USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 805 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 187 HIS : no HE2:sc= -0.0838 K(o=-0.2,f=-5.6!) USER MOD Set 1.2: A 191 THR OG1 : rot -150:sc= -0.114 USER MOD Set 2.1: A 177 HIS : no HE2:sc= -0.623 K(o=-0.63,f=-2) USER MOD Set 2.2: A 181 ASN : amide:sc= -0.0084 K(o=-0.63,f=-2!) USER MOD Set 3.1: A 138 MET CE :methyl 139:sc= -0.0997 (180deg=-0.719) USER MOD Set 3.2: A 154 MET CE :methyl 154:sc= -0.918 (180deg=-2.53!) USER MOD Set 4.1: A 134 MET CE :methyl -169:sc= -4 (180deg=-4.23) USER MOD Set 4.2: A 217 GLN : amide:sc= 0.159 K(o=-3.8,f=-7.2) USER MOD Single : A 128 TYR OH : rot -177:sc= 0.958 USER MOD Single : A 129 MET CE :methyl 141:sc= -2.5! (180deg=-5.52!) USER MOD Single : A 132 SER OG : rot 82:sc= 0.0312 USER MOD Single : A 135 SER OG : rot 180:sc= 0.55 USER MOD Single : A 140 HIS : no HD1:sc= -0.243 X(o=-0.24,f=-0.15) USER MOD Single : A 143 ASN :FLIP amide:sc= -0.59 F(o=-1.1,f=-0.59) USER MOD Single : A 149 TYR OH : rot -165:sc= 1.24 USER MOD Single : A 150 TYR OH : rot -164:sc= 1.08 USER MOD Single : A 153 ASN : amide:sc= 0.17 K(o=0.17,f=-1.8) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= 0.957 K(o=0.96,f=-0.0065) USER MOD Single : A 160 GLN : amide:sc= 0.668 K(o=0.67,f=-0.088) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= -0.525 X(o=-0.52,f=-0.36) USER MOD Single : A 170 SER OG : rot 180:sc= 0.0465 USER MOD Single : A 171 ASN : amide:sc= 0.757 K(o=0.76,f=-6.3!) USER MOD Single : A 172 GLN : amide:sc= -0.209 X(o=-0.21,f=-0.097) USER MOD Single : A 173 ASN : amide:sc= -0.419 X(o=-0.42,f=-0.016) USER MOD Single : A 174 ASN : amide:sc= -2.63! C(o=-2.6!,f=-3!) USER MOD Single : A 183 THR OG1 : rot 75:sc= 1.4 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= 0.0178 K(o=0.018,f=-0.54) USER MOD Single : A 188 THR OG1 : rot 86:sc= 0.374 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 THR OG1 : rot -160:sc= -0.442 USER MOD Single : A 193 THR OG1 : rot -24:sc= 0.287 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.0559 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ -162:sc= 1.33 (180deg=0.798) USER MOD Single : A 205 MET CE :methyl -121:sc= -0.333 (180deg=-2.66!) USER MOD Single : A 206 MET CE :methyl 178:sc= -0.0961 (180deg=-0.106) USER MOD Single : A 212 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 213 MET CE :methyl 176:sc= -0.844 (180deg=-0.902) USER MOD Single : A 216 THR OG1 : rot 96:sc= 1.32 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 220 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0734) USER MOD Single : A 222 SER OG : rot 96:sc= 1.14 USER MOD Single : A 223 GLN :FLIP amide:sc= -0.262 F(o=-0.84,f=-0.26) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 9.712 -13.004 -1.854 1.00 0.00 N ATOM 66 CA LEU A 125 9.483 -12.334 -3.149 1.00 0.00 C ATOM 67 C LEU A 125 10.731 -11.964 -3.949 1.00 0.00 C ATOM 68 O LEU A 125 10.638 -11.478 -5.071 1.00 0.00 O ATOM 69 CB LEU A 125 8.630 -11.084 -2.948 1.00 0.00 C ATOM 70 CG LEU A 125 7.214 -11.296 -2.406 1.00 0.00 C ATOM 71 CD1 LEU A 125 6.651 -9.931 -2.026 1.00 0.00 C ATOM 72 CD2 LEU A 125 6.305 -11.921 -3.459 1.00 0.00 C ATOM 0 HA LEU A 125 8.971 -13.086 -3.750 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.159 -10.418 -2.266 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.554 -10.567 -3.904 1.00 0.00 H new ATOM 0 HG LEU A 125 7.258 -11.968 -1.549 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.640 -10.050 -1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.283 -9.476 -1.264 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.626 -9.290 -2.907 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.307 -12.059 -3.043 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.249 -11.264 -4.327 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.709 -12.888 -3.761 1.00 0.00 H new ATOM 84 N GLY A 126 11.888 -12.321 -3.430 1.00 0.00 N ATOM 85 CA GLY A 126 13.229 -12.065 -3.928 1.00 0.00 C ATOM 86 C GLY A 126 14.119 -11.442 -2.854 1.00 0.00 C ATOM 87 O GLY A 126 15.089 -10.757 -3.179 1.00 0.00 O ATOM 0 H GLY A 126 11.918 -12.852 -2.560 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.674 -12.998 -4.273 1.00 0.00 H new ATOM 0 HA3 GLY A 126 13.177 -11.399 -4.789 1.00 0.00 H new ATOM 91 N GLY A 127 13.784 -11.623 -1.575 1.00 0.00 N ATOM 92 CA GLY A 127 14.307 -10.839 -0.474 1.00 0.00 C ATOM 93 C GLY A 127 13.654 -9.462 -0.477 1.00 0.00 C ATOM 94 O GLY A 127 14.363 -8.452 -0.416 1.00 0.00 O ATOM 0 H GLY A 127 13.123 -12.340 -1.277 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.111 -11.344 0.472 1.00 0.00 H new ATOM 0 HA3 GLY A 127 15.389 -10.741 -0.565 1.00 0.00 H new ATOM 98 N TYR A 128 12.325 -9.407 -0.628 1.00 0.00 N ATOM 99 CA TYR A 128 11.596 -8.158 -0.422 1.00 0.00 C ATOM 100 C TYR A 128 11.600 -7.784 1.060 1.00 0.00 C ATOM 101 O TYR A 128 11.638 -8.647 1.940 1.00 0.00 O ATOM 102 CB TYR A 128 10.154 -8.281 -0.920 1.00 0.00 C ATOM 103 CG TYR A 128 9.993 -7.987 -2.394 1.00 0.00 C ATOM 104 CD1 TYR A 128 10.803 -8.653 -3.329 1.00 0.00 C ATOM 105 CD2 TYR A 128 8.973 -7.127 -2.835 1.00 0.00 C ATOM 106 CE1 TYR A 128 10.532 -8.553 -4.696 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.704 -7.007 -4.210 1.00 0.00 C ATOM 108 CZ TYR A 128 9.459 -7.745 -5.150 1.00 0.00 C ATOM 109 OH TYR A 128 9.151 -7.695 -6.477 1.00 0.00 O ATOM 0 H TYR A 128 11.743 -10.203 -0.888 1.00 0.00 H new ATOM 0 HA TYR A 128 12.095 -7.375 -0.993 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.794 -9.290 -0.718 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.523 -7.598 -0.351 1.00 0.00 H new ATOM 0 HD1 TYR A 128 11.640 -9.245 -2.989 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.397 -6.559 -2.119 1.00 0.00 H new ATOM 0 HE1 TYR A 128 11.140 -9.092 -5.407 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.918 -6.349 -4.549 1.00 0.00 H new ATOM 0 HH TYR A 128 8.420 -7.058 -6.619 1.00 0.00 H new ATOM 119 N MET A 129 11.522 -6.485 1.321 1.00 0.00 N ATOM 120 CA MET A 129 11.244 -5.929 2.633 1.00 0.00 C ATOM 121 C MET A 129 9.745 -5.845 2.821 1.00 0.00 C ATOM 122 O MET A 129 8.979 -5.914 1.861 1.00 0.00 O ATOM 123 CB MET A 129 11.855 -4.526 2.771 1.00 0.00 C ATOM 124 CG MET A 129 13.379 -4.433 2.677 1.00 0.00 C ATOM 125 SD MET A 129 14.320 -5.194 4.029 1.00 0.00 S ATOM 126 CE MET A 129 14.066 -6.940 3.652 1.00 0.00 C ATOM 0 H MET A 129 11.655 -5.772 0.604 1.00 0.00 H new ATOM 0 HA MET A 129 11.686 -6.574 3.392 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.426 -3.889 1.997 1.00 0.00 H new ATOM 0 HB3 MET A 129 11.547 -4.112 3.731 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.692 -4.895 1.741 1.00 0.00 H new ATOM 0 HG3 MET A 129 13.654 -3.380 2.620 1.00 0.00 H new ATOM 0 HE1 MET A 129 14.987 -7.491 3.842 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.270 -7.336 4.282 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.788 -7.049 2.604 1.00 0.00 H new ATOM 136 N LEU A 130 9.360 -5.659 4.077 1.00 0.00 N ATOM 137 CA LEU A 130 8.043 -5.290 4.536 1.00 0.00 C ATOM 138 C LEU A 130 8.196 -4.090 5.464 1.00 0.00 C ATOM 139 O LEU A 130 9.073 -4.078 6.334 1.00 0.00 O ATOM 140 CB LEU A 130 7.355 -6.480 5.215 1.00 0.00 C ATOM 141 CG LEU A 130 5.974 -6.145 5.811 1.00 0.00 C ATOM 142 CD1 LEU A 130 4.919 -5.878 4.740 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.529 -7.307 6.694 1.00 0.00 C ATOM 0 H LEU A 130 10.014 -5.772 4.852 1.00 0.00 H new ATOM 0 HA LEU A 130 7.400 -5.011 3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.241 -7.284 4.488 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.001 -6.856 6.008 1.00 0.00 H new ATOM 0 HG LEU A 130 6.073 -5.228 6.392 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.966 -5.647 5.217 1.00 0.00 H new ATOM 0 HD12 LEU A 130 5.231 -5.034 4.125 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.806 -6.762 4.112 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.552 -7.084 7.123 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.464 -8.215 6.095 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.253 -7.453 7.496 1.00 0.00 H new ATOM 155 N GLY A 131 7.356 -3.087 5.250 1.00 0.00 N ATOM 156 CA GLY A 131 7.314 -1.815 5.948 1.00 0.00 C ATOM 157 C GLY A 131 6.722 -1.904 7.348 1.00 0.00 C ATOM 158 O GLY A 131 6.225 -2.952 7.761 1.00 0.00 O ATOM 0 H GLY A 131 6.635 -3.148 4.531 1.00 0.00 H new ATOM 0 HA2 GLY A 131 8.325 -1.414 6.016 1.00 0.00 H new ATOM 0 HA3 GLY A 131 6.729 -1.107 5.360 1.00 0.00 H new ATOM 162 N SER A 132 6.741 -0.792 8.077 1.00 0.00 N ATOM 163 CA SER A 132 6.065 -0.661 9.359 1.00 0.00 C ATOM 164 C SER A 132 4.553 -0.479 9.141 1.00 0.00 C ATOM 165 O SER A 132 4.111 -0.089 8.059 1.00 0.00 O ATOM 166 CB SER A 132 6.653 0.516 10.155 1.00 0.00 C ATOM 167 OG SER A 132 7.913 0.976 9.678 1.00 0.00 O ATOM 0 H SER A 132 7.233 0.053 7.788 1.00 0.00 H new ATOM 0 HA SER A 132 6.221 -1.571 9.938 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.945 1.344 10.132 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.760 0.217 11.198 1.00 0.00 H new ATOM 0 HG SER A 132 7.775 1.580 8.919 1.00 0.00 H new ATOM 173 N ALA A 133 3.742 -0.751 10.166 1.00 0.00 N ATOM 174 CA ALA A 133 2.305 -0.508 10.118 1.00 0.00 C ATOM 175 C ALA A 133 2.044 0.997 9.981 1.00 0.00 C ATOM 176 O ALA A 133 2.348 1.764 10.900 1.00 0.00 O ATOM 177 CB ALA A 133 1.619 -1.069 11.373 1.00 0.00 C ATOM 0 H ALA A 133 4.066 -1.145 11.049 1.00 0.00 H new ATOM 0 HA ALA A 133 1.885 -1.020 9.252 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.547 -0.878 11.318 1.00 0.00 H new ATOM 0 HB2 ALA A 133 1.793 -2.143 11.433 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.029 -0.585 12.259 1.00 0.00 H new ATOM 183 N MET A 134 1.491 1.424 8.848 1.00 0.00 N ATOM 184 CA MET A 134 1.128 2.819 8.603 1.00 0.00 C ATOM 185 C MET A 134 -0.285 3.134 9.073 1.00 0.00 C ATOM 186 O MET A 134 -1.048 2.230 9.422 1.00 0.00 O ATOM 187 CB MET A 134 1.224 3.168 7.121 1.00 0.00 C ATOM 188 CG MET A 134 2.635 3.027 6.588 1.00 0.00 C ATOM 189 SD MET A 134 2.842 3.994 5.076 1.00 0.00 S ATOM 190 CE MET A 134 4.048 2.898 4.345 1.00 0.00 C ATOM 0 H MET A 134 1.280 0.805 8.065 1.00 0.00 H new ATOM 0 HA MET A 134 1.839 3.416 9.174 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.557 2.519 6.553 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.881 4.191 6.968 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.349 3.361 7.341 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.851 1.978 6.388 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.491 3.376 3.471 1.00 0.00 H new ATOM 0 HE2 MET A 134 4.828 2.678 5.074 1.00 0.00 H new ATOM 0 HE3 MET A 134 3.561 1.971 4.043 1.00 0.00 H new ATOM 200 N SER A 135 -0.651 4.415 9.061 1.00 0.00 N ATOM 201 CA SER A 135 -2.016 4.883 9.212 1.00 0.00 C ATOM 202 C SER A 135 -2.733 4.866 7.858 1.00 0.00 C ATOM 203 O SER A 135 -2.301 4.188 6.919 1.00 0.00 O ATOM 204 CB SER A 135 -1.984 6.238 9.933 1.00 0.00 C ATOM 205 OG SER A 135 -3.264 6.599 10.427 1.00 0.00 O ATOM 0 H SER A 135 0.020 5.174 8.942 1.00 0.00 H new ATOM 0 HA SER A 135 -2.613 4.220 9.838 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.274 6.194 10.759 1.00 0.00 H new ATOM 0 HB3 SER A 135 -1.628 7.007 9.247 1.00 0.00 H new ATOM 0 HG SER A 135 -3.207 7.465 10.881 1.00 0.00 H new ATOM 211 N ARG A 136 -3.900 5.505 7.794 1.00 0.00 N ATOM 212 CA ARG A 136 -4.661 5.664 6.570 1.00 0.00 C ATOM 213 C ARG A 136 -4.460 7.101 6.075 1.00 0.00 C ATOM 214 O ARG A 136 -4.700 8.022 6.858 1.00 0.00 O ATOM 215 CB ARG A 136 -6.141 5.290 6.735 1.00 0.00 C ATOM 216 CG ARG A 136 -6.916 5.938 7.894 1.00 0.00 C ATOM 217 CD ARG A 136 -6.842 5.143 9.203 1.00 0.00 C ATOM 218 NE ARG A 136 -6.193 5.856 10.323 1.00 0.00 N ATOM 219 CZ ARG A 136 -6.813 6.290 11.430 1.00 0.00 C ATOM 220 NH1 ARG A 136 -8.141 6.370 11.488 1.00 0.00 N ATOM 221 NH2 ARG A 136 -6.100 6.639 12.493 1.00 0.00 N ATOM 0 H ARG A 136 -4.345 5.931 8.607 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.293 4.966 5.818 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.655 5.539 5.807 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -6.203 4.208 6.854 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.525 6.941 8.065 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -7.961 6.048 7.604 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -7.853 4.868 9.503 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -6.301 4.215 9.019 1.00 0.00 H new ATOM 0 HE ARG A 136 -5.191 6.032 10.248 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.704 6.099 10.682 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -8.595 6.702 12.339 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -5.082 6.577 12.467 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.570 6.969 13.336 1.00 0.00 H new ATOM 235 N PRO A 137 -4.012 7.308 4.829 1.00 0.00 N ATOM 236 CA PRO A 137 -4.045 8.612 4.173 1.00 0.00 C ATOM 237 C PRO A 137 -5.483 9.147 4.078 1.00 0.00 C ATOM 238 O PRO A 137 -6.452 8.401 4.258 1.00 0.00 O ATOM 239 CB PRO A 137 -3.406 8.420 2.783 1.00 0.00 C ATOM 240 CG PRO A 137 -3.013 6.943 2.697 1.00 0.00 C ATOM 241 CD PRO A 137 -3.562 6.259 3.941 1.00 0.00 C ATOM 0 HA PRO A 137 -3.491 9.357 4.745 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -4.108 8.683 1.992 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.534 9.063 2.663 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -3.422 6.488 1.795 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -1.930 6.835 2.645 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.384 5.591 3.684 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.794 5.651 4.419 1.00 0.00 H new ATOM 249 N MET A 138 -5.639 10.419 3.725 1.00 0.00 N ATOM 250 CA MET A 138 -6.888 10.959 3.199 1.00 0.00 C ATOM 251 C MET A 138 -6.804 10.904 1.680 1.00 0.00 C ATOM 252 O MET A 138 -5.726 11.078 1.107 1.00 0.00 O ATOM 253 CB MET A 138 -7.095 12.397 3.693 1.00 0.00 C ATOM 254 CG MET A 138 -7.873 12.515 5.014 1.00 0.00 C ATOM 255 SD MET A 138 -7.734 11.165 6.228 1.00 0.00 S ATOM 256 CE MET A 138 -9.265 10.249 5.875 1.00 0.00 C ATOM 0 H MET A 138 -4.894 11.111 3.797 1.00 0.00 H new ATOM 0 HA MET A 138 -7.741 10.376 3.545 1.00 0.00 H new ATOM 0 HB2 MET A 138 -6.120 12.868 3.818 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.624 12.959 2.923 1.00 0.00 H new ATOM 0 HG2 MET A 138 -7.556 13.436 5.504 1.00 0.00 H new ATOM 0 HG3 MET A 138 -8.928 12.632 4.768 1.00 0.00 H new ATOM 0 HE1 MET A 138 -9.063 9.178 5.903 1.00 0.00 H new ATOM 0 HE2 MET A 138 -10.018 10.496 6.623 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.633 10.523 4.886 1.00 0.00 H new ATOM 266 N ILE A 139 -7.932 10.617 1.030 1.00 0.00 N ATOM 267 CA ILE A 139 -8.075 10.557 -0.426 1.00 0.00 C ATOM 268 C ILE A 139 -9.382 11.309 -0.746 1.00 0.00 C ATOM 269 O ILE A 139 -10.247 11.422 0.130 1.00 0.00 O ATOM 270 CB ILE A 139 -8.020 9.072 -0.911 1.00 0.00 C ATOM 271 CG1 ILE A 139 -6.947 8.260 -0.129 1.00 0.00 C ATOM 272 CG2 ILE A 139 -7.771 8.972 -2.431 1.00 0.00 C ATOM 273 CD1 ILE A 139 -6.432 6.964 -0.752 1.00 0.00 C ATOM 0 H ILE A 139 -8.803 10.412 1.520 1.00 0.00 H new ATOM 0 HA ILE A 139 -7.261 11.037 -0.969 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.998 8.636 -0.705 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -6.091 8.913 0.038 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -7.360 8.018 0.851 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.740 7.923 -2.726 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.576 9.476 -2.966 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -6.821 9.446 -2.676 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.691 6.512 -0.092 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -7.263 6.272 -0.892 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.974 7.181 -1.717 1.00 0.00 H new ATOM 285 N HIS A 140 -9.544 11.860 -1.956 1.00 0.00 N ATOM 286 CA HIS A 140 -10.701 12.653 -2.343 1.00 0.00 C ATOM 287 C HIS A 140 -11.021 12.431 -3.820 1.00 0.00 C ATOM 288 O HIS A 140 -11.003 13.362 -4.628 1.00 0.00 O ATOM 289 CB HIS A 140 -10.506 14.135 -1.989 1.00 0.00 C ATOM 290 CG HIS A 140 -9.410 14.884 -2.712 1.00 0.00 C ATOM 291 ND1 HIS A 140 -9.563 16.076 -3.389 1.00 0.00 N ATOM 292 CD2 HIS A 140 -8.090 14.534 -2.788 1.00 0.00 C ATOM 293 CE1 HIS A 140 -8.357 16.443 -3.852 1.00 0.00 C ATOM 294 NE2 HIS A 140 -7.428 15.545 -3.491 1.00 0.00 N ATOM 0 H HIS A 140 -8.856 11.761 -2.703 1.00 0.00 H new ATOM 0 HA HIS A 140 -11.567 12.319 -1.771 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -11.447 14.652 -2.175 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.311 14.203 -0.919 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -7.641 13.640 -2.380 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -8.163 17.333 -4.432 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -6.429 15.591 -3.691 1.00 0.00 H new ATOM 302 N PHE A 141 -11.348 11.179 -4.141 1.00 0.00 N ATOM 303 CA PHE A 141 -11.760 10.661 -5.445 1.00 0.00 C ATOM 304 C PHE A 141 -12.559 11.662 -6.285 1.00 0.00 C ATOM 305 O PHE A 141 -12.324 11.814 -7.482 1.00 0.00 O ATOM 306 CB PHE A 141 -12.629 9.415 -5.229 1.00 0.00 C ATOM 307 CG PHE A 141 -11.944 8.235 -4.570 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.774 8.183 -3.171 1.00 0.00 C ATOM 309 CD2 PHE A 141 -11.499 7.169 -5.370 1.00 0.00 C ATOM 310 CE1 PHE A 141 -11.091 7.103 -2.584 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.804 6.096 -4.781 1.00 0.00 C ATOM 312 CZ PHE A 141 -10.587 6.069 -3.391 1.00 0.00 C ATOM 0 H PHE A 141 -11.330 10.441 -3.437 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.845 10.439 -5.994 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.489 9.697 -4.621 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -13.014 9.093 -6.196 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -12.169 8.973 -2.550 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.690 7.173 -6.433 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.954 7.068 -1.513 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -10.436 5.290 -5.399 1.00 0.00 H new ATOM 0 HZ PHE A 141 -10.034 5.255 -2.945 1.00 0.00 H new ATOM 322 N GLY A 142 -13.526 12.332 -5.671 1.00 0.00 N ATOM 323 CA GLY A 142 -14.412 13.302 -6.269 1.00 0.00 C ATOM 324 C GLY A 142 -15.767 13.111 -5.619 1.00 0.00 C ATOM 325 O GLY A 142 -16.278 14.022 -4.969 1.00 0.00 O ATOM 0 H GLY A 142 -13.718 12.198 -4.678 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.044 14.315 -6.106 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.476 13.155 -7.347 1.00 0.00 H new ATOM 329 N ASN A 143 -16.339 11.913 -5.761 1.00 0.00 N ATOM 330 CA ASN A 143 -17.701 11.642 -5.327 1.00 0.00 C ATOM 331 C ASN A 143 -17.722 11.409 -3.823 1.00 0.00 C ATOM 332 O ASN A 143 -16.804 10.774 -3.294 1.00 0.00 O ATOM 333 CB ASN A 143 -18.298 10.391 -5.989 1.00 0.00 C ATOM 334 CG ASN A 143 -17.927 10.143 -7.444 1.00 0.00 C ATOM 335 OD1 ASN A 143 -16.712 9.686 -7.703 1.00 0.00 O flip ATOM 336 ND2 ASN A 143 -18.722 10.332 -8.361 1.00 0.00 N flip ATOM 0 H ASN A 143 -15.869 11.110 -6.179 1.00 0.00 H new ATOM 0 HA ASN A 143 -18.294 12.510 -5.615 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -17.994 9.521 -5.407 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -19.384 10.456 -5.921 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -19.658 10.684 -8.160 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -18.446 10.137 -9.323 1.00 0.00 H new ATOM 343 N ASP A 144 -18.805 11.807 -3.155 1.00 0.00 N ATOM 344 CA ASP A 144 -18.997 11.467 -1.746 1.00 0.00 C ATOM 345 C ASP A 144 -19.161 9.963 -1.547 1.00 0.00 C ATOM 346 O ASP A 144 -18.641 9.433 -0.574 1.00 0.00 O ATOM 347 CB ASP A 144 -20.223 12.158 -1.150 1.00 0.00 C ATOM 348 CG ASP A 144 -20.412 11.694 0.293 1.00 0.00 C ATOM 349 OD1 ASP A 144 -19.538 11.998 1.140 1.00 0.00 O ATOM 350 OD2 ASP A 144 -21.438 11.024 0.553 1.00 0.00 O ATOM 0 H ASP A 144 -19.557 12.361 -3.564 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.099 11.814 -1.235 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.097 13.240 -1.183 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -21.110 11.923 -1.739 1.00 0.00 H new ATOM 355 N TRP A 145 -19.855 9.258 -2.450 1.00 0.00 N ATOM 356 CA TRP A 145 -20.126 7.837 -2.236 1.00 0.00 C ATOM 357 C TRP A 145 -18.833 7.026 -2.173 1.00 0.00 C ATOM 358 O TRP A 145 -18.781 6.029 -1.457 1.00 0.00 O ATOM 359 CB TRP A 145 -21.079 7.285 -3.307 1.00 0.00 C ATOM 360 CG TRP A 145 -20.593 7.370 -4.728 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.888 8.362 -5.595 1.00 0.00 C ATOM 362 CD2 TRP A 145 -19.763 6.426 -5.478 1.00 0.00 C ATOM 363 NE1 TRP A 145 -20.260 8.125 -6.801 1.00 0.00 N ATOM 364 CE2 TRP A 145 -19.556 6.945 -6.791 1.00 0.00 C ATOM 365 CE3 TRP A 145 -19.157 5.185 -5.186 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -18.781 6.282 -7.755 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -18.449 4.465 -6.168 1.00 0.00 C ATOM 368 CH2 TRP A 145 -18.241 5.024 -7.441 1.00 0.00 C ATOM 0 H TRP A 145 -20.231 9.641 -3.317 1.00 0.00 H new ATOM 0 HA TRP A 145 -20.621 7.739 -1.270 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -21.287 6.240 -3.077 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -22.025 7.821 -3.235 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -21.519 9.211 -5.378 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -20.312 8.751 -7.604 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -19.238 4.779 -4.189 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -18.603 6.731 -8.721 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -18.065 3.481 -5.942 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -17.665 4.485 -8.179 1.00 0.00 H new ATOM 379 N GLU A 146 -17.799 7.445 -2.902 1.00 0.00 N ATOM 380 CA GLU A 146 -16.474 6.853 -2.836 1.00 0.00 C ATOM 381 C GLU A 146 -15.806 7.207 -1.512 1.00 0.00 C ATOM 382 O GLU A 146 -15.355 6.324 -0.793 1.00 0.00 O ATOM 383 CB GLU A 146 -15.608 7.351 -4.007 1.00 0.00 C ATOM 384 CG GLU A 146 -16.134 6.771 -5.317 1.00 0.00 C ATOM 385 CD GLU A 146 -15.117 6.811 -6.448 1.00 0.00 C ATOM 386 OE1 GLU A 146 -14.889 7.906 -7.008 1.00 0.00 O ATOM 387 OE2 GLU A 146 -14.586 5.738 -6.816 1.00 0.00 O ATOM 0 H GLU A 146 -17.865 8.218 -3.564 1.00 0.00 H new ATOM 0 HA GLU A 146 -16.574 5.770 -2.906 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.625 8.440 -4.047 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.570 7.054 -3.857 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -16.441 5.738 -5.151 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -17.024 7.324 -5.619 1.00 0.00 H new ATOM 394 N ASP A 147 -15.735 8.495 -1.181 1.00 0.00 N ATOM 395 CA ASP A 147 -15.066 8.966 0.030 1.00 0.00 C ATOM 396 C ASP A 147 -15.682 8.350 1.282 1.00 0.00 C ATOM 397 O ASP A 147 -14.981 7.805 2.127 1.00 0.00 O ATOM 398 CB ASP A 147 -15.181 10.480 0.104 1.00 0.00 C ATOM 399 CG ASP A 147 -14.535 11.065 1.354 1.00 0.00 C ATOM 400 OD1 ASP A 147 -13.378 10.709 1.663 1.00 0.00 O ATOM 401 OD2 ASP A 147 -15.209 11.910 1.987 1.00 0.00 O ATOM 0 H ASP A 147 -16.140 9.242 -1.745 1.00 0.00 H new ATOM 0 HA ASP A 147 -14.019 8.665 -0.016 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -14.715 10.918 -0.778 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -16.234 10.761 0.080 1.00 0.00 H new ATOM 406 N ARG A 148 -17.006 8.378 1.410 1.00 0.00 N ATOM 407 CA ARG A 148 -17.674 7.787 2.558 1.00 0.00 C ATOM 408 C ARG A 148 -17.372 6.298 2.621 1.00 0.00 C ATOM 409 O ARG A 148 -17.099 5.821 3.708 1.00 0.00 O ATOM 410 CB ARG A 148 -19.180 8.113 2.549 1.00 0.00 C ATOM 411 CG ARG A 148 -20.057 7.142 1.759 1.00 0.00 C ATOM 412 CD ARG A 148 -21.535 7.550 1.793 1.00 0.00 C ATOM 413 NE ARG A 148 -22.247 6.696 2.748 1.00 0.00 N ATOM 414 CZ ARG A 148 -23.462 6.838 3.276 1.00 0.00 C ATOM 415 NH1 ARG A 148 -24.174 7.947 3.103 1.00 0.00 N ATOM 416 NH2 ARG A 148 -23.946 5.818 3.977 1.00 0.00 N ATOM 0 H ARG A 148 -17.635 8.805 0.730 1.00 0.00 H new ATOM 0 HA ARG A 148 -17.285 8.227 3.476 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.535 8.140 3.579 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.315 9.114 2.139 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.715 7.103 0.725 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.948 6.138 2.169 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.629 8.597 2.082 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.975 7.452 0.801 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.735 5.869 3.054 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -23.793 8.717 2.554 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -25.102 8.028 3.519 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -23.391 4.970 4.093 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -24.872 5.883 4.399 1.00 0.00 H new ATOM 430 N TYR A 149 -17.403 5.575 1.499 1.00 0.00 N ATOM 431 CA TYR A 149 -17.117 4.142 1.466 1.00 0.00 C ATOM 432 C TYR A 149 -15.691 3.895 1.959 1.00 0.00 C ATOM 433 O TYR A 149 -15.504 3.070 2.855 1.00 0.00 O ATOM 434 CB TYR A 149 -17.372 3.609 0.051 1.00 0.00 C ATOM 435 CG TYR A 149 -17.246 2.112 -0.160 1.00 0.00 C ATOM 436 CD1 TYR A 149 -18.245 1.234 0.303 1.00 0.00 C ATOM 437 CD2 TYR A 149 -16.161 1.603 -0.896 1.00 0.00 C ATOM 438 CE1 TYR A 149 -18.150 -0.145 0.035 1.00 0.00 C ATOM 439 CE2 TYR A 149 -16.053 0.232 -1.173 1.00 0.00 C ATOM 440 CZ TYR A 149 -17.048 -0.649 -0.697 1.00 0.00 C ATOM 441 OH TYR A 149 -16.982 -1.969 -1.015 1.00 0.00 O ATOM 0 H TYR A 149 -17.628 5.970 0.586 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.780 3.595 2.137 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.377 3.909 -0.247 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.678 4.105 -0.627 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -19.084 1.618 0.864 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -15.398 2.279 -1.254 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -18.918 -0.818 0.388 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -15.218 -0.145 -1.744 1.00 0.00 H new ATOM 0 HH TYR A 149 -16.071 -2.192 -1.300 1.00 0.00 H new ATOM 451 N TYR A 150 -14.728 4.685 1.465 1.00 0.00 N ATOM 452 CA TYR A 150 -13.348 4.705 1.929 1.00 0.00 C ATOM 453 C TYR A 150 -13.307 4.886 3.443 1.00 0.00 C ATOM 454 O TYR A 150 -12.818 3.997 4.142 1.00 0.00 O ATOM 455 CB TYR A 150 -12.545 5.803 1.214 1.00 0.00 C ATOM 456 CG TYR A 150 -11.135 5.944 1.736 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.193 4.952 1.412 1.00 0.00 C ATOM 458 CD2 TYR A 150 -10.780 7.027 2.570 1.00 0.00 C ATOM 459 CE1 TYR A 150 -8.890 5.029 1.922 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.461 7.130 3.045 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.521 6.119 2.738 1.00 0.00 C ATOM 462 OH TYR A 150 -7.259 6.169 3.233 1.00 0.00 O ATOM 0 H TYR A 150 -14.901 5.346 0.708 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.883 3.749 1.686 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.510 5.582 0.147 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -13.064 6.755 1.326 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.474 4.130 0.770 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.516 7.770 2.841 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.171 4.257 1.691 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.166 7.979 3.643 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.220 6.821 3.964 1.00 0.00 H new ATOM 472 N ARG A 151 -13.833 6.002 3.969 1.00 0.00 N ATOM 473 CA ARG A 151 -13.857 6.225 5.415 1.00 0.00 C ATOM 474 C ARG A 151 -14.559 5.092 6.162 1.00 0.00 C ATOM 475 O ARG A 151 -14.084 4.687 7.222 1.00 0.00 O ATOM 476 CB ARG A 151 -14.502 7.576 5.758 1.00 0.00 C ATOM 477 CG ARG A 151 -13.533 8.757 5.583 1.00 0.00 C ATOM 478 CD ARG A 151 -13.916 9.769 4.502 1.00 0.00 C ATOM 479 NE ARG A 151 -15.152 10.510 4.818 1.00 0.00 N ATOM 480 CZ ARG A 151 -15.225 11.760 5.295 1.00 0.00 C ATOM 481 NH1 ARG A 151 -14.134 12.500 5.448 1.00 0.00 N ATOM 482 NH2 ARG A 151 -16.398 12.280 5.643 1.00 0.00 N ATOM 0 H ARG A 151 -14.243 6.756 3.417 1.00 0.00 H new ATOM 0 HA ARG A 151 -12.819 6.242 5.747 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.374 7.730 5.122 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -14.858 7.553 6.788 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.452 9.282 6.535 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -12.544 8.362 5.352 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -13.098 10.477 4.369 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.044 9.248 3.553 1.00 0.00 H new ATOM 0 HE ARG A 151 -16.035 10.025 4.658 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -13.221 12.119 5.201 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -14.209 13.450 5.813 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -17.250 11.727 5.548 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -16.446 13.232 6.005 1.00 0.00 H new ATOM 496 N GLU A 152 -15.648 4.546 5.638 1.00 0.00 N ATOM 497 CA GLU A 152 -16.409 3.479 6.258 1.00 0.00 C ATOM 498 C GLU A 152 -15.594 2.195 6.442 1.00 0.00 C ATOM 499 O GLU A 152 -15.935 1.414 7.332 1.00 0.00 O ATOM 500 CB GLU A 152 -17.694 3.213 5.455 1.00 0.00 C ATOM 501 CG GLU A 152 -18.803 4.236 5.751 1.00 0.00 C ATOM 502 CD GLU A 152 -19.420 4.019 7.136 1.00 0.00 C ATOM 503 OE1 GLU A 152 -19.822 2.872 7.455 1.00 0.00 O ATOM 504 OE2 GLU A 152 -19.475 4.980 7.941 1.00 0.00 O ATOM 0 H GLU A 152 -16.035 4.845 4.743 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.677 3.812 7.261 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.462 3.233 4.390 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.059 2.212 5.683 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.394 5.244 5.689 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.580 4.160 4.991 1.00 0.00 H new ATOM 511 N ASN A 153 -14.525 1.984 5.667 1.00 0.00 N ATOM 512 CA ASN A 153 -13.773 0.729 5.643 1.00 0.00 C ATOM 513 C ASN A 153 -12.266 0.934 5.748 1.00 0.00 C ATOM 514 O ASN A 153 -11.514 -0.026 5.586 1.00 0.00 O ATOM 515 CB ASN A 153 -14.121 -0.067 4.375 1.00 0.00 C ATOM 516 CG ASN A 153 -15.564 -0.537 4.390 1.00 0.00 C ATOM 517 OD1 ASN A 153 -15.885 -1.541 5.028 1.00 0.00 O ATOM 518 ND2 ASN A 153 -16.448 0.199 3.737 1.00 0.00 N ATOM 0 H ASN A 153 -14.154 2.690 5.031 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.069 0.163 6.526 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -13.949 0.554 3.496 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -13.458 -0.928 4.292 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -17.435 -0.058 3.751 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -16.143 1.024 3.220 1.00 0.00 H new ATOM 525 N MET A 154 -11.807 2.144 6.076 1.00 0.00 N ATOM 526 CA MET A 154 -10.399 2.548 6.082 1.00 0.00 C ATOM 527 C MET A 154 -9.476 1.658 6.934 1.00 0.00 C ATOM 528 O MET A 154 -8.263 1.694 6.749 1.00 0.00 O ATOM 529 CB MET A 154 -10.304 4.029 6.498 1.00 0.00 C ATOM 530 CG MET A 154 -10.622 4.265 7.985 1.00 0.00 C ATOM 531 SD MET A 154 -11.419 5.844 8.414 1.00 0.00 S ATOM 532 CE MET A 154 -10.349 7.099 7.669 1.00 0.00 C ATOM 0 H MET A 154 -12.432 2.900 6.356 1.00 0.00 H new ATOM 0 HA MET A 154 -10.027 2.415 5.066 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.299 4.395 6.286 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.992 4.615 5.889 1.00 0.00 H new ATOM 0 HG2 MET A 154 -11.267 3.455 8.327 1.00 0.00 H new ATOM 0 HG3 MET A 154 -9.691 4.191 8.547 1.00 0.00 H new ATOM 0 HE1 MET A 154 -10.931 7.997 7.461 1.00 0.00 H new ATOM 0 HE2 MET A 154 -9.540 7.343 8.358 1.00 0.00 H new ATOM 0 HE3 MET A 154 -9.930 6.714 6.739 1.00 0.00 H new ATOM 542 N TYR A 155 -10.039 0.866 7.849 1.00 0.00 N ATOM 543 CA TYR A 155 -9.349 -0.058 8.740 1.00 0.00 C ATOM 544 C TYR A 155 -9.135 -1.456 8.144 1.00 0.00 C ATOM 545 O TYR A 155 -8.368 -2.240 8.696 1.00 0.00 O ATOM 546 CB TYR A 155 -10.184 -0.177 10.019 1.00 0.00 C ATOM 547 CG TYR A 155 -11.642 -0.574 9.814 1.00 0.00 C ATOM 548 CD1 TYR A 155 -12.016 -1.933 9.779 1.00 0.00 C ATOM 549 CD2 TYR A 155 -12.631 0.421 9.676 1.00 0.00 C ATOM 550 CE1 TYR A 155 -13.372 -2.294 9.663 1.00 0.00 C ATOM 551 CE2 TYR A 155 -13.985 0.069 9.588 1.00 0.00 C ATOM 552 CZ TYR A 155 -14.363 -1.289 9.592 1.00 0.00 C ATOM 553 OH TYR A 155 -15.680 -1.608 9.564 1.00 0.00 O ATOM 0 H TYR A 155 -11.049 0.855 7.993 1.00 0.00 H new ATOM 0 HA TYR A 155 -8.353 0.344 8.927 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -9.714 -0.912 10.673 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -10.156 0.779 10.541 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -11.259 -2.701 9.841 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -12.344 1.461 9.638 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -13.654 -3.336 9.628 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -14.739 0.839 9.517 1.00 0.00 H new ATOM 0 HH TYR A 155 -16.214 -0.788 9.516 1.00 0.00 H new ATOM 563 N ARG A 156 -9.829 -1.808 7.058 1.00 0.00 N ATOM 564 CA ARG A 156 -9.750 -3.145 6.460 1.00 0.00 C ATOM 565 C ARG A 156 -8.523 -3.297 5.575 1.00 0.00 C ATOM 566 O ARG A 156 -8.093 -4.407 5.281 1.00 0.00 O ATOM 567 CB ARG A 156 -11.002 -3.413 5.617 1.00 0.00 C ATOM 568 CG ARG A 156 -12.268 -3.367 6.478 1.00 0.00 C ATOM 569 CD ARG A 156 -13.501 -3.734 5.663 1.00 0.00 C ATOM 570 NE ARG A 156 -13.529 -5.164 5.316 1.00 0.00 N ATOM 571 CZ ARG A 156 -14.535 -6.018 5.523 1.00 0.00 C ATOM 572 NH1 ARG A 156 -15.668 -5.646 6.119 1.00 0.00 N ATOM 573 NH2 ARG A 156 -14.377 -7.267 5.118 1.00 0.00 N ATOM 0 H ARG A 156 -10.461 -1.175 6.568 1.00 0.00 H new ATOM 0 HA ARG A 156 -9.678 -3.863 7.277 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.073 -2.672 4.821 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -10.920 -4.389 5.138 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.165 -4.055 7.317 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.390 -2.368 6.897 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.398 -3.481 6.229 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.522 -3.139 4.750 1.00 0.00 H new ATOM 0 HE ARG A 156 -12.693 -5.542 4.871 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.787 -4.683 6.433 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -16.416 -6.325 6.261 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -13.508 -7.550 4.664 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -15.124 -7.947 5.259 1.00 0.00 H new ATOM 587 N TYR A 157 -7.982 -2.189 5.090 1.00 0.00 N ATOM 588 CA TYR A 157 -6.792 -2.167 4.266 1.00 0.00 C ATOM 589 C TYR A 157 -5.573 -2.662 5.056 1.00 0.00 C ATOM 590 O TYR A 157 -5.593 -2.668 6.294 1.00 0.00 O ATOM 591 CB TYR A 157 -6.623 -0.730 3.759 1.00 0.00 C ATOM 592 CG TYR A 157 -7.798 -0.247 2.925 1.00 0.00 C ATOM 593 CD1 TYR A 157 -8.279 -1.028 1.853 1.00 0.00 C ATOM 594 CD2 TYR A 157 -8.421 0.978 3.231 1.00 0.00 C ATOM 595 CE1 TYR A 157 -9.408 -0.617 1.127 1.00 0.00 C ATOM 596 CE2 TYR A 157 -9.541 1.405 2.496 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.048 0.595 1.458 1.00 0.00 C ATOM 598 OH TYR A 157 -11.171 0.962 0.793 1.00 0.00 O ATOM 0 H TYR A 157 -8.370 -1.262 5.265 1.00 0.00 H new ATOM 0 HA TYR A 157 -6.885 -2.843 3.416 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.493 -0.064 4.612 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -5.712 -0.667 3.163 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -7.776 -1.947 1.590 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.037 1.592 4.033 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -9.785 -1.226 0.319 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.012 2.350 2.725 1.00 0.00 H new ATOM 0 HH TYR A 157 -11.491 1.821 1.140 1.00 0.00 H new ATOM 608 N PRO A 158 -4.484 -3.051 4.367 1.00 0.00 N ATOM 609 CA PRO A 158 -3.239 -3.353 5.048 1.00 0.00 C ATOM 610 C PRO A 158 -2.700 -2.074 5.678 1.00 0.00 C ATOM 611 O PRO A 158 -2.943 -0.970 5.181 1.00 0.00 O ATOM 612 CB PRO A 158 -2.292 -3.893 3.974 1.00 0.00 C ATOM 613 CG PRO A 158 -2.817 -3.285 2.681 1.00 0.00 C ATOM 614 CD PRO A 158 -4.316 -3.151 2.923 1.00 0.00 C ATOM 0 HA PRO A 158 -3.359 -4.085 5.847 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.261 -3.596 4.165 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -2.308 -4.982 3.938 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.357 -2.318 2.478 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.606 -3.924 1.824 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.714 -2.269 2.422 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.853 -4.012 2.527 1.00 0.00 H new ATOM 622 N ASN A 159 -1.914 -2.218 6.741 1.00 0.00 N ATOM 623 CA ASN A 159 -1.154 -1.117 7.312 1.00 0.00 C ATOM 624 C ASN A 159 0.225 -1.086 6.684 1.00 0.00 C ATOM 625 O ASN A 159 0.807 -0.019 6.519 1.00 0.00 O ATOM 626 CB ASN A 159 -0.935 -1.309 8.819 1.00 0.00 C ATOM 627 CG ASN A 159 -2.189 -1.195 9.652 1.00 0.00 C ATOM 628 OD1 ASN A 159 -2.678 -2.168 10.215 1.00 0.00 O ATOM 629 ND2 ASN A 159 -2.672 0.014 9.828 1.00 0.00 N ATOM 0 H ASN A 159 -1.788 -3.104 7.230 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.717 -0.202 7.126 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.490 -2.290 8.987 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -0.214 -0.568 9.166 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -3.472 0.159 10.445 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -2.247 0.808 9.348 1.00 0.00 H new ATOM 636 N GLN A 160 0.801 -2.258 6.441 1.00 0.00 N ATOM 637 CA GLN A 160 2.171 -2.408 5.994 1.00 0.00 C ATOM 638 C GLN A 160 2.167 -2.525 4.470 1.00 0.00 C ATOM 639 O GLN A 160 1.118 -2.775 3.873 1.00 0.00 O ATOM 640 CB GLN A 160 2.745 -3.680 6.634 1.00 0.00 C ATOM 641 CG GLN A 160 2.866 -3.631 8.158 1.00 0.00 C ATOM 642 CD GLN A 160 3.503 -4.893 8.735 1.00 0.00 C ATOM 643 OE1 GLN A 160 2.883 -5.948 8.809 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.739 -4.798 9.189 1.00 0.00 N ATOM 0 H GLN A 160 0.313 -3.147 6.553 1.00 0.00 H new ATOM 0 HA GLN A 160 2.783 -1.554 6.284 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.113 -4.525 6.360 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.731 -3.870 6.211 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.461 -2.764 8.444 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.876 -3.496 8.594 1.00 0.00 H new ATOM 0 HE21 GLN A 160 5.241 -3.913 9.120 1.00 0.00 H new ATOM 0 HE22 GLN A 160 5.192 -5.610 9.609 1.00 0.00 H new ATOM 653 N VAL A 161 3.338 -2.408 3.845 1.00 0.00 N ATOM 654 CA VAL A 161 3.507 -2.656 2.411 1.00 0.00 C ATOM 655 C VAL A 161 4.854 -3.345 2.193 1.00 0.00 C ATOM 656 O VAL A 161 5.814 -3.034 2.906 1.00 0.00 O ATOM 657 CB VAL A 161 3.393 -1.335 1.614 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.049 -0.614 1.814 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.503 -0.336 1.975 1.00 0.00 C ATOM 0 H VAL A 161 4.200 -2.138 4.319 1.00 0.00 H new ATOM 