USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 793 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 :FLIP no HE2:sc= -3.39 F(o=-5.3!,f=-3.6) USER MOD Set 1.2: A 188 THR OG1 : rot 84:sc= -0.208 USER MOD Set 2.1: A 163 TYR OH : rot 30:sc= 0 USER MOD Set 2.2: A 217 GLN : amide:sc= -0.166 K(o=-0.17,f=-3.7!) USER MOD Set 3.1: A 138 MET CE :methyl -120:sc= -1.81! (180deg=-3.85!) USER MOD Set 3.2: A 154 MET CE :methyl 167:sc= -3.07! (180deg=-3.54!) USER MOD Set 4.1: A 153 ASN : amide:sc= -1.86 K(o=-0.92,f=-7.1!) USER MOD Set 4.2: A 157 TYR OH : rot 14:sc= 0.944 USER MOD Single : A 128 TYR OH : rot -117:sc= 0.185 USER MOD Single : A 129 MET CE :methyl 160:sc= -0.0222 (180deg=-0.84) USER MOD Single : A 132 SER OG : rot 180:sc= 0.0238 USER MOD Single : A 134 MET CE :methyl -179:sc= -0.231 (180deg=-0.231) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HE2:sc= 0.818 K(o=0.82,f=-5.9!) USER MOD Single : A 143 ASN : amide:sc= 1.08 K(o=1.1,f=-0.056) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot -172:sc= 1.27 USER MOD Single : A 155 TYR OH : rot -142:sc= 0.0954 USER MOD Single : A 159 ASN : amide:sc= -0.299 X(o=-0.3,f=-0.28) USER MOD Single : A 160 GLN :FLIP amide:sc= -0.195 F(o=-0.74,f=-0.19) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 170 SER OG : rot -140:sc= 0.196 USER MOD Single : A 171 ASN :FLIP amide:sc= 0 F(o=-0.58,f=0) USER MOD Single : A 172 GLN : amide:sc= 0 X(o=0,f=-0.001) USER MOD Single : A 173 ASN : amide:sc= -0.038 X(o=-0.038,f=0) USER MOD Single : A 174 ASN : amide:sc= 0.587 K(o=0.59,f=0.0078) USER MOD Single : A 177 HIS :FLIP no HD1:sc= -0.306 F(o=-1.2,f=-0.31) USER MOD Single : A 181 ASN : amide:sc= 0.111 K(o=0.11,f=-0.7) USER MOD Single : A 183 THR OG1 : rot 84:sc= 1.79 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -2.33 K(o=-2.3,f=-3.5!) USER MOD Single : A 190 THR OG1 : rot -66:sc= -0.0741 USER MOD Single : A 191 THR OG1 : rot 97:sc= 0.197 USER MOD Single : A 192 THR OG1 : rot 180:sc= -0.381 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= -0.0356 X(o=-0.036,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.133 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ -166:sc= 0.649 (180deg=0.483) USER MOD Single : A 205 MET CE :methyl 135:sc= -0.937 (180deg=-1.23) USER MOD Single : A 206 MET CE :methyl -139:sc= -0.159 (180deg=-1.19) USER MOD Single : A 212 GLN : amide:sc=-0.00618 K(o=-0.0062,f=-0.65) USER MOD Single : A 213 MET CE :methyl -169:sc= -0.648 (180deg=-0.995) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 TYR OH : rot 180:sc= -0.273 USER MOD Single : A 219 GLN : amide:sc= 0.562 K(o=0.56,f=0) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 92:sc= 0.781 USER MOD Single : A 223 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 6.328 -13.505 -1.006 1.00 0.00 N ATOM 66 CA LEU A 125 6.823 -12.707 0.115 1.00 0.00 C ATOM 67 C LEU A 125 8.115 -13.247 0.738 1.00 0.00 C ATOM 68 O LEU A 125 8.400 -12.954 1.899 1.00 0.00 O ATOM 69 CB LEU A 125 5.697 -12.552 1.143 1.00 0.00 C ATOM 70 CG LEU A 125 4.699 -11.497 0.623 1.00 0.00 C ATOM 71 CD1 LEU A 125 3.464 -12.070 -0.047 1.00 0.00 C ATOM 72 CD2 LEU A 125 4.308 -10.509 1.703 1.00 0.00 C ATOM 0 HA LEU A 125 7.106 -11.726 -0.267 1.00 0.00 H new ATOM 0 HB2 LEU A 125 5.193 -13.506 1.299 1.00 0.00 H new ATOM 0 HB3 LEU A 125 6.104 -12.246 2.107 1.00 0.00 H new ATOM 0 HG LEU A 125 5.246 -10.970 -0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 125 2.820 -11.256 -0.381 1.00 0.00 H new ATOM 0 HD12 LEU A 125 3.762 -12.672 -0.905 1.00 0.00 H new ATOM 0 HD13 LEU A 125 2.921 -12.694 0.663 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.604 -9.784 1.295 1.00 0.00 H new ATOM 0 HD22 LEU A 125 3.841 -11.042 2.531 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.197 -9.990 2.061 1.00 0.00 H new ATOM 84 N GLY A 126 8.902 -14.038 0.012 1.00 0.00 N ATOM 85 CA GLY A 126 10.154 -14.626 0.491 1.00 0.00 C ATOM 86 C GLY A 126 11.285 -13.602 0.600 1.00 0.00 C ATOM 87 O GLY A 126 12.291 -13.689 -0.108 1.00 0.00 O ATOM 0 H GLY A 126 8.682 -14.295 -0.950 1.00 0.00 H new ATOM 0 HA2 GLY A 126 9.986 -15.081 1.467 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.457 -15.425 -0.185 1.00 0.00 H new ATOM 91 N GLY A 127 11.103 -12.595 1.451 1.00 0.00 N ATOM 92 CA GLY A 127 12.022 -11.506 1.691 1.00 0.00 C ATOM 93 C GLY A 127 11.308 -10.173 1.587 1.00 0.00 C ATOM 94 O GLY A 127 11.973 -9.142 1.555 1.00 0.00 O ATOM 0 H GLY A 127 10.259 -12.521 2.020 1.00 0.00 H new ATOM 0 HA2 GLY A 127 12.467 -11.610 2.680 1.00 0.00 H new ATOM 0 HA3 GLY A 127 12.837 -11.545 0.969 1.00 0.00 H new ATOM 98 N TYR A 128 9.976 -10.165 1.478 1.00 0.00 N ATOM 99 CA TYR A 128 9.208 -8.985 1.752 1.00 0.00 C ATOM 100 C TYR A 128 9.178 -8.753 3.265 1.00 0.00 C ATOM 101 O TYR A 128 9.479 -9.631 4.083 1.00 0.00 O ATOM 102 CB TYR A 128 7.817 -9.196 1.168 1.00 0.00 C ATOM 103 CG TYR A 128 7.726 -8.938 -0.329 1.00 0.00 C ATOM 104 CD1 TYR A 128 8.387 -9.798 -1.232 1.00 0.00 C ATOM 105 CD2 TYR A 128 6.972 -7.853 -0.825 1.00 0.00 C ATOM 106 CE1 TYR A 128 8.230 -9.624 -2.614 1.00 0.00 C ATOM 107 CE2 TYR A 128 6.859 -7.638 -2.211 1.00 0.00 C ATOM 108 CZ TYR A 128 7.468 -8.545 -3.107 1.00 0.00 C ATOM 109 OH TYR A 128 7.346 -8.404 -4.449 1.00 0.00 O ATOM 0 H TYR A 128 9.422 -10.975 1.200 1.00 0.00 H new ATOM 0 HA TYR A 128 9.644 -8.096 1.297 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.502 -10.220 1.369 1.00 0.00 H new ATOM 0 HB3 TYR A 128 7.115 -8.539 1.682 1.00 0.00 H new ATOM 0 HD1 TYR A 128 9.015 -10.592 -0.857 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.478 -7.183 -0.136 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.693 -10.317 -3.301 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.311 -6.787 -2.587 1.00 0.00 H new ATOM 0 HH TYR A 128 7.754 -7.558 -4.727 1.00 0.00 H new ATOM 119 N MET A 129 8.786 -7.549 3.632 1.00 0.00 N ATOM 120 CA MET A 129 8.844 -6.952 4.945 1.00 0.00 C ATOM 121 C MET A 129 7.531 -6.247 5.166 1.00 0.00 C ATOM 122 O MET A 129 6.803 -5.989 4.204 1.00 0.00 O ATOM 123 CB MET A 129 9.967 -5.919 5.005 1.00 0.00 C ATOM 124 CG MET A 129 11.238 -6.423 4.347 1.00 0.00 C ATOM 125 SD MET A 129 12.737 -5.751 5.056 1.00 0.00 S ATOM 126 CE MET A 129 13.630 -7.316 5.025 1.00 0.00 C ATOM 0 H MET A 129 8.381 -6.906 2.951 1.00 0.00 H new ATOM 0 HA MET A 129 9.028 -7.715 5.701 1.00 0.00 H new ATOM 0 HB2 MET A 129 9.643 -5.002 4.513 1.00 0.00 H new ATOM 0 HB3 MET A 129 10.173 -5.667 6.045 1.00 0.00 H new ATOM 0 HG2 MET A 129 11.268 -7.510 4.422 1.00 0.00 H new ATOM 0 HG3 MET A 129 11.208 -6.177 3.285 1.00 0.00 H new ATOM 0 HE1 MET A 129 14.702 -7.125 5.082 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.325 -7.926 5.875 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.405 -7.845 4.099 1.00 0.00 H new ATOM 136 N LEU A 130 7.259 -5.897 6.418 1.00 0.00 N ATOM 137 CA LEU A 130 5.988 -5.329 6.800 1.00 0.00 C ATOM 138 C LEU A 130 6.226 -4.024 7.546 1.00 0.00 C ATOM 139 O LEU A 130 6.853 -4.002 8.608 1.00 0.00 O ATOM 140 CB LEU A 130 5.202 -6.394 7.568 1.00 0.00 C ATOM 141 CG LEU A 130 3.741 -6.049 7.919 1.00 0.00 C ATOM 142 CD1 LEU A 130 3.652 -5.578 9.343 1.00 0.00 C ATOM 143 CD2 LEU