USER MOD reduce.3.24.130724 H: found=0, std=0, add=574, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 575 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 184 MET CE :methyl 140:sc= -2.48 (180deg=-5.51!) USER MOD Set 1.2: A 195 MET CE :methyl -144:sc= -3.25 (180deg=-3.56) USER MOD Single : A 133 ASN : amide:sc= -1.17 K(o=-1.2,f=-0.031) USER MOD Single : A 140 GLN : amide:sc= -1.41 K(o=-1.4,f=-4.4!) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot -85:sc= -0.881! USER MOD Single : A 148 GLN : amide:sc= -1.58 K(o=-1.6,f=-3.3!) USER MOD Single : A 151 SER OG : rot -61:sc= 0.184 USER MOD Single : A 159 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 SER OG : rot 71:sc= 0.075 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 176 HIS : no HE2:sc= -8.38! C(o=-8.4!,f=-9!) USER MOD Single : A 179 ASN : amide:sc=-0.00527 X(o=-0.0053,f=0) USER MOD Single : A 181 MET CE :methyl -168:sc= -7.09! (180deg=-7.59!) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 SER OG : rot 180:sc= -0.119 USER MOD Single : A 191 HIS : no HD1:sc= -0.534 K(o=-0.53,f=-2) USER MOD ----------------------------------------------------------------- ATOM 68 N ASP A 131 15.023 -6.372 1.350 1.00 0.00 N ATOM 69 CA ASP A 131 14.762 -7.529 0.501 1.00 0.00 C ATOM 70 C ASP A 131 13.375 -7.445 -0.122 1.00 0.00 C ATOM 71 O ASP A 131 12.718 -6.407 -0.061 1.00 0.00 O ATOM 72 CB ASP A 131 14.890 -8.821 1.311 1.00 0.00 C ATOM 73 CG ASP A 131 15.731 -9.866 0.605 1.00 0.00 C ATOM 74 OD1 ASP A 131 15.470 -10.130 -0.588 1.00 0.00 O ATOM 75 OD2 ASP A 131 16.650 -10.421 1.244 1.00 0.00 O ATOM 0 HA ASP A 131 15.501 -7.534 -0.300 1.00 0.00 H new ATOM 0 HB2 ASP A 131 15.334 -8.596 2.281 1.00 0.00 H new ATOM 0 HB3 ASP A 131 13.896 -9.227 1.502 1.00 0.00 H new ATOM 80 N ALA A 132 12.935 -8.544 -0.723 1.00 0.00 N ATOM 81 CA ALA A 132 11.624 -8.592 -1.357 1.00 0.00 C ATOM 82 C ALA A 132 10.596 -9.247 -0.442 1.00 0.00 C ATOM 83 O ALA A 132 9.545 -8.670 -0.161 1.00 0.00 O ATOM 84 CB ALA A 132 11.705 -9.333 -2.683 1.00 0.00 C ATOM 0 H ALA A 132 13.466 -9.413 -0.784 1.00 0.00 H new ATOM 0 HA ALA A 132 11.301 -7.568 -1.547 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.718 -9.361 -3.145 1.00 0.00 H new ATOM 0 HB2 ALA A 132 12.401 -8.819 -3.345 1.00 0.00 H new ATOM 0 HB3 ALA A 132 12.054 -10.351 -2.510 1.00 0.00 H new ATOM 90 N ASN A 133 10.904 -10.451 0.033 1.00 0.00 N ATOM 91 CA ASN A 133 10.030 -11.163 0.909 1.00 0.00 C ATOM 92 C ASN A 133 9.872 -10.395 2.208 1.00 0.00 C ATOM 93 O ASN A 133 8.796 -10.365 2.805 1.00 0.00 O ATOM 94 CB ASN A 133 10.600 -12.556 1.164 1.00 0.00 C ATOM 95 CG ASN A 133 9.830 -13.289 2.222 1.00 0.00 C ATOM 96 OD1 ASN A 133 10.393 -14.040 3.018 1.00 0.00 O ATOM 97 ND2 ASN A 133 8.530 -13.073 2.235 1.00 0.00 N ATOM 0 H ASN A 133 11.769 -10.944 -0.189 1.00 0.00 H new ATOM 0 HA ASN A 133 9.046 -11.266 0.452 1.00 0.00 H new ATOM 0 HB2 ASN A 133 10.582 -13.131 0.238 1.00 0.00 H new ATOM 0 HB3 ASN A 133 11.644 -12.472 1.467 1.00 0.00 H new ATOM 0 HD21 ASN A 133 7.943 -13.538 2.927 1.00 0.00 H new ATOM 0 HD22 ASN A 133 8.111 -12.441 1.553 1.00 0.00 H new ATOM 104 N ASP A 134 10.953 -9.753 2.624 1.00 0.00 N ATOM 105 CA ASP A 134 10.941 -8.957 3.837 1.00 0.00 C ATOM 106 C ASP A 134 9.830 -7.920 3.753 1.00 0.00 C ATOM 107 O ASP A 134 9.288 -7.488 4.771 1.00 0.00 O ATOM 108 CB ASP A 134 12.293 -8.271 4.046 1.00 0.00 C ATOM 109 CG ASP A 134 12.559 -7.948 5.503 1.00 0.00 C ATOM 110 OD1 ASP A 134 12.023 -6.932 5.994 1.00 0.00 O ATOM 111 OD2 ASP A 134 13.304 -8.711 6.154 1.00 0.00 O ATOM 0 H ASP A 134 11.849 -9.769 2.137 1.00 0.00 H new ATOM 0 HA ASP A 134 10.758 -9.612 4.689 1.00 0.00 H new ATOM 0 HB2 ASP A 134 13.087 -8.916 3.669 1.00 0.00 H new ATOM 0 HB3 ASP A 134 12.325 -7.352 3.461 1.00 0.00 H new ATOM 116 N ILE A 135 9.474 -7.545 2.525 1.00 0.00 N ATOM 117 CA ILE A 135 8.405 -6.586 2.314 1.00 0.00 C ATOM 118 C ILE A 135 7.072 -7.244 2.615 1.00 0.00 C ATOM 119 O ILE A 135 6.307 -6.762 3.441 1.00 0.00 O ATOM 120 CB ILE A 135 8.343 -6.036 0.874 1.00 0.00 C ATOM 121 CG1 ILE A 135 9.740 -5.841 0.266 1.00 0.00 C ATOM 122 CG2 ILE A 135 7.568 -4.729 0.864 1.00 0.00 C ATOM 123 CD1 ILE A 135 10.501 -4.666 0.830 1.00 0.00 C ATOM 0 H ILE A 135 9.910 -7.891 1.670 1.00 0.00 H new ATOM 0 HA ILE A 135 8.612 -5.750 2.982 1.00 0.00 H new ATOM 0 HB ILE A 135 7.830 -6.772 0.254 1.00 0.00 H new ATOM 0 HG12 ILE A 135 10.323 -6.748 0.426 1.00 0.00 H new ATOM 0 HG13 ILE A 135 9.640 -5.712 -0.812 1.00 0.00 H new ATOM 0 HG21 ILE A 135 7.524 -4.340 -0.153 1.00 0.00 H new ATOM 0 HG22 ILE A 135 6.556 -4.903 1.230 1.00 0.00 H new ATOM 0 HG23 ILE A 135 8.067 -4.005 1.508 1.00 0.00 H new ATOM 0 HD11 ILE A 135 11.476 -4.599 0.348 1.00 0.00 H new ATOM 0 HD12 ILE A 135 9.942 -3.749 0.647 1.00 0.00 H new ATOM 0 HD13 ILE A 135 10.635 -4.801 1.903 1.00 0.00 H new ATOM 135 N ARG A 136 6.809 -8.365 1.942 1.00 0.00 N ATOM 136 CA ARG A 136 5.567 -9.110 2.143 1.00 0.00 C ATOM 137 C ARG A 136 5.293 -9.288 3.628 1.00 0.00 C ATOM 138 O ARG A 136 4.216 -8.955 4.122 1.00 0.00 O ATOM 139 CB ARG A 136 5.644 -10.485 1.471 1.00 0.00 C ATOM 140 CG ARG A 136 6.313 -10.474 0.108 1.00 0.00 C ATOM 141 CD ARG A 136 6.106 -11.792 -0.619 1.00 0.00 C ATOM 142 NE ARG A 136 4.696 -12.050 -0.896 1.00 0.00 N ATOM 143 CZ ARG A 136 4.232 -13.218 -1.326 1.00 0.00 C ATOM 144 NH1 ARG A 136 5.064 -14.230 -1.531 1.00 0.00 N ATOM 145 NH2 ARG A 136 2.934 -13.375 -1.553 1.00 0.00 N ATOM 0 H ARG A 136 7.439 -8.776 1.254 1.00 0.00 H new ATOM 0 HA ARG A 136 4.755 -8.540 1.691 1.00 0.00 H new ATOM 0 HB2 ARG A 136 6.188 -11.167 2.125 1.00 0.00 H new ATOM 0 HB3 ARG A 136 4.635 -10.882 1.365 1.00 0.00 H new ATOM 0 HG2 ARG A 136 5.909 -9.658 -0.491 1.00 0.00 H new ATOM 0 HG3 ARG A 136 7.380 -10.285 0.226 1.00 0.00 H new ATOM 0 HD2 ARG A 136 6.663 -11.780 -1.556 1.00 0.00 H new ATOM 0 HD3 ARG A 136 6.512 -12.605 -0.017 1.00 0.00 H new ATOM 0 HE ARG A 136 4.030 -11.291 -0.751 1.00 0.00 H new ATOM 0 HH11 ARG A 136 6.062 -14.112 -1.358 1.00 0.00 H new ATOM 0 HH12 ARG A 136 4.706 -15.126 -1.861 1.00 0.00 H new ATOM 0 HH21 ARG A 136 2.291 -12.598 -1.397 1.00 0.00 H new ATOM 0 HH22 ARG A 136 2.579 -14.272 -1.883 1.00 0.00 H new ATOM 159 N ALA A 137 6.288 -9.809 4.334 1.00 0.00 N ATOM 160 CA ALA A 137 6.175 -10.027 5.764 1.00 0.00 C ATOM 161 C ALA A 137 5.734 -8.750 6.468 1.00 0.00 C ATOM 162 O ALA A 137 4.986 -8.793 7.446 1.00 0.00 O ATOM 163 CB ALA A 137 7.500 -10.516 6.319 1.00 0.00 C ATOM 0 H ALA A 137 7.184 -10.088 3.935 1.00 0.00 H new ATOM 0 HA ALA A 137 5.418 -10.790 5.945 1.00 0.00 H new ATOM 0 HB1 ALA A 137 7.407 -10.677 7.393 1.00 0.00 H new ATOM 0 HB2 ALA A 137 7.774 -11.453 5.834 1.00 0.00 H new ATOM 0 HB3 ALA A 137 8.271 -9.770 6.130 1.00 0.00 H new ATOM 169 N ARG A 138 6.194 -7.612 5.955 1.00 0.00 N ATOM 170 CA ARG A 138 5.836 -6.319 6.528 1.00 0.00 C ATOM 171 C ARG A 138 4.490 -5.856 5.982 1.00 0.00 C ATOM 172 O ARG A 138 3.690 -5.250 6.695 1.00 0.00 O ATOM 173 CB ARG A 138 6.914 -5.280 6.212 1.00 0.00 C ATOM 174 CG ARG A 138 7.340 -4.460 7.418 1.00 0.00 C ATOM 175 CD ARG A 138 7.827 -3.080 7.009 1.00 0.00 C ATOM 176 NE ARG A 138 8.281 -2.296 8.155 1.00 0.00 N ATOM 177 CZ ARG A 138 7.465 -1.810 9.085 1.00 0.00 C ATOM 178 NH1 ARG A 138 6.160 -2.025 9.003 1.00 0.00 N ATOM 179 NH2 ARG A 138 7.955 -1.107 10.097 1.00 0.00 N ATOM 0 H ARG A 138 6.813 -7.559 5.146 1.00 0.00 H new ATOM 0 HA ARG A 138 5.760 -6.428 7.610 1.00 0.00 H new ATOM 0 HB2 ARG A 138 7.787 -5.788 5.801 1.00 0.00 H new ATOM 0 HB3 ARG A 138 6.543 -4.608 5.438 1.00 0.00 H new ATOM 0 HG2 ARG A 138 6.501 -4.362 8.107 1.00 0.00 H new ATOM 0 HG3 ARG A 138 8.133 -4.983 7.953 1.00 0.00 H new ATOM 0 HD2 ARG A 138 8.643 -3.181 6.293 1.00 0.00 H new ATOM 0 HD3 ARG A 138 7.022 -2.548 6.502 1.00 0.00 H new ATOM 0 HE ARG A 138 9.280 -2.111 8.247 1.00 0.00 H new ATOM 0 HH11 ARG A 138 5.780 -2.564 8.225 1.00 0.00 H new ATOM 0 HH12 ARG A 138 5.536 -1.651 9.718 1.00 0.00 H new ATOM 0 HH21 ARG A 138 8.959 -0.939 10.162 1.00 0.00 H new ATOM 0 HH22 ARG A 138 7.328 -0.734 10.810 1.00 0.00 H new ATOM 193 N LEU A 139 4.248 -6.164 4.711 1.00 0.00 N ATOM 194 CA LEU A 139 3.005 -5.803 4.042 