0 HA VAL A 161 2.716 -3.310 2.044 1.00 0.00 H new ATOM 0 HB VAL A 161 3.485 -1.648 0.574 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.038 0.304 1.227 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.236 -1.263 1.489 1.00 0.00 H new ATOM 0 HG13 VAL A 161 1.920 -0.371 2.869 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.378 0.574 1.388 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.444 -0.095 3.036 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.475 -0.778 1.757 1.00 0.00 H new ATOM 669 N TYR A 162 4.939 -4.290 1.257 1.00 0.00 N ATOM 670 CA TYR A 162 6.221 -4.869 0.869 1.00 0.00 C ATOM 671 C TYR A 162 6.867 -3.976 -0.174 1.00 0.00 C ATOM 672 O TYR A 162 6.163 -3.433 -1.019 1.00 0.00 O ATOM 673 CB TYR A 162 6.053 -6.257 0.253 1.00 0.00 C ATOM 674 CG TYR A 162 5.536 -7.324 1.192 1.00 0.00 C ATOM 675 CD1 TYR A 162 4.154 -7.530 1.333 1.00 0.00 C ATOM 676 CD2 TYR A 162 6.441 -8.091 1.950 1.00 0.00 C ATOM 677 CE1 TYR A 162 3.675 -8.448 2.278 1.00 0.00 C ATOM 678 CE2 TYR A 162 5.967 -8.965 2.945 1.00 0.00 C ATOM 679 CZ TYR A 162 4.573 -9.135 3.126 1.00 0.00 C ATOM 680 OH TYR A 162 4.090 -9.931 4.120 1.00 0.00 O ATOM 0 H TYR A 162 4.136 -4.669 0.755 1.00 0.00 H new ATOM 0 HA TYR A 162 6.834 -4.953 1.767 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.371 -6.180 -0.594 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.016 -6.580 -0.142 1.00 0.00 H new ATOM 0 HD1 TYR A 162 3.460 -6.981 0.713 1.00 0.00 H new ATOM 0 HD2 TYR A 162 7.502 -8.008 1.767 1.00 0.00 H new ATOM 0 HE1 TYR A 162 2.614 -8.631 2.358 1.00 0.00 H new ATOM 0 HE2 TYR A 162 6.664 -9.505 3.569 1.00 0.00 H new ATOM 0 HH TYR A 162 4.838 -10.331 4.611 1.00 0.00 H new ATOM 690 N TYR A 163 8.195 -3.903 -0.190 1.00 0.00 N ATOM 691 CA TYR A 163 8.934 -3.156 -1.198 1.00 0.00 C ATOM 692 C TYR A 163 10.290 -3.815 -1.411 1.00 0.00 C ATOM 693 O TYR A 163 10.794 -4.526 -0.537 1.00 0.00 O ATOM 694 CB TYR A 163 9.097 -1.693 -0.753 1.00 0.00 C ATOM 695 CG TYR A 163 9.827 -1.502 0.570 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.128 -1.635 1.786 1.00 0.00 C ATOM 697 CD2 TYR A 163 11.205 -1.206 0.588 1.00 0.00 C ATOM 698 CE1 TYR A 163 9.803 -1.483 3.008 1.00 0.00 C ATOM 699 CE2 TYR A 163 11.885 -1.044 1.809 1.00 0.00 C ATOM 700 CZ TYR A 163 11.176 -1.162 3.025 1.00 0.00 C ATOM 701 OH TYR A 163 11.822 -1.031 4.215 1.00 0.00 O ATOM 0 H TYR A 163 8.789 -4.363 0.500 1.00 0.00 H new ATOM 0 HA TYR A 163 8.386 -3.162 -2.140 1.00 0.00 H new ATOM 0 HB2 TYR A 163 9.635 -1.150 -1.530 1.00 0.00 H new ATOM 0 HB3 TYR A 163 8.109 -1.240 -0.674 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.071 -1.854 1.778 1.00 0.00 H new ATOM 0 HD2 TYR A 163 11.743 -1.103 -0.343 1.00 0.00 H new ATOM 0 HE1 TYR A 163 9.269 -1.612 3.938 1.00 0.00 H new ATOM 0 HE2 TYR A 163 12.944 -0.831 1.816 1.00 0.00 H new ATOM 0 HH TYR A 163 12.763 -0.809 4.054 1.00 0.00 H new ATOM 711 N ARG A 164 10.926 -3.566 -2.552 1.00 0.00 N ATOM 712 CA ARG A 164 12.327 -3.927 -2.742 1.00 0.00 C ATOM 713 C ARG A 164 13.160 -2.804 -2.156 1.00 0.00 C ATOM 714 O ARG A 164 12.889 -1.644 -2.471 1.00 0.00 O ATOM 715 CB ARG A 164 12.655 -4.091 -4.220 1.00 0.00 C ATOM 716 CG ARG A 164 11.993 -5.360 -4.755 1.00 0.00 C ATOM 717 CD ARG A 164 11.855 -5.319 -6.281 1.00 0.00 C ATOM 718 NE ARG A 164 12.953 -6.029 -6.954 1.00 0.00 N ATOM 719 CZ ARG A 164 14.200 -5.625 -7.216 1.00 0.00 C ATOM 720 NH1 ARG A 164 14.606 -4.402 -6.883 1.00 0.00 N ATOM 721 NH2 ARG A 164 15.034 -6.461 -7.829 1.00 0.00 N ATOM 0 H ARG A 164 10.494 -3.116 -3.359 1.00 0.00 H new ATOM 0 HA ARG A 164 12.538 -4.878 -2.252 1.00 0.00 H new ATOM 0 HB2 ARG A 164 12.305 -3.223 -4.779 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.735 -4.146 -4.359 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.583 -6.230 -4.465 1.00 0.00 H new ATOM 0 HG3 ARG A 164 11.008 -5.477 -4.302 1.00 0.00 H new ATOM 0 HD2 ARG A 164 10.904 -5.765 -6.571 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.836 -4.282 -6.615 1.00 0.00 H new ATOM 0 HE ARG A 164 12.729 -6.973 -7.269 1.00 0.00 H new ATOM 0 HH11 ARG A 164 13.963 -3.759 -6.421 1.00 0.00 H new ATOM 0 HH12 ARG A 164 15.561 -4.108 -7.089 1.00 0.00 H new ATOM 0 HH21 ARG A 164 14.719 -7.395 -8.092 1.00 0.00 H new ATOM 0 HH22 ARG A 164 15.989 -6.168 -8.036 1.00 0.00 H new ATOM 735 N PRO A 165 14.211 -3.106 -1.387 1.00 0.00 N ATOM 736 CA PRO A 165 15.055 -2.083 -0.796 1.00 0.00 C ATOM 737 C PRO A 165 15.672 -1.256 -1.928 1.00 0.00 C ATOM 738 O PRO A 165 16.096 -1.814 -2.948 1.00 0.00 O ATOM 739 CB PRO A 165 16.063 -2.838 0.071 1.00 0.00 C ATOM 740 CG PRO A 165 16.115 -4.249 -0.524 1.00 0.00 C ATOM 741 CD PRO A 165 14.787 -4.430 -1.261 1.00 0.00 C ATOM 0 HA PRO A 165 14.531 -1.365 -0.165 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.043 -2.361 0.044 1.00 0.00 H new ATOM 0 HB3 PRO A 165 15.748 -2.860 1.114 1.00 0.00 H new ATOM 0 HG2 PRO A 165 16.960 -4.357 -1.205 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.236 -5.000 0.257 1.00 0.00 H new ATOM 0 HD2 PRO A 165 14.944 -4.881 -2.241 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.122 -5.093 -0.708 1.00 0.00 H new ATOM 749 N VAL A 166 15.611 0.073 -1.824 1.00 0.00 N ATOM 750 CA VAL A 166 16.000 0.952 -2.915 1.00 0.00 C ATOM 751 C VAL A 166 17.505 0.850 -3.097 1.00 0.00 C ATOM 752 O VAL A 166 18.271 1.030 -2.152 1.00 0.00 O ATOM 753 CB VAL A 166 15.500 2.400 -2.715 1.00 0.00 C ATOM 754 CG1 VAL A 166 15.558 2.915 -1.278 1.00 0.00 C ATOM 755 CG2 VAL A 166 16.219 3.385 -3.633 1.00 0.00 C ATOM 0 H VAL A 166 15.293 0.561 -0.987 1.00 0.00 H new ATOM 0 HA VAL A 166 15.516 0.630 -3.837 1.00 0.00 H new ATOM 0 HB VAL A 166 14.444 2.343 -2.981 1.00 0.00 H new ATOM 0 HG11 VAL A 166 15.186 3.939 -1.243 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.941 2.283 -0.640 1.00 0.00 H new ATOM 0 HG13 VAL A 166 16.589 2.891 -0.924 1.00 0.00 H new ATOM 0 HG21 VAL A 166 15.836 4.391 -3.459 1.00 0.00 H new ATOM 0 HG22 VAL A 166 17.289 3.363 -3.424 1.00 0.00 H new ATOM 0 HG23 VAL A 166 16.046 3.106 -4.672 1.00 0.00 H new ATOM 765 N ASP A 167 17.911 0.616 -4.340 1.00 0.00 N ATOM 766 CA ASP A 167 19.238 0.979 -4.813 1.00 0.00 C ATOM 767 C ASP A 167 19.149 1.325 -6.282 1.00 0.00 C ATOM 768 O ASP A 167 19.761 2.300 -6.704 1.00 0.00 O ATOM 769 CB ASP A 167 20.263 -0.149 -4.599 1.00 0.00 C ATOM 770 CG ASP A 167 21.418 0.322 -3.717 1.00 0.00 C ATOM 771 OD1 ASP A 167 22.162 1.223 -4.158 1.00 0.00 O ATOM 772 OD2 ASP A 167 21.597 -0.188 -2.587 1.00 0.00 O ATOM 0 H ASP A 167 17.327 0.169 -5.047 1.00 0.00 H new ATOM 0 HA ASP A 167 19.585 1.836 -4.236 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.774 -1.007 -4.137 1.00 0.00 H new ATOM 0 HB3 ASP A 167 20.649 -0.483 -5.562 1.00 0.00 H new ATOM 777 N GLN A 168 18.391 0.540 -7.060 1.00 0.00 N ATOM 778 CA GLN A 168 18.332 0.683 -8.507 1.00 0.00 C ATOM 779 C GLN A 168 16.949 0.992 -9.031 1.00 0.00 C ATOM 780 O GLN A 168 16.803 1.902 -9.841 1.00 0.00 O ATOM 781 CB GLN A 168 18.905 -0.564 -9.185 1.00 0.00 C ATOM 782 CG GLN A 168 20.428 -0.585 -9.104 1.00 0.00 C ATOM 783 CD GLN A 168 21.034 0.696 -9.691 1.00 0.00 C ATOM 784 OE1 GLN A 168 21.050 0.890 -10.906 1.00 0.00 O ATOM 785 NE2 GLN A 168 21.461 1.623 -8.849 1.00 0.00 N ATOM 0 H GLN A 168 17.804 -0.210 -6.696 1.00 0.00 H new ATOM 0 HA GLN A 168 18.944 1.549 -8.757 1.00 0.00 H new ATOM 0 HB2 GLN A 168 18.501 -1.458 -8.710 1.00 0.00 H new ATOM 0 HB3 GLN A 168 18.593 -0.589 -10.229 1.00 0.00 H new ATOM 0 HG2 GLN A 168 20.738 -0.693 -8.065 1.00 0.00 H new ATOM 0 HG3 GLN A 168 20.811 -1.451 -9.643 1.00 0.00 H new ATOM 0 HE21 GLN A 168 21.441 1.447 -7.844 1.00 0.00 H new ATOM 0 HE22 GLN A 168 21.810 2.513 -9.204 1.00 0.00 H new ATOM 794 N ALA A 169 15.934 0.294 -8.535 1.00 0.00 N ATOM 795 CA ALA A 169 14.545 0.518 -8.899 1.00 0.00 C ATOM 796 C ALA A 169 13.980 1.837 -8.337 1.00 0.00 C ATOM 797 O ALA A 169 12.768 2.013 -8.322 1.00 0.00 O ATOM 798 CB ALA A 169 13.746 -0.698 -8.444 1.00 0.00 C ATOM 0 H ALA A 169 16.059 -0.457 -7.856 1.00 0.00 H new ATOM 0 HA ALA A 169 14.468 0.631 -9.980 1.00 0.00 H new ATOM 0 HB1 ALA A 169 12.696 -0.561 -8.703 1.00 0.00 H new ATOM 0 HB2 ALA A 169 14.129 -1.591 -8.939 1.00 0.00 H new ATOM 0 HB3 ALA A 169 13.841 -0.813 -7.364 1.00 0.00 H new ATOM 804 N SER A 170 14.830 2.767 -7.901 1.00 0.00 N ATOM 805 CA SER A 170 14.554 4.109 -7.421 1.00 0.00 C ATOM 806 C SER A 170 13.764 4.956 -8.418 1.00 0.00 C ATOM 807 O SER A 170 14.344 5.725 -9.189 1.00 0.00 O ATOM 808 CB SER A 170 15.883 4.782 -7.068 1.00 0.00 C ATOM 809 OG SER A 170 16.871 4.447 -8.025 1.00 0.00 O ATOM 0 H SER A 170 15.831 2.572 -7.875 1.00 0.00 H new ATOM 0 HA SER A 170 13.919 4.028 -6.539 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.753 5.864 -7.032 1.00 0.00 H new ATOM 0 HB3 SER A 170 16.206 4.467 -6.076 1.00 0.00 H new ATOM 0 HG SER A 170 17.716 4.884 -7.790 1.00 0.00 H new ATOM 815 N ASN A 171 12.447 4.806 -8.387 1.00 0.00 N ATOM 816 CA ASN A 171 11.477 5.550 -9.169 1.00 0.00 C ATOM 817 C ASN A 171 10.174 5.495 -8.395 1.00 0.00 C ATOM 818 O ASN A 171 9.763 4.423 -7.947 1.00 0.00 O ATOM 819 CB ASN A 171 11.305 4.849 -10.512 1.00 0.00 C ATOM 820 CG ASN A 171 10.384 5.495 -11.525 1.00 0.00 C ATOM 821 OD1 ASN A 171 9.636 6.418 -11.240 1.00 0.00 O ATOM 822 ND2 ASN A 171 10.334 4.906 -12.706 1.00 0.00 N ATOM 0 H ASN A 171 12.003 4.119 -7.777 1.00 0.00 H new ATOM 0 HA ASN A 171 11.787 6.581 -9.341 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.290 4.750 -10.968 1.00 0.00 H new ATOM 0 HB3 ASN A 171 10.939 3.840 -10.320 1.00 0.00 H new ATOM 0 HD21 ASN A 171 9.660 5.220 -13.404 1.00 0.00 H new ATOM 0 HD22 ASN A 171 10.969 4.137 -12.920 1.00 0.00 H new ATOM 829 N GLN A 172 9.487 6.626 -8.324 1.00 0.00 N ATOM 830 CA GLN A 172 8.228 6.752 -7.585 1.00 0.00 C ATOM 831 C GLN A 172 7.087 6.160 -8.423 1.00 0.00 C ATOM 832 O GLN A 172 5.949 6.114 -7.973 1.00 0.00 O ATOM 833 CB GLN A 172 7.997 8.220 -7.155 1.00 0.00 C ATOM 834 CG GLN A 172 6.837 8.444 -6.166 1.00 0.00 C ATOM 835 CD GLN A 172 6.569 9.915 -5.885 1.00 0.00 C ATOM 836 OE1 GLN A 172 5.957 10.599 -6.703 1.00 0.00 O ATOM 837 NE2 GLN A 172 6.959 10.400 -4.722 1.00 0.00 N ATOM 0 H GLN A 172 9.784 7.490 -8.778 1.00 0.00 H new ATOM 0 HA GLN A 172 8.268 6.180 -6.658 1.00 0.00 H new ATOM 0 HB2 GLN A 172 8.915 8.597 -6.704 1.00 0.00 H new ATOM 0 HB3 GLN A 172 7.812 8.817 -8.048 1.00 0.00 H new ATOM 0 HG2 GLN A 172 5.933 7.986 -6.566 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.063 7.936 -5.228 1.00 0.00 H new ATOM 0 HE21 GLN A 172 7.465 9.806 -4.065 1.00 0.00 H new ATOM 0 HE22 GLN A 172 6.754 11.369 -4.479 1.00 0.00 H new ATOM 846 N ASN A 173 7.376 5.673 -9.632 1.00 0.00 N ATOM 847 CA ASN A 173 6.536 4.780 -10.370 1.00 0.00 C ATOM 848 C ASN A 173 6.932 3.362 -9.994 1.00 0.00 C ATOM 849 O ASN A 173 6.143 2.663 -9.382 1.00 0.00 O ATOM 850 CB ASN A 173 6.730 5.028 -11.863 1.00 0.00 C ATOM 851 CG ASN A 173 5.640 4.334 -12.638 1.00 0.00 C ATOM 852 OD1 ASN A 173 4.719 4.990 -13.101 1.00 0.00 O ATOM 853 ND2 ASN A 173 5.685 3.023 -12.759 1.00 0.00 N ATOM 0 H ASN A 173 8.237 5.910 -10.125 1.00 0.00 H new ATOM 0 HA ASN A 173 5.483 4.938 -10.137 1.00 0.00 H new ATOM 0 HB2 ASN A 173 6.712 6.098 -12.069 1.00 0.00 H new ATOM 0 HB3 ASN A 173 7.706 4.659 -12.179 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.939 2.530 -13.249 1.00 0.00 H new ATOM 0 HD22 ASN A 173 6.466 2.501 -12.362 1.00 0.00 H new ATOM 860 N ASN A 174 8.124 2.889 -10.391 1.00 0.00 N ATOM 861 CA ASN A 174 8.282 1.441 -10.558 1.00 0.00 C ATOM 862 C ASN A 174 8.422 0.725 -9.204 1.00 0.00 C ATOM 863 O ASN A 174 7.823 -0.334 -9.030 1.00 0.00 O ATOM 864 CB ASN A 174 9.416 1.077 -11.534 1.00 0.00 C ATOM 865 CG ASN A 174 10.744 0.742 -10.878 1.00 0.00 C ATOM 866 OD1 ASN A 174 10.949 -0.374 -10.428 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.698 1.647 -10.889 1.00 0.00 N ATOM 0 H ASN A 174 8.949 3.454 -10.592 1.00 0.00 H new ATOM 0 HA ASN A 174 7.364 1.076 -11.018 1.00 0.00 H new ATOM 0 HB2 ASN A 174 9.099 0.224 -12.134 1.00 0.00 H new ATOM 0 HB3 ASN A 174 9.567 1.911 -12.220 1.00 0.00 H new ATOM 0 HD21 ASN A 174 12.621 1.420 -10.519 1.00 0.00 H new ATOM 0 HD22 ASN A 174 11.515 2.576 -11.268 1.00 0.00 H new ATOM 874 N PHE A 175 9.119 1.333 -8.230 1.00 0.00 N ATOM 875 CA PHE A 175 9.231 0.789 -6.867 1.00 0.00 C ATOM 876 C PHE A 175 7.826 0.663 -6.266 1.00 0.00 C ATOM 877 O PHE A 175 7.469 -0.327 -5.629 1.00 0.00 O ATOM 878 CB PHE A 175 10.118 1.737 -6.025 1.00 0.00 C ATOM 879 CG PHE A 175 10.288 1.460 -4.534 1.00 0.00 C ATOM 880 CD1 PHE A 175 9.219 1.669 -3.640 1.00 0.00 C ATOM 881 CD2 PHE A 175 11.565 1.181 -4.006 1.00 0.00 C ATOM 882 CE1 PHE A 175 9.422 1.641 -2.251 1.00 0.00 C ATOM 883 CE2 PHE A 175 11.764 1.141 -2.612 1.00 0.00 C ATOM 884 CZ PHE A 175 10.698 1.384 -1.730 1.00 0.00 C ATOM 0 H PHE A 175 9.619 2.212 -8.365 1.00 0.00 H new ATOM 0 HA PHE A 175 9.691 -0.199 -6.878 1.00 0.00 H new ATOM 0 HB2 PHE A 175 11.111 1.744 -6.474 