161 8.504 -6.661 1.00 0.00 H new ATOM 0 HH12 ARG A 162 5.030 10.039 -6.754 1.00 0.00 H new ATOM 0 HH21 ARG A 162 5.638 9.805 -10.204 1.00 0.00 H new ATOM 0 HH22 ARG A 162 5.859 10.770 -8.741 1.00 0.00 H new ATOM 2441 N GLU A 163 4.933 3.683 -11.915 1.00 0.00 N ATOM 2442 CA GLU A 163 5.974 2.676 -12.076 1.00 0.00 C ATOM 2443 C GLU A 163 7.082 3.172 -13.001 1.00 0.00 C ATOM 2444 O GLU A 163 8.190 2.649 -12.985 1.00 0.00 O ATOM 2445 CB GLU A 163 5.378 1.377 -12.619 1.00 0.00 C ATOM 2446 CG GLU A 163 5.374 0.249 -11.601 1.00 0.00 C ATOM 2447 CD GLU A 163 6.756 -0.333 -11.374 1.00 0.00 C ATOM 2448 OE1 GLU A 163 7.744 0.426 -11.473 1.00 0.00 O ATOM 2449 OE2 GLU A 163 6.851 -1.546 -11.097 1.00 0.00 O ATOM 0 H GLU A 163 4.023 3.418 -12.292 1.00 0.00 H new ATOM 0 HA GLU A 163 6.410 2.484 -11.096 1.00 0.00 H new ATOM 0 HB2 GLU A 163 4.356 1.564 -12.949 1.00 0.00 H new ATOM 0 HB3 GLU A 163 5.944 1.064 -13.496 1.00 0.00 H new ATOM 0 HG2 GLU A 163 4.979 0.619 -10.655 1.00 0.00 H new ATOM 0 HG3 GLU A 163 4.702 -0.540 -11.940 1.00 0.00 H new ATOM 2456 N GLY A 164 6.778 4.182 -13.803 1.00 0.00 N ATOM 2457 CA GLY A 164 7.771 4.718 -14.712 1.00 0.00 C ATOM 2458 C GLY A 164 8.799 5.563 -13.999 1.00 0.00 C ATOM 2459 O GLY A 164 9.992 5.267 -14.033 1.00 0.00 O ATOM 0 H GLY A 164 5.867 4.638 -13.841 1.00 0.00 H new ATOM 0 HA2 GLY A 164 8.271 3.897 -15.226 1.00 0.00 H new ATOM 0 HA3 GLY A 164 7.276 5.318 -15.475 1.00 0.00 H new ATOM 2463 N ASN A 165 8.323 6.618 -13.353 1.00 0.00 N ATOM 2464 CA ASN A 165 9.195 7.537 -12.622 1.00 0.00 C ATOM 2465 C ASN A 165 9.821 6.852 -11.406 1.00 0.00 C ATOM 2466 O ASN A 165 11.007 7.029 -11.129 1.00 0.00 O ATOM 2467 CB ASN A 165 8.422 8.798 -12.195 1.00 0.00 C ATOM 2468 CG ASN A 165 9.319 9.873 -11.629 1.00 0.00 C ATOM 2469 OD1 ASN A 165 8.756 10.694 -10.753 1.00 0.00 O flip ATOM 2470 ND2 ASN A 165 10.497 9.974 -11.981 1.00 0.00 N flip ATOM 0 H ASN A 165 7.333 6.863 -13.318 1.00 0.00 H new ATOM 0 HA ASN A 165 10.001 7.838 -13.292 1.00 0.00 H new ATOM 0 HB2 ASN A 165 7.883 9.197 -13.055 1.00 0.00 H new ATOM 0 HB3 ASN A 165 7.675 8.525 -11.449 1.00 0.00 H new ATOM 0 HD21 ASN A 165 10.885 9.318 -12.658 1.00 0.00 H new ATOM 0 HD22 ASN A 165 11.083 10.714 -11.595 1.00 0.00 H new ATOM 2477 N TRP A 166 9.024 6.068 -10.685 1.00 0.00 N ATOM 2478 CA TRP A 166 9.521 5.361 -9.508 1.00 0.00 C ATOM 2479 C TRP A 166 10.589 4.347 -9.891 1.00 0.00 C ATOM 2480 O TRP A 166 11.732 4.441 -9.446 1.00 0.00 O ATOM 2481 CB TRP A 166 8.385 4.649 -8.778 1.00 0.00 C ATOM 2482 CG TRP A 166 7.746 5.486 -7.722 1.00 0.00 C ATOM 2483 CD1 TRP A 166 6.965 6.586 -7.911 1.00 0.00 C ATOM 2484 CD2 TRP A 166 7.834 5.293 -6.307 1.00 0.00 C ATOM 2485 NE1 TRP A 166 6.561 7.090 -6.700 1.00 0.00 N ATOM 2486 CE2 TRP A 166 7.078 6.311 -5.701 1.00 0.00 C ATOM 2487 CE3 TRP A 166 8.476 4.358 -5.494 1.00 0.00 