1.00 0.00 C ATOM 195 C LEU A 139 1.799 -6.174 4.898 1.00 0.00 C ATOM 196 O LEU A 139 0.730 -5.575 4.785 1.00 0.00 O ATOM 197 CB LEU A 139 2.922 -6.511 2.689 1.00 0.00 C ATOM 198 CG LEU A 139 3.234 -5.647 1.456 1.00 0.00 C ATOM 199 CD1 LEU A 139 4.184 -4.503 1.789 1.00 0.00 C ATOM 200 CD2 LEU A 139 3.829 -6.506 0.361 1.00 0.00 C ATOM 0 H LEU A 139 4.907 -6.669 4.119 1.00 0.00 H new ATOM 0 HA LEU A 139 2.996 -4.724 3.888 1.00 0.00 H new ATOM 0 HB2 LEU A 139 3.611 -7.355 2.700 1.00 0.00 H new ATOM 0 HB3 LEU A 139 1.918 -6.920 2.576 1.00 0.00 H new ATOM 0 HG LEU A 139 2.296 -5.210 1.114 1.00 0.00 H new ATOM 0 HD11 LEU A 139 4.378 -3.918 0.890 1.00 0.00 H new ATOM 0 HD12 LEU A 139 3.732 -3.864 2.548 1.00 0.00 H new ATOM 0 HD13 LEU A 139 5.122 -4.908 2.168 1.00 0.00 H new ATOM 0 HD21 LEU A 139 4.047 -5.887 -0.509 1.00 0.00 H new ATOM 0 HD22 LEU A 139 4.750 -6.966 0.719 1.00 0.00 H new ATOM 0 HD23 LEU A 139 3.119 -7.285 0.083 1.00 0.00 H new ATOM 212 N GLN A 140 1.986 -7.174 5.751 1.00 0.00 N ATOM 213 CA GLN A 140 0.930 -7.647 6.631 1.00 0.00 C ATOM 214 C GLN A 140 1.077 -7.059 8.029 1.00 0.00 C ATOM 215 O GLN A 140 0.093 -6.657 8.650 1.00 0.00 O ATOM 216 CB GLN A 140 0.962 -9.172 6.688 1.00 0.00 C ATOM 217 CG GLN A 140 1.029 -9.810 5.312 1.00 0.00 C ATOM 218 CD GLN A 140 -0.170 -10.691 5.015 1.00 0.00 C ATOM 219 OE1 GLN A 140 -1.178 -10.229 4.483 1.00 0.00 O ATOM 220 NE2 GLN A 140 -0.063 -11.969 5.361 1.00 0.00 N ATOM 0 H GLN A 140 2.869 -7.676 5.850 1.00 0.00 H new ATOM 0 HA GLN A 140 -0.030 -7.319 6.233 1.00 0.00 H new ATOM 0 HB2 GLN A 140 1.824 -9.491 7.274 1.00 0.00 H new ATOM 0 HB3 GLN A 140 0.073 -9.531 7.207 1.00 0.00 H new ATOM 0 HG2 GLN A 140 1.096 -9.027 4.556 1.00 0.00 H new ATOM 0 HG3 GLN A 140 1.939 -10.405 5.236 1.00 0.00 H new ATOM 0 HE21 GLN A 140 0.793 -12.309 5.800 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -0.837 -12.611 5.187 1.00 0.00 H new ATOM 229 N THR A 141 2.312 -7.000 8.516 1.00 0.00 N ATOM 230 CA THR A 141 2.579 -6.447 9.835 1.00 0.00 C ATOM 231 C THR A 141 2.078 -5.003 9.918 1.00 0.00 C ATOM 232 O THR A 141 1.762 -4.504 10.998 1.00 0.00 O ATOM 233 CB THR A 141 4.073 -6.553 10.160 1.00 0.00 C ATOM 234 OG1 THR A 141 4.268 -6.785 11.544 1.00 0.00 O ATOM 235 CG2 THR A 141 4.860 -5.326 9.792 1.00 0.00 C ATOM 0 H THR A 141 3.140 -7.327 8.018 1.00 0.00 H new ATOM 0 HA THR A 141 2.037 -7.025 10.583 1.00 0.00 H new ATOM 0 HB THR A 141 4.436 -7.387 9.559 1.00 0.00 H new ATOM 0 HG1 THR A 141 5.227 -6.852 11.733 1.00 0.00 H new ATOM 0 HG21 THR A 141 5.908 -5.475 10.051 1.00 0.00 H new ATOM 0 HG22 THR A 141 4.773 -5.146 8.720 1.00 0.00 H new ATOM 0 HG23 THR A 141 4.470 -4.466 10.337 1.00 0.00 H new ATOM 243 N LEU A 142 2.008 -4.345 8.765 1.00 0.00 N ATOM 244 CA LEU A 142 1.545 -2.966 8.696 1.00 0.00 C ATOM 245 C LEU A 142 0.127 -2.845 9.232 1.00 0.00 C ATOM 246 O LEU A 142 -0.084 -2.471 10.385 1.00 0.00 O ATOM 247 CB LEU A 142 1.632 -2.453 7.258 1.00 0.00 C ATOM 248 CG LEU A 142 3.058 -2.171 6.769 1.00 0.00 C ATOM 249 CD1 LEU A 142 3.325 -2.876 5.449 1.00 0.00 C ATOM 250 CD2 LEU A 142 3.291 -0.674 6.631 1.00 0.00 C ATOM 0 H LEU A 142 2.267 -4.747 7.864 1.00 0.00 H new ATOM 0 HA LEU A 142 2.191 -2.350 9.322 1.00 0.00 H new ATOM 0 HB2 LEU A 142 1.173 -3.187 6.595 1.00 0.00 H new ATOM 0 HB3 LEU A 142 1.046 -1.538 7.176 1.00 0.00 H new ATOM 0 HG LEU A 142 3.755 -2.561 7.511 1.00 0.00 H new ATOM 0 HD11 LEU A 142 4.342 -2.662 5.121 1.00 0.00 H new ATOM 0 HD12 LEU A 142 3.205 -3.951 5.580 1.00 0.00 H new ATOM 0 HD13 LEU A 142 2.620 -2.521 4.698 1.00 0.00 H new ATOM 0 HD21 LEU A 142 4.308 -0.495 6.283 1.00 0.00 H new ATOM 0 HD22 LEU A 142 2.583 -0.260 5.912 1.00 0.00 H new ATOM 0 HD23 LEU A 142 3.148 -0.193 7.599 1.00 0.00 H new ATOM 262 N SER A 143 -0.838 -3.170 8.390 1.00 0.00 N ATOM 263 CA SER A 143 -2.245 -3.106 8.778 1.00 0.00 C ATOM 264 C SER A 143 -3.161 -3.364 7.587 1.00 0.00 C ATOM 265 O SER A 143 -2.738 -3.276 6.434 1.00 0.00 O ATOM 266 CB SER A 143 -2.569 -1.742 9.391 1.00 0.00 C ATOM 267 OG SER A 143 -1.573 -0.787 9.069 1.00 0.00 O ATOM 0 H SER A 143 -0.678 -3.482 7.432 1.00 0.00 H new ATOM 0 HA SER A 143 -2.418 -3.885 9.520 1.00 0.00 H new ATOM 0 HB2 SER A 143 -3.538 -1.398 9.028 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.650 -1.837 10.474 1.00 0.00 H new ATOM 0 HG SER A 143 -0.840 -0.848 9.717 1.00 0.00 H new ATOM 273 N GLU A 144 -4.423 -3.676 7.875 1.00 0.00 N ATOM 274 CA GLU A 144 -5.407 -3.937 6.829 1.00 0.00 C ATOM 275 C GLU A 144 -5.386 -2.829 5.785 1.00 0.00 C ATOM 276 O GLU A 144 -5.722 -3.049 4.624 1.00 0.00 O ATOM 277 CB GLU A 144 -6.807 -4.058 7.435 1.00 0.00 C ATOM 278 CG GLU A 144 -7.608 -5.229 6.889 1.00 0.00 C ATOM 279 CD GLU A 144 -8.906 -5.450 7.641 1.00 0.00 C ATOM 280 OE1 GLU A 144 -9.139 -4.743 8.643 1.00 0.00 O ATOM 281 OE2 GLU A 144 -9.688 -6.332 7.227 1.00 0.00 O ATOM 0 H GLU A 144 -4.787 -3.754 8.825 1.00 0.00 H new ATOM 0 HA GLU A 144 -5.149 -4.878 6.343 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -6.718 -4.162 8.516 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -7.356 -3.135 7.248 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -7.828 -5.054 5.836 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -7.003 -6.134 6.942 1.00 0.00 H new ATOM 288 N ARG A 145 -4.976 -1.640 6.209 1.00 0.00 N ATOM 289 CA ARG A 145 -4.896 -0.494 5.317 1.00 0.00 C ATOM 290 C ARG A 145 -3.786 -0.704 4.293 1.00 0.00 C ATOM 291 O ARG A 145 -3.948 -0.399 3.112 1.00 0.00 O ATOM 292 CB ARG A 145 -4.638 0.793 6.112 1.00 0.00 C ATOM 293 CG ARG A 145 -5.199 0.775 7.526 1.00 0.00 C ATOM 294 CD ARG A 145 -6.641 0.295 7.548 1.00 0.00 C ATOM 295 NE ARG A 145 -7.419 0.948 8.598 1.00 0.00 N ATOM 296 CZ ARG A 145 -8.708 0.710 8.815 1.00 0.00 C ATOM 297 NH1 ARG A 145 -9.360 -0.162 8.059 1.00 0.00 N ATOM 298 NH2 ARG A 145 -9.346 1.342 9.791 1.00 0.00 N ATOM 0 H ARG A 145 -4.693 -1.446 7.169 1.00 0.00 H new ATOM 0 HA ARG A 145 -5.849 -0.395 4.796 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -3.563 0.967 6.162 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -5.072 1.634 5.571 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -4.588 0.125 8.152 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -5.141 1.776 7.954 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -7.103 0.490 6.580 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -6.662 -0.784 7.699 1.00 0.00 H new ATOM 0 HE ARG A 145 -6.946 1.624 9.198 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -8.872 -0.652 7.309 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -10.350 -0.343 8.227 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -8.847 2.012 10.376 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -10.336 1.158 9.956 1.00 0.00 H new ATOM 312 N GLU A 146 -2.660 -1.239 4.757 1.00 0.00 N ATOM 313 CA GLU A 146 -1.522 -1.500 3.886 1.00 0.00 C ATOM 314 C GLU A 146 -1.852 -2.565 2.862 1.00 0.00 C ATOM 315 O GLU A 146 -1.717 -2.346 1.660 1.00 0.00 O ATOM 316 CB GLU A 146 -0.301 -1.914 4.708 1.00 0.00 C ATOM 317 CG GLU A 146 0.995 -1.399 4.121 1.00 0.00 C ATOM 318 CD GLU A 146 1.619 -2.365 3.137 1.00 0.00 C ATOM 319 OE1 GLU A 146 1.270 -3.564 3.177 1.00 0.00 O ATOM 320 OE2 GLU A 146 2.457 -1.921 2.325 1.00 0.00 O ATOM 0 H GLU A 146 -2.513 -1.500 5.732 1.00 0.00 H new ATOM 0 HA GLU A 146 -1.289 -0.578 3.354 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -0.409 -1.540 5.726 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -0.261 -3.001 4.770 1.00 0.00 H new ATOM 0 HG2 GLU A 146 0.810 -0.448 3.621 1.00 0.00 H new ATOM 0 HG3 GLU A 146 1.701 -1.203 4.928 1.00 0.00 H new ATOM 327 N ARG A 147 -2.301 -3.708 3.337 1.00 0.00 N ATOM 328 CA ARG A 147 -2.666 -4.789 2.448 1.00 0.00 C ATOM 329 C ARG A 147 -3.761 -4.312 1.510 1.00 0.00 C ATOM 330 O ARG A 147 -3.793 -4.671 0.333 1.00 0.00 O ATOM 331 CB ARG A 147 -3.145 -6.006 3.245 1.00 0.00 C ATOM 332 CG ARG A 147 -2.306 -6.294 4.480 1.00 0.00 C ATOM 333 CD ARG A 147 -2.646 -7.649 5.079 1.00 0.00 C ATOM 334 NE ARG A 147 -4.060 -7.755 5.425 1.00 0.00 N ATOM 335 CZ ARG A 147 -4.579 -8.775 6.103 1.00 0.00 C ATOM 336 NH1 ARG A 147 -3.801 -9.772 6.502 1.00 0.00 N ATOM 337 NH2 ARG