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.714 2.744 -6.129 1.00 0.00 H new ATOM 0 HD1 PHE A 175 8.229 1.854 -4.029 1.00 0.00 H new ATOM 0 HD2 PHE A 175 12.394 0.997 -4.673 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.593 1.818 -1.582 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.745 0.921 -2.218 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.860 1.373 -0.662 1.00 0.00 H new ATOM 894 N VAL A 176 7.049 1.723 -6.465 1.00 0.00 N ATOM 895 CA VAL A 176 5.772 2.027 -5.848 1.00 0.00 C ATOM 896 C VAL A 176 4.652 1.180 -6.489 1.00 0.00 C ATOM 897 O VAL A 176 3.754 0.704 -5.793 1.00 0.00 O ATOM 898 CB VAL A 176 5.637 3.563 -5.989 1.00 0.00 C ATOM 899 CG1 VAL A 176 4.274 4.147 -5.632 1.00 0.00 C ATOM 900 CG2 VAL A 176 6.698 4.276 -5.127 1.00 0.00 C ATOM 0 H VAL A 176 7.326 2.453 -7.121 1.00 0.00 H new ATOM 0 HA VAL A 176 5.695 1.762 -4.793 1.00 0.00 H new ATOM 0 HB VAL A 176 5.780 3.740 -7.055 1.00 0.00 H new ATOM 0 HG11 VAL A 176 4.295 5.228 -5.767 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.512 3.715 -6.280 1.00 0.00 H new ATOM 0 HG13 VAL A 176 4.040 3.916 -4.593 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.591 5.355 -5.237 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.561 4.002 -4.081 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.694 3.976 -5.453 1.00 0.00 H new ATOM 910 N HIS A 177 4.741 0.911 -7.791 1.00 0.00 N ATOM 911 CA HIS A 177 3.887 0.016 -8.558 1.00 0.00 C ATOM 912 C HIS A 177 4.060 -1.408 -8.028 1.00 0.00 C ATOM 913 O HIS A 177 3.085 -2.033 -7.626 1.00 0.00 O ATOM 914 CB HIS A 177 4.279 0.145 -10.043 1.00 0.00 C ATOM 915 CG HIS A 177 3.615 -0.786 -11.031 1.00 0.00 C ATOM 916 ND1 HIS A 177 3.945 -0.873 -12.365 1.00 0.00 N ATOM 917 CD2 HIS A 177 2.620 -1.697 -10.798 1.00 0.00 C ATOM 918 CE1 HIS A 177 3.144 -1.792 -12.928 1.00 0.00 C ATOM 919 NE2 HIS A 177 2.350 -2.351 -12.003 1.00 0.00 N ATOM 0 H HIS A 177 5.460 1.342 -8.372 1.00 0.00 H new ATOM 0 HA HIS A 177 2.832 0.273 -8.459 1.00 0.00 H new ATOM 0 HB2 HIS A 177 4.072 1.168 -10.356 1.00 0.00 H new ATOM 0 HB3 HIS A 177 5.357 0.000 -10.119 1.00 0.00 H new ATOM 0 HD1 HIS A 177 4.669 -0.335 -12.841 1.00 0.00 H new ATOM 0 HD2 HIS A 177 2.131 -1.878 -9.852 1.00 0.00 H new ATOM 0 HE1 HIS A 177 3.140 -2.045 -13.978 1.00 0.00 H new ATOM 927 N ASP A 178 5.290 -1.924 -8.020 1.00 0.00 N ATOM 928 CA ASP A 178 5.637 -3.255 -7.517 1.00 0.00 C ATOM 929 C ASP A 178 5.142 -3.476 -6.091 1.00 0.00 C ATOM 930 O ASP A 178 4.528 -4.491 -5.773 1.00 0.00 O ATOM 931 CB ASP A 178 7.158 -3.373 -7.545 1.00 0.00 C ATOM 932 CG ASP A 178 7.703 -4.666 -6.932 1.00 0.00 C ATOM 933 OD1 ASP A 178 7.297 -5.779 -7.343 1.00 0.00 O ATOM 934 OD2 ASP A 178 8.603 -4.535 -6.076 1.00 0.00 O ATOM 0 H ASP A 178 6.098 -1.412 -8.374 1.00 0.00 H new ATOM 0 HA ASP A 178 5.160 -4.007 -8.145 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.497 -3.304 -8.579 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.586 -2.524 -7.012 1.00 0.00 H new ATOM 939 N CYS A 179 5.382 -2.477 -5.253 1.00 0.00 N ATOM 940 CA CYS A 179 4.918 -2.405 -3.873 1.00 0.00 C ATOM 941 C CYS A 179 3.393 -2.604 -3.768 1.00 0.00 C ATOM 942 O CYS A 179 2.933 -3.472 -3.015 1.00 0.00 O ATOM 943 CB CYS A 179 5.400 -1.060 -3.310 1.00 0.00 C ATOM 944 SG CYS A 179 4.976 -0.648 -1.609 1.00 0.00 S ATOM 0 H CYS A 179 5.928 -1.660 -5.527 1.00 0.00 H new ATOM 0 HA CYS A 179 5.334 -3.217 -3.277 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.486 -1.032 -3.398 1.00 0.00 H new ATOM 0 HB3 CYS A 179 5.008 -0.271 -3.951 1.00 0.00 H new ATOM 949 N VAL A 180 2.604 -1.841 -4.534 1.00 0.00 N ATOM 950 CA VAL A 180 1.152 -2.004 -4.637 1.00 0.00 C ATOM 951 C VAL A 180 0.820 -3.406 -5.128 1.00 0.00 C ATOM 952 O VAL A 180 0.134 -4.134 -4.415 1.00 0.00 O ATOM 953 CB VAL A 180 0.556 -0.862 -5.492 1.00 0.00 C ATOM 954 CG1 VAL A 180 -0.881 -1.108 -5.972 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.545 0.414 -4.646 1.00 0.00 C ATOM 0 H VAL A 180 2.965 -1.080 -5.109 1.00 0.00 H new ATOM 0 HA VAL A 180 0.681 -1.917 -3.658 1.00 0.00 H new ATOM 0 HB VAL A 180 1.182 -0.789 -6.381 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.218 -0.257 -6.564 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -0.911 -2.010 -6.584 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.536 -1.233 -5.110 1.00 0.00 H new ATOM 0 HG21 VAL A 180 0.128 1.234 -5.230 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.064 0.255 -3.756 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.564 0.662 -4.348 1.00 0.00 H new ATOM 965 N ASN A 181 1.327 -3.802 -6.295 1.00 0.00 N ATOM 966 CA ASN A 181 1.118 -5.102 -6.924 1.00 0.00 C ATOM 967 C ASN A 181 1.261 -6.227 -5.921 1.00 0.00 C ATOM 968 O ASN A 181 0.414 -7.118 -5.887 1.00 0.00 O ATOM 969 CB ASN A 181 2.160 -5.346 -8.025 1.00 0.00 C ATOM 970 CG ASN A 181 1.813 -4.726 -9.354 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.680 -4.347 -9.628 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.776 -4.678 -10.252 1.00 0.00 N ATOM 0 H ASN A 181 1.924 -3.193 -6.854 1.00 0.00 H new ATOM 0 HA ASN A 181 0.110 -5.090 -7.338 1.00 0.00 H new ATOM 0 HB2 ASN A 181 3.121 -4.953 -7.693 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.285 -6.420 -8.160 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.583 -4.322 -11.188 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.715 -4.997 -10.011 1.00 0.00 H new ATOM 979 N ILE A 182 2.351 -6.222 -5.157 1.00 0.00 N ATOM 980 CA ILE A 182 2.647 -7.235 -4.170 1.00 0.00 C ATOM 981 C ILE A 182 1.683 -7.149 -2.996 1.00 0.00 C ATOM 982 O ILE A 182 1.152 -8.178 -2.591 1.00 0.00 O ATOM 983 CB ILE A 182 4.121 -7.111 -3.731 1.00 0.00 C ATOM 984 CG1 ILE A 182 5.121 -7.755 -4.714 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.344 -7.723 -2.349 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.736 -9.140 -5.245 1.00 0.00 C ATOM 0 H ILE A 182 3.063 -5.494 -5.215 1.00 0.00 H new ATOM 0 HA ILE A 182 2.509 -8.223 -4.610 1.00 0.00 H new ATOM 0 HB ILE A 182 4.314 -6.038 -3.711 1.00 0.00 H new ATOM 0 HG12 ILE A 182 5.250 -7.084 -5.563 1.00 0.00 H new ATOM 0 HG13 ILE A 182 6.089 -7.833 -4.219 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.393 -7.619 -2.070 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.721 -7.208 -1.618 1.00 0.00 H new ATOM 0 HG23 ILE A 182 4.078 -8.780 -2.372 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.509 -9.496 -5.926 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.638 -9.835 -4.411 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.786 -9.075 -5.776 1.00 0.00 H new ATOM 998 N THR A 183 1.509 -5.979 -2.390 1.00 0.00 N ATOM 999 CA THR A 183 0.758 -5.875 -1.149 1.00 0.00 C ATOM 1000 C THR A 183 -0.720 -6.184 -1.426 1.00 0.00 C ATOM 1001 O THR A 183 -1.377 -6.856 -0.637 1.00 0.00 O ATOM 1002 CB THR A 183 1.012 -4.501 -0.516 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.411 -4.261 -0.431 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.421 -4.426 0.894 1.00 0.00 C ATOM 0 H THR A 183 1.877 -5.094 -2.738 1.00 0.00 H new ATOM 0 HA THR A 183 1.089 -6.610 -0.416 1.00 0.00 H new ATOM 0 HB THR A 183 0.534 -3.750 -1.145 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.760 -4.044 -1.321 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.616 -3.441 1.318 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.655 -4.594 0.847 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.880 -5.189 1.522 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.225 -5.819 -2.602 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.499 -6.274 -3.135 1.00 0.00 C ATOM 1014 C ILE A 184 -2.457 -7.795 -3.305 1.00 0.00 C ATOM 1015 O ILE A 184 -3.288 -8.489 -2.726 1.00 0.00 O ATOM 1016 CB ILE A 184 -2.791 -5.459 -4.412 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.262 -4.063 -3.943 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -3.811 -6.100 -5.344 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.685 -3.120 -5.063 1.00 0.00 C ATOM 0 H ILE A 184 -0.739 -5.177 -3.228 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.338 -6.095 -2.463 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.883 -5.406 -5.013 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.100 -4.189 -3.258 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.456 -3.594 -3.378 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -3.958 -5.463 -6.216 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.448 -7.076 -5.665 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -4.759 -6.220 -4.819 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.999 -2.167 -4.637 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.845 -2.957 -5.738 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.514 -3.561 -5.616 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.450 -8.360 -3.980 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.213 -9.803 -4.048 1.00 0.00 C ATOM 1033 C LYS A 185 -0.962 -10.441 -2.671 1.00 0.00 C ATOM 1034 O LYS A 185 -0.711 -11.642 -2.604 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.090 -10.048 -5.066 1.00 0.00 C ATOM 1036 CG LYS A 185 0.174 -11.510 -5.427 1.00 0.00 C ATOM 1037 CD LYS A 185 0.456 -11.632 -6.929 1.00 0.00 C ATOM 1038 CE LYS A 185 0.996 -13.008 -7.324 1.00 0.00 C ATOM 1039 NZ LYS A 185 1.110 -13.135 -8.792 1.00 0.00 N ATOM 0 H LYS A 185 -0.765 -7.815 -4.504 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.115 -10.310 -4.391 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.330 -9.505 -5.980 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.831 -9.619 -4.673 1.00 0.00 H new ATOM 0 HG2 LYS A 185 1.023 -11.887 -4.857 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.687 -12.122 -5.159 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -0.462 -11.435 -7.483 1.00 0.00 H new ATOM 0 HD3 LYS A 185 1.175 -10.867 -7.222 1.00 0.00 H new ATOM 0 HE2 LYS A 185 1.973 -13.164 -6.866 1.00 0.00 H new ATOM 0 HE3 LYS A 185 0.336 -13.785 -6.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 1.479 -14.078 -9.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 0.173 -13.009 -9.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 1.759 -12.407 -9.154 1.00 0.00 H new ATOM 1053 N GLN A 186 -1.068 -9.713 -1.557 1.00 0.00 N ATOM 1054 CA GLN A 186 -1.090 -10.239 -0.208 1.00 0.00 C ATOM 1055 C GLN A 186 -2.434 -9.985 0.461 1.00 0.00 C ATOM 1056 O GLN A 186 -2.942 -10.911 1.085 1.00 0.00 O ATOM 1057 CB GLN A 186 0.116 -9.707 0.581 1.00 0.00 C ATOM 1058 CG GLN A 186 1.409 -10.344 0.066 1.00 0.00 C ATOM 1059 CD GLN A 186 1.413 -11.856 0.248 1.00 0.00 C ATOM 1060 OE1 GLN A 186 1.625 -12.378 1.333 1.00 0.00 O ATOM 1061 NE2 GLN A 186 1.138 -12.625 -0.787 1.00 0.00 N ATOM 0 H GLN A 186 -1.144 -8.696 -1.582 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.988 -11.324 -0.234 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.173 -8.623 0.485 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -0.009 -9.927 1.641 1.00 0.00 H new ATOM 0 HG2 GLN A 186 1.535 -10.106 -0.990 1.00 0.00 H new ATOM 0 HG3 GLN A 186 2.260 -9.913 0.593 1.00 0.00 H new ATOM 0 HE21 GLN A 186 0.958 -12.207 -1.700 1.00 0.00 H new ATOM 0 HE22 GLN A 186 1.105 -13.638 -0.675 1.00 0.00 H new ATOM 1070 N HIS A 187 -3.111 -8.857 0.268 1.00 0.00 N ATOM 1071 CA HIS A 187 -4.446 -8.698 0.832 1.00 0.00 C ATOM 1072 C HIS A 187 -5.476 -9.536 0.078 1.00 0.00 C ATOM 1073 O HIS A 187 -6.554 -9.784 0.607 1.00 0.00 O ATOM 1074 CB HIS A 187 -4.830 -7.220 0.970 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.880 -6.827 2.430 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -5.948 -6.268 3.090 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -3.924 -7.109 3.371 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -5.645 -6.223 4.397 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -4.433 -6.759 4.628 1.00 0.00 N ATOM 0 H HIS A 187 -2.767 -8.056 -0.262 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.434 -9.091 1.848 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -4.106 -6.598 0.443 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.800 -7.044 0.505 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -6.816 -5.945 2.663 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -2.948 -7.528 3.177 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -6.288 -5.812 5.161 1.00 0.00 H new ATOM 1087 N THR A 188 -5.098 -10.087 -1.072 1.00 0.00 N ATOM 1088 CA THR A 188 -5.961 -10.842 -1.963 1.00 0.00 C ATOM 1089 C THR A 188 -5.566 -12.330 -1.935 1.00 0.00 C ATOM 1090 O THR A 188 -6.238 -13.174 -2.529 1.00 0.00 O ATOM 1091 CB THR A 188 -5.911 -10.185 -3.357 1.00 0.00 C ATOM 1092 OG1 THR A 188 -6.157 -8.792 -3.268 1.00 0.00 O ATOM 1093 CG2 THR A 188 -6.998 -10.718 -4.275 1.00 0.00 C ATOM 0 H THR A 188 -4.142 -10.014 -1.419 1.00 0.00 H new ATOM 0 HA THR A 188 -7.002 -10.818 -1.642 1.00 0.00 H new ATOM 0 HB THR A 188 -4.918 -10.407 -3.748 1.00 0.00 H new ATOM 0 HG1 THR A 188 -5.319 -8.324 -3.072 1.00 0.00 H new