A 130 3.014 -5.070 6.993 1.00 0.00 C ATOM 0 H LEU A 130 7.918 -6.002 7.190 1.00 0.00 H new ATOM 0 HA LEU A 130 5.372 -5.056 5.943 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.204 -7.311 6.979 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.734 -6.609 8.495 1.00 0.00 H new ATOM 0 HG LEU A 130 3.208 -6.988 7.770 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.616 -5.336 9.582 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.004 -6.365 10.009 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.271 -4.690 9.472 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.997 -4.915 7.354 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.544 -4.118 6.982 1.00 0.00 H new ATOM 0 HD23 LEU A 130 2.983 -5.479 5.983 1.00 0.00 H new ATOM 155 N GLY A 131 5.786 -2.921 6.950 1.00 0.00 N ATOM 156 CA GLY A 131 5.820 -1.590 7.522 1.00 0.00 C ATOM 157 C GLY A 131 4.905 -1.567 8.726 1.00 0.00 C ATOM 158 O GLY A 131 3.691 -1.715 8.581 1.00 0.00 O ATOM 0 H GLY A 131 5.379 -2.937 6.015 1.00 0.00 H new ATOM 0 HA2 GLY A 131 6.837 -1.328 7.813 1.00 0.00 H new ATOM 0 HA3 GLY A 131 5.499 -0.852 6.787 1.00 0.00 H new ATOM 162 N SER A 132 5.494 -1.416 9.909 1.00 0.00 N ATOM 163 CA SER A 132 4.747 -1.333 11.149 1.00 0.00 C ATOM 164 C SER A 132 3.783 -0.140 11.083 1.00 0.00 C ATOM 165 O SER A 132 4.009 0.830 10.351 1.00 0.00 O ATOM 166 CB SER A 132 5.715 -1.222 12.336 1.00 0.00 C ATOM 167 OG SER A 132 6.889 -2.004 12.158 1.00 0.00 O ATOM 0 H SER A 132 6.505 -1.348 10.029 1.00 0.00 H new ATOM 0 HA SER A 132 4.156 -2.238 11.292 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.996 -0.178 12.475 1.00 0.00 H new ATOM 0 HB3 SER A 132 5.206 -1.539 13.246 1.00 0.00 H new ATOM 0 HG SER A 132 7.473 -1.899 12.938 1.00 0.00 H new ATOM 173 N ALA A 133 2.709 -0.243 11.861 1.00 0.00 N ATOM 174 CA ALA A 133 1.431 0.433 11.681 1.00 0.00 C ATOM 175 C ALA A 133 1.546 1.946 11.452 1.00 0.00 C ATOM 176 O ALA A 133 2.371 2.622 12.070 1.00 0.00 O ATOM 177 CB ALA A 133 0.572 0.090 12.897 1.00 0.00 C ATOM 0 H ALA A 133 2.710 -0.841 12.688 1.00 0.00 H new ATOM 0 HA ALA A 133 0.966 0.078 10.762 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -0.399 0.577 12.805 1.00 0.00 H new ATOM 0 HB2 ALA A 133 0.433 -0.990 12.951 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.068 0.438 13.803 1.00 0.00 H new ATOM 183 N MET A 134 0.711 2.476 10.559 1.00 0.00 N ATOM 184 CA MET A 134 0.848 3.802 9.964 1.00 0.00 C ATOM 185 C MET A 134 -0.433 4.607 10.183 1.00 0.00 C ATOM 186 O MET A 134 -1.480 4.063 10.553 1.00 0.00 O ATOM 187 CB MET A 134 1.162 3.676 8.459 1.00 0.00 C ATOM 188 CG MET A 134 2.294 2.684 8.156 1.00 0.00 C ATOM 189 SD MET A 134 2.618 2.447 6.405 1.00 0.00 S ATOM 190 CE MET A 134 4.174 3.341 6.302 1.00 0.00 C ATOM 0 H MET A 134 -0.109 1.974 10.219 1.00 0.00 H new ATOM 0 HA MET A 134 1.673 4.327 10.445 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.261 3.361 7.932 1.00 0.00 H new ATOM 0 HB3 MET A 134 1.433 4.657 8.068 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.207 3.033 8.639 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.046 1.721 8.602 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.536 3.325 5.274 1.00 0.00 H new ATOM 0 HE2 MET A 134 4.022 4.373 6.617 1.00 0.00 H new ATOM 0 HE3 MET A 134 4.909 2.868 6.953 1.00 0.00 H new ATOM 200 N SER A 135 -0.368 5.917 9.948 1.00 0.00 N ATOM 201 CA SER A 135 -1.544 6.776 9.972 1.00 0.00 C ATOM 202 C SER A 135 -2.295 6.634 8.650 1.00 0.00 C ATOM 203 O SER A 135 -1.706 6.289 7.620 1.00 0.00 O ATOM 204 CB SER A 135 -1.104 8.219 10.206 1.00 0.00 C ATOM 205 OG SER A 135 -2.199 9.057 10.513 1.00 0.00 O ATOM 0 H SER A 135 0.500 6.409 9.736 1.00 0.00 H new ATOM 0 HA SER A 135 -2.214 6.485 10.781 1.00 0.00 H new ATOM 0 HB2 SER A 135 -0.382 8.251 11.022 1.00 0.00 H new ATOM 0 HB3 SER A 135 -0.598 8.594 9.316 1.00 0.00 H new ATOM 0 HG SER A 135 -1.880 9.972 10.658 1.00 0.00 H new ATOM 211 N ARG A 136 -3.587 6.957 8.650 1.00 0.00 N ATOM 212 CA ARG A 136 -4.353 7.046 7.408 1.00 0.00 C ATOM 213 C ARG A 136 -4.010 8.343 6.673 1.00 0.00 C ATOM 214 O ARG A 136 -3.858 9.372 7.336 1.00 0.00 O ATOM 215 CB ARG A 136 -5.854 6.882 7.648 1.00 0.00 C ATOM 216 CG ARG A 136 -6.521 8.060 8.364 1.00 0.00 C ATOM 217 CD ARG A 136 -8.030 7.926 8.268 1.00 0.00 C ATOM 218 NE ARG A 136 -8.535 6.808 9.069 1.00 0.00 N ATOM 219 CZ ARG A 136 -9.481 6.815 10.011 1.00 0.00 C ATOM 220 NH1 ARG A 136 -10.047 7.939 10.437 1.00 0.00 N ATOM 221 NH2 ARG A 136 -9.843 5.655 10.530 1.00 0.00 N ATOM 0 H ARG A 136 -4.124 7.161 9.493 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.067 6.214 6.764 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.347 6.732 6.688 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -6.017 5.978 8.235 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.214 8.084 9.410 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.200 9.000 7.916 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -8.498 8.852 8.603 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -8.315 7.783 7.226 1.00 0.00 H new ATOM 0 HE ARG A 136 -8.106 5.902 8.882 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -9.762 8.835 10.042 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -10.767 7.906 11.159 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -9.403 4.793 10.209 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -10.563 5.622 11.252 1.00 0.00 H new ATOM 235 N PRO A 137 -3.889 8.343 5.338 1.00 0.00 N ATOM 236 CA PRO A 137 -3.889 9.565 4.550 1.00 0.00 C ATOM 237 C PRO A 137 -5.283 10.112 4.376 1.00 0.00 C ATOM 238 O PRO A 137 -6.284 9.412 4.570 1.00 0.00 O ATOM 239 CB PRO A 137 -3.280 9.175 3.201 1.00 0.00 C ATOM 240 CG PRO A 137 -3.759 7.731 3.044 1.00 0.00 C ATOM 241 CD PRO A 137 -3.736 7.186 4.470 1.00 0.00 C ATOM 0 HA PRO A 137 -3.321 10.355 5.041 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.636 9.813 2.392 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.192 9.246 3.208 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -4.759 7.685 2.614 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -3.103 7.161 2.386 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.542 6.469 4.628 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.801 6.664 4.674 1.00 0.00 H new ATOM 249 N MET A 138 -5.307 11.363 3.939 1.00 0.00 N ATOM 250 CA MET A 138 -6.448 11.963 3.308 1.00 0.00 C ATOM 251 C MET A 138 -6.341 11.729 1.811 1.00 0.00 C ATOM 252 O MET A 138 -5.249 11.837 1.255 1.00 0.00 O ATOM 253 CB MET A 138 -6.480 13.462 3.634 1.00 0.00 C ATOM 254 CG MET A 138 -7.553 13.888 4.647 1.00 0.00 C ATOM 255 SD MET A 138 -8.052 12.732 5.959 1.00 0.00 S ATOM 256 CE MET A 138 -9.300 11.707 5.119 1.00 0.00 C ATOM 0 H MET A 138 -4.510 11.994 4.021 1.00 0.00 H new ATOM 0 HA MET A 138 -7.374 11.519 3.674 1.00 0.00 H new ATOM 0 HB2 MET A 138 -5.503 13.755 4.019 1.00 0.00 H new ATOM 0 HB3 MET A 138 -6.637 14.016 2.708 1.00 0.00 H new ATOM 0 HG2 MET A 138 -7.203 14.800 5.131 1.00 0.00 H new ATOM 0 HG3 MET A 138 -8.449 14.150 4.084 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.254 11.797 5.638 1.00 0.00 H new ATOM 0 HE2 MET A 138 -9.414 12.044 4.089 1.00 0.00 H