A 147 -5.874 -8.798 6.380 1.00 0.00 N ATOM 0 H ARG A 147 -2.421 -3.911 4.329 1.00 0.00 H new ATOM 0 HA ARG A 147 -1.792 -5.088 1.869 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -4.180 -5.847 3.548 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -3.134 -6.882 2.596 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -1.248 -6.266 4.218 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -2.471 -5.514 5.224 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -2.387 -8.434 4.369 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -2.041 -7.813 5.971 1.00 0.00 H new ATOM 0 HE ARG A 147 -4.685 -7.005 5.130 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -2.804 -9.757 6.289 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -4.200 -10.554 7.022 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -6.475 -8.033 6.073 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -6.270 -9.581 6.900 1.00 0.00 H new ATOM 351 N GLN A 148 -4.653 -3.484 2.047 1.00 0.00 N ATOM 352 CA GLN A 148 -5.753 -2.941 1.275 1.00 0.00 C ATOM 353 C GLN A 148 -5.254 -1.977 0.203 1.00 0.00 C ATOM 354 O GLN A 148 -5.327 -2.270 -0.991 1.00 0.00 O ATOM 355 CB GLN A 148 -6.734 -2.226 2.200 1.00 0.00 C ATOM 356 CG GLN A 148 -7.736 -3.156 2.865 1.00 0.00 C ATOM 357 CD GLN A 148 -8.561 -2.463 3.934 1.00 0.00 C ATOM 358 OE1 GLN A 148 -8.915 -3.067 4.946 1.00 0.00 O ATOM 359 NE2 GLN A 148 -8.870 -1.189 3.716 1.00 0.00 N ATOM 0 H GLN A 148 -4.630 -3.177 3.019 1.00 0.00 H new ATOM 0 HA GLN A 148 -6.259 -3.769 0.778 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -6.173 -1.699 2.972 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -7.275 -1.472 1.628 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -8.403 -3.566 2.107 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -7.204 -3.997 3.311 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -8.556 -0.727 2.863 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -9.421 -0.673 4.402 1.00 0.00 H new ATOM 368 N VAL A 149 -4.750 -0.825 0.636 1.00 0.00 N ATOM 369 CA VAL A 149 -4.243 0.181 -0.292 1.00 0.00 C ATOM 370 C VAL A 149 -3.208 -0.415 -1.230 1.00 0.00 C ATOM 371 O VAL A 149 -3.318 -0.303 -2.450 1.00 0.00 O ATOM 372 CB VAL A 149 -3.580 1.367 0.438 1.00 0.00 C ATOM 373 CG1 VAL A 149 -3.379 2.533 -0.517 1.00 0.00 C ATOM 374 CG2 VAL A 149 -4.389 1.798 1.647 1.00 0.00 C ATOM 0 H VAL A 149 -4.682 -0.565 1.620 1.00 0.00 H new ATOM 0 HA VAL A 149 -5.110 0.536 -0.850 1.00 0.00 H new ATOM 0 HB VAL A 149 -2.605 1.036 0.795 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -2.910 3.362 0.014 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -2.738 2.221 -1.342 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -4.345 2.853 -0.909 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -3.893 2.636 2.137 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -5.386 2.103 1.328 1.00 0.00 H new ATOM 0 HG23 VAL A 149 -4.471 0.965 2.346 1.00 0.00 H new ATOM 384 N LEU A 150 -2.188 -1.024 -0.641 1.00 0.00 N ATOM 385 CA LEU A 150 -1.102 -1.615 -1.406 1.00 0.00 C ATOM 386 C LEU A 150 -1.598 -2.577 -2.481 1.00 0.00 C ATOM 387 O LEU A 150 -0.882 -2.859 -3.440 1.00 0.00 O ATOM 388 CB LEU A 150 -0.125 -2.335 -0.480 1.00 0.00 C ATOM 389 CG LEU A 150 1.213 -2.707 -1.125 1.00 0.00 C ATOM 390 CD1 LEU A 150 1.735 -1.558 -1.977 1.00 0.00 C ATOM 391 CD2 LEU A 150 2.227 -3.088 -0.061 1.00 0.00 C ATOM 0 H LEU A 150 -2.091 -1.121 0.370 1.00 0.00 H new ATOM 0 HA LEU A 150 -0.592 -0.794 -1.911 1.00 0.00 H new ATOM 0 HB2 LEU A 150 0.068 -1.701 0.385 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -0.599 -3.244 -0.110 1.00 0.00 H new ATOM 0 HG LEU A 150 1.055 -3.568 -1.774 1.00 0.00 H new ATOM 0 HD11 LEU A 150 2.686 -1.842 -2.427 1.00 0.00 H new ATOM 0 HD12 LEU A 150 1.015 -1.332 -2.763 1.00 0.00 H new ATOM 0 HD13 LEU A 150 1.878 -0.677 -1.351 1.00 0.00 H new ATOM 0 HD21 LEU A 150 3.172 -3.350 -0.536 1.00 0.00 H new ATOM 0 HD22 LEU A 150 2.381 -2.246 0.613 1.00 0.00 H new ATOM 0 HD23 LEU A 150 1.857 -3.943 0.505 1.00 0.00 H new ATOM 403 N SER A 151 -2.818 -3.078 -2.328 1.00 0.00 N ATOM 404 CA SER A 151 -3.381 -4.008 -3.307 1.00 0.00 C ATOM 405 C SER A 151 -4.257 -3.287 -4.323 1.00 0.00 C ATOM 406 O SER A 151 -4.538 -3.818 -5.398 1.00 0.00 O ATOM 407 CB SER A 151 -4.173 -5.116 -2.632 1.00 0.00 C ATOM 408 OG SER A 151 -5.091 -4.596 -1.685 1.00 0.00 O ATOM 0 H SER A 151 -3.434 -2.860 -1.544 1.00 0.00 H new ATOM 0 HA SER A 151 -2.540 -4.458 -3.835 1.00 0.00 H new ATOM 0 HB2 SER A 151 -4.712 -5.690 -3.386 1.00 0.00 H new ATOM 0 HB3 SER A 151 -3.488 -5.804 -2.136 1.00 0.00 H new ATOM 0 HG SER A 151 -4.602 -4.108 -0.990 1.00 0.00 H new ATOM 414 N ALA A 152 -4.656 -2.065 -4.000 1.00 0.00 N ATOM 415 CA ALA A 152 -5.461 -1.270 -4.910 1.00 0.00 C ATOM 416 C ALA A 152 -4.542 -0.412 -5.759 1.00 0.00 C ATOM 417 O ALA A 152 -4.784 -0.185 -6.944 1.00 0.00 O ATOM 418 CB ALA A 152 -6.436 -0.399 -4.143 1.00 0.00 C ATOM 0 H ALA A 152 -4.435 -1.605 -3.117 1.00 0.00 H new ATOM 0 HA ALA A 152 -6.040 -1.934 -5.552 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -7.029 0.188 -4.844 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -7.097 -1.029 -3.548 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -5.884 0.272 -3.484 1.00 0.00 H new ATOM 424 N VAL A 153 -3.469 0.044 -5.126 1.00 0.00 N ATOM 425 CA VAL A 153 -2.471 0.858 -5.771 1.00 0.00 C ATOM 426 C VAL A 153 -1.713 0.042 -6.813 1.00 0.00 C ATOM 427 O VAL A 153 -1.481 0.496 -7.934 1.00 0.00 O ATOM 428 CB VAL A 153 -1.488 1.391 -4.721 1.00 0.00 C ATOM 429 CG1 VAL A 153 -2.201 2.285 -3.716 1.00 0.00 C ATOM 430 CG2 VAL A 153 -0.775 0.248 -4.022 1.00 0.00 C ATOM 0 H VAL A 153 -3.274 -0.147 -4.143 1.00 0.00 H new ATOM 0 HA VAL A 153 -2.964 1.693 -6.269 1.00 0.00 H new ATOM 0 HB VAL A 153 -0.738 1.993 -5.233 1.00 0.00 H new ATOM 0 HG11 VAL A 153 -1.484 2.651 -2.981 1.00 0.00 H new ATOM 0 HG12 VAL A 153 -2.651 3.131 -4.236 1.00 0.00 H new ATOM 0 HG13 VAL A 153 -2.980 1.714 -3.210 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -0.083 0.649 -3.282 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.508 -0.389 -3.526 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -0.222 -0.339 -4.755 1.00 0.00 H new ATOM 440 N VAL A 154 -1.344 -1.174 -6.425 1.00 0.00 N ATOM 441 CA VAL A 154 -0.625 -2.089 -7.295 1.00 0.00 C ATOM 442 C VAL A 154 -1.302 -2.207 -8.656 1.00 0.00 C ATOM 443 O VAL A 154 -0.652 -2.482 -9.664 1.00 0.00 O ATOM 444 CB VAL A 154 -0.547 -3.481 -6.646 1.00 0.00 C ATOM 445 CG1 VAL A 154 0.544 -3.514 -5.589 1.00 0.00 C ATOM 446 CG2 VAL A 154 -1.886 -3.862 -6.054 1.00 0.00 C ATOM 0 H VAL A 154 -1.537 -1.551 -5.497 1.00 0.00 H new ATOM 0 HA VAL A 154 0.379 -1.690 -7.440 1.00 0.00 H new ATOM 0 HB VAL A 154 -0.295 -4.211 -7.415 1.00 0.00 H new ATOM 0 HG11 VAL A 154 0.586 -4.506 -5.140 1.00 0.00 H new ATOM 0 HG12 VAL A 154 1.504 -3.284 -6.050 1.00 0.00 H new ATOM 0 HG13 VAL A 154 0.326 -2.775 -4.818 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -1.815 -4.850 -5.598 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -2.169 -3.132 -5.296 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -2.640 -3.879 -6.841 1.00 0.00 H new ATOM 456 N ALA A 155 -2.615 -2.000 -8.676 1.00 0.00 N ATOM 457 CA ALA A 155 -3.385 -2.086 -9.911 1.00 0.00 C ATOM 458 C ALA A 155 -3.332 -0.775 -10.687 1.00 0.00 C ATOM 459 O ALA A 155 -2.998 -0.757 -11.871 1.00 0.00 O ATOM 460 CB ALA A 155 -4.825 -2.464 -9.603 1.00 0.00 C ATOM 0 H ALA A 155 -3.168 -1.771 -7.850 1.00 0.00 H new ATOM 0 HA ALA A 155 -2.941 -2.861 -10.536 1.00 0.00 H new ATOM 0 HB1 ALA A 155 -5.392 -2.526 -10.532 1.00 0.00 H new ATOM 0 HB2 ALA A 155 -4.848 -3.430 -9.099 1.00 0.00 H new ATOM 0 HB3 ALA A 155 -5.269 -1.707 -8.956 1.00 0.00 H new ATOM 466 N GLY A 156 -3.663 0.321 -10.012 1.00 0.00 N ATOM 467 CA GLY A 156 -3.647 1.621 -10.658 1.00 0.00 C ATOM 468 C GLY A 156 -5.038 2.201 -10.833 1.00 0.00 C ATOM 469 O GLY A 156 -5.271 3.012 -11.728 1.00 0.00 O ATOM 0 H GLY A 156 -3.942 0.333 -9.031 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -3.042 2.309 -10.068 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -3.169 1.532 -11.633 1.00 0.00 