ATOM 0 HG21 THR A 188 -6.926 -10.228 -5.246 1.00 0.00 H new ATOM 0 HG22 THR A 188 -6.873 -11.794 -4.401 1.00 0.00 H new ATOM 0 HG23 THR A 188 -7.976 -10.515 -3.838 1.00 0.00 H new ATOM 1101 N VAL A 189 -4.477 -12.689 -1.235 1.00 0.00 N ATOM 1102 CA VAL A 189 -3.944 -14.054 -1.260 1.00 0.00 C ATOM 1103 C VAL A 189 -3.408 -14.523 0.098 1.00 0.00 C ATOM 1104 O VAL A 189 -3.315 -15.723 0.346 1.00 0.00 O ATOM 1105 CB VAL A 189 -2.862 -14.201 -2.354 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -2.803 -15.681 -2.723 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -3.096 -13.394 -3.648 1.00 0.00 C ATOM 0 H VAL A 189 -3.949 -12.047 -0.644 1.00 0.00 H new ATOM 0 HA VAL A 189 -4.785 -14.705 -1.499 1.00 0.00 H new ATOM 0 HB VAL A 189 -1.940 -13.802 -1.931 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -2.049 -15.834 -3.496 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -2.542 -16.266 -1.841 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -3.775 -16.002 -3.096 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -2.275 -13.574 -4.342 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -4.034 -13.706 -4.107 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -3.144 -12.331 -3.410 1.00 0.00 H new ATOM 1117 N THR A 190 -3.118 -13.607 1.019 1.00 0.00 N ATOM 1118 CA THR A 190 -2.782 -13.953 2.405 1.00 0.00 C ATOM 1119 C THR A 190 -3.807 -13.369 3.388 1.00 0.00 C ATOM 1120 O THR A 190 -3.659 -13.538 4.600 1.00 0.00 O ATOM 1121 CB THR A 190 -1.281 -13.689 2.673 1.00 0.00 C ATOM 1122 OG1 THR A 190 -0.705 -14.751 3.421 1.00 0.00 O ATOM 1123 CG2 THR A 190 -0.933 -12.378 3.380 1.00 0.00 C ATOM 0 H THR A 190 -3.108 -12.605 0.830 1.00 0.00 H new ATOM 0 HA THR A 190 -2.882 -15.024 2.583 1.00 0.00 H new ATOM 0 HB THR A 190 -0.866 -13.614 1.668 1.00 0.00 H new ATOM 0 HG1 THR A 190 0.244 -14.564 3.577 1.00 0.00 H new ATOM 0 HG21 THR A 190 0.147 -12.310 3.510 1.00 0.00 H new ATOM 0 HG22 THR A 190 -1.280 -11.537 2.779 1.00 0.00 H new ATOM 0 HG23 THR A 190 -1.418 -12.351 4.356 1.00 0.00 H new ATOM 1131 N THR A 191 -4.895 -12.795 2.865 1.00 0.00 N ATOM 1132 CA THR A 191 -6.000 -12.278 3.674 1.00 0.00 C ATOM 1133 C THR A 191 -7.338 -12.814 3.144 1.00 0.00 C ATOM 1134 O THR A 191 -8.161 -13.261 3.940 1.00 0.00 O ATOM 1135 CB THR A 191 -5.935 -10.741 3.797 1.00 0.00 C ATOM 1136 OG1 THR A 191 -4.612 -10.275 3.995 1.00 0.00 O ATOM 1137 CG2 THR A 191 -6.738 -10.222 4.986 1.00 0.00 C ATOM 0 H THR A 191 -5.033 -12.676 1.861 1.00 0.00 H new ATOM 0 HA THR A 191 -5.907 -12.645 4.696 1.00 0.00 H new ATOM 0 HB THR A 191 -6.345 -10.375 2.856 1.00 0.00 H new ATOM 0 HG1 THR A 191 -4.632 -9.447 4.520 1.00 0.00 H new ATOM 0 HG21 THR A 191 -6.661 -9.136 5.030 1.00 0.00 H new ATOM 0 HG22 THR A 191 -7.784 -10.508 4.871 1.00 0.00 H new ATOM 0 HG23 THR A 191 -6.343 -10.651 5.907 1.00 0.00 H new ATOM 1145 N THR A 192 -7.536 -12.926 1.826 1.00 0.00 N ATOM 1146 CA THR A 192 -8.752 -13.498 1.224 1.00 0.00 C ATOM 1147 C THR A 192 -8.885 -15.025 1.385 1.00 0.00 C ATOM 1148 O THR A 192 -9.811 -15.660 0.893 1.00 0.00 O ATOM 1149 CB THR A 192 -8.820 -13.033 -0.231 1.00 0.00 C ATOM 1150 OG1 THR A 192 -8.689 -11.630 -0.228 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.115 -13.364 -0.958 1.00 0.00 C ATOM 0 H THR A 192 -6.850 -12.619 1.136 1.00 0.00 H new ATOM 0 HA THR A 192 -9.619 -13.126 1.771 1.00 0.00 H new ATOM 0 HB THR A 192 -8.026 -13.560 -0.760 1.00 0.00 H new ATOM 0 HG1 THR A 192 -9.036 -11.267 -1.070 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.063 -12.992 -1.981 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.259 -14.444 -0.971 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.952 -12.893 -0.443 1.00 0.00 H new ATOM 1159 N THR A 193 -7.956 -15.644 2.101 1.00 0.00 N ATOM 1160 CA THR A 193 -8.041 -17.024 2.559 1.00 0.00 C ATOM 1161 C THR A 193 -8.020 -17.078 4.098 1.00 0.00 C ATOM 1162 O THR A 193 -8.006 -18.158 4.688 1.00 0.00 O ATOM 1163 CB THR A 193 -6.975 -17.845 1.801 1.00 0.00 C ATOM 1164 OG1 THR A 193 -6.936 -19.210 2.178 1.00 0.00 O ATOM 1165 CG2 THR A 193 -5.543 -17.311 1.928 1.00 0.00 C ATOM 0 H THR A 193 -7.093 -15.183 2.389 1.00 0.00 H new ATOM 0 HA THR A 193 -8.992 -17.499 2.317 1.00 0.00 H new ATOM 0 HB THR A 193 -7.308 -17.742 0.768 1.00 0.00 H new ATOM 0 HG1 THR A 193 -7.293 -19.309 3.085 1.00 0.00 H new ATOM 0 HG21 THR A 193 -4.865 -17.951 1.364 1.00 0.00 H new ATOM 0 HG22 THR A 193 -5.497 -16.296 1.534 1.00 0.00 H new ATOM 0 HG23 THR A 193 -5.248 -17.306 2.977 1.00 0.00 H new ATOM 1173 N LYS A 194 -8.052 -15.932 4.788 1.00 0.00 N ATOM 1174 CA LYS A 194 -7.828 -15.803 6.228 1.00 0.00 C ATOM 1175 C LYS A 194 -8.759 -14.754 6.854 1.00 0.00 C ATOM 1176 O LYS A 194 -8.405 -14.170 7.878 1.00 0.00 O ATOM 1177 CB LYS A 194 -6.353 -15.465 6.508 1.00 0.00 C ATOM 1178 CG LYS A 194 -5.338 -16.358 5.785 1.00 0.00 C ATOM 1179 CD LYS A 194 -3.961 -16.274 6.443 1.00 0.00 C ATOM 1180 CE LYS A 194 -2.876 -16.593 5.414 1.00 0.00 C ATOM 1181 NZ LYS A 194 -1.594 -16.915 6.061 1.00 0.00 N ATOM 0 H LYS A 194 -8.242 -15.036 4.339 1.00 0.00 H new ATOM 0 HA LYS A 194 -8.062 -16.761 6.692 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.172 -14.429 6.222 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -6.177 -15.535 7.581 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -5.686 -17.391 5.795 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.264 -16.057 4.740 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -3.804 -15.277 6.853 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -3.902 -16.974 7.276 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -3.194 -17.434 4.797 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -2.744 -15.741 4.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -0.881 -17.126 5.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -1.279 -16.103 6.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -1.715 -17.744 6.678 1.00 0.00 H new ATOM 1195 N GLY A 195 -9.914 -14.476 6.245 1.00 0.00 N ATOM 1196 CA GLY A 195 -10.978 -13.672 6.845 1.00 0.00 C ATOM 1197 C GLY A 195 -11.578 -12.605 5.926 1.00 0.00 C ATOM 1198 O GLY A 195 -12.552 -11.964 6.331 1.00 0.00 O ATOM 0 H GLY A 195 -10.138 -14.809 5.307 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -11.776 -14.338 7.173 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -10.585 -13.183 7.736 1.00 0.00 H new ATOM 1202 N GLU A 196 -11.053 -12.401 4.712 1.00 0.00 N ATOM 1203 CA GLU A 196 -11.505 -11.338 3.805 1.00 0.00 C ATOM 1204 C GLU A 196 -12.047 -11.885 2.497 1.00 0.00 C ATOM 1205 O GLU A 196 -11.818 -13.046 2.171 1.00 0.00 O ATOM 1206 CB GLU A 196 -10.334 -10.388 3.489 1.00 0.00 C ATOM 1207 CG GLU A 196 -10.349 -9.170 4.414 1.00 0.00 C ATOM 1208 CD GLU A 196 -11.484 -8.179 4.104 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -12.373 -8.477 3.270 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -11.566 -7.124 4.771 1.00 0.00 O ATOM 0 H GLU A 196 -10.299 -12.971 4.329 1.00 0.00 H new ATOM 0 HA GLU A 196 -12.310 -10.808 4.314 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -9.389 -10.921 3.599 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.397 -10.061 2.451 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.444 -9.508 5.446 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -9.393 -8.652 4.335 1.00 0.00 H new ATOM 1217 N ASN A 197 -12.655 -10.995 1.708 1.00 0.00 N ATOM 1218 CA ASN A 197 -12.681 -11.032 0.257 1.00 0.00 C ATOM 1219 C ASN A 197 -12.977 -9.637 -0.270 1.00 0.00 C ATOM 1220 O ASN A 197 -14.128 -9.268 -0.507 1.00 0.00 O ATOM 1221 CB ASN A 197 -13.717 -12.019 -0.236 1.00 0.00 C ATOM 1222 CG ASN A 197 -13.814 -12.045 -1.755 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -12.908 -12.500 -2.453 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -14.908 -11.534 -2.297 1.00 0.00 N ATOM 0 H ASN A 197 -13.163 -10.196 2.088 1.00 0.00 H new ATOM 0 HA ASN A 197 -11.709 -11.360 -0.112 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -13.467 -13.016 0.127 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -14.689 -11.761 0.184 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -15.012 -11.512 -3.311 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -15.647 -11.162 -1.700 1.00 0.00 H new ATOM 1231 N PHE A 198 -11.909 -8.867 -0.444 1.00 0.00 N ATOM 1232 CA PHE A 198 -11.965 -7.575 -1.106 1.00 0.00 C ATOM 1233 C PHE A 198 -12.492 -7.762 -2.521 1.00 0.00 C ATOM 1234 O PHE A 198 -12.019 -8.627 -3.269 1.00 0.00 O ATOM 1235 CB PHE A 198 -10.592 -6.901 -1.149 1.00 0.00 C ATOM 1236 CG PHE A 198 -9.985 -6.683 0.218 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -10.389 -5.594 1.017 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -9.057 -7.613 0.718 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -9.876 -5.438 2.314 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -8.573 -7.473 2.027 1.00 0.00 C ATOM 1241 CZ PHE A 198 -8.993 -6.397 2.830 1.00 0.00 C ATOM 0 H PHE A 198 -10.975 -9.126 -0.126 1.00 0.00 H new ATOM 0 HA PHE A 198 -12.632 -6.928 -0.537 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -9.915 -7.512 -1.746 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -10.683 -5.940 -1.655 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -11.097 -4.876 0.629 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -8.719 -8.430 0.098 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -10.160 -4.584 2.911 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -7.874 -8.196 2.421 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.635 -6.310 3.845 1.00 0.00 H new ATOM 1251 N THR A 199 -13.449 -6.927 -2.881 1.00 0.00 N ATOM 1252 CA THR A 199 -14.067 -6.860 -4.190 1.00 0.00 C ATOM 1253 C THR A 199 -13.259 -5.928 -5.090 1.00 0.00 C ATOM 1254 O THR A 199 -12.282 -5.320 -4.652 1.00 0.00 O ATOM 1255 CB THR A 199 -15.499 -6.359 -3.976 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.489 -5.161 -3.214 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.304 -7.427 -3.238 1.00 0.00 C ATOM 0 H THR A 199 -13.836 -6.241 -2.233 1.00 0.00 H new ATOM 0 HA THR A 199 -14.090 -7.831 -4.684 1.00 0.00 H new ATOM 0 HB THR A 199 -15.956 -6.158 -4.945 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.409 -4.848 -3.084 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.323 -7.073 -3.084 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.323 -8.342 -3.830 1.00 0.00 H new ATOM 0 HG23 THR A 199 -15.841 -7.629 -2.272 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.649 -5.779 -6.352 1.00 0.00 N ATOM 1266 CA GLU A 200 -12.983 -4.904 -7.277 1.00 0.00 C ATOM 1267 C GLU A 200 -13.050 -3.456 -6.791 1.00 0.00 C ATOM 1268 O GLU A 200 -12.035 -2.770 -6.807 1.00 0.00 O ATOM 1269 CB GLU A 200 -13.622 -5.087 -8.652 1.00 0.00 C ATOM 1270 CG GLU A 200 -12.655 -4.547 -9.700 1.00 0.00 C ATOM 1271 CD GLU A 200 -13.334 -4.290 -11.038 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -14.014 -3.244 -11.172 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -13.163 -5.094 -11.976 1.00 0.00 O ATOM 0 H GLU A 200 -14.446 -6.273 -6.754 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.924 -5.154 -7.347 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.833 -6.140 -8.836 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -14.573 -4.557 -8.703 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -12.211 -3.620 -9.337 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.841 -5.258 -9.839 1.00 0.00 H new ATOM 1280 N THR A 201 -14.209 -2.987 -6.323 1.00 0.00 N ATOM 1281 CA THR A 201 -14.330 -1.618 -5.835 1.00 0.00 C ATOM 1282 C THR A 201 -13.450 -1.418 -4.597 1.00 0.00 C ATOM 1283 O THR A 201 -12.859 -0.349 -4.452 1.00 0.00 O ATOM 1284 CB THR A 201 -15.799 -1.272 -5.543 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.635 -1.682 -6.614 1.00 0.00 O ATOM 1286 CG2 THR A 201 -16.008 0.236 -5.380 1.00 0.00 C ATOM 0 H THR A 201 -15.069 -3.533 -6.273 1.00 0.00 H new ATOM 0 HA THR A 201 -13.981 -0.936 -6.611 1.00 0.00 H new ATOM 0 HB THR A 201 -16.053 -1.791 -4.619 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.566 -1.454 -6.408 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.059 0.438 -5.175 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.400 0.600 -4.552 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.713 0.745 -6.297 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.318 -2.437 -3.736 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.426 -2.374 -2.579 1.00 0.00 C ATOM 1296 C ASP A 202 -10.982 -2.293 -3.053 1.00 0.00 C ATOM 1297 O ASP A 202 -10.226 -1.452 -2.575 1.00 0.00 O ATOM 1298 CB ASP A 202 -12.543 -3.616 -1.681 1.00 0.00 C ATOM 1299 CG ASP A 202 -13.782 -3.713 -0.804 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -14.557 -2.734 -0.722 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -13.911 -4.739 -0.093 1.00 0.00 O ATOM 0 H ASP A 202 -13.823 -3.319 -3.824 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.716 -1.493 -2.007 