new ATOM 0 HE3 MET A 138 -8.980 10.665 5.126 1.00 0.00 H new ATOM 266 N ILE A 139 -7.464 11.375 1.181 1.00 0.00 N ATOM 267 CA ILE A 139 -7.588 11.210 -0.257 1.00 0.00 C ATOM 268 C ILE A 139 -8.997 11.647 -0.620 1.00 0.00 C ATOM 269 O ILE A 139 -9.949 11.304 0.082 1.00 0.00 O ATOM 270 CB ILE A 139 -7.321 9.742 -0.699 1.00 0.00 C ATOM 271 CG1 ILE A 139 -6.177 9.064 0.093 1.00 0.00 C ATOM 272 CG2 ILE A 139 -7.035 9.710 -2.212 1.00 0.00 C ATOM 273 CD1 ILE A 139 -5.886 7.615 -0.293 1.00 0.00 C ATOM 0 H ILE A 139 -8.335 11.191 1.679 1.00 0.00 H new ATOM 0 HA ILE A 139 -6.843 11.813 -0.776 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.218 9.165 -0.477 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -5.267 9.649 -0.043 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -6.422 9.098 1.154 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -6.847 8.683 -2.525 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -7.896 10.103 -2.753 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -6.159 10.321 -2.430 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.069 7.232 0.319 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -6.777 7.009 -0.129 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.604 7.568 -1.345 1.00 0.00 H new ATOM 285 N HIS A 140 -9.114 12.404 -1.707 1.00 0.00 N ATOM 286 CA HIS A 140 -10.359 12.972 -2.210 1.00 0.00 C ATOM 287 C HIS A 140 -10.605 12.618 -3.681 1.00 0.00 C ATOM 288 O HIS A 140 -11.572 13.065 -4.290 1.00 0.00 O ATOM 289 CB HIS A 140 -10.347 14.488 -2.009 1.00 0.00 C ATOM 290 CG HIS A 140 -9.907 14.878 -0.625 1.00 0.00 C ATOM 291 ND1 HIS A 140 -10.368 14.328 0.542 1.00 0.00 N ATOM 292 CD2 HIS A 140 -8.839 15.666 -0.312 1.00 0.00 C ATOM 293 CE1 HIS A 140 -9.604 14.786 1.538 1.00 0.00 C ATOM 294 NE2 HIS A 140 -8.664 15.616 1.074 1.00 0.00 N ATOM 0 H HIS A 140 -8.310 12.648 -2.285 1.00 0.00 H new ATOM 0 HA HIS A 140 -11.182 12.537 -1.643 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -9.681 14.944 -2.741 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -11.345 14.885 -2.196 1.00 0.00 H new ATOM 0 HD1 HIS A 140 -11.154 13.684 0.634 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -8.236 16.228 -1.010 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -9.729 14.521 2.578 1.00 0.00 H new ATOM 302 N PHE A 141 -9.688 11.819 -4.227 1.00 0.00 N ATOM 303 CA PHE A 141 -9.464 11.253 -5.566 1.00 0.00 C ATOM 304 C PHE A 141 -9.752 12.157 -6.776 1.00 0.00 C ATOM 305 O PHE A 141 -9.585 11.732 -7.919 1.00 0.00 O ATOM 306 CB PHE A 141 -10.229 9.931 -5.691 1.00 0.00 C ATOM 307 CG PHE A 141 -10.022 8.954 -4.549 1.00 0.00 C ATOM 308 CD1 PHE A 141 -10.738 9.125 -3.351 1.00 0.00 C ATOM 309 CD2 PHE A 141 -9.130 7.872 -4.678 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.586 8.211 -2.300 1.00 0.00 C ATOM 311 CE2 PHE A 141 -8.997 6.941 -3.630 1.00 0.00 C ATOM 312 CZ PHE A 141 -9.731 7.105 -2.444 1.00 0.00 C ATOM 0 H PHE A 141 -8.939 11.491 -3.618 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.385 11.111 -5.620 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -11.293 10.152 -5.770 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -9.934 9.446 -6.621 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.408 9.965 -3.240 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -8.548 7.756 -5.580 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.127 8.357 -1.377 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -8.329 6.099 -3.738 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.639 6.384 -1.645 1.00 0.00 H new ATOM 322 N GLY A 142 -10.169 13.401 -6.571 1.00 0.00 N ATOM 323 CA GLY A 142 -10.816 14.200 -7.590 1.00 0.00 C ATOM 324 C GLY A 142 -12.191 13.630 -7.958 1.00 0.00 C ATOM 325 O GLY A 142 -12.599 13.732 -9.117 1.00 0.00 O ATOM 0 H GLY A 142 -10.063 13.884 -5.679 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -10.928 15.224 -7.235 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -10.186 14.238 -8.479 1.00 0.00 H new ATOM 329 N ASN A 143 -12.891 12.993 -7.012 1.00 0.00 N ATOM 330 CA ASN A 143 -14.297 12.618 -7.129 1.00 0.00 C ATOM 331 C ASN A 143 -14.924 12.787 -5.757 1.00 0.00 C ATOM 332 O ASN A 143 -14.528 12.094 -4.823 1.00 0.00 O ATOM 333 CB ASN A 143 -14.468 11.161 -7.573 1.00 0.00 C ATOM 334 CG ASN A 143 -14.159 10.987 -9.041 1.00 0.00 C ATOM 335 OD1 ASN A 143 -14.866 11.511 -9.895 1.00 0.00 O ATOM 336 ND2 ASN A 143 -13.126 10.241 -9.378 1.00 0.00 N ATOM 0 H ASN A 143 -12.479 12.718 -6.120 1.00 0.00 H new ATOM 0 HA ASN A 143 -14.772 13.249 -7.881 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -13.811 10.521 -6.984 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -15.490 10.837 -7.375 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -12.904 10.092 -10.362 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -12.549 9.813 -8.654 1.00 0.00 H new ATOM 343 N ASP A 144 -15.917 13.661 -5.633 1.00 0.00 N ATOM 344 CA ASP A 144 -16.587 13.984 -4.367 1.00 0.00 C ATOM 345 C ASP A 144 -17.198 12.752 -3.710 1.00 0.00 C ATOM 346 O ASP A 144 -17.270 12.660 -2.484 1.00 0.00 O ATOM 347 CB ASP A 144 -17.679 15.040 -4.605 1.00 0.00 C ATOM 348 CG ASP A 144 -17.638 16.191 -3.607 1.00 0.00 C ATOM 349 OD1 ASP A 144 -17.532 15.981 -2.376 1.00 0.00 O ATOM 350 OD2 ASP A 144 -17.656 17.357 -4.070 1.00 0.00 O ATOM 0 H ASP A 144 -16.292 14.180 -6.427 1.00 0.00 H new ATOM 0 HA ASP A 144 -15.830 14.379 -3.690 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -17.573 15.440 -5.613 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -18.656 14.559 -4.553 1.00 0.00 H new ATOM 355 N TRP A 145 -17.636 11.784 -4.522 1.00 0.00 N ATOM 356 CA TRP A 145 -18.159 10.549 -3.970 1.00 0.00 C ATOM 357 C TRP A 145 -17.032 9.632 -3.508 1.00 0.00 C ATOM 358 O TRP A 145 -17.218 8.935 -2.518 1.00 0.00 O ATOM 359 CB TRP A 145 -19.117 9.827 -4.930 1.00 0.00 C ATOM 360 CG TRP A 145 -18.510 9.064 -6.079 1.00 0.00 C ATOM 361 CD1 TRP A 145 -18.398 9.498 -7.358 1.00 0.00 C ATOM 362 CD2 TRP A 145 -17.886 7.737 -6.067 1.00 0.00 C ATOM 363 NE1 TRP A 145 -17.842 8.496 -8.131 1.00 0.00 N ATOM 364 CE2 TRP A 145 -17.433 7.438 -7.382 1.00 0.00 C ATOM 365 CE3 TRP A 145 -17.598 6.771 -5.082 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -16.699 6.299 -7.713 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -16.828 5.631 -5.383 1.00 0.00 C ATOM 368 CH2 TRP A 145 -16.356 5.419 -6.686 1.00 0.00 C ATOM 0 H TRP A 145 -17.636 11.837 -5.541 1.00 0.00 H new ATOM 0 HA TRP A 145 -18.751 10.822 -3.097 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -19.718 9.131 -4.345 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -19.801 10.569 -5.343 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -18.696 10.472 -7.716 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -17.749 8.545 -9.146 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -17.974 6.907 -4.079 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -16.405 6.104 -8.734 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -16.600 4.916 -4.606 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -15.723 4.569 -6.896 1.00 0.00 H new ATOM 379 N GLU A 146 -15.880 9.610 -4.184 1.00 0.00 N ATOM 380 