H new ATOM 473 N LEU A 157 -5.963 1.783 -9.974 1.00 0.00 N ATOM 474 CA LEU A 157 -7.337 2.265 -10.037 1.00 0.00 C ATOM 475 C LEU A 157 -7.443 3.677 -9.464 1.00 0.00 C ATOM 476 O LEU A 157 -6.491 4.189 -8.876 1.00 0.00 O ATOM 477 CB LEU A 157 -8.266 1.320 -9.271 1.00 0.00 C ATOM 478 CG LEU A 157 -8.024 -0.169 -9.525 1.00 0.00 C ATOM 479 CD1 LEU A 157 -8.417 -0.987 -8.305 1.00 0.00 C ATOM 480 CD2 LEU A 157 -8.798 -0.632 -10.751 1.00 0.00 C ATOM 0 H LEU A 157 -5.785 1.112 -9.227 1.00 0.00 H new ATOM 0 HA LEU A 157 -7.640 2.292 -11.084 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -8.157 1.514 -8.204 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -9.297 1.555 -9.534 1.00 0.00 H new ATOM 0 HG LEU A 157 -6.961 -0.320 -9.712 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -8.239 -2.044 -8.503 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -7.821 -0.672 -7.448 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -9.474 -0.832 -8.088 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -8.615 -1.693 -10.918 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -9.864 -0.468 -10.592 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -8.471 -0.066 -11.623 1.00 0.00 H new ATOM 492 N PRO A 158 -8.608 4.328 -9.631 1.00 0.00 N ATOM 493 CA PRO A 158 -8.831 5.687 -9.128 1.00 0.00 C ATOM 494 C PRO A 158 -8.758 5.755 -7.607 1.00 0.00 C ATOM 495 O PRO A 158 -8.631 4.731 -6.935 1.00 0.00 O ATOM 496 CB PRO A 158 -10.248 6.032 -9.605 1.00 0.00 C ATOM 497 CG PRO A 158 -10.563 5.035 -10.669 1.00 0.00 C ATOM 498 CD PRO A 158 -9.792 3.796 -10.321 1.00 0.00 C ATOM 0 HA PRO A 158 -8.070 6.379 -9.490 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -10.964 5.971 -8.785 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -10.295 7.049 -9.994 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -11.633 4.830 -10.707 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -10.275 5.410 -11.651 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -10.368 3.129 -9.679 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -9.520 3.227 -11.210 1.00 0.00 H new ATOM 506 N ASN A 159 -8.844 6.967 -7.068 1.00 0.00 N ATOM 507 CA ASN A 159 -8.793 7.167 -5.626 1.00 0.00 C ATOM 508 C ASN A 159 -10.083 6.688 -4.966 1.00 0.00 C ATOM 509 O ASN A 159 -10.095 6.339 -3.786 1.00 0.00 O ATOM 510 CB ASN A 159 -8.559 8.643 -5.302 1.00 0.00 C ATOM 511 CG ASN A 159 -7.104 9.044 -5.450 1.00 0.00 C ATOM 512 OD1 ASN A 159 -6.600 9.196 -6.562 1.00 0.00 O ATOM 513 ND2 ASN A 159 -6.422 9.217 -4.323 1.00 0.00 N ATOM 0 H ASN A 159 -8.949 7.825 -7.609 1.00 0.00 H new ATOM 0 HA ASN A 159 -7.963 6.580 -5.232 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -9.171 9.258 -5.961 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -8.887 8.845 -4.282 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -5.439 9.487 -4.358 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -6.881 9.080 -3.423 1.00 0.00 H new ATOM 520 N LYS A 160 -11.165 6.674 -5.737 1.00 0.00 N ATOM 521 CA LYS A 160 -12.461 6.238 -5.230 1.00 0.00 C ATOM 522 C LYS A 160 -12.594 4.722 -5.304 1.00 0.00 C ATOM 523 O LYS A 160 -12.827 4.061 -4.292 1.00 0.00 O ATOM 524 CB LYS A 160 -13.590 6.899 -6.024 1.00 0.00 C ATOM 525 CG LYS A 160 -14.550 7.704 -5.163 1.00 0.00 C ATOM 526 CD LYS A 160 -15.583 8.431 -6.011 1.00 0.00 C ATOM 527 CE LYS A 160 -15.872 9.819 -5.467 1.00 0.00 C ATOM 528 NZ LYS A 160 -17.333 10.090 -5.380 1.00 0.00 N ATOM 0 H LYS A 160 -11.170 6.960 -6.716 1.00 0.00 H new ATOM 0 HA LYS A 160 -12.534 6.540 -4.185 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -13.156 7.554 -6.779 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -14.150 6.128 -6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -15.055 7.040 -4.462 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -13.990 8.427 -4.570 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -15.223 8.509 -7.037 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -16.505 7.851 -6.040 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -15.425 9.921 -4.478 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -15.402 10.565 -6.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -17.487 11.047 -5.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -17.756 10.018 -6.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -17.778 9.394 -4.748 1.00 0.00 H new ATOM 542 N SER A 161 -12.441 4.174 -6.507 1.00 0.00 N ATOM 543 CA SER A 161 -12.541 2.731 -6.709 1.00 0.00 C ATOM 544 C SER A 161 -11.711 1.984 -5.671 1.00 0.00 C ATOM 545 O SER A 161 -12.136 0.959 -5.141 1.00 0.00 O ATOM 546 CB SER A 161 -12.076 2.359 -8.118 1.00 0.00 C ATOM 547 OG SER A 161 -12.739 1.196 -8.584 1.00 0.00 O ATOM 0 H SER A 161 -12.248 4.706 -7.355 1.00 0.00 H new ATOM 0 HA SER A 161 -13.585 2.441 -6.593 1.00 0.00 H new ATOM 0 HB2 SER A 161 -12.268 3.188 -8.799 1.00 0.00 H new ATOM 0 HB3 SER A 161 -10.999 2.191 -8.116 1.00 0.00 H new ATOM 0 HG SER A 161 -12.425 0.980 -9.487 1.00 0.00 H new ATOM 553 N ILE A 162 -10.527 2.514 -5.384 1.00 0.00 N ATOM 554 CA ILE A 162 -9.628 1.917 -4.405 1.00 0.00 C ATOM 555 C ILE A 162 -10.264 1.897 -3.022 1.00 0.00 C ATOM 556 O ILE A 162 -10.439 0.838 -2.418 1.00 0.00 O ATOM 557 CB ILE A 162 -8.299 2.703 -4.338 1.00 0.00 C ATOM 558 CG1 ILE A 162 -7.511 2.512 -5.630 1.00 0.00 C ATOM 559 CG2 ILE A 162 -7.458 2.287 -3.133 1.00 0.00 C ATOM 560 CD1 ILE A 162 -6.445 3.559 -5.833 1.00 0.00 C ATOM 0 H ILE A 162 -10.166 3.363 -5.820 1.00 0.00 H new ATOM 0 HA ILE A 162 -9.430 0.893 -4.722 1.00 0.00 H new ATOM 0 HB ILE A 162 -8.541 3.759 -4.220 1.00 0.00 H new ATOM 0 HG12 ILE A 162 -7.047 1.526 -5.623 1.00 0.00 H new ATOM 0 HG13 ILE A 162 -8.199 2.534 -6.475 1.00 0.00 H new ATOM 0 HG21 ILE A 162 -6.532 2.861 -3.120 1.00 0.00 H new ATOM 0 HG22 ILE A 162 -8.016 2.478 -2.216 1.00 0.00 H new ATOM 0 HG23 ILE A 162 -7.225 1.224 -3.201 1.00 0.00 H new ATOM 0 HD11 ILE A 162 -5.920 3.367 -6.769 1.00 0.00 H new ATOM 0 HD12 ILE A 162 -6.907 4.546 -5.871 1.00 0.00 H new ATOM 0 HD13 ILE A 162 -5.736 3.522 -5.006 1.00 0.00 H new ATOM 572 N ALA A 163 -10.593 3.080 -2.525 1.00 0.00 N ATOM 573 CA ALA A 163 -11.192 3.213 -1.216 1.00 0.00 C ATOM 574 C ALA A 163 -12.419 2.340 -1.097 1.00 0.00 C ATOM 575 O ALA A 163 -12.674 1.751 -0.049 1.00 0.00 O ATOM 576 CB ALA A 163 -11.542 4.663 -0.943 1.00 0.00 C ATOM 0 H ALA A 163 -10.452 3.963 -3.016 1.00 0.00 H new ATOM 0 HA ALA A 163 -10.468 2.883 -0.471 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -11.992 4.749 0.046 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -10.637 5.270 -0.984 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -12.248 5.015 -1.695 1.00 0.00 H new ATOM 582 N TYR A 164 -13.184 2.245 -2.171 1.00 0.00 N ATOM 583 CA TYR A 164 -14.373 1.424 -2.132 1.00 0.00 C ATOM 584 C TYR A 164 -14.031 -0.034 -2.389 1.00 0.00 C ATOM 585 O TYR A 164 -14.742 -0.934 -1.943 1.00 0.00 O ATOM 586 CB TYR A 164 -15.443 1.919 -3.107 1.00 0.00 C ATOM 587 CG TYR A 164 -16.744 2.263 -2.412 1.00 0.00 C ATOM 588 CD1 TYR A 164 -17.144 1.565 -1.257 1.00 0.00 C ATOM 589 CD2 TYR A 164 -17.575 3.291 -2.888 1.00 0.00 C ATOM 590 CE1 TYR A 164 -18.332 1.879 -0.598 1.00 0.00 C ATOM 591 CE2 TYR A 164 -18.766 3.614 -2.232 1.00 0.00 C ATOM 592 CZ TYR A 164 -19.140 2.907 -1.087 1.00 0.00 C ATOM 593 OH TYR A 164 -20.312 3.222 -0.439 1.00 0.00 O ATOM 0 H TYR A 164 -13.007 2.715 -3.059 1.00 0.00 H new ATOM 0 HA TYR A 164 -14.792 1.506 -1.129 1.00 0.00 H new ATOM 0 HB2 TYR A 164 -15.072 2.798 -3.633 1.00 0.00 H new ATOM 0 HB3 TYR A 164 -15.628 1.152 -3.859 1.00 0.00 H new ATOM 0 HD1 TYR A 164 -16.519 0.772 -0.874 1.00 0.00 H new ATOM 0 HD2 TYR A 164 -17.289 3.839 -3.773 1.00 0.00 H new ATOM 0 HE1 TYR A 164 -18.625 1.330 0.285 1.00 0.00 H new ATOM 0 HE2 TYR A 164 -19.395 4.407 -2.609 1.00 0.00 H new ATOM 0 HH TYR A 164 -20.756 3.960 -0.906 1.00 0.00 H new ATOM 603 N ASP A 165 -12.919 -0.266 -3.075 1.00 0.00 N ATOM 604 CA ASP A 165 -12.476 -1.621 -3.341 1.00 0.00 C ATOM 605 C ASP A 165 -12.073 -2.290 -2.029 1.00 0.00 C ATOM 606 O ASP A 165 -12.044 -3.516 -1.925 1.00 0.00 O ATOM 607 CB ASP A 165 -11.298 -1.620 -4.315 1.00 0.00 C ATOM 608 CG ASP A 165 -11.706 -2.034 -5.716 1.00 0.00 C ATOM 609 OD1 ASP A 165 -12.816 -2.581 -5.874 1.00 0.00 O ATOM 610 OD2 ASP A 165 -10.913 -1.809 -6.655 1.00 0.00 O ATOM 0 H ASP A 165 -12.314 0.463 -3.453 1.00 0.00 H new ATOM 0 HA ASP A 165 -13.294 -2.179 -3.796 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -10.858 -0.623 -4.347 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -10.527 -2.298 -3.949 1.00 0.00 H new ATOM 615 N LEU A 166 -11.778 -1.464 -1.023 1.00 0.00 N ATOM 616 CA LEU A 166 -11.393 -1.955 0.289 1.00 0.00 C ATOM 617 C LEU A 166 -12.386 -1.460 1.338 1.00 0.00 C ATOM 618 O LEU A 166 -12.003 -1.043 2.432 1.00 0.00 O ATOM 619 CB LEU A 166 -9.978 -1.482 0.641 1.00 0.00 C ATOM 620 CG LEU A 166 -9.034 -1.285 -0.552 1.00 0.00 C ATOM 621 CD1 LEU A 166 -8.039 -0.172 -0.263 1.00 0.00 C ATOM 622 CD2 LEU A 166 -8.306 -2.582 -0.881 1.00 0.00 C ATOM 0 H LEU A 166 -11.801 -0.447 -1.099 1.00 0.00 H new ATOM 0 HA LEU A 166 -11.402 -3.045 0.274 1.00 0.00 H new ATOM 0 HB2 LEU A 166 -10.053 -0.539 1.183 1.00 0.00 H new ATOM 0 HB3 LEU A 166 -9.530 -2.206 1.321 1.00 0.00 H new ATOM 0 HG LEU A 166 -9.630 -0.999 -1.419 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -7.376 -0.045 -1.119 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -8.577 0.758 -0.079 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -7.449 -0.430 0.617 1.00 0.00 H new ATOM 0 HD21 LEU A 166 -7.642 -2.421 -1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -7.721 -2.900 -0.018 1.00 0.00 H new ATOM 0 HD23 LEU A 166 -9.033 -3.354 -1.131 1.00 0.00 H new ATOM 634 N ASP A 167 -13.668 -1.520 0.987 1.00 0.00 N ATOM 635 CA ASP A 167 -14.754 -1.095 1.872 1.00 0.00 C ATOM 636 C ASP A 167 -14.391 0.146 2.691 1.00 0.00 C ATOM 637 O ASP A 167 -14.442 0.116 3.920 1.00 0.00 O ATOM 638 CB ASP A 167 -15.139 -2.238 2.812 1.00 0.00 C ATOM 639 CG ASP A 167 -16.249 -1.851 3.770 1.00 0.00 C ATOM 640 OD1 ASP A 167 -17.058 -0.967 3.416 1.00 0.00 O ATOM 641 OD2 ASP A 167 -16.310 -2.432 4.873 1.00 0.00 O ATOM 0 H ASP A 167 -13.985 -1.865 0.081 1.00 0.00 H new ATOM 0 HA ASP A 167 -15.600 -0.831 1.238 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -15.455 -3.098 2.222 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -14.263 -2.547 3.382 1.00 0.00 H new ATOM 646 N ILE A 168 -14.042 1.239 2.013 1.00 0.00 N ATOM 647 CA ILE A 168 -13.691 2.477 2.702 1.00 0.00 C ATOM 648 C ILE A 168 -13.843 3.703 1.808 1.00 0.00 C ATOM 649 O ILE A 168 -14.098 3.586 0.610 1.00 0.00 O ATOM 650 CB ILE A 168 -12.270 2.431 3.261 1.00 0.00 C ATOM 651 CG1 ILE A 168 -11.283 1.979 2.194 1.00 0.00 C ATOM 652 CG2 ILE A 168 -12.232 1.502 4.458 1.00 0.00 C ATOM 653 CD1 ILE A 168 -9.891 1.799 2.732 1.00 0.00 C ATOM 0 H ILE A 168 -13.995 1.291 0.995 1.00 0.00 H new ATOM 0 HA ILE A 168 -14.396 2.566 3.529 1.00 0.00 H new ATOM 0 HB ILE A 168 -11.978 3.433 3.577 1.00 0.00 H new ATOM 0 HG12 ILE A 168 -11.626 1.039 1.762 1.00 0.00 H new ATOM 0 HG13 ILE A 168 -11.265 2.712 1.388 1.00 0.00 H new ATOM 0 HG21 ILE A 168 -11.219 1.467 4.859 1.00 0.00 H new ATOM 0 HG22 ILE A 168 -12.914 1.869 5.225 1.00 0.00 H new ATOM 0 HG23 ILE A 168 -12.536 0.501 4.151 1.00 0.00 H new ATOM 0 HD11 ILE A 168 -9.229 1.476 1.928 1.00 0.00 H new ATOM 0 HD12 ILE A 168 -9.533 2.745 3.139 1.00 0.00 H new ATOM 0 HD13 ILE A 168 -9.900 1.045 3.519 1.00 0.00 H new ATOM 665 N SER A 169 -13.698 4.880 2.410 1.00 0.00 N ATOM 666 CA SER A 169 -13.829 6.135 1.685 1.00 0.00 C ATOM 667 C SER A 169 -12.505 6.564 1.056 1.00 0.00 C ATOM 668 O SER A 169 -11.433 6.183 1.523 1.00 0.00 O ATOM 669 CB SER A 169 -14.342 7.232 2.619 1.00 0.00 C ATOM 670 OG SER A 169 -14.305 6.809 3.971 1.00 0.00 O ATOM 0 H SER A 169 -13.489 4.988 3.402 1.00 0.00 H new ATOM 0 HA SER A 169 -14.547 5.978 0.880 1.00 0.00 H new ATOM 0 HB2 SER A 169 -13.735 8.129 2.499 1.00 0.00 H new ATOM 0 HB3 SER A 169 -15.363 7.499 2.346 1.00 0.00 H new ATOM 0 HG SER A 169 -13.374 6.758 4.273 1.00 0.00 H new ATOM 676 N PRO A 170 -12.565 7.368 -0.022 1.00 0.00 N ATOM 677 CA PRO A 170 -11.367 7.849 -0.720 1.00 0.00 C ATOM 678 C PRO A 170 -10.515 8.746 0.160 1.00 0.00 C ATOM 679 O PRO A 170 -9.309 8.874 -0.047 1.00 0.00 O ATOM 680 CB PRO A 170 -11.921 8.634 -1.917 1.00 0.00 C ATOM 681 CG PRO A 170 -13.348 8.217 -2.035 1.00 0.00 C ATOM 682 CD PRO A 170 -13.798 7.868 -0.646 1.00 0.00 C ATOM 0 HA PRO A 170 -10.713 7.027 -1.012 1.00 0.00 H new ATOM 0 HB2 PRO A 170 -11.837 9.709 -1.755 1.00 0.00 H new ATOM 0 HB3 PRO A 170 -11.368 8.405 -2.828 1.00 0.00 H new ATOM 0 HG2 PRO A 170 -13.955 9.021 -2.451 1.00 0.00 H new ATOM 0 HG3 PRO A 170 -13.450 7.362 -2.704 1.00 0.00 H new ATOM 0 HD2 PRO A 170 -14.195 8.736 -0.119 1.00 0.00 H new ATOM 0 HD3 PRO A 170 -14.583 7.112 -0.653 1.00 0.00 H new ATOM 690 N ARG A 171 -11.139 9.340 1.162 1.00 0.00 N ATOM 691 CA ARG A 171 -10.432 10.189 2.094 1.00 0.00 C ATOM 692 C ARG A 171 -9.635 9.315 3.054 1.00 0.00 C ATOM 693 O ARG A 171 -8.660 9.759 3.662 1.00 0.00 O ATOM 694 CB ARG A 171 -11.420 11.064 2.861 1.00 0.00 C ATOM 695 CG ARG A 171 -11.750 12.368 2.153 1.00 0.00 C ATOM 696 CD ARG A 171 -12.210 13.436 3.133 1.00 0.00 C ATOM 697 NE ARG A 171 -12.811 14.580 2.454 1.00 0.00 N ATOM 698 CZ ARG A 171 -12.119 15.456 1.734 1.00 0.00 C ATOM 699 NH1 ARG A 171 -10.807 15.317 1.599 1.00 0.00 N ATOM 700 NH2 ARG A 171 -12.737 16.472 1.148 1.00 0.00 N ATOM 0 H ARG A 171 -12.138 9.247 1.348 1.00 0.00 H new ATOM 0 HA ARG A 171 -9.750 10.843 1.551 1.00 0.00 H new ATOM 0 HB2 ARG A 171 -12.341 10.504 3.022 1.00 0.00 H new ATOM 0 HB3 ARG A 171 -11.007 11.288 3.845 1.00 0.00 H new ATOM 0 HG2 ARG A 171 -10.872 12.722 1.614 1.00 0.00 H new ATOM 0 HG3 ARG A 171 -12.530 12.193 1.412 1.00 0.00 H new ATOM 0 HD2 ARG A 171 -12.933 13.005 3.826 1.00 0.00 H new ATOM 0 HD3 ARG A 171 -11.361 13.773 3.727 1.00 0.00 H new ATOM 0 HE ARG A 171 -13.819 14.714 2.537 1.00 0.00 H new ATOM 0 HH11 ARG A 171 -10.328 14.537 2.048 1.00 0.00 H new ATOM 0 HH12 ARG A 171 -10.277 15.990 1.046 1.00 0.00 H new ATOM 0 HH21 ARG A 171 -13.746 16.582 1.250 1.00 0.00 H new ATOM 0 HH22 ARG A 171 -12.204 17.143 0.596 1.00 0.00 H new ATOM 714 N THR A 172 -10.056 8.054 3.170 1.00 0.00 N ATOM 715 CA THR A 172 -9.389 7.104 4.031 1.00 0.00 C ATOM 716 C THR A 172 -8.107 6.613 3.364 1.00 0.00 C ATOM 717 O THR A 172 -7.041 6.641 3.972 1.00 0.00 O ATOM 718 CB THR A 172 -10.348 5.946 4.382 1.00 0.00 C ATOM 719 OG1 THR A 172 -10.928 6.156 5.656 1.00 0.00 O ATOM 720 CG2 THR A 172 -9.710 4.569 4.403 1.00 0.00 C ATOM 0 H THR A 172 -10.861 7.676 2.671 1.00 0.00 H new ATOM 0 HA THR A 172 -9.107 7.586 4.967 1.00 0.00 H new ATOM 0 HB THR A 172 -11.086 5.956 3.580 1.00 0.00 H new ATOM 0 HG1 THR A 172 -11.535 5.416 5.865 1.00 0.00 H new ATOM 0 HG21 THR A 172 -10.463 3.823 4.659 1.00 0.00 H new ATOM 0 HG22 THR A 172 -9.297 4.345 3.420 1.00 0.00 H new ATOM 0 HG23 THR A 172 -8.912 4.549 5.145 1.00 0.00 H new ATOM 728 N VAL A 173 -8.207 6.180 2.109 1.00 0.00 N ATOM 729 CA VAL A 173 -7.037 5.713 1.394 1.00 0.00 C ATOM 730 C VAL A 173 -5.976 6.800 1.384 1.00 0.00 C ATOM 731 O VAL A 173 -4.780 6.519 1.438 1.00 0.00 O ATOM 732 CB VAL A 173 -7.369 5.282 -0.050 1.00 0.00 C ATOM 733 CG1 VAL A 173 -8.530 4.302 -0.064 1.00 0.00 C ATOM 734 CG2 VAL A 173 -7.662 6.480 -0.941 1.00 0.00 C ATOM 0 H VAL A 173 -9.077 6.145 1.578 1.00 0.00 H new ATOM 0 HA VAL A 173 -6.661 4.833 1.915 1.00 0.00 H new ATOM 0 HB VAL A 173 -6.489 4.782 -0.455 1.00 0.00 H new ATOM 0 HG11 VAL A 173 -8.748 4.011 -1.092 1.00 0.00 H new ATOM 0 HG12 VAL A 173 -8.266 3.417 0.516 1.00 0.00 H new ATOM 0 HG13 VAL A 173 -9.410 4.774 0.374 1.00 0.00 H new ATOM 0 HG21 VAL A 173 -7.891 6.136 -1.950 1.00 0.00 H new ATOM 0 HG22 VAL A 173 -8.515 7.030 -0.543 1.00 0.00 H new ATOM 0 HG23 VAL A 173 -6.790 7.134 -0.970 1.00 0.00 H new ATOM 744 N GLU A 174 -6.427 8.052 1.353 1.00 0.00 N ATOM 745 CA GLU A 174 -5.515 9.178 1.379 1.00 0.00 C ATOM 746 C GLU A 174 -4.696 9.100 2.650 1.00 0.00 C ATOM 747 O GLU A 174 -3.479 9.288 2.641 1.00 0.00 O ATOM 748 CB GLU A 174 -6.282 10.499 1.314 1.00 0.00 C ATOM 749 CG GLU A 174 -6.375 11.081 -0.086 1.00 0.00 C ATOM 750 CD GLU A 174 -5.402 12.223 -0.310 1.00 0.00 C ATOM 751 OE1 GLU A 174 -5.583 