C ATOM 2488 CZ2 TRP A 166 6.946 6.420 -4.322 1.00 0.00 C ATOM 2489 CZ3 TRP A 166 8.345 4.467 -4.123 1.00 0.00 C ATOM 2490 CH2 TRP A 166 7.584 5.491 -3.549 1.00 0.00 C ATOM 0 H TRP A 166 8.038 5.907 -10.893 1.00 0.00 H new ATOM 0 HA TRP A 166 9.960 6.105 -8.843 1.00 0.00 H new ATOM 0 HB2 TRP A 166 7.628 4.350 -9.503 1.00 0.00 H new ATOM 0 HB3 TRP A 166 8.770 3.736 -8.324 1.00 0.00 H new ATOM 0 HD1 TRP A 166 6.702 7.001 -8.873 1.00 0.00 H new ATOM 0 HE1 TRP A 166 5.971 7.912 -6.566 1.00 0.00 H new ATOM 0 HE3 TRP A 166 9.065 3.564 -5.929 1.00 0.00 H new ATOM 0 HZ2 TRP A 166 6.360 7.211 -3.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 166 8.838 3.750 -3.484 1.00 0.00 H new ATOM 0 HH2 TRP A 166 7.499 5.548 -2.474 1.00 0.00 H new ATOM 2501 N ALA A 167 10.212 3.371 -10.713 1.00 0.00 N ATOM 2502 CA ALA A 167 11.153 2.348 -11.139 1.00 0.00 C ATOM 2503 C ALA A 167 12.303 2.952 -11.941 1.00 0.00 C ATOM 2504 O ALA A 167 13.326 2.300 -12.145 1.00 0.00 O ATOM 2505 CB ALA A 167 10.451 1.261 -11.938 1.00 0.00 C ATOM 0 H ALA A 167 9.271 3.270 -11.092 1.00 0.00 H new ATOM 0 HA ALA A 167 11.574 1.893 -10.242 1.00 0.00 H new ATOM 0 HB1 ALA A 167 11.177 0.508 -12.245 1.00 0.00 H new ATOM 0 HB2 ALA A 167 9.683 0.794 -11.321 1.00 0.00 H new ATOM 0 HB3 ALA A 167 9.989 1.700 -12.822 1.00 0.00 H new ATOM 2511 N SER A 168 12.147 4.203 -12.382 1.00 0.00 N ATOM 2512 CA SER A 168 13.199 4.876 -13.146 1.00 0.00 C ATOM 2513 C SER A 168 14.432 5.149 -12.276 1.00 0.00 C ATOM 2514 O SER A 168 15.300 5.935 -12.653 1.00 0.00 O ATOM 2515 CB SER A 168 12.683 6.196 -13.732 1.00 0.00 C ATOM 2516 OG SER A 168 13.055 7.304 -12.925 1.00 0.00 O ATOM 0 H SER A 168 11.311 4.765 -12.225 1.00 0.00 H new ATOM 0 HA SER A 168 13.488 4.210 -13.959 1.00 0.00 H new ATOM 0 HB2 SER A 168 13.080 6.328 -14.739 1.00 0.00 H new ATOM 0 HB3 SER A 168 11.597 6.157 -13.820 1.00 0.00 H new ATOM 0 HG SER A 168 12.421 7.396 -12.183 1.00 0.00 H new ATOM 2522 N VAL A 169 14.505 4.504 -11.114 1.00 0.00 N ATOM 2523 CA VAL A 169 15.627 4.684 -10.205 1.00 0.00 C ATOM 2524 C VAL A 169 16.938 4.226 -10.841 1.00 0.00 C ATOM 2525 O VAL A 169 18.018 4.659 -10.440 1.00 0.00 O ATOM 2526 CB VAL A 169 15.393 3.919 -8.886 1.00 0.00 C ATOM 2527 CG1 VAL A 169 15.383 2.415 -9.126 1.00 0.00 C ATOM 2528 CG2 VAL A 169 16.438 4.298 -7.848 1.00 0.00 C ATOM 0 H VAL A 169 13.796 3.850 -10.782 1.00 0.00 H new ATOM 0 HA VAL A 169 15.702 5.750 -9.989 1.00 0.00 H new ATOM 0 HB VAL A 169 14.415 4.204 -8.498 1.00 0.00 H new ATOM 0 HG11 VAL A 169 15.216 1.897 -8.182 1.00 0.00 H new ATOM 0 HG12 VAL A 169 14.584 2.163 -9.824 1.00 0.00 H new ATOM 0 HG13 VAL A 169 16.341 2.107 -9.545 1.00 0.00 H new ATOM 0 HG21 VAL A 169 16.252 3.746 -6.927 1.00 0.00 H new ATOM 0 HG22 VAL A 169 17.431 4.052 -8.225 1.00 0.00 H new ATOM 0 HG23 VAL A 169 16.381 5.368 -7.648 1.00 0.00 H new