CA GLU A 146 -14.790 8.742 -3.761 1.00 0.00 C ATOM 381 C GLU A 146 -14.185 9.285 -2.473 1.00 0.00 C ATOM 382 O GLU A 146 -13.871 8.514 -1.572 1.00 0.00 O ATOM 383 CB GLU A 146 -13.696 8.600 -4.823 1.00 0.00 C ATOM 384 CG GLU A 146 -14.159 7.790 -6.031 1.00 0.00 C ATOM 385 CD GLU A 146 -13.035 7.497 -7.028 1.00 0.00 C ATOM 386 OE1 GLU A 146 -12.354 8.442 -7.474 1.00 0.00 O ATOM 387 OE2 GLU A 146 -12.813 6.316 -7.393 1.00 0.00 O ATOM 0 H GLU A 146 -15.684 10.174 -5.011 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.209 7.749 -3.601 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -13.382 9.591 -5.152 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -12.823 8.120 -4.380 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.585 6.848 -5.687 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -14.955 8.333 -6.540 1.00 0.00 H new ATOM 394 N ASP A 147 -14.069 10.612 -2.378 1.00 0.00 N ATOM 395 CA ASP A 147 -13.674 11.319 -1.169 1.00 0.00 C ATOM 396 C ASP A 147 -14.552 10.829 -0.005 1.00 0.00 C ATOM 397 O ASP A 147 -14.051 10.219 0.941 1.00 0.00 O ATOM 398 CB ASP A 147 -13.874 12.830 -1.357 1.00 0.00 C ATOM 399 CG ASP A 147 -13.629 13.615 -0.061 1.00 0.00 C ATOM 400 OD1 ASP A 147 -12.804 13.216 0.787 1.00 0.00 O ATOM 401 OD2 ASP A 147 -14.271 14.671 0.131 1.00 0.00 O ATOM 0 H ASP A 147 -14.253 11.236 -3.164 1.00 0.00 H new ATOM 0 HA ASP A 147 -12.623 11.125 -0.957 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -13.197 13.190 -2.131 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -14.889 13.019 -1.708 1.00 0.00 H new ATOM 406 N ARG A 148 -15.878 11.035 -0.096 1.00 0.00 N ATOM 407 CA ARG A 148 -16.790 10.669 0.990 1.00 0.00 C ATOM 408 C ARG A 148 -16.739 9.173 1.261 1.00 0.00 C ATOM 409 O ARG A 148 -16.818 8.785 2.424 1.00 0.00 O ATOM 410 CB ARG A 148 -18.238 11.146 0.733 1.00 0.00 C ATOM 411 CG ARG A 148 -19.170 10.092 0.100 1.00 0.00 C ATOM 412 CD ARG A 148 -20.620 10.549 -0.017 1.00 0.00 C ATOM 413 NE ARG A 148 -21.573 9.472 0.298 1.00 0.00 N ATOM 414 CZ ARG A 148 -21.831 8.957 1.509 1.00 0.00 C ATOM 415 NH1 ARG A 148 -21.313 9.470 2.623 1.00 0.00 N ATOM 416 NH2 ARG A 148 -22.623 7.902 1.600 1.00 0.00 N ATOM 0 H ARG A 148 -16.335 11.451 -0.908 1.00 0.00 H new ATOM 0 HA ARG A 148 -16.447 11.190 1.884 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -18.671 11.470 1.679 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -18.206 12.019 0.081 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -18.797 9.839 -0.892 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.132 9.181 0.697 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -20.789 11.389 0.657 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -20.804 10.910 -1.029 1.00 0.00 H new ATOM 0 HE ARG A 148 -22.091 9.076 -0.487 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -20.697 10.282 2.572 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -21.532 9.051 3.527 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -23.027 7.493 0.757 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -22.830 7.497 2.513 1.00 0.00 H new ATOM 430 N TYR A 149 -16.678 8.344 0.210 1.00 0.00 N ATOM 431 CA TYR A 149 -16.732 6.900 0.363 1.00 0.00 C ATOM 432 C TYR A 149 -15.578 6.502 1.260 1.00 0.00 C ATOM 433 O TYR A 149 -15.781 5.800 2.244 1.00 0.00 O ATOM 434 CB TYR A 149 -16.576 6.160 -0.977 1.00 0.00 C ATOM 435 CG TYR A 149 -17.840 5.693 -1.667 1.00 0.00 C ATOM 436 CD1 TYR A 149 -19.008 6.480 -1.672 1.00 0.00 C ATOM 437 CD2 TYR A 149 -17.800 4.489 -2.396 1.00 0.00 C ATOM 438 CE1 TYR A 149 -20.117 6.089 -2.439 1.00 0.00 C ATOM 439 CE2 TYR A 149 -18.910 4.085 -3.159 1.00 0.00 C ATOM 440 CZ TYR A 149 -20.063 4.902 -3.199 1.00 0.00 C ATOM 441 OH TYR A 149 -21.109 4.578 -3.998 1.00 0.00 O ATOM 0 H TYR A 149 -16.591 8.659 -0.756 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.703 6.630 0.777 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -16.040 6.816 -1.663 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -15.943 5.289 -0.809 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -19.051 7.386 -1.085 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -16.913 3.873 -2.369 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -21.010 6.696 -2.447 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -18.882 3.157 -3.711 1.00 0.00 H new ATOM 0 HH TYR A 149 -20.921 3.733 -4.457 1.00 0.00 H new ATOM 451 N TYR A 150 -14.380 6.978 0.929 1.00 0.00 N ATOM 452 CA TYR A 150 -13.191 6.685 1.688 1.00 0.00 C ATOM 453 C TYR A 150 -13.365 7.080 3.153 1.00 0.00 C ATOM 454 O TYR A 150 -13.097 6.276 4.047 1.00 0.00 O ATOM 455 CB TYR A 150 -12.004 7.380 1.028 1.00 0.00 C ATOM 456 CG TYR A 150 -10.730 7.262 1.819 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.346 6.008 2.316 1.00 0.00 C ATOM 458 CD2 TYR A 150 -9.966 8.405 2.102 1.00 0.00 C ATOM 459 CE1 TYR A 150 -9.199 5.883 3.105 1.00 0.00 C ATOM 460 CE2 TYR A 150 -8.824 8.295 2.908 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.444 7.038 3.432 1.00 0.00 C ATOM 462 OH TYR A 150 -7.378 6.966 4.274 1.00 0.00 O ATOM 0 H TYR A 150 -14.218 7.579 0.121 1.00 0.00 H new ATOM 0 HA TYR A 150 -13.002 5.611 1.688 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -11.848 6.955 0.036 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.241 8.435 0.889 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.939 5.135 2.088 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -10.256 9.365 1.701 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.890 4.912 3.464 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -8.234 9.172 3.129 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.067 7.871 4.486 1.00 0.00 H new ATOM 472 N ARG A 151 -13.862 8.287 3.428 1.00 0.00 N ATOM 473 CA ARG A 151 -14.133 8.720 4.801 1.00 0.00 C ATOM 474 C ARG A 151 -15.085 7.768 5.523 1.00 0.00 C ATOM 475 O ARG A 151 -14.904 7.522 6.718 1.00 0.00 O ATOM 476 CB ARG A 151 -14.554 10.196 4.821 1.00 0.00 C ATOM 477 CG ARG A 151 -13.448 11.084 4.219 1.00 0.00 C ATOM 478 CD ARG A 151 -13.580 12.545 4.646 1.00 0.00 C ATOM 479 NE ARG A 151 -13.205 13.470 3.565 1.00 0.00 N ATOM 480 CZ ARG A 151 -12.910 14.764 3.721 1.00 0.00 C ATOM 481 NH1 ARG A 151 -13.127 15.359 4.890 1.00 0.00 N ATOM 482 NH2 ARG A 151 -12.383 15.424 2.703 1.00 0.00 N ATOM 0 H ARG A 151 -14.086 8.984 2.717 1.00 0.00 H new ATOM 0 HA ARG A 151 -13.214 8.665 5.384 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.478 10.324 4.257 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -14.760 10.507 5.845 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -12.473 10.705 4.526 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.486 11.021 3.132 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -14.607 12.742 4.952 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -12.948 12.727 5.515 1.00 0.00 H new ATOM 0 HE ARG A 151 -13.167 13.092 2.618 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -13.519 14.828 5.668 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -12.902 16.347 5.009 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -12.209 14.945 1.820 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -12.151 16.412 