13.288 0.316 1.00 0.00 O ATOM 752 OE2 GLU A 174 -4.459 12.049 -1.110 1.00 0.00 O ATOM 0 H GLU A 174 -7.414 8.305 1.310 1.00 0.00 H new ATOM 0 HA GLU A 174 -4.857 9.138 0.511 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -7.289 10.344 1.701 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -5.797 11.224 1.968 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -6.181 10.295 -0.816 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -7.391 11.435 -0.261 1.00 0.00 H new ATOM 759 N VAL A 175 -5.378 8.780 3.744 1.00 0.00 N ATOM 760 CA VAL A 175 -4.719 8.628 5.031 1.00 0.00 C ATOM 761 C VAL A 175 -3.978 7.304 5.073 1.00 0.00 C ATOM 762 O VAL A 175 -2.761 7.258 5.236 1.00 0.00 O ATOM 763 CB VAL A 175 -5.719 8.659 6.203 1.00 0.00 C ATOM 764 CG1 VAL A 175 -5.009 9.026 7.499 1.00 0.00 C ATOM 765 CG2 VAL A 175 -6.860 9.625 5.918 1.00 0.00 C ATOM 0 H VAL A 175 -6.385 8.621 3.763 1.00 0.00 H new ATOM 0 HA VAL A 175 -4.031 9.466 5.140 1.00 0.00 H new ATOM 0 HB VAL A 175 -6.145 7.662 6.316 1.00 0.00 H new ATOM 0 HG11 VAL A 175 -5.730 9.043 8.316 1.00 0.00 H new ATOM 0 HG12 VAL A 175 -4.236 8.287 7.712 1.00 0.00 H new ATOM 0 HG13 VAL A 175 -4.552 10.010 7.397 1.00 0.00 H new ATOM 0 HG21 VAL A 175 -7.552 9.629 6.760 1.00 0.00 H new ATOM 0 HG22 VAL A 175 -6.460 10.628 5.773 1.00 0.00 H new ATOM 0 HG23 VAL A 175 -7.386 9.311 5.017 1.00 0.00 H new ATOM 775 N HIS A 176 -4.738 6.229 4.910 1.00 0.00 N ATOM 776 CA HIS A 176 -4.196 4.879 4.919 1.00 0.00 C ATOM 777 C HIS A 176 -2.957 4.774 4.041 1.00 0.00 C ATOM 778 O HIS A 176 -1.918 4.287 4.479 1.00 0.00 O ATOM 779 CB HIS A 176 -5.257 3.892 4.432 1.00 0.00 C ATOM 780 CG HIS A 176 -6.364 3.669 5.415 1.00 0.00 C ATOM 781 ND1 HIS A 176 -6.621 4.525 6.466 1.00 0.00 N ATOM 782 CD2 HIS A 176 -7.284 2.679 5.505 1.00 0.00 C ATOM 783 CE1 HIS A 176 -7.651 4.070 7.159 1.00 0.00 C ATOM 784 NE2 HIS A 176 -8.071 2.952 6.596 1.00 0.00 N ATOM 0 H HIS A 176 -5.747 6.270 4.768 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.909 4.637 5.942 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.681 4.259 3.497 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.779 2.937 4.212 1.00 0.00 H new ATOM 0 HD1 HIS A 176 -6.098 5.375 6.676 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -7.380 1.832 4.842 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -8.077 4.534 8.037 1.00 0.00 H new ATOM 793 N ARG A 177 -3.078 5.223 2.797 1.00 0.00 N ATOM 794 CA ARG A 177 -1.969 5.168 1.852 1.00 0.00 C ATOM 795 C ARG A 177 -0.735 5.885 2.396 1.00 0.00 C ATOM 796 O ARG A 177 0.256 5.247 2.745 1.00 0.00 O ATOM 797 CB ARG A 177 -2.384 5.776 0.512 1.00 0.00 C ATOM 798 CG ARG A 177 -1.423 5.461 -0.618 1.00 0.00 C ATOM 799 CD ARG A 177 -1.269 6.639 -1.564 1.00 0.00 C ATOM 800 NE ARG A 177 -0.666 7.795 -0.906 1.00 0.00 N ATOM 801 CZ ARG A 177 -0.696 9.025 -1.408 1.00 0.00 C ATOM 802 NH1 ARG A 177 -1.296 9.256 -2.568 1.00 0.00 N ATOM 803 NH2 ARG A 177 -0.125 10.025 -0.751 1.00 0.00 N ATOM 0 H ARG A 177 -3.934 5.630 2.419 1.00 0.00 H new ATOM 0 HA ARG A 177 -1.709 4.120 1.704 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -3.376 5.410 0.247 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -2.462 6.858 0.621 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -0.450 5.195 -0.206 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -1.783 4.594 -1.171 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -0.653 6.343 -2.413 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -2.246 6.916 -1.960 1.00 0.00 H new ATOM 0 HE ARG A 177 -0.196 7.650 -0.012 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -1.736 8.489 -3.077 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -1.318 10.201 -2.952 1.00 0.00 H new ATOM 0 HH21 ARG A 177 0.338 9.851 0.141 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -0.149 10.969 -1.138 1.00 0.00 H new ATOM 817 N ALA A 178 -0.799 7.214 2.462 1.00 0.00 N ATOM 818 CA ALA A 178 0.321 8.014 2.959 1.00 0.00 C ATOM 819 C ALA A 178 0.923 7.405 4.223 1.00 0.00 C ATOM 820 O ALA A 178 2.142 7.391 4.400 1.00 0.00 O ATOM 821 CB ALA A 178 -0.128 9.443 3.222 1.00 0.00 C ATOM 0 H ALA A 178 -1.613 7.759 2.178 1.00 0.00 H new ATOM 0 HA ALA A 178 1.095 8.021 2.191 1.00 0.00 H new ATOM 0 HB1 ALA A 178 0.715 10.027 3.591 1.00 0.00 H new ATOM 0 HB2 ALA A 178 -0.498 9.884 2.296 1.00 0.00 H new ATOM 0 HB3 ALA A 178 -0.924 9.443 3.967 1.00 0.00 H new ATOM 827 N ASN A 179 0.061 6.883 5.086 1.00 0.00 N ATOM 828 CA ASN A 179 0.505 6.254 6.323 1.00 0.00 C ATOM 829 C ASN A 179 1.173 4.933 6.005 1.00 0.00 C ATOM 830 O ASN A 179 2.246 4.613 6.510 1.00 0.00 O ATOM 831 CB ASN A 179 -0.688 5.996 7.244 1.00 0.00 C ATOM 832 CG ASN A 179 -0.531 6.647 8.603 1.00 0.00 C ATOM 833 OD1 ASN A 179 0.434 6.388 9.324 1.00 0.00 O ATOM 834 ND2 ASN A 179 -1.486 7.498 8.960 1.00 0.00 N ATOM 0 H ASN A 179 -0.950 6.883 4.952 1.00 0.00 H new ATOM 0 HA ASN A 179 1.209 6.920 6.822 1.00 0.00 H new ATOM 0 HB2 ASN A 179 -1.595 6.370 6.770 1.00 0.00 H new ATOM 0 HB3 ASN A 179 -0.816 4.921 7.373 1.00 0.00 H new ATOM 0 HD21 ASN A 179 -1.439 7.968 9.864 1.00 0.00 H new ATOM 0 HD22 ASN A 179 -2.267 7.682 8.330 1.00 0.00 H new ATOM 841 N VAL A 180 0.507 4.181 5.150 1.00 0.00 N ATOM 842 CA VAL A 180 0.963 2.895 4.717 1.00 0.00 C ATOM 843 C VAL A 180 2.403 2.979 4.214 1.00 0.00 C ATOM 844 O VAL A 180 3.329 2.512 4.877 1.00 0.00 O ATOM 845 CB VAL A 180 -0.022 2.389 3.639 1.00 0.00 C ATOM 846 CG1 VAL A 180 0.661 1.647 2.515 1.00 0.00 C ATOM 847 CG2 VAL A 180 -1.093 1.539 4.292 1.00 0.00 C ATOM 0 H VAL A 180 -0.382 4.461 4.735 1.00 0.00 H new ATOM 0 HA VAL A 180 0.978 2.182 5.542 1.00 0.00 H new ATOM 0 HB VAL A 180 -0.483 3.262 3.176 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.084 1.318 1.791 1.00 0.00 H new ATOM 0 HG12 VAL A 180 1.376 2.307 2.025 1.00 0.00 H new ATOM 0 HG13 VAL A 180 1.185 0.780 2.917 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.788 1.182 3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.629 0.687 4.788 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -1.634 2.136 5.026 1.00 0.00 H new ATOM 857 N MET A 181 2.588 3.586 3.047 1.00 0.00 N ATOM 858 CA MET A 181 3.920 3.737 2.472 1.00 0.00 C ATOM 859 C MET A 181 4.906 4.230 3.525 1.00 0.00 C ATOM 860 O MET A 181 6.098 3.933 3.467 1.00 0.00 O ATOM 861 CB MET A 181 3.880 4.714 1.303 1.00 0.00 C ATOM 862 CG MET A 181 3.209 6.034 1.637 1.00 0.00 C ATOM 863 SD MET A 181 2.978 7.079 0.187 1.00 0.00 S ATOM 864 CE MET A 181 4.469 6.717 -0.740 1.00 0.00 C ATOM 0 H MET A 181 1.836 3.980 2.482 1.00 0.00 H new ATOM 0 HA MET A 181 4.251 2.763 2.112 1.00 0.00 H new ATOM 0 HB2 MET A 181 4.899 4.908 0.968 1.00 0.00 H new ATOM 0 HB3 MET A 181 3.354 4.249 0.470 1.00 0.00 H new ATOM 0 HG2 MET A 181 2.241 5.839 2.098 1.00 0.00 H new ATOM 0 HG3 MET A 181 3.811 6.567 2.373 1.00 0.00 H new ATOM 0 HE1 MET A 181 4.577 7.437 -1.551 1.00 0.00 H new ATOM 0 HE2 MET A 181 5.333 6.782 -0.079 1.00 0.00 H new ATOM 0 HE3 MET A 181 4.404 5.711 -1.155 1.00 0.00 H new ATOM 874 N ALA A 182 4.391 4.979 4.495 1.00 0.00 N ATOM 875 CA ALA A 182 5.216 5.509 5.571 1.00 0.00 C ATOM 876 C ALA A 182 5.524 4.424 6.598 1.00 0.00 C ATOM 877 O ALA A 182 6.645 4.327 7.098 1.00 0.00 O ATOM 878 CB ALA A 182 4.524 6.689 6.235 1.00 0.00 C ATOM 0 H ALA A 182 3.405 5.232 4.556 1.00 0.00 H new ATOM 0 HA ALA A 182 6.158 5.853 5.145 1.00 0.00 H new ATOM 0 HB1 ALA A 182 5.153 7.075 7.038 1.00 0.00 H new ATOM 0 HB2 ALA A 182 4.355 7.474 5.498 1.00 0.00 H new ATOM 0 HB3 ALA A 182 3.568 6.366 6.647 1.00 0.00 H new ATOM 884 N LYS A 183 4.520 3.607 6.903 1.00 0.00 N ATOM 885 CA LYS A 183 4.679 2.524 7.865 1.00 0.00 C ATOM 886 C LYS A 183 5.649 1.472 7.336 1.00 0.00 C ATOM 887 O LYS A 183 6.527 1.005 8.063 1.00 0.00 O ATOM 888 CB LYS A 183 3.324 1.882 8.172 1.00 0.00 C ATOM 889 CG LYS A 183 2.401 2.760 9.004 1.00 0.00 C ATOM 890 CD LYS A 183 3.136 3.398 10.172 1.00 0.00 C ATOM 891 CE LYS A 183 3.853 2.357 11.017 1.00 0.00 C ATOM 892 NZ LYS A 183 2.900 1.526 11.804 1.00 0.00 N ATOM 0 H LYS A 183 3.587 3.676 6.497 1.00 0.00 H new ATOM 0 HA LYS A 183 5.088 2.941 8.785 1.00 0.00 H new ATOM 0 HB2 LYS A 183 2.828 1.637 7.233 1.00 0.00 H new ATOM 0 HB3 LYS A 183 3.489 0.943 8.700 1.00 0.00 H new ATOM 0 HG2 LYS A 183 1.974 3.539 8.373 1.00 0.00 H new ATOM 0 HG3 LYS A 183 1.570 2.162 9.379 1.00 0.00 H new ATOM 0 HD2 LYS A 183 3.858 4.123 9.796 1.00 0.00 H new ATOM 0 HD3 LYS A 183 2.428 3.946 10.793 1.00 0.00 H new ATOM 0 HE2 LYS A 183 4.448 1.712 10.370 1.00 0.00 H new ATOM 0 HE3 LYS A 183 4.546 2.855 11.