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.507 -4.500 -2.317 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -11.666 -3.652 -1.035 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.590 -3.162 -3.987 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.227 -3.225 -4.503 1.00 0.00 C ATOM 1308 C VAL A 203 -8.881 -1.904 -5.185 1.00 0.00 C ATOM 1309 O VAL A 203 -7.788 -1.391 -4.974 1.00 0.00 O ATOM 1310 CB VAL A 203 -9.025 -4.463 -5.405 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.723 -4.418 -6.218 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -8.966 -5.731 -4.535 1.00 0.00 C ATOM 0 H VAL A 203 -11.218 -3.847 -4.408 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.525 -3.356 -3.679 1.00 0.00 H new ATOM 0 HB VAL A 203 -9.868 -4.470 -6.096 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.644 -5.317 -6.829 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.727 -3.540 -6.864 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.872 -4.365 -5.539 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -8.824 -6.603 -5.173 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.134 -5.653 -3.835 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -9.899 -5.835 -3.980 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.797 -1.297 -5.938 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.552 -0.014 -6.590 1.00 0.00 C ATOM 1324 C LYS A 204 -9.485 1.149 -5.601 1.00 0.00 C ATOM 1325 O LYS A 204 -8.987 2.207 -5.977 1.00 0.00 O ATOM 1326 CB LYS A 204 -10.607 0.220 -7.676 1.00 0.00 C ATOM 1327 CG LYS A 204 -10.387 -0.756 -8.839 1.00 0.00 C ATOM 1328 CD LYS A 204 -11.309 -0.494 -10.032 1.00 0.00 C ATOM 1329 CE LYS A 204 -12.787 -0.480 -9.635 1.00 0.00 C ATOM 1330 NZ LYS A 204 -13.683 -0.551 -10.806 1.00 0.00 N ATOM 0 H LYS A 204 -10.726 -1.680 -6.112 1.00 0.00 H new ATOM 0 HA LYS A 204 -8.568 -0.056 -7.056 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.605 0.084 -7.260 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -10.549 1.247 -8.036 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -9.350 -0.690 -9.169 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -10.544 -1.775 -8.484 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.048 0.462 -10.486 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -11.146 -1.261 -10.789 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -12.991 -1.322 -8.973 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -13.001 0.428 -9.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -14.636 -0.238 -10.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -13.318 0.066 -11.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -13.726 -1.531 -11.151 1.00 0.00 H new ATOM 1344 N MET A 205 -9.902 0.983 -4.344 1.00 0.00 N ATOM 1345 CA MET A 205 -9.583 1.940 -3.284 1.00 0.00 C ATOM 1346 C MET A 205 -8.262 1.590 -2.616 1.00 0.00 C ATOM 1347 O MET A 205 -7.460 2.476 -2.317 1.00 0.00 O ATOM 1348 CB MET A 205 -10.681 1.983 -2.225 1.00 0.00 C ATOM 1349 CG MET A 205 -11.960 2.550 -2.819 1.00 0.00 C ATOM 1350 SD MET A 205 -12.992 3.405 -1.626 1.00 0.00 S ATOM 1351 CE MET A 205 -13.948 4.365 -2.815 1.00 0.00 C ATOM 0 H MET A 205 -10.464 0.190 -4.035 1.00 0.00 H new ATOM 0 HA MET A 205 -9.504 2.921 -3.752 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.864 0.980 -1.839 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.360 2.595 -1.382 1.00 0.00 H new ATOM 0 HG2 MET A 205 -11.702 3.239 -3.623 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.533 1.738 -3.266 1.00 0.00 H new ATOM 0 HE1 MET A 205 -13.820 5.428 -2.611 1.00 0.00 H new ATOM 0 HE2 MET A 205 -13.600 4.145 -3.824 1.00 0.00 H new ATOM 0 HE3 MET A 205 -15.003 4.103 -2.730 1.00 0.00 H new ATOM 1361 N MET A 206 -8.011 0.301 -2.401 1.00 0.00 N ATOM 1362 CA MET A 206 -6.769 -0.194 -1.844 1.00 0.00 C ATOM 1363 C MET A 206 -5.588 0.195 -2.735 1.00 0.00 C ATOM 1364 O MET A 206 -4.534 0.533 -2.217 1.00 0.00 O ATOM 1365 CB MET A 206 -6.881 -1.708 -1.663 1.00 0.00 C ATOM 1366 CG MET A 206 -5.594 -2.337 -1.134 1.00 0.00 C ATOM 1367 SD MET A 206 -5.857 -3.857 -0.168 1.00 0.00 S ATOM 1368 CE MET A 206 -6.910 -4.825 -1.293 1.00 0.00 C ATOM 0 H MET A 206 -8.682 -0.437 -2.615 1.00 0.00 H new ATOM 0 HA MET A 206 -6.587 0.259 -0.869 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.697 -1.928 -0.975 1.00 0.00 H new ATOM 0 HB3 MET A 206 -7.138 -2.166 -2.618 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.939 -2.562 -1.976 1.00 0.00 H new ATOM 0 HG3 MET A 206 -5.074 -1.608 -0.512 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.122 -5.797 -0.847 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.846 -4.293 -1.464 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.394 -4.966 -2.243 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.775 0.250 -4.050 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.821 0.753 -5.025 1.00 0.00 C ATOM 1380 C GLU A 207 -4.409 2.189 -4.723 1.00 0.00 C ATOM 1381 O GLU A 207 -3.299 2.573 -5.068 1.00 0.00 O ATOM 1382 CB GLU A 207 -5.455 0.723 -6.421 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.295 -0.611 -7.164 1.00 0.00 C ATOM 1384 CD GLU A 207 -4.249 -0.537 -8.281 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -4.486 0.242 -9.235 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -3.226 -1.254 -8.262 1.00 0.00 O ATOM 0 H GLU A 207 -6.640 -0.072 -4.483 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.938 0.116 -4.979 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.518 0.948 -6.329 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -5.013 1.516 -7.024 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.010 -1.387 -6.454 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.255 -0.905 -7.588 1.00 0.00 H new ATOM 1393 N ARG A 208 -5.277 3.001 -4.116 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.946 4.374 -3.755 1.00 0.00 C ATOM 1395 C ARG A 208 -4.298 4.394 -2.384 1.00 0.00 C ATOM 1396 O ARG A 208 -3.288 5.068 -2.198 1.00 0.00 O ATOM 1397 CB ARG A 208 -6.182 5.286 -3.781 1.00 0.00 C ATOM 1398 CG ARG A 208 -6.587 5.727 -5.178 1.00 0.00 C ATOM 1399 CD ARG A 208 -7.396 4.710 -5.963 1.00 0.00 C ATOM 1400 NE ARG A 208 -7.594 5.217 -7.316 1.00 0.00 N ATOM 1401 CZ ARG A 208 -8.666 5.084 -8.097 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -9.669 4.277 -7.778 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -8.732 5.797 -9.208 1.00 0.00 N ATOM 0 H ARG A 208 -6.225 2.723 -3.863 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.246 4.762 -4.495 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.019 4.763 -3.318 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.984 6.169 -3.174 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.167 6.647 -5.099 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -5.686 5.966 -5.743 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -6.876 3.753 -5.990 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -8.357 4.537 -5.479 1.00 0.00 H new ATOM 0 HE ARG A 208 -6.814 5.739 -7.715 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -9.634 3.736 -6.914 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -10.476 4.197 -8.397 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -7.972 6.432 -9.452 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -9.543 5.712 -9.821 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.857 3.666 -1.421 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.329 3.662 -0.064 1.00 0.00 C ATOM 1419 C VAL A 209 -2.902 3.106 -0.066 1.00 0.00 C ATOM 1420 O VAL A 209 -1.982 3.748 0.434 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.325 2.956 0.884 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.077 1.475 1.177 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.367 3.675 2.223 1.00 0.00 C ATOM 0 H VAL A 209 -5.675 3.072 -1.557 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.236 4.673 0.332 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.263 3.002 0.331 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.847 1.104 1.854 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.110 0.909 0.246 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.098 1.355 1.640 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.071 3.171 2.885 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.374 3.664 2.673 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.685 4.706 2.072 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.693 1.942 -0.679 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.403 1.285 -0.743 1.00 0.00 C ATOM 1435 C VAL A 210 -0.479 2.080 -1.672 1.00 0.00 C ATOM 1436 O VAL A 210 0.716 2.051 -1.435 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.585 -0.208 -1.112 1.00 0.00 C ATOM 1438 CG1 VAL A 210 -0.287 -1.012 -1.240 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -2.386 -0.938 -0.027 1.00 0.00 C ATOM 0 H VAL A 210 -3.434 1.425 -1.152 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.911 1.275 0.230 1.00 0.00 H new ATOM 0 HB VAL A 210 -2.082 -0.167 -2.081 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.522 -2.044 -1.501 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.337 -0.574 -2.019 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.249 -0.991 -0.291 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.503 -1.986 -0.304 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.856 -0.871 0.923 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.369 -0.477 0.072 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.971 2.866 -2.641 1.00 0.00 N ATOM 1450 CA GLU A 211 -0.139 3.757 -3.434 1.00 0.00 C ATOM 1451 C GLU A 211 0.427 4.804 -2.490 1.00 0.00 C ATOM 1452 O GLU A 211 1.636 4.896 -2.354 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.952 4.382 -4.574 1.00 0.00 C ATOM 1454 CG GLU A 211 -0.226 5.499 -5.315 1.00 0.00 C ATOM 1455 CD GLU A 211 -1.201 6.484 -5.966 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -1.989 6.095 -6.863 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -1.201 7.667 -5.540 1.00 0.00 O ATOM 0 H GLU A 211 -1.960 2.895 -2.890 1.00 0.00 H new ATOM 0 HA GLU A 211 0.679 3.214 -3.908 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.219 3.601 -5.286 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.884 4.775 -4.168 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.420 6.035 -4.620 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.418 5.067 -6.081 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.419 5.568 -1.799 1.00 0.00 N ATOM 1465 CA GLN A 212 0.004 6.574 -0.833 1.00 0.00 C ATOM 1466 C GLN A 212 0.982 6.001 0.195 1.00 0.00 C ATOM 1467 O GLN A 212 1.930 6.672 0.591 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.237 7.072 -0.091 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.208 7.883 -0.949 1.00 0.00 C ATOM 1470 CD GLN A 212 -1.806 9.352 -0.968 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -1.704 10.008 0.068 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.501 9.867 -2.140 1.00 0.00 N ATOM 0 H GLN A 212 -1.432 5.502 -1.898 1.00 0.00 H new ATOM 0 HA GLN A 212 0.507 7.378 -1.370 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.767 6.213 0.321 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -0.919 7.685 0.752 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.219 7.490 -1.966 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.220 7.782 -0.557 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.594 9.303 -2.985 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.172 10.830 -2.204 1.00 0.00 H new ATOM 1481 N MET A 213 0.765 4.771 0.649 1.00 0.00 N ATOM 1482 CA MET A 213 1.688 4.112 1.557 1.00 0.00 C ATOM 1483 C MET A 213 3.011 3.813 0.834 1.00 0.00 C ATOM 1484 O MET A 213 4.072 4.186 1.324 1.00 0.00 O ATOM 1485 CB MET A 213 0.999 2.872 2.140 1.00 0.00 C ATOM 1486 CG MET A 213 -0.101 3.277 3.144 1.00 0.00 C ATOM 1487 SD MET A 213 -1.608 2.267 3.207 1.00 0.00 S ATOM 1488 CE MET A 213 -0.906 0.605 3.261 1.00 0.00 C ATOM 0 H MET A 213 -0.049 4.210 0.399 1.00 0.00 H new ATOM 0 HA MET A 213 1.951 4.756 2.396 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.563 2.281 1.335 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.736 2.241 2.636 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.341 3.281 4.140 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.395 4.303 2.922 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.708 -0.125 3.374 1.00 0.00 H new ATOM 0 HE2 MET A 213 -0.364 0.409 2.336 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.222 0.526 4.106 1.00 0.00 H new ATOM 1498 N CYS A 214 2.980 3.189 -0.340 1.00 0.00 N ATOM 1499 CA CYS A 214 4.151 2.771 -1.101 1.00 0.00 C ATOM 1500 C CYS A 214 4.983 3.963 -1.564 1.00 0.00 C ATOM 1501 O CYS A 214 6.206 3.926 -1.459 1.00 0.00 O ATOM 1502 CB CYS A 214 3.698 1.938 -2.300 1.00 0.00 C ATOM 1503 SG CYS A 214 3.192 0.263 -1.848 1.00 0.00 S ATOM 0 H CYS A 214 2.103 2.952 -0.805 1.00 0.00 H new ATOM 0 HA CYS A 214 4.787 2.170 -0.451 