2.801 1.00 0.00 H new ATOM 496 N GLU A 152 -16.015 7.148 4.804 1.00 0.00 N ATOM 497 CA GLU A 152 -16.988 6.224 5.361 1.00 0.00 C ATOM 498 C GLU A 152 -16.474 4.789 5.509 1.00 0.00 C ATOM 499 O GLU A 152 -17.160 3.969 6.122 1.00 0.00 O ATOM 500 CB GLU A 152 -18.238 6.206 4.469 1.00 0.00 C ATOM 501 CG GLU A 152 -19.012 7.534 4.469 1.00 0.00 C ATOM 502 CD GLU A 152 -20.165 7.598 5.479 1.00 0.00 C ATOM 503 OE1 GLU A 152 -20.053 7.085 6.621 1.00 0.00 O ATOM 504 OE2 GLU A 152 -21.198 8.217 5.136 1.00 0.00 O ATOM 0 H GLU A 152 -16.113 7.279 3.797 1.00 0.00 H new ATOM 0 HA GLU A 152 -17.210 6.586 6.365 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.942 5.967 3.447 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.901 5.408 4.803 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.316 8.346 4.680 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.411 7.707 3.470 1.00 0.00 H new ATOM 511 N ASN A 153 -15.302 4.436 4.973 1.00 0.00 N ATOM 512 CA ASN A 153 -14.832 3.045 4.986 1.00 0.00 C ATOM 513 C ASN A 153 -13.343 2.879 5.279 1.00 0.00 C ATOM 514 O ASN A 153 -12.874 1.750 5.371 1.00 0.00 O ATOM 515 CB ASN A 153 -15.214 2.335 3.679 1.00 0.00 C ATOM 516 CG ASN A 153 -14.660 3.026 2.451 1.00 0.00 C ATOM 517 OD1 ASN A 153 -13.553 3.539 2.477 1.00 0.00 O ATOM 518 ND2 ASN A 153 -15.415 3.060 1.371 1.00 0.00 N ATOM 0 H ASN A 153 -14.662 5.092 4.525 1.00 0.00 H new ATOM 0 HA ASN A 153 -15.343 2.572 5.825 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -14.848 1.309 3.708 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -16.300 2.284 3.603 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -15.078 3.524 0.527 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -16.336 2.622 1.379 1.00 0.00 H new ATOM 525 N MET A 154 -12.608 3.955 5.530 1.00 0.00 N ATOM 526 CA MET A 154 -11.186 3.942 5.875 1.00 0.00 C ATOM 527 C MET A 154 -10.871 2.992 7.030 1.00 0.00 C ATOM 528 O MET A 154 -9.928 2.208 6.970 1.00 0.00 O ATOM 529 CB MET A 154 -10.728 5.373 6.180 1.00 0.00 C ATOM 530 CG MET A 154 -11.525 6.066 7.306 1.00 0.00 C ATOM 531 SD MET A 154 -11.425 7.880 7.443 1.00 0.00 S ATOM 532 CE MET A 154 -10.833 8.403 5.815 1.00 0.00 C ATOM 0 H MET A 154 -12.997 4.897 5.499 1.00 0.00 H new ATOM 0 HA MET A 154 -10.630 3.560 5.019 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.673 5.354 6.455 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.810 5.970 5.272 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.575 5.799 7.183 1.00 0.00 H new ATOM 0 HG3 MET A 154 -11.197 5.642 8.255 1.00 0.00 H new ATOM 0 HE1 MET A 154 -10.956 9.481 5.712 1.00 0.00 H new ATOM 0 HE2 MET A 154 -9.779 8.147 5.712 1.00 0.00 H new ATOM 0 HE3 MET A 154 -11.407 7.897 5.039 1.00 0.00 H new ATOM 542 N TYR A 155 -11.704 3.002 8.066 1.00 0.00 N ATOM 543 CA TYR A 155 -11.554 2.144 9.229 1.00 0.00 C ATOM 544 C TYR A 155 -11.706 0.649 8.892 1.00 0.00 C ATOM 545 O TYR A 155 -11.340 -0.205 9.699 1.00 0.00 O ATOM 546 CB TYR A 155 -12.571 2.613 10.272 1.00 0.00 C ATOM 547 CG TYR A 155 -14.026 2.527 9.858 1.00 0.00 C ATOM 548 CD1 TYR A 155 -14.764 1.354 10.108 1.00 0.00 C ATOM 549 CD2 TYR A 155 -14.641 3.624 9.228 1.00 0.00 C ATOM 550 CE1 TYR A 155 -16.103 1.265 9.687 1.00 0.00 C ATOM 551 CE2 TYR A 155 -15.987 3.551 8.842 1.00 0.00 C ATOM 552 CZ TYR A 155 -16.717 2.356 9.028 1.00 0.00 C ATOM 553 OH TYR A 155 -17.999 2.251 8.580 1.00 0.00 O ATOM 0 H TYR A 155 -12.515 3.618 8.119 1.00 0.00 H new ATOM 0 HA TYR A 155 -10.542 2.230 9.624 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -12.435 2.021 11.177 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -12.347 3.648 10.531 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -14.302 0.524 10.622 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -14.075 4.525 9.041 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -16.665 0.360 9.867 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -16.467 4.412 8.401 1.00 0.00 H new ATOM 0 HH TYR A 155 -18.086 2.720 7.724 1.00 0.00 H new ATOM 563 N ARG A 156 -12.227 0.322 7.707 1.00 0.00 N ATOM 564 CA ARG A 156 -12.459 -1.024 7.178 1.00 0.00 C ATOM 565 C ARG A 156 -11.290 -1.447 6.276 1.00 0.00 C ATOM 566 O ARG A 156 -11.374 -2.506 5.644 1.00 0.00 O ATOM 567 CB ARG A 156 -13.772 -1.061 6.367 1.00 0.00 C ATOM 568 CG ARG A 156 -14.943 -0.395 7.104 1.00 0.00 C ATOM 569 CD ARG A 156 -16.143 -0.148 6.194 1.00 0.00 C ATOM 570 NE ARG A 156 -17.148 -1.199 6.349 1.00 0.00 N ATOM 571 CZ ARG A 156 -17.631 -2.063 5.453 1.00 0.00 C ATOM 572 NH1 ARG A 156 -17.239 -2.036 4.187 1.00 0.00 N ATOM 573 NH2 ARG A 156 -18.528 -2.958 5.844 1.00 0.00 N ATOM 0 H ARG A 156 -12.518 1.042 7.045 1.00 0.00 H new ATOM 0 HA ARG A 156 -12.536 -1.716 8.017 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -13.618 -0.560 5.411 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -14.029 -2.097 6.147 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -15.248 -1.026 7.939 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.610 0.553 7.526 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -16.586 0.820 6.427 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -15.813 -0.106 5.156 1.00 0.00 H new ATOM 0 HE ARG A 156 -17.541 -1.285 7.286 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -16.554 -1.345 3.880 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -17.622 -2.706 3.520 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -18.838 -2.978 6.816 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -18.908 -3.626 5.173 1.00 0.00 H new ATOM 587 N TYR A 157 -10.256 -0.613 6.128 1.00 0.00 N ATOM 588 CA TYR A 157 -9.114 -0.816 5.248 1.00 0.00 C ATOM 589 C TYR A 157 -7.844 -1.015 6.085 1.00 0.00 C ATOM 590 O TYR A 157 -7.840 -0.709 7.282 1.00 0.00 O ATOM 591 CB TYR A 157 -8.969 0.393 4.308 1.00 0.00 C ATOM 592 CG TYR A 157 -10.007 0.579 3.223 1.00 0.00 C ATOM 593 CD1 TYR A 157 -10.694 -0.496 2.617 1.00 0.00 C ATOM 594 CD2 TYR A 157 -10.200 1.880 2.744 1.00 0.00 C ATOM 595 CE1 TYR A 157 -11.613 -0.253 1.577 1.00 0.00 C ATOM 596 CE2 TYR A 157 -11.110 2.131 1.714 1.00 0.00 C ATOM 597 CZ TYR A 157 -11.854 1.071 1.140 1.00 0.00 C ATOM 598 OH TYR A 157 -12.784 1.334 0.178 1.00 0.00 O ATOM 0 H TYR A 157 -10.195 0.263 6.647 1.00 0.00 H new ATOM 0 HA TYR A 157 -9.269 -1.709 4.643 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -8.963 1.294 4.922 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -7.993 0.327 3.828 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -10.514 -1.507 2.952 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -9.640 2.697 3.175 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -12.134 -1.078 1.113 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -11.247 3.140 1.353 1.00 0.00 H new ATOM 0 HH TYR A 157 -13.357 0.549 0.053 1.00 0.00 H new ATOM 608 N PRO A 158 -6.760 -1.535 5.477 1.00 0.00 N ATOM 609 CA PRO A 158 -5.504 -1.791 6.171 1.00 0.00 C ATOM 610 C PRO A 158 -4.860 -0.479 6.642 1.00 0.00 C ATOM 611 O PRO A 158 -5.191 0.605 6.156 1.00 0.00 O ATOM 612 CB PRO A 158 -4.623 -2.568 5.177 1.00 0.00 C ATOM 613 CG PRO A 158 -5.432 -2.684 3.876 1.00 0.00 C ATOM 614 CD PRO A 158 -6.600 -1.747 4.047 1.00 0.00 C ATOM 0 HA PRO