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 3.429 0.829 12.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 2.349 2.138 12.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 2.255 1.030 11.156 1.00 0.00 H new ATOM 906 N MET A 184 5.494 1.111 6.064 1.00 0.00 N ATOM 907 CA MET A 184 6.371 0.123 5.442 1.00 0.00 C ATOM 908 C MET A 184 7.789 0.672 5.265 1.00 0.00 C ATOM 909 O MET A 184 8.702 -0.067 4.898 1.00 0.00 O ATOM 910 CB MET A 184 5.812 -0.317 4.086 1.00 0.00 C ATOM 911 CG MET A 184 5.437 0.838 3.172 1.00 0.00 C ATOM 912 SD MET A 184 5.666 0.445 1.427 1.00 0.00 S ATOM 913 CE MET A 184 5.196 -1.282 1.403 1.00 0.00 C ATOM 0 H MET A 184 4.773 1.486 5.447 1.00 0.00 H new ATOM 0 HA MET A 184 6.416 -0.740 6.106 1.00 0.00 H new ATOM 0 HB2 MET A 184 6.552 -0.940 3.584 1.00 0.00 H new ATOM 0 HB3 MET A 184 4.932 -0.938 4.251 1.00 0.00 H new ATOM 0 HG2 MET A 184 4.396 1.110 3.346 1.00 0.00 H new ATOM 0 HG3 MET A 184 6.041 1.709 3.427 1.00 0.00 H new ATOM 0 HE1 MET A 184 4.616 -1.489 0.503 1.00 0.00 H new ATOM 0 HE2 MET A 184 6.092 -1.903 1.408 1.00 0.00 H new ATOM 0 HE3 MET A 184 4.593 -1.507 2.283 1.00 0.00 H new ATOM 923 N LYS A 185 7.969 1.970 5.529 1.00 0.00 N ATOM 924 CA LYS A 185 9.273 2.619 5.406 1.00 0.00 C ATOM 925 C LYS A 185 9.568 3.001 3.961 1.00 0.00 C ATOM 926 O LYS A 185 10.728 3.059 3.551 1.00 0.00 O ATOM 927 CB LYS A 185 10.388 1.722 5.951 1.00 0.00 C ATOM 928 CG LYS A 185 10.045 1.060 7.275 1.00 0.00 C ATOM 929 CD LYS A 185 10.583 1.861 8.450 1.00 0.00 C ATOM 930 CE LYS A 185 9.772 3.125 8.683 1.00 0.00 C ATOM 931 NZ LYS A 185 9.873 3.597 10.091 1.00 0.00 N ATOM 0 H LYS A 185 7.221 2.594 5.831 1.00 0.00 H new ATOM 0 HA LYS A 185 9.238 3.531 6.001 1.00 0.00 H new ATOM 0 HB2 LYS A 185 10.613 0.949 5.216 1.00 0.00 H new ATOM 0 HB3 LYS A 185 11.293 2.317 6.076 1.00 0.00 H new ATOM 0 HG2 LYS A 185 8.963 0.961 7.365 1.00 0.00 H new ATOM 0 HG3 LYS A 185 10.460 0.053 7.298 1.00 0.00 H new ATOM 0 HD2 LYS A 185 10.565 1.245 9.349 1.00 0.00 H new ATOM 0 HD3 LYS A 185 11.624 2.125 8.265 1.00 0.00 H new ATOM 0 HE2 LYS A 185 10.121 3.909 8.011 1.00 0.00 H new ATOM 0 HE3 LYS A 185 8.727 2.936 8.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 9.306 4.461 10.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 9.517 2.859 10.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 10.867 3.802 10.318 1.00 0.00 H new ATOM 945 N ALA A 186 8.517 3.273 3.192 1.00 0.00 N ATOM 946 CA ALA A 186 8.684 3.662 1.798 1.00 0.00 C ATOM 947 C ALA A 186 8.976 5.153 1.686 1.00 0.00 C ATOM 948 O ALA A 186 9.241 5.821 2.686 1.00 0.00 O ATOM 949 CB ALA A 186 7.444 3.303 0.990 1.00 0.00 C ATOM 0 H ALA A 186 7.548 3.231 3.509 1.00 0.00 H new ATOM 0 HA ALA A 186 9.534 3.113 1.391 1.00 0.00 H new ATOM 0 HB1 ALA A 186 7.588 3.601 -0.049 1.00 0.00 H new ATOM 0 HB2 ALA A 186 7.277 2.227 1.039 1.00 0.00 H new ATOM 0 HB3 ALA A 186 6.579 3.824 1.401 1.00 0.00 H new ATOM 955 N LYS A 187 8.918 5.669 0.466 1.00 0.00 N ATOM 956 CA LYS A 187 9.168 7.083 0.220 1.00 0.00 C ATOM 957 C LYS A 187 8.091 7.660 -0.693 1.00 0.00 C ATOM 958 O LYS A 187 7.571 8.748 -0.448 1.00 0.00 O ATOM 959 CB LYS A 187 10.551 7.282 -0.399 1.00 0.00 C ATOM 960 CG LYS A 187 10.687 6.679 -1.784 1.00 0.00 C ATOM 961 CD LYS A 187 10.184 7.628 -2.859 1.00 0.00 C ATOM 962 CE LYS A 187 11.329 8.204 -3.675 1.00 0.00 C ATOM 963 NZ LYS A 187 11.358 7.655 -5.059 1.00 0.00 N ATOM 0 H LYS A 187 8.699 5.128 -0.371 1.00 0.00 H new ATOM 0 HA LYS A 187 9.137 7.611 1.173 1.00 0.00 H new ATOM 0 HB2 LYS A 187 10.766 8.349 -0.453 1.00 0.00 H new ATOM 0 HB3 LYS A 187 11.301 6.839 0.257 1.00 0.00 H new ATOM 0 HG2 LYS A 187 11.732 6.434 -1.974 1.00 0.00 H new ATOM 0 HG3 LYS A 187 10.127 5.745 -1.831 1.00 0.00 H new ATOM 0 HD2 LYS A 187 9.496 7.100 -3.519 1.00 0.00 H new ATOM 0 HD3 LYS A 187 9.622 8.439 -2.396 1.00 0.00 H new ATOM 0 HE2 LYS A 187 11.234 9.289 -3.717 1.00 0.00 H new ATOM 0 HE3 LYS A 187 12.274 7.985 -3.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 187 12.154 8.074 -5.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 187 11.474 6.622 -5.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 187 10.467 7.885 -5.543 1.00 0.00 H new ATOM 977 N SER A 188 7.754 6.913 -1.739 1.00 0.00 N ATOM 978 CA SER A 188 6.730 7.334 -2.685 1.00 0.00 C ATOM 979 C SER A 188 6.003 6.119 -3.238 1.00 0.00 C ATOM 980 O SER A 188 6.487 4.998 -3.119 1.00 0.00 O ATOM 981 CB SER A 188 7.348 8.148 -3.823 1.00 0.00 C ATOM 982 OG SER A 188 6.351 8.834 -4.560 1.00 0.00 O ATOM 0 H SER A 188 8.178 6.010 -1.952 1.00 0.00 H new ATOM 0 HA SER A 188 6.013 7.968 -2.163 1.00 0.00 H new ATOM 0 HB2 SER A 188 8.061 8.865 -3.416 1.00 0.00 H new ATOM 0 HB3 SER A 188 7.905 7.486 -4.487 1.00 0.00 H new ATOM 0 HG SER A 188 6.772 9.348 -5.280 1.00 0.00 H new ATOM 988 N LEU A 189 4.839 6.341 -3.842 1.00 0.00 N ATOM 989 CA LEU A 189 4.052 5.246 -4.404 1.00 0.00 C ATOM 990 C LEU A 189 4.943 4.298 -5.201 1.00 0.00 C ATOM 991 O LEU A 189 5.079 3.125 -4.854 1.00 0.00 O ATOM 992 CB LEU A 189 2.927 5.791 -5.287 1.00 0.00 C ATOM 993 CG LEU A 189 1.548 5.831 -4.624 1.00 0.00 C ATOM 994 CD1 LEU A 189 0.992 7.246 -4.637 1.00 0.00 C ATOM 995 CD2 LEU A 189 0.595 4.872 -5.319 1.00 0.00 C ATOM 0 H LEU A 189 4.421 7.264 -3.955 1.00 0.00 H new ATOM 0 HA LEU A 189 3.606 4.688 -3.581 1.00 0.00 H new ATOM 0 HB2 LEU A 189 3.191 6.800 -5.604 1.00 0.00 H new ATOM 0 HB3 LEU A 189 2.863 5.180 -6.187 1.00 0.00 H new ATOM 0 HG LEU A 189 1.654 5.515 -3.586 1.00 0.00 H new ATOM 0 HD11 LEU A 189 0.011 7.256 -4.162 1.00 0.00 H new ATOM 0 HD12 LEU A 189 1.666 7.907 -4.092 1.00 0.00 H new ATOM 0 HD13 LEU A 189 0.900 7.591 -5.667 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -0.381 4.914 -4.834 1.00 0.00 H new ATOM 0 HD22 LEU A 189 0.492 5.156 -6.366 1.00 0.00 H new ATOM 0 HD23 LEU A 189 0.989 3.858 -5.255 1.00 0.00 H new ATOM 1007 N PRO A 190 5.579 4.801 -6.269 1.00 0.00 N ATOM 1008 CA PRO A 190 6.475 4.000 -7.101 1.00 0.00 C ATOM 1009 C PRO A 190 7.385 3.096 -6.273 1.00 0.00 C ATOM 1010 O PRO A 190 7.530 1.909 -6.567 1.00 0.00 O ATOM 1011 CB PRO A 190 7.297 5.065 -7.820 1.00 0.00 C ATOM 1012 CG PRO A 190 6.360 6.209 -7.975 1.00 0.00 C ATOM 1013 CD PRO A 190 5.491 6.199 -6.745 1.00 0.00 C ATOM 0 HA PRO A 190 5.935 3.323 -7.763 1.00 0.00 H new ATOM 0 HB2 PRO A 190 8.177 5.347 -7.241 1.00 0.00 H new ATOM 0 HB3 PRO A 190 7.652 4.708 -8.787 1.00 0.00 H new ATOM 0 HG2 PRO A 190 6.903 7.150 -8.062 1.00 0.00 H new ATOM 0 HG3 PRO A 190 5.760 6.103 -8.879 1.00 0.00 H new ATOM 0 HD2 PRO A 190 5.851 6.902 -5.994 1.00 0.00 H new ATOM 0 HD3 PRO A 190 4.464 6.480 -6.977 1.00 0.00 H new ATOM 1021 N HIS A 191 8.002 3.668 -5.242 1.00 0.00 N ATOM 1022 CA HIS A 191 8.905 2.913 -4.378 1.00 0.00 C ATOM 1023 C HIS A 191 8.138 2.089 -3.351 1.00 0.00 C ATOM 1024 O HIS A 191 8.622 1.058 -2.889 1.00 0.00 O ATOM 1025 CB HIS A 191 9.874 3.852 -3.661 1.00 0.00 C ATOM 1026 CG HIS A 191 10.774 3.144 -2.693 1.00 0.00 C ATOM 1027 ND1 HIS A 191 10.782 3.407 -1.339 1.00 0.00 N ATOM 1028 CD2 HIS A 191 11.689 2.166 -2.888 1.00 0.00 C ATOM 1029 CE1 HIS A 191 11.661 2.622 -0.744 1.00 0.00 C ATOM 1030 NE2 HIS A 191 12.225 1.859 -1.661 1.00 0.00 N ATOM 0 H HIS A 191 7.894 4.649 -4.985 1.00 0.00 H new ATOM 0 HA HIS A 191 9.468 2.231 -5.015 1.00 0.00 H new ATOM 0 HB2 HIS A 191 10.483 4.370 -4.402 1.00 0.00 H new ATOM 0 HB3 HIS A 191 9.305 4.613 -3.128 1.00 0.00 H new ATOM 0 HD2 HIS A 191 11.949 1.712 -3.832 1.00 0.00 H new ATOM 0 HE1 HIS A 191 11.881 2.607 0.313 1.00 0.00 H new ATOM 0 HE2 HIS A 191 12.943 1.155 -1.487 1.00 0.00 H new ATOM 1039 N LEU A 192 6.943 2.542 -2.997 1.00 0.00 N ATOM 1040 CA LEU A 192 6.127 1.838 -2.030 1.00 0.00 C ATOM 1041 C LEU A 192 5.586 0.556 -2.663 1.00 0.00 C ATOM 1042 O LEU A 192 5.744 -0.535 -2.113 1.00 0.00 O