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.866 2.442 -2.792 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.511 1.883 -3.024 1.00 0.00 H new ATOM 1508 N VAL A 215 4.337 5.024 -2.048 1.00 0.00 N ATOM 1509 CA VAL A 215 4.946 6.292 -2.411 1.00 0.00 C ATOM 1510 C VAL A 215 5.687 6.809 -1.191 1.00 0.00 C ATOM 1511 O VAL A 215 6.832 7.230 -1.303 1.00 0.00 O ATOM 1512 CB VAL A 215 3.861 7.268 -2.936 1.00 0.00 C ATOM 1513 CG1 VAL A 215 3.337 8.332 -1.982 1.00 0.00 C ATOM 1514 CG2 VAL A 215 4.360 8.090 -4.106 1.00 0.00 C ATOM 0 H VAL A 215 3.329 5.017 -2.203 1.00 0.00 H new ATOM 0 HA VAL A 215 5.663 6.182 -3.224 1.00 0.00 H new ATOM 0 HB VAL A 215 3.066 6.557 -3.160 1.00 0.00 H new ATOM 0 HG11 VAL A 215 2.586 8.937 -2.489 1.00 0.00 H new ATOM 0 HG12 VAL A 215 2.889 7.852 -1.112 1.00 0.00 H new ATOM 0 HG13 VAL A 215 4.160 8.970 -1.661 1.00 0.00 H new ATOM 0 HG21 VAL A 215 3.569 8.760 -4.443 1.00 0.00 H new ATOM 0 HG22 VAL A 215 5.225 8.676 -3.796 1.00 0.00 H new ATOM 0 HG23 VAL A 215 4.645 7.426 -4.922 1.00 0.00 H new ATOM 1524 N THR A 216 5.046 6.774 -0.024 1.00 0.00 N ATOM 1525 CA THR A 216 5.628 7.325 1.175 1.00 0.00 C ATOM 1526 C THR A 216 6.831 6.475 1.600 1.00 0.00 C ATOM 1527 O THR A 216 7.869 7.037 1.910 1.00 0.00 O ATOM 1528 CB THR A 216 4.562 7.402 2.283 1.00 0.00 C ATOM 1529 OG1 THR A 216 3.510 8.281 1.942 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.156 7.852 3.614 1.00 0.00 C ATOM 0 H THR A 216 4.120 6.366 0.106 1.00 0.00 H new ATOM 0 HA THR A 216 5.984 8.338 0.986 1.00 0.00 H new ATOM 0 HB THR A 216 4.169 6.391 2.386 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.772 7.771 1.549 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.370 7.893 4.368 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.923 7.144 3.928 1.00 0.00 H new ATOM 0 HG23 THR A 216 5.600 8.841 3.499 1.00 0.00 H new ATOM 1538 N GLN A 217 6.729 5.142 1.602 1.00 0.00 N ATOM 1539 CA GLN A 217 7.848 4.240 1.877 1.00 0.00 C ATOM 1540 C GLN A 217 8.995 4.554 0.923 1.00 0.00 C ATOM 1541 O GLN A 217 10.094 4.845 1.386 1.00 0.00 O ATOM 1542 CB GLN A 217 7.368 2.775 1.825 1.00 0.00 C ATOM 1543 CG GLN A 217 6.782 2.346 3.170 1.00 0.00 C ATOM 1544 CD GLN A 217 7.580 1.558 4.195 1.00 0.00 C ATOM 1545 OE1 GLN A 217 7.028 1.205 5.235 1.00 0.00 O ATOM 1546 NE2 GLN A 217 8.852 1.316 4.034 1.00 0.00 N ATOM 0 H GLN A 217 5.854 4.654 1.410 1.00 0.00 H new ATOM 0 HA GLN A 217 8.233 4.392 2.885 1.00 0.00 H new ATOM 0 HB2 GLN A 217 6.617 2.662 1.043 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.202 2.124 1.563 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.447 3.256 3.668 1.00 0.00 H new ATOM 0 HG3 GLN A 217 5.892 1.757 2.949 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.321 1.604 3.175 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.377 0.839 4.767 1.00 0.00 H new ATOM 1555 N TYR A 218 8.741 4.622 -0.387 1.00 0.00 N ATOM 1556 CA TYR A 218 9.782 4.971 -1.341 1.00 0.00 C ATOM 1557 C TYR A 218 10.466 6.284 -0.959 1.00 0.00 C ATOM 1558 O TYR A 218 11.697 6.341 -0.942 1.00 0.00 O ATOM 1559 CB TYR A 218 9.240 5.042 -2.774 1.00 0.00 C ATOM 1560 CG TYR A 218 10.317 5.415 -3.777 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.543 4.727 -3.768 1.00 0.00 C ATOM 1562 CD2 TYR A 218 10.159 6.534 -4.615 1.00 0.00 C ATOM 1563 CE1 TYR A 218 12.629 5.198 -4.519 1.00 0.00 C ATOM 1564 CE2 TYR A 218 11.227 6.976 -5.416 1.00 0.00 C ATOM 1565 CZ TYR A 218 12.482 6.337 -5.335 1.00 0.00 C ATOM 1566 OH TYR A 218 13.556 6.866 -5.977 1.00 0.00 O ATOM 0 H TYR A 218 7.828 4.440 -0.803 1.00 0.00 H new ATOM 0 HA TYR A 218 10.526 4.175 -1.307 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.811 4.078 -3.046 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.434 5.774 -2.820 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.649 3.829 -3.178 1.00 0.00 H new ATOM 0 HD2 TYR A 218 9.214 7.056 -4.643 1.00 0.00 H new ATOM 0 HE1 TYR A 218 13.579 4.687 -4.472 1.00 0.00 H new ATOM 0 HE2 TYR A 218 11.086 7.805 -6.094 1.00 0.00 H new ATOM 0 HH TYR A 218 13.274 7.648 -6.497 1.00 0.00 H new ATOM 1576 N GLN A 219 9.692 7.327 -0.654 1.00 0.00 N ATOM 1577 CA GLN A 219 10.211 8.619 -0.228 1.00 0.00 C ATOM 1578 C GLN A 219 11.037 8.461 1.060 1.00 0.00 C ATOM 1579 O GLN A 219 12.193 8.879 1.078 1.00 0.00 O ATOM 1580 CB GLN A 219 9.057 9.619 -0.057 1.00 0.00 C ATOM 1581 CG GLN A 219 8.398 10.042 -1.379 1.00 0.00 C ATOM 1582 CD GLN A 219 7.294 11.072 -1.179 1.00 0.00 C ATOM 1583 OE1 GLN A 219 6.052 10.633 -1.116 1.00 0.00 O flip ATOM 1584 NE2 GLN A 219 7.541 12.274 -1.120 1.00 0.00 N flip ATOM 0 H GLN A 219 8.674 7.293 -0.698 1.00 0.00 H new ATOM 0 HA GLN A 219 10.877 9.015 -0.994 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.299 9.177 0.590 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.432 10.507 0.451 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.157 10.453 -2.044 1.00 0.00 H new ATOM 0 HG3 GLN A 219 7.984 9.162 -1.872 1.00 0.00 H new ATOM 0 HE21 GLN A 219 8.506 12.599 -1.170 1.00 0.00 H new ATOM 0 HE22 GLN A 219 6.781 12.947 -1.021 1.00 0.00 H new ATOM 1593 N LYS A 220 10.503 7.827 2.110 1.00 0.00 N ATOM 1594 CA LYS A 220 11.162 7.576 3.389 1.00 0.00 C ATOM 1595 C LYS A 220 12.479 6.854 3.193 1.00 0.00 C ATOM 1596 O LYS A 220 13.488 7.323 3.705 1.00 0.00 O ATOM 1597 CB LYS A 220 10.269 6.739 4.317 1.00 0.00 C ATOM 1598 CG LYS A 220 9.097 7.540 4.893 1.00 0.00 C ATOM 1599 CD LYS A 220 8.073 6.625 5.580 1.00 0.00 C ATOM 1600 CE LYS A 220 8.399 6.289 7.034 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.283 7.461 7.926 1.00 0.00 N ATOM 0 H LYS A 220 9.552 7.458 2.086 1.00 0.00 H new ATOM 0 HA LYS A 220 11.348 8.547 3.847 1.00 0.00 H new ATOM 0 HB2 LYS A 220 9.882 5.882 3.766 1.00 0.00 H new ATOM 0 HB3 LYS A 220 10.871 6.345 5.136 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.472 8.271 5.610 1.00 0.00 H new ATOM 0 HG3 LYS A 220 8.609 8.098 4.094 1.00 0.00 H new ATOM 0 HD2 LYS A 220 7.094 7.103 5.541 1.00 0.00 H new ATOM 0 HD3 LYS A 220 7.997 5.697 5.014 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.727 5.504 7.381 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.412 5.891 7.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 8.330 7.149 8.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 9.063 8.122 7.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.375 7.938 7.756 1.00 0.00 H new ATOM 1615 N GLU A 221 12.498 5.722 2.499 1.00 0.00 N ATOM 1616 CA GLU A 221 13.711 4.951 2.297 1.00 0.00 C ATOM 1617 C GLU A 221 14.718 5.734 1.466 1.00 0.00 C ATOM 1618 O GLU A 221 15.915 5.624 1.726 1.00 0.00 O ATOM 1619 CB GLU A 221 13.427 3.662 1.535 1.00 0.00 C ATOM 1620 CG GLU A 221 12.965 2.472 2.363 1.00 0.00 C ATOM 1621 CD GLU A 221 11.546 2.612 2.869 1.00 0.00 C ATOM 1622 OE1 GLU A 221 10.633 2.139 2.162 1.00 0.00 O ATOM 1623 OE2 GLU A 221 11.387 3.064 4.027 1.00 0.00 O ATOM 0 H GLU A 221 11.671 5.316 2.062 1.00 0.00 H new ATOM 0 HA GLU A 221 14.106 4.732 3.289 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.666 3.871 0.783 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.333 3.375 1.001 1.00 0.00 H new ATOM 0 HG2 GLU A 221 13.041 1.567 1.760 1.00 0.00 H new ATOM 0 HG3 GLU A 221 13.636 2.347 3.213 1.00 0.00 H new ATOM 1630 N SER A 222 14.252 6.466 0.451 1.00 0.00 N ATOM 1631 CA SER A 222 15.116 7.274 -0.391 1.00 0.00 C ATOM 1632 C SER A 222 15.782 8.352 0.435 1.00 0.00 C ATOM 1633 O SER A 222 16.998 8.503 0.374 1.00 0.00 O ATOM 1634 CB SER A 222 14.320 7.980 -1.475 1.00 0.00 C ATOM 1635 OG SER A 222 13.766 7.058 -2.387 1.00 0.00 O ATOM 0 H SER A 222 13.265 6.510 0.196 1.00 0.00 H new ATOM 0 HA SER A 222 15.850 6.603 -0.837 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.523 8.568 -1.019 1.00 0.00 H new ATOM 0 HB3 SER A 222 14.966 8.678 -2.007 1.00 0.00 H new ATOM 0 HG SER A 222 12.840 6.862 -2.133 1.00 0.00 H new ATOM 1641 N GLN A 223 14.990 9.096 1.210 1.00 0.00 N ATOM 1642 CA GLN A 223 15.480 10.160 2.036 1.00 0.00 C ATOM 1643 C GLN A 223 16.439 9.523 3.025 1.00 0.00 C ATOM 1644 O GLN A 223 17.585 9.923 3.128 1.00 0.00 O ATOM 1645 CB GLN A 223 14.270 10.858 2.666 1.00 0.00 C ATOM 1646 CG GLN A 223 14.520 11.592 3.997 1.00 0.00 C ATOM 1647 CD GLN A 223 14.267 10.707 5.221 1.00 0.00 C ATOM 1648 OE1 GLN A 223 13.151 9.998 5.229 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 15.070 10.640 6.151 1.00 0.00 N flip ATOM 0 H GLN A 223 13.981 8.961 1.270 1.00 0.00 H new ATOM 0 HA GLN A 223 16.029 10.936 1.502 1.00 0.00 H new ATOM 0 HB2 GLN A 223 13.878 11.578 1.947 1.00 0.00 H new ATOM 0 HB3 GLN A 223 13.491 10.113 2.828 1.00 0.00 H new ATOM 0 HG2 GLN A 223 15.549 11.951 4.021 1.00 0.00 H new ATOM 0 HG3 GLN A 223 13.875 12.469 4.049 1.00 0.00 H new ATOM 0 HE21 GLN A 223 15.926 11.195 6.127 1.00 0.00 H new ATOM 0 HE22 GLN A 223 14.880 10.030 6.946 1.00 0.00 H new ATOM 1658 N ALA A 224 16.034 8.453 3.686 1.00 0.00 N ATOM 1659 CA ALA A 224 16.882 7.787 4.640 1.00 0.00 C ATOM 1660 C ALA A 224 18.178 7.233 4.020 1.00 0.00 C ATOM 1661 O ALA A 224 19.153 7.081 4.747 1.00 0.00 O ATOM 1662 CB ALA A 224 16.036 6.743 5.350 1.00 0.00 C ATOM 0 H ALA A 224 15.113 8.029 3.573 1.00 0.00 H new ATOM 0 HA ALA A 224 17.254 8.503 5.373 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.647 6.216 6.083 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.204 7.232 5.856 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.650 6.031 4.621 1.00 0.00 H new ATOM 1668 N ALA A 225 18.259 6.994 2.708 1.00 0.00 N ATOM 1669 CA ALA A 225 19.499 6.619 2.043 1.00 0.00 C ATOM 1670 C ALA A 225 20.324 7.859 1.642 1.00 0.00 C ATOM 1671 O ALA A 225 21.530 7.909 1.895 1.00 0.00 O ATOM 1672 CB ALA A 225 19.182 5.747 0.822 1.00 0.00 C ATOM 0 H ALA A 225 17.459 7.057 2.079 1.00 0.00 H new ATOM 0 HA ALA A 225 20.108 6.045 2.741 1.00 0.00 H new ATOM 0 HB1 ALA A 225 20.110 5.466 0.324 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.657 4.848 1.144 1.00 0.00 H new ATOM 0 HB3 ALA A 225 18.553 6.306 0.129 1.00 0.00 H new ATOM 1678 N ALA A 226 19.714 8.841 0.969 1.00 0.00 N ATOM 1679 CA ALA A 226 20.363 10.014 0.368 1.00 0.00 C ATOM 1680 C ALA A 226 20.618 11.158 1.356 1.00 0.00 C ATOM 1681 O ALA A 226 21.504 11.987 1.135 1.00 0.00 O ATOM 1682 CB ALA A 226 19.476 10.532 -0.773 1.00 0.00 C ATOM 0 H ALA A 226 18.705 8.840 0.821 1.00 0.00 H new ATOM 0 HA ALA A 226 21.340 9.687 0.012 1.00 0.00 H new ATOM 0 HB1 ALA A 226 19.944 11.404 -1.230 1.00 0.00 H new ATOM 0 HB2 ALA A 226 19.354 9.750 -1.523 1.00 0.00 H new ATOM 0 HB3 ALA A 226 18.499 10.810 -0.377 1.00 0.00 H new ATOM 1688 N ASP A 227 19.851 11.205 2.437 1.00 0.00 N ATOM 1689 CA ASP A 227 20.041 12.052 3.609 1.00 0.00 C ATOM 1690 C ASP A 227 20.919 11.321 4.631 1.00 0.00 C ATOM 1691 O ASP A 227 21.535 11.953 5.479 1.00 0.00 O ATOM 1692 CB ASP A 227 18.661 12.407 4.214 1.00 0.00 C ATOM 1693 CG ASP A 227 18.537 13.741 4.949 1.00 0.00 C ATOM 1694 OD1 ASP A 227 19.209 14.726 4.560 1.00 0.00 O ATOM 1695 OD2 ASP A 227 17.633 13.852 5.810 1.00 0.00 O ATOM 0 H ASP A 227 19.025 10.614 2.525 1.00 0.00 H new ATOM 0 HA ASP A 227 20.542 12.977 3.325 1.00 0.00 H new ATOM 0 HB2 ASP A 227 17.927 12.397 3.408 1.00 0.00 H new ATOM 0 HB3 ASP A 227 18.383 11.613 4.908 1.00 0.00 H new ATOM 1700 N GLY A 228 21.021 9.987 4.543 1.00 0.00 N ATOM 1701 CA GLY A 228 21.833 9.167 5.439 1.00 0.00 C ATOM 1702 C GLY A 228 21.138 8.904 6.773 1.00 0.00 C ATOM 1703 O GLY A 228 21.778 8.793 7.823 1.00 0.00 O ATOM 0 H GLY A 228 20.531 9.443 3.833 1.00 0.00 H new ATOM 0 HA2 GLY A 228 22.057 8.216 4.955 1.00 0.00 H new ATOM 0 HA3 GLY A 228 22.786 9.665 5.620 1.00 0.00 H new ATOM 1707 N ARG A 229 19.811 8.838 6.738 1.00 0.00 N ATOM 1708 CA ARG A 229 18.912 8.896 7.872 1.00 0.00 C ATOM 1709 C ARG A 229 18.050 7.637 7.985 1.00 0.00 C ATOM 1710 O ARG A 229 16.829 7.739 8.134 1.00 0.00 O ATOM 1711 CB ARG A 229 18.115 10.200 7.712 1.00 0.00 C ATOM 1712 CG ARG A 229 19.015 11.441 7.852 1.00 0.00 C ATOM 1713 CD ARG A 229 19.355 11.735 9.301 1.00 0.00 C ATOM 1714 NE ARG A 229 18.178 12.172 10.067 1.00 0.00 N ATOM 1715 CZ ARG A 229 18.086 12.159 11.400 1.00 0.00 C ATOM 1716 NH1 ARG A 229 19.141 11.896 12.166 1.00 0.00 N ATOM 1717 NH2 ARG A 229 16.932 12.404 11.995 1.00 0.00 N ATOM 0 H ARG A 229 19.308 8.736 5.857 1.00 0.00 H new ATOM 0 HA ARG A 229 19.450 8.913 8.820 1.00 0.00 H new ATOM 0 HB2 ARG A 229 17.629 10.212 6.736 1.00 0.00 H new ATOM 0 HB3 ARG A 229 17.325 10.237 8.462 1.00 0.00 H new ATOM 0 HG2 ARG A 229 19.935 11.287 7.288 1.00 0.00 H new ATOM 0 HG3 ARG A 229 18.513 12.304 7.415 1.00 0.00 H new ATOM 0 HD2 ARG A 229 19.776 10.842 9.763 1.00 0.00 H new ATOM 0 HD3 ARG A 229 20.122 12.508 9.343 1.00 0.00 H new ATOM 0 HE ARG A 229 17.372 12.510 9.542 1.00 0.00 H new ATOM 0 HH11 ARG A 229 20.045 11.698 11.738 1.00 0.00 H new ATOM 0 HH12 ARG A 229 19.046 11.892 13.182 1.00 0.00 H new ATOM 0 HH21 ARG A 229 16.103 12.605 11.436 1.00 0.00 H new ATOM 0 HH22 ARG A 229 16.870 12.392 13.013 1.00 0.00 H new