A 158 -5.649 -2.376 7.079 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -3.682 -2.047 5.003 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -4.374 -3.554 5.568 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -4.829 -2.406 3.012 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -5.770 -3.707 3.713 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -6.417 -0.803 3.534 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -7.505 -2.174 3.615 1.00 0.00 H new ATOM 622 N ASN A 159 -3.909 -0.583 7.570 1.00 0.00 N ATOM 623 CA ASN A 159 -3.129 0.518 8.140 1.00 0.00 C ATOM 624 C ASN A 159 -1.630 0.195 8.158 1.00 0.00 C ATOM 625 O ASN A 159 -0.864 0.866 8.845 1.00 0.00 O ATOM 626 CB ASN A 159 -3.644 0.910 9.539 1.00 0.00 C ATOM 627 CG ASN A 159 -3.351 -0.143 10.604 1.00 0.00 C ATOM 628 OD1 ASN A 159 -3.807 -1.277 10.528 1.00 0.00 O ATOM 629 ND2 ASN A 159 -2.637 0.182 11.666 1.00 0.00 N ATOM 0 H ASN A 159 -3.647 -1.486 7.966 1.00 0.00 H new ATOM 0 HA ASN A 159 -3.265 1.384 7.492 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -3.188 1.854 9.836 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -4.720 1.078 9.489 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -2.475 -0.506 12.402 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -2.247 1.121 11.751 1.00 0.00 H new ATOM 636 N GLN A 160 -1.202 -0.824 7.413 1.00 0.00 N ATOM 637 CA GLN A 160 0.190 -1.215 7.195 1.00 0.00 C ATOM 638 C GLN A 160 0.427 -1.398 5.690 1.00 0.00 C ATOM 639 O GLN A 160 -0.540 -1.453 4.925 1.00 0.00 O ATOM 640 CB GLN A 160 0.450 -2.533 7.937 1.00 0.00 C ATOM 641 CG GLN A 160 0.421 -2.386 9.464 1.00 0.00 C ATOM 642 CD GLN A 160 0.134 -3.703 10.166 1.00 0.00 C ATOM 643 OE1 GLN A 160 1.040 -4.158 11.013 1.00 0.00 O flip ATOM 644 NE2 GLN A 160 -0.926 -4.302 9.988 1.00 0.00 N flip ATOM 0 H GLN A 160 -1.854 -1.432 6.918 1.00 0.00 H new ATOM 0 HA GLN A 160 0.868 -0.448 7.571 1.00 0.00 H new ATOM 0 HB2 GLN A 160 -0.299 -3.266 7.635 1.00 0.00 H new ATOM 0 HB3 GLN A 160 1.421 -2.926 7.635 1.00 0.00 H new ATOM 0 HG2 GLN A 160 1.379 -1.995 9.807 1.00 0.00 H new ATOM 0 HG3 GLN A 160 -0.339 -1.656 9.742 1.00 0.00 H new ATOM 0 HE21 GLN A 160 -1.614 -3.936 9.330 1.00 0.00 H new ATOM 0 HE22 GLN A 160 -1.116 -5.164 10.498 1.00 0.00 H new ATOM 653 N VAL A 161 1.691 -1.519 5.266 1.00 0.00 N ATOM 654 CA VAL A 161 2.062 -1.860 3.890 1.00 0.00 C ATOM 655 C VAL A 161 3.162 -2.932 3.889 1.00 0.00 C ATOM 656 O VAL A 161 3.975 -2.948 4.815 1.00 0.00 O ATOM 657 CB VAL A 161 2.502 -0.588 3.136 1.00 0.00 C ATOM 658 CG1 VAL A 161 1.388 0.466 3.073 1.00 0.00 C ATOM 659 CG2 VAL A 161 3.750 0.088 3.736 1.00 0.00 C ATOM 0 H VAL A 161 2.495 -1.381 5.879 1.00 0.00 H new ATOM 0 HA VAL A 161 1.198 -2.275 3.371 1.00 0.00 H new ATOM 0 HB VAL A 161 2.742 -0.948 2.136 1.00 0.00 H new ATOM 0 HG11 VAL A 161 1.746 1.342 2.533 1.00 0.00 H new ATOM 0 HG12 VAL A 161 0.523 0.050 2.557 1.00 0.00 H new ATOM 0 HG13 VAL A 161 1.103 0.755 4.085 1.00 0.00 H new ATOM 0 HG21 VAL A 161 3.999 0.975 3.153 1.00 0.00 H new ATOM 0 HG22 VAL A 161 3.547 0.377 4.767 1.00 0.00 H new ATOM 0 HG23 VAL A 161 4.588 -0.609 3.712 1.00 0.00 H new ATOM 669 N TYR A 162 3.227 -3.788 2.863 1.00 0.00 N ATOM 670 CA TYR A 162 4.287 -4.783 2.675 1.00 0.00 C ATOM 671 C TYR A 162 5.201 -4.336 1.522 1.00 0.00 C ATOM 672 O TYR A 162 4.733 -3.668 0.603 1.00 0.00 O ATOM 673 CB TYR A 162 3.675 -6.166 2.375 1.00 0.00 C ATOM 674 CG TYR A 162 2.946 -6.848 3.524 1.00 0.00 C ATOM 675 CD1 TYR A 162 3.657 -7.587 4.496 1.00 0.00 C ATOM 676 CD2 TYR A 162 1.548 -6.723 3.636 1.00 0.00 C ATOM 677 CE1 TYR A 162 2.986 -8.114 5.618 1.00 0.00 C ATOM 678 CE2 TYR A 162 0.888 -7.216 4.775 1.00 0.00 C ATOM 679 CZ TYR A 162 1.602 -7.901 5.774 1.00 0.00 C ATOM 680 OH TYR A 162 0.959 -8.355 6.884 1.00 0.00 O ATOM 0 H TYR A 162 2.526 -3.808 2.122 1.00 0.00 H new ATOM 0 HA TYR A 162 4.876 -4.864 3.589 1.00 0.00 H new ATOM 0 HB2 TYR A 162 2.978 -6.058 1.544 1.00 0.00 H new ATOM 0 HB3 TYR A 162 4.473 -6.827 2.037 1.00 0.00 H new ATOM 0 HD1 TYR A 162 4.718 -7.749 4.379 1.00 0.00 H new ATOM 0 HD2 TYR A 162 0.983 -6.249 2.847 1.00 0.00 H new ATOM 0 HE1 TYR A 162 3.532 -8.681 6.358 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -0.176 -7.067 4.884 1.00 0.00 H new ATOM 0 HH TYR A 162 0.009 -8.122 6.830 1.00 0.00 H new ATOM 690 N TYR A 163 6.488 -4.707 1.530 1.00 0.00 N ATOM 691 CA TYR A 163 7.486 -4.291 0.528 1.00 0.00 C ATOM 692 C TYR A 163 8.748 -5.152 0.615 1.00 0.00 C ATOM 693 O TYR A 163 9.004 -5.740 1.656 1.00 0.00 O ATOM 694 CB TYR A 163 7.907 -2.838 0.805 1.00 0.00 C ATOM 695 CG TYR A 163 8.208 -2.518 2.254 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.481 -2.754 2.812 1.00 0.00 C ATOM 697 CD2 TYR A 163 7.183 -1.980 3.047 1.00 0.00 C ATOM 698 CE1 TYR A 163 9.731 -2.447 4.159 1.00 0.00 C ATOM 699 CE2 TYR A 163 7.423 -1.683 4.392 1.00 0.00 C ATOM 700 CZ TYR A 163 8.694 -1.914 4.959 1.00 0.00 C ATOM 701 OH TYR A 163 8.890 -1.611 6.270 1.00 0.00 O ATOM 0 H TYR A 163 6.876 -5.318 2.248 1.00 0.00 H new ATOM 0 HA TYR A 163 7.033 -4.398 -0.458 1.00 0.00 H new ATOM 0 HB2 TYR A 163 8.791 -2.613 0.209 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.113 -2.175 0.461 1.00 0.00 H new ATOM 0 HD1 TYR A 163 10.267 -3.173 2.201 1.00 0.00 H new ATOM 0 HD2 TYR A 163 6.209 -1.795 2.619 1.00 0.00 H new ATOM 0 HE1 TYR A 163 10.710 -2.617 4.582 1.00 0.00 H new ATOM 0 HE2 TYR A 163 6.630 -1.274 5.001 1.00 0.00 H new ATOM 0 HH TYR A 163 9.826 -1.356 6.410 1.00 0.00 H new ATOM 711 N ARG A 164 9.587 -5.193 -0.424 1.00 0.00 N ATOM 712 CA ARG A 164 10.965 -5.700 -0.339 1.00 0.00 C ATOM 713 C ARG A 164 11.882 -4.638 0.289 1.00 0.00 C ATOM 714 O ARG A 164 11.587 -3.448 0.116 1.00 0.00 O ATOM 715 CB ARG A 164 11.480 -6.026 -1.750 1.00 0.00 C ATOM 716 CG ARG A 164 10.718 -7.170 -2.427 1.00 0.00 C ATOM 717 CD ARG A 164 10.860 -7.067 -3.948 1.00 0.00 C ATOM 718 NE ARG A 164 10.616 -8.353 -4.614 1.00 0.00 N ATOM 719 CZ ARG A 164 11.098 -8.632 -5.829 1.00 0.00 C ATOM 720 NH1 ARG A 164 11.356 -7.655 -6.683 1.00 0.00 N ATOM 721 NH2 ARG A 164 11.359 -9.886 -6.174 1.00 0.00 N ATOM 0 H ARG A 164 9.329 -4.873 -1.358 1.00 0.00 H new ATOM 0 HA ARG A 164 10.971 -6.598 0.279 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.407 -5.133 -2.371 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.537 -6.288 -1.692 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.104 -8.129 -2.082 1.00 0.00 H new ATOM 0 HG3 ARG A 164 9.665 -7.131 -2.149 1.00 0.00 H new ATOM 0 HD2 ARG A 164 10.159 -6.324 -4.328 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.862 -6.716 -4.195 1.00 0.00 H new ATOM 0 HE ARG A 164 10.059 -9.058 -4.132 1.00 0.00 H new ATOM 0 HH11 ARG A 164 11.187 -6.685 -6.415 1.00 0.00 H new ATOM 0 HH12 ARG A 164 11.724 -7.871 -7.609 1.00 0.00 H new ATOM 0 HH21 ARG A 164 11.192 -10.643 -5.511 1.00 0.00 H new ATOM 0 HH22 ARG A 164 11.727 -10.094 -7.103 1.00 0.00 H new ATOM 735 N PRO A 165 13.005 -5.027 0.928 1.00 0.00 N ATOM 736 CA PRO A 165 14.058 -4.125 1.385 1.00 0.00 C ATOM 737 C PRO A 165 14.839 -3.610 0.176 1.00 0.00 C ATOM 738 O PRO A 165 15.927 -4.103 -0.114 1.00 0.00 O ATOM 739 CB PRO A 165 14.942 -4.955 2.324 1.00 0.00 C ATOM 740 CG PRO A 165 14.816 -6.363 1.754 1.00 0.00 C ATOM 741 CD PRO A 165 13.400 -6.401 1.192 1.00 0.00 C ATOM 0 HA PRO A 165 13.669 -3.251 1.908 1.00 0.00 H new ATOM 0 HB2 PRO A 165 15.975 -4.608 2.318 1.00 0.00 H new ATOM 0 HB3 PRO A 165 14.595 -4.904 3.356 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.559 -6.549 0.979 1.00 0.00 H new ATOM 0 HG3 PRO A 165 14.962 -7.121 2.524 1.00 0.00 H new ATOM 0 HD2 PRO A 165 13.365 -6.994 0.278 1.00 0.00 H new ATOM 0 HD3 PRO A 165 12.717 -6.868 1.901 1.00 0.00 H new ATOM 749 N VAL A 166 14.218 -2.687 -0.553 1.00 0.00 N ATOM 750 CA VAL A 166 14.804 -1.781 -1.534 1.00 0.00 C ATOM 751 C VAL A 166 15.967 -2.415 -2.295 1.00 0.00 C ATOM 752 O VAL A 166 17.140 -2.281 -1.954 1.00 0.00 O ATOM 753 CB VAL A 166 15.174 -0.453 -0.874 1.00 0.00 C ATOM 754 CG1 VAL A 166 15.502 0.653 -1.874 1.00 0.00 C ATOM 755 CG2 VAL A 166 14.004 0.097 -0.057 1.00 0.00 C ATOM 0 H VAL A 166 13.212 -2.543 -0.465 1.00 0.00 H new ATOM 0 HA VAL A 166 14.051 -1.571 -2.293 1.00 0.00 H new ATOM 0 HB VAL A 166 16.047 -0.690 -0.265 1.00 0.00 H new ATOM 0 HG11 VAL A 166 15.755 1.566 -1.336 1.00 0.00 H new ATOM 0 HG12 VAL A 166 16.348 0.348 -2.490 1.00 0.00 H new ATOM 0 HG13 VAL A 166 14.637 0.835 -2.511 1.00 0.00 H new ATOM 0 HG21 VAL A 166 14.293 1.042 0.402 1.00 0.00 H new ATOM 0 HG22 VAL A 166 13.147 0.259 -0.711 1.00 0.00 H new ATOM 0 HG23 VAL A 166 13.736 -0.617 0.721 1.00 0.00 H new ATOM 765 N ASP A 167 15.611 -3.128 -3.345 1.00 0.00 N ATOM 766 CA ASP A 167 16.554 -3.629 -4.308 1.00 0.00 C ATOM 767 C ASP A 167 17.144 -2.470 -5.112 1.00 0.00 C ATOM 768 O ASP A 167 16.631 -1.347 -5.146 1.00 0.00 O ATOM 769 CB ASP A 167 15.870 -4.629 -5.246 1.00 0.00 C ATOM 770 CG ASP A 167 15.689 -5.993 -4.602 1.00 0.00 C ATOM 771 OD1 ASP A 167 16.588 -6.850 -4.782 1.00 0.00 O ATOM 772 OD2 ASP A 167 14.613 -6.287 -4.045 1.00 0.00 O ATOM 0 H ASP A 167 14.643 -3.376 -3.550 1.00 0.00 H new ATOM 0 HA ASP A 167 17.360 -4.140 -3.781 1.00 0.00 H new ATOM 0 HB2 ASP A 167 14.897 -4.238 -5.543 1.00 0.00 H new ATOM 0 HB3 ASP A 167 16.462 -4.735 -6.155 1.00 0.00 H new ATOM 777 N GLN A 168 18.162 -2.813 -5.894 1.00 0.00 N ATOM 778 CA GLN A 168 18.798 -2.020 -6.941 1.00 0.00 C ATOM 779 C GLN A 168 17.801 -1.335 -7.889 1.00 0.00 C ATOM 780 O GLN A 168 18.141 -0.316 -8.489 1.00 0.00 O ATOM 781 CB GLN A 168 19.756 -2.939 -7.728 1.00 0.00 C ATOM 782 CG GLN A 168 19.024 -4.074 -8.476 1.00 0.00 C ATOM 783 CD GLN A 168 19.971 -5.150 -9.003 1.00 0.00 C ATOM 784 OE1 GLN A 168 20.860 -4.901 -9.813 1.00 0.00 O ATOM 785 NE2 GLN A 168 19.802 -6.377 -8.533 1.00 0.00 N ATOM 0 H GLN A 168 18.600 -3.730 -5.804 1.00 0.00 H new ATOM 0 HA GLN A 168 19.342 -1.207 -6.461 1.00 0.00 H new ATOM 0 HB2 GLN A 168 20.317 -2.341 -8.446 1.00 0.00 H new ATOM 0 HB3 GLN A 168 20.481 -3.373 -7.040 1.00 0.00 H new ATOM 0 HG2 GLN A 168 18.298 -4.534 -7.806 1.00 0.00 H new ATOM 0 HG3 GLN A 168 18.465 -3.650 -9.310 1.00 0.00 H new ATOM 0 HE21 GLN A 168 19.059 -6.568 -7.861 1.00 0.00 H new ATOM 0 HE22 GLN A 168 20.415 -7.131 -8.843 1.00 0.00 H new ATOM 794 N ALA A 169 16.582 -1.865 -8.011 1.00 0.00 N ATOM 795 CA ALA A 169 15.545 -1.394 -8.925 1.00 0.00 C ATOM 796 C ALA A 169 14.392 -0.680 -8.213 1.00 0.00 C ATOM 797 O ALA A 169 13.536 -0.096 -8.873 1.00 0.00 O ATOM 798 CB ALA A 169 15.016 -2.590 -9.717 1.00 0.00 C ATOM 0 H ALA A 169 16.281 -2.664 -7.454 1.00 0.00 H new ATOM 0 HA ALA A 169 15.995 -0.655 -9.588 1.00 0.00 H new ATOM 0 HB1 ALA A 169 14.240 -2.256 -10.405 1.00 0.00 H new ATOM 0 HB2 ALA A 169 15.832 -3.042 -10.281 1.00 0.00 H new ATOM 0 HB3 ALA A 169 14.599 -3.326 -9.030 1.00 0.00 H new ATOM 804 N SER A 170 14.356 -0.685 -6.881 1.00 0.00 N ATOM 805 CA SER A 170 13.210 -0.265 -6.091 1.00 0.00 C ATOM 806 C SER A 170 13.029 1.247 -5.992 1.00 0.00 C ATOM 807 O SER A 170 12.311 1.712 -5.113 1.00 0.00 O ATOM 808 CB SER A 170 13.309 -0.878 -4.702 1.00 0.00 C ATOM 809 OG SER A 170 13.262 -2.291 -4.773 1.00 0.00 O ATOM 0 H SER A 170 15.145 -0.990 -6.311 1.00 0.00 H new ATOM 0 HA SER A 170 12.325 -0.625 -6.615 1.00 0.00 H new ATOM 0 HB2 SER A 170 14.238 -0.564 -4.226 1.00 0.00 H new ATOM 0 HB3 SER A 170 12.492 -0.513 -4.079 1.00 0.00 H new ATOM 0 HG SER A 170 12.719 -2.638 -4.034 1.00 0.00 H new ATOM 815 N ASN A 171 13.648 2.040 -6.866 1.00 0.00 N ATOM 816 CA ASN A 171 13.278 3.453 -6.962 1.00 0.00 C ATOM 817 C ASN A 171 11.787 3.610 -7.200 1.00 0.00 C ATOM 818 O ASN A 171 11.157 2.717 -7.772 1.00 0.00 O ATOM 819 CB ASN A 171 14.093 4.311 -7.941 1.00 0.00 C ATOM 820 CG ASN A 171 14.412 3.766 -9.329 1.00 0.00 C ATOM 821 OD1 ASN A 171 13.911 2.618 -9.755 1.00 0.00 O flip ATOM 822 ND2 ASN A 171 15.157 4.417 -10.054 1.00 0.00 N flip ATOM 0 H ASN A 171 14.387 1.741 -7.502 1.00 0.00 H new ATOM 0 HA ASN A 171 13.544 3.859 -5.986 1.00 0.00 H new ATOM 0 HB2 ASN A 171 13.559 5.252 -8.074 1.00 0.00 H new ATOM 0 HB3 ASN A 171 15.041 4.548 -7.457 1.00 0.00 H new ATOM 0 HD21 ASN A 171 15.543 5.302 -9.725 1.00 0.00 H new ATOM 0 HD22 ASN A 171 15.390 4.073 -10.986 1.00 0.00 H new ATOM 829 N GLN A 172 11.254 4.746 -6.730 1.00 0.00 N ATOM 830 CA GLN A 172 10.025 4.869 -5.976 1.00 0.00 C ATOM 831 C GLN A 172 8.971 3.998 -6.587 1.00 0.00 C ATOM 832 O GLN A 172 8.455 3.116 -5.924 1.00 0.00 O ATOM 833 CB GLN A 172 9.607 6.345 -5.936 1.00 0.00 C ATOM 834 CG GLN A 172 8.198 6.585 -5.382 1.00 0.00 C ATOM 835 CD GLN A 172 7.898 8.075 -5.365 1.00 0.00 C ATOM 836 OE1 GLN A 172 7.881 8.715 -6.413 1.00 0.00 O ATOM 837 NE2 GLN A 172 7.643 8.647 -4.205 1.00 0.00 N ATOM 0 H GLN A 172 11.704 5.649 -6.881 1.00 0.00 H new ATOM 0 HA GLN A 172 10.169 4.533 -4.949 1.00 0.00 H new ATOM 0 HB2 GLN A 172 10.323 6.897 -5.328 1.00 0.00 H new ATOM 0 HB3 GLN A 172 9.663 6.754 -6.945 1.00 0.00 H new ATOM 0 HG2 GLN A 172 7.463 6.064 -5.995 1.00 0.00 H new ATOM 0 HG3 GLN A 172 8.119 6.177 -4.374 1.00 0.00 H new ATOM 0 HE21 GLN A 172 7.663 8.094 -3.348 1.00 0.00 H new ATOM 0 HE22 GLN A 172 7.425 9.643 -4.164 1.00 0.00 H new ATOM 846 N ASN A 173 8.682 4.246 -7.854 1.00 0.00 N ATOM 847 CA ASN A 173 7.599 3.668 -8.599 1.00 0.00 C ATOM 848 C ASN A 173 7.505 2.160 -8.477 1.00 0.00 C ATOM 849 O ASN A 173 6.429 1.598 -8.352 1.00 0.00 O ATOM 850 CB ASN A 173 7.801 3.972 -10.076 1.00 0.00 C ATOM 851 CG ASN A 173 6.609 3.479 -10.865 1.00 0.00 C ATOM 852 OD1 ASN A 173 6.739 2.678 -11.781 1.00 0.00 O ATOM 853 ND2 ASN A 173 5.422 3.908 -10.492 1.00 0.00 N ATOM 0 H ASN A 173 9.235 4.895 -8.413 1.00 0.00 H new ATOM 0 HA ASN A 173 6.687 4.102 -8.188 1.00 0.00 H new ATOM 0 HB2 ASN A 173 7.928 5.045 -10.222 1.00 0.00 H new ATOM 0 HB3 ASN A 173 8.711 3.491 -10.435 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.585 3.573 -10.969 1.00 0.00 H new ATOM 0 HD22 ASN A 173 5.339 4.576 -9.726 1.00 0.00 H new ATOM 860 N ASN A 174 8.654 1.513 -8.506 1.00 0.00 N ATOM 861 CA ASN A 174 8.770 0.068 -8.465 1.00 0.00 C ATOM 862 C ASN A 174 8.507 -0.444 -7.045 1.00 0.00 C ATOM 863 O ASN A 174 8.114 -1.592 -6.858 1.00 0.00 O ATOM 864 CB ASN A 174 10.180 -0.366 -8.907 1.00 0.00 C ATOM 865 CG ASN A 174 10.611 0.200 -10.252 1.00 0.00 C ATOM 866 OD1 ASN A 174 10.525 -0.449 -11.290 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.057 1.442 -10.277 1.00 0.00 N ATOM 0 H ASN A 174 9.554 1.989 -8.560 1.00 0.00 H new ATOM 0 HA ASN A 174 8.031 -0.355 -9.145 1.00 0.00 H new ATOM 0 HB2 ASN A 174 10.898 -0.057 -8.148 1.00 0.00 H new ATOM 0 HB3 ASN A 174 10.215 -1.454 -8.955 1.00 0.00 H new ATOM 0 HD21 ASN A 174 11.332 1.867 -11.162 1.00 0.00 H new ATOM 0 HD22 ASN A 174 11.126 1.977 -9.411 1.00 0.00 H new ATOM 874 N PHE A 175 8.699 0.408 -6.035 1.00 0.00 N ATOM 875 CA PHE A 175 8.521 0.070 -4.634 1.00 0.00 C ATOM 876 C PHE A 175 7.052 0.185 -4.353 1.00 0.00 C ATOM 877 O PHE A 175 6.451 -0.760 -3.856 1.00 0.00 O ATOM 878 CB PHE A 175 9.349 0.968 -3.699 1.00 0.00 C ATOM 879 CG PHE A 175 9.221 0.694 -2.209 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.063 1.071 -1.497 1.00 0.00 C ATOM 881 CD2 PHE A 175 10.306 0.134 -1.507 1.00 0.00 C ATOM 882 CE1 PHE A 175 8.003 0.906 -0.104 1.00 0.00 C ATOM 883 CE2 PHE A 175 10.243 -0.038 -0.114 1.00 0.00 C ATOM 884 CZ PHE A 175 9.097 0.368 0.589 1.00 0.00 C ATOM 0 H PHE A 175 8.990 1.375 -6.180 1.00 0.00 H new ATOM 0 HA PHE A 175 8.881 -0.941 -4.442 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.399 0.872 -3.975 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.065 2.004 -3.881 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.219 1.488 -2.026 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.194 -0.166 -2.044 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.112 1.194 0.435 1.00 0.00 H new ATOM 0 HE2 PHE A 175 11.074 -0.481 0.415 1.00 0.00 H new ATOM 0 HZ PHE A 175 9.058 0.266 1.663 1.00 0.00 H new ATOM 894 N VAL A 176 6.477 1.337 -4.674 1.00 0.00 N ATOM 895 CA VAL A 176 5.048 1.536 -4.608 1.00 0.00 C ATOM 896 C VAL A 176 4.315 0.488 -5.446 1.00 0.00 C ATOM 897 O VAL A 176 3.284 0.017 -4.981 1.00 0.00 O ATOM 898 CB VAL A 176 4.681 2.975 -4.999 1.00 0.00 C ATOM 899 CG1 VAL A 176 4.503 3.817 -3.742 1.00 0.00 C ATOM 900 CG2 VAL A 176 5.688 3.761 -5.773 1.00 0.00 C ATOM 0 H VAL A 176 6.996 2.157 -4.987 1.00 0.00 H new ATOM 0 HA VAL A 176 4.719 1.398 -3.578 1.00 0.00 H new ATOM 0 HB VAL A 176 3.800 2.818 -5.621 1.00 0.00 H new ATOM 0 HG11 VAL A 176 4.243 4.838 -4.022 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.706 3.394 -3.130 1.00 0.00 H new ATOM 0 HG13 VAL A 176 5.433 3.823 -3.173 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.293 4.756 -5.978 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.606 3.847 -5.192 1.00 0.00 H new ATOM 0 HG23 VAL A 176 5.900 3.254 -6.714 1.00 0.00 H new ATOM 910 N HIS A 177 4.848 0.072 -6.600 1.00 0.00 N ATOM 911 CA HIS A 177 4.233 -0.939 -7.443 1.00 0.00 C ATOM 912 C HIS A 177 4.078 -2.233 -6.650 1.00 0.00 C ATOM 913 O HIS A 177 2.959 -2.659 -6.370 1.00 0.00 O ATOM 914 CB HIS A 177 5.036 -1.156 -8.739 1.00 0.00 C ATOM 915 CG HIS A 177 4.474 -2.174 -9.705 1.00 0.00 C ATOM 916 ND1 HIS A 177 4.150 -3.483 -9.453 1.00 0.00 N flip ATOM 917 CD2 HIS A 177 4.293 -1.964 -11.051 1.00 0.00 C flip ATOM 918 CE1 HIS A 177 3.755 -4.072 -10.657 1.00 0.00 C flip ATOM 919 NE2 HIS A 177 3.858 -3.111 -11.588 1.00 0.00 N flip ATOM 0 H HIS A 177 5.726 0.435 -6.971 1.00 0.00 H new ATOM 0 HA HIS A 177 3.244 -0.595 -7.746 1.00 0.00 H new ATOM 0 HB2 HIS A 177 5.118 -0.200 -9.256 1.00 0.00 H new ATOM 0 HB3 HIS A 177 6.047 -1.460 -8.469 1.00 0.00 H new ATOM 0 HD2 HIS A 177 4.470 -1.040 -11.581 1.00 0.00 H new ATOM 0 HE1 HIS A 177 3.433 -5.092 -10.807 1.00 0.00 H new ATOM 0 HE2 HIS A 177 3.634 -3.238 -12.575 1.00 0.00 H new ATOM 927 N ASP A 178 5.193 -2.895 -6.323 1.00 0.00 N ATOM 928 CA ASP A 178 5.143 -4.210 -5.682 1.00 0.00 C ATOM 929 C ASP A 178 4.588 -4.107 -4.272 1.00 0.00 C ATOM 930 O ASP A 178 4.008 -5.075 -3.800 1.00 0.00 O ATOM 931 CB ASP A 178 6.499 -4.925 -5.731 1.00 0.00 C ATOM 932 CG ASP A 178 6.529 -6.150 -6.653 1.00 0.00 C ATOM 933 OD1 ASP A 178 5.498 -6.564 -7.232 1.00 0.00 O ATOM 934 OD2 ASP A 178 7.618 -6.764 -6.738 1.00 0.00 O ATOM 0 H ASP A 178 6.135 -2.543 -6.491 1.00 0.00 H new ATOM 0 HA ASP A 178 4.454 -4.833 -6.253 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.259 -4.217 -6.061 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.770 -5.236 -4.722 1.00 0.00 H new ATOM 939 N CYS A 179 4.658 -2.937 -3.637 1.00 0.00 N ATOM 940 CA CYS A 179 3.957 -2.670 -2.397 1.00 0.00 C ATOM 941 C CYS A 179 2.457 -2.779 -2.598 1.00 0.00 C ATOM 942 O CYS A 179 1.831 -3.620 -1.960 1.00 0.00 O ATOM 943 CB CYS A 179 4.337 -1.294 -1.846 1.00 0.00 C ATOM 944 SG CYS A 179 3.251 -0.642 -0.565 1.00 0.00 S ATOM 0 H CYS A 179 5.208 -2.148 -3.977 1.00 0.00 H new ATOM 0 HA CYS A 179 4.256 -3.420 -1.665 1.00 0.00 H new ATOM 0 HB2 CYS A 179 5.349 -1.350 -1.445 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.360 -0.585 -2.673 1.00 0.00 H new ATOM 949 N VAL A 180 1.869 -1.943 -3.450 1.00 0.00 N ATOM 950 CA VAL A 180 0.441 -1.944 -3.738 1.00 0.00 C ATOM 951 C VAL A 180 0.019 -3.360 -4.137 1.00 0.00 C ATOM 952 O VAL A 180 -0.947 -3.891 -3.594 1.00 0.00 O ATOM 953 CB VAL A 180 0.168 -0.858 -4.803 1.00 0.00 C ATOM 954 CG1 VAL A 180 -1.188 -0.993 -5.499 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.248 0.537 -4.154 1.00 0.00 C ATOM 0 H VAL A 180 2.384 -1.232 -3.969 1.00 0.00 H new ATOM 0 HA VAL A 180 -0.168 -1.688 -2.871 1.00 0.00 H new ATOM 0 HB VAL A 180 0.934 -0.991 -5.567 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.302 -0.194 -6.231 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.244 -1.958 -6.003 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.985 -0.924 -4.759 1.00 0.00 H new ATOM 0 HG21 VAL A 180 0.055 1.301 -4.908 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.497 0.613 -3.362 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.242 0.686 -3.733 1.00 0.00 H new ATOM 965 N ASN A 181 0.799 -3.998 -5.012 1.00 0.00 N ATOM 966 CA ASN A 181 0.554 -5.305 -5.594 1.00 0.00 C ATOM 967 C ASN A 181 0.454 -6.333 -4.475 1.00 0.00 C ATOM 968 O ASN A 181 -0.582 -6.977 -4.326 1.00 0.00 O ATOM 969 CB ASN A 181 1.696 -5.594 -6.585 1.00 0.00 C ATOM 970 CG ASN A 181 1.575 -6.859 -7.415 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.553 -7.530 -7.431 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.629 -7.199 -8.145 1.00 0.00 N ATOM 0 H ASN A 181 1.669 -3.585 -5.349 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.387 -5.347 -6.142 1.00 0.00 H new ATOM 0 HB2 ASN A 181 1.778 -4.747 -7.266 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.629 -5.643 -6.024 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.595 -8.032 -8.732 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.473 -6.627 -8.119 1.00 0.00 H new ATOM 979 N ILE A 182 1.510 -6.473 -3.667 1.00 0.00 N ATOM 980 CA ILE A 182 1.577 -7.488 -2.634 1.00 0.00 C ATOM 981 C ILE A 182 0.618 -7.165 -1.495 1.00 0.00 C ATOM 982 O ILE A 182 -0.086 -8.062 -1.059 1.00 0.00 O ATOM 983 CB ILE A 182 3.045 -7.749 -2.207 1.00 0.00 C ATOM 984 CG1 ILE A 182 3.619 -8.900 -3.042 1.00 0.00 C ATOM 985 CG2 ILE A 182 3.252 -8.126 -0.739 1.00 0.00 C ATOM 986 CD1 ILE A 182 3.774 -8.595 -4.528 1.00 0.00 C ATOM 0 H ILE A 182 2.339 -5.880 -3.718 1.00 0.00 H new ATOM 0 HA ILE A 182 1.230 -8.442 -3.032 1.00 0.00 H new ATOM 0 HB ILE A 182 3.548 -