ATOM 1043 CB LEU A 192 5.019 2.782 -1.518 1.00 0.00 C ATOM 1044 CG LEU A 192 3.578 2.300 -1.658 1.00 0.00 C ATOM 1045 CD1 LEU A 192 3.225 1.390 -0.498 1.00 0.00 C ATOM 1046 CD2 LEU A 192 2.622 3.480 -1.723 1.00 0.00 C ATOM 0 H LEU A 192 6.521 3.394 -3.367 1.00 0.00 H new ATOM 0 HA LEU A 192 6.715 1.538 -1.163 1.00 0.00 H new ATOM 0 HB2 LEU A 192 5.207 2.985 -0.464 1.00 0.00 H new ATOM 0 HB3 LEU A 192 5.112 3.731 -2.046 1.00 0.00 H new ATOM 0 HG LEU A 192 3.484 1.738 -2.587 1.00 0.00 H new ATOM 0 HD11 LEU A 192 2.195 1.049 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 192 3.894 0.529 -0.494 1.00 0.00 H new ATOM 0 HD13 LEU A 192 3.332 1.937 0.439 1.00 0.00 H new ATOM 0 HD21 LEU A 192 1.600 3.115 -1.823 1.00 0.00 H new ATOM 0 HD22 LEU A 192 2.709 4.070 -0.810 1.00 0.00 H new ATOM 0 HD23 LEU A 192 2.870 4.103 -2.582 1.00 0.00 H new ATOM 1058 N VAL A 193 4.968 0.696 -3.830 1.00 0.00 N ATOM 1059 CA VAL A 193 4.427 -0.444 -4.550 1.00 0.00 C ATOM 1060 C VAL A 193 5.544 -1.364 -5.028 1.00 0.00 C ATOM 1061 O VAL A 193 5.417 -2.587 -4.975 1.00 0.00 O ATOM 1062 CB VAL A 193 3.584 -0.013 -5.763 1.00 0.00 C ATOM 1063 CG1 VAL A 193 2.156 0.261 -5.332 1.00 0.00 C ATOM 1064 CG2 VAL A 193 4.190 1.194 -6.460 1.00 0.00 C ATOM 0 H VAL A 193 4.830 1.592 -4.297 1.00 0.00 H new ATOM 0 HA VAL A 193 3.783 -0.976 -3.850 1.00 0.00 H new ATOM 0 HB VAL A 193 3.578 -0.830 -6.485 1.00 0.00 H new ATOM 0 HG11 VAL A 193 1.567 0.565 -6.197 1.00 0.00 H new ATOM 0 HG12 VAL A 193 1.726 -0.643 -4.900 1.00 0.00 H new ATOM 0 HG13 VAL A 193 2.147 1.058 -4.588 1.00 0.00 H new ATOM 0 HG21 VAL A 193 3.569 1.472 -7.312 1.00 0.00 H new ATOM 0 HG22 VAL A 193 4.242 2.029 -5.762 1.00 0.00 H new ATOM 0 HG23 VAL A 193 5.194 0.948 -6.807 1.00 0.00 H new ATOM 1074 N ARG A 194 6.648 -0.770 -5.485 1.00 0.00 N ATOM 1075 CA ARG A 194 7.790 -1.549 -5.959 1.00 0.00 C ATOM 1076 C ARG A 194 8.160 -2.610 -4.939 1.00 0.00 C ATOM 1077 O ARG A 194 8.399 -3.763 -5.289 1.00 0.00 O ATOM 1078 CB ARG A 194 8.987 -0.636 -6.234 1.00 0.00 C ATOM 1079 CG ARG A 194 9.089 -0.186 -7.682 1.00 0.00 C ATOM 1080 CD ARG A 194 10.269 0.748 -7.893 1.00 0.00 C ATOM 1081 NE ARG A 194 11.541 0.102 -7.583 1.00 0.00 N ATOM 1082 CZ ARG A 194 12.725 0.661 -7.807 1.00 0.00 C ATOM 1083 NH1 ARG A 194 12.799 1.872 -8.342 1.00 0.00 N ATOM 1084 NH2 ARG A 194 13.838 0.009 -7.498 1.00 0.00 N ATOM 0 H ARG A 194 6.774 0.241 -5.536 1.00 0.00 H new ATOM 0 HA ARG A 194 7.511 -2.040 -6.891 1.00 0.00 H new ATOM 0 HB2 ARG A 194 8.918 0.243 -5.593 1.00 0.00 H new ATOM 0 HB3 ARG A 194 9.903 -1.159 -5.959 1.00 0.00 H new ATOM 0 HG2 ARG A 194 9.193 -1.057 -8.328 1.00 0.00 H new ATOM 0 HG3 ARG A 194 8.168 0.318 -7.973 1.00 0.00 H new ATOM 0 HD2 ARG A 194 10.279 1.091 -8.928 1.00 0.00 H new ATOM 0 HD3 ARG A 194 10.149 1.631 -7.266 1.00 0.00 H new ATOM 0 HE ARG A 194 11.519 -0.831 -7.171 1.00 0.00 H new ATOM 0 HH11 ARG A 194 11.946 2.376 -8.582 1.00 0.00 H new ATOM 0 HH12 ARG A 194 13.709 2.299 -8.513 1.00 0.00 H new ATOM 0 HH21 ARG A 194 13.786 -0.923 -7.088 1.00 0.00 H new ATOM 0 HH22 ARG A 194 14.746 0.440 -7.671 1.00 0.00 H new ATOM 1098 N MET A 195 8.173 -2.220 -3.673 1.00 0.00 N ATOM 1099 CA MET A 195 8.474 -3.155 -2.605 1.00 0.00 C ATOM 1100 C MET A 195 7.343 -4.164 -2.496 1.00 0.00 C ATOM 1101 O MET A 195 7.551 -5.324 -2.138 1.00 0.00 O ATOM 1102 CB MET A 195 8.649 -2.417 -1.282 1.00 0.00 C ATOM 1103 CG MET A 195 9.822 -1.457 -1.281 1.00 0.00 C ATOM 1104 SD MET A 195 10.211 -0.836 0.364 1.00 0.00 S ATOM 1105 CE MET A 195 8.664 -0.040 0.786 1.00 0.00 C ATOM 0 H MET A 195 7.979 -1.268 -3.364 1.00 0.00 H new ATOM 0 HA MET A 195 9.406 -3.672 -2.831 1.00 0.00 H new ATOM 0 HB2 MET A 195 7.736 -1.865 -1.059 1.00 0.00 H new ATOM 0 HB3 MET A 195 8.784 -3.146 -0.483 1.00 0.00 H new ATOM 0 HG2 MET A 195 10.698 -1.960 -1.692 1.00 0.00 H new ATOM 0 HG3 MET A 195 9.599 -0.617 -1.939 1.00 0.00 H new ATOM 0 HE1 MET A 195 8.865 0.861 1.366 1.00 0.00 H new ATOM 0 HE2 MET A 195 8.131 0.227 -0.127 1.00 0.00 H new ATOM 0 HE3 MET A 195 8.053 -0.723 1.376 1.00 0.00 H new ATOM 1115 N ALA A 196 6.141 -3.705 -2.830 1.00 0.00 N ATOM 1116 CA ALA A 196 4.958 -4.543 -2.800 1.00 0.00 C ATOM 1117 C ALA A 196 5.081 -5.645 -3.836 1.00 0.00 C ATOM 1118 O ALA A 196 4.896 -6.823 -3.535 1.00 0.00 O ATOM 1119 CB ALA A 196 3.724 -3.695 -3.063 1.00 0.00 C ATOM 0 H ALA A 196 5.965 -2.745 -3.127 1.00 0.00 H new ATOM 0 HA ALA A 196 4.862 -5.003 -1.816 1.00 0.00 H new ATOM 0 HB1 ALA A 196 2.836 -4.327 -3.040 1.00 0.00 H new ATOM 0 HB2 ALA A 196 3.641 -2.925 -2.296 1.00 0.00 H new ATOM 0 HB3 ALA A 196 3.808 -3.224 -4.042 1.00 0.00 H new ATOM 1125 N LEU A 197 5.427 -5.251 -5.055 1.00 0.00 N ATOM 1126 CA LEU A 197 5.609 -6.210 -6.141 1.00 0.00 C ATOM 1127 C LEU A 197 6.914 -6.942 -5.934 1.00 0.00 C ATOM 1128 O LEU A 197 7.036 -8.130 -6.230 1.00 0.00 O ATOM 1129 CB LEU A 197 5.603 -5.540 -7.516 1.00 0.00 C ATOM 1130 CG LEU A 197 5.133 -4.097 -7.526 1.00 0.00 C ATOM 1131 CD1 LEU A 197 5.115 -3.541 -8.941 1.00 0.00 C ATOM 1132 CD2 LEU A 197 3.759 -3.995 -6.881 1.00 0.00 C ATOM 0 H LEU A 197 5.587 -4.278 -5.317 1.00 0.00 H new ATOM 0 HA LEU A 197 4.770 -6.906 -6.120 1.00 0.00 H new ATOM 0 HB2 LEU A 197 6.612 -5.580 -7.927 1.00 0.00 H new ATOM 0 HB3 LEU A 197 4.964 -6.119 -8.182 1.00 0.00 H new ATOM 0 HG LEU A 197 5.834 -3.497 -6.947 1.00 0.00 H new ATOM 0 HD11 LEU A 197 4.775 -2.506 -8.921 1.00 0.00 H new ATOM 0 HD12 LEU A 197 6.120 -3.585 -9.362 1.00 0.00 H new ATOM 0 HD13 LEU A 197 4.438 -4.134 -9.556 1.00 0.00 H new ATOM 0 HD21 LEU A 197 3.428 -2.956 -6.892 1.00 0.00 H new ATOM 0 HD22 LEU A 197 3.050 -4.608 -7.437 1.00 0.00 H new ATOM 0 HD23 LEU A 197 3.813 -4.348 -5.851 1.00 0.00 H new ATOM 1144 N ALA A 198 7.889 -6.218 -5.390 1.00 0.00 N ATOM 1145 CA ALA A 198 9.190 -6.789 -5.102 1.00 0.00 C ATOM 1146 C ALA A 198 9.005 -8.075 -4.319 1.00 0.00 C ATOM 1147 O ALA A 198 9.748 -9.042 -4.477 1.00 0.00 O ATOM 1148 CB ALA A 198 10.032 -5.808 -4.300 1.00 0.00 C ATOM 0 H ALA A 198 7.796 -5.233 -5.141 1.00 0.00 H new ATOM 0 HA ALA A 198 9.706 -7.001 -6.038 1.00 0.00 H new ATOM 0 HB1 ALA A 198 11.006 -6.250 -4.091 1.00 0.00 H new ATOM 0 HB2 ALA A 198 10.166 -4.890 -4.873 1.00 0.00 H new ATOM 0 HB3 ALA A 198 9.528 -5.579 -3.361 1.00 0.00 H new ATOM 1154 N GLY A 199 7.978 -8.061 -3.478 1.00 0.00 N ATOM 1155 CA GLY A 199 7.653 -9.213 -2.668 1.00 0.00 C ATOM 1156 C GLY A 199 6.637 -10.115 -3.338 1.00 0.00 C ATOM 1157 O GLY A 199 6.998 -11.044 -4.060 1.00 0.00 O ATOM 0 H GLY A 199 7.360 -7.261 -3.344 1.00 0.00 H new ATOM 0 HA2 GLY A 199 8.561 -9.780 -2.465 1.00 0.00 H new ATOM 0 HA3 GLY A 199 7.263 -8.880 -1.706 1.00 0.00 H new ATOM 1161 N GLY A 200 5.363 -9.839 -3.094 1.00 0.00 N ATOM 1162 CA GLY A 200 4.302 -10.642 -3.683 1.00 0.00 C ATOM 1163 C GLY A 200 3.019 -9.866 -3.923 1.00 0.00 C ATOM 1164 O GLY A 200 1.976 -10.458 -4.197 1.00 0.00 O ATOM 0 H GLY A 200 5.042 -9.075 -2.500 1.00 0.00 H new ATOM 0 HA2 GLY A 200 4.651 -11.053 -4.630 1.00 0.00 H new ATOM 0 HA3 GLY A 200 4.090 -11.487 -3.028 1.00 0.00 H new ATOM 1168 N PHE A 201 3.085 -8.545 -3.805 1.00 0.00 N ATOM 1169 CA PHE A 201 1.918 -7.701 -3.991 1.00 0.00 C ATOM 1170 C PHE A 201 1.896 -7.085 -5.384 1.00 0.00 C ATOM 1171 O PHE A 201 1.781 -5.871 -5.532 1.00 0.00 O ATOM 1172 CB PHE A 201 1.913 -6.602 -2.934 1.00 0.00 C ATOM 1173 CG PHE A 201 1.239 -7.007 -1.657 1.00 0.00 C ATOM 1174 CD1 PHE A 201 1.732 -8.083 -0.904 1.00 0.00 C ATOM 1175 CD2 PHE A 201 0.107 -6.322 -1.199 1.00 0.00 C ATOM 1176 CE1 PHE A 201 1.106 -8.466 0.286 1.00 0.00 C ATOM 1177 CE2 PHE A 201 -0.524 -6.700 -0.011 1.00 0.00 C ATOM 1178 CZ PHE A 201 -0.024 -7.773 0.733 1.00 0.00 C ATOM 0 H PHE A 201 3.940 -8.036 -3.580 1.00 0.00 H new ATOM 0 HA PHE A 201 1.026 -8.318 -3.885 1.00 0.00 H new ATOM 0 HB2 PHE A 201 2.941 -6.312 -2.717 1.00 0.00 H new ATOM 0 HB3 PHE A 201 1.412 -5.722 -3.338 1.00 0.00 H new ATOM 0 HD1 PHE A 201 2.604 -8.621 -1.247 1.00 0.00 H new ATOM 0 HD2 PHE A 201 -0.283 -5.492 -1.770 1.00 0.00 H new ATOM 0 HE1 PHE A 201 1.494 -9.295 0.859 1.00 0.00 H new ATOM 0 HE2 PHE A 201 -1.397 -6.164 0.332 1.00 0.00 H new ATOM 0 HZ PHE A 201 -0.510 -8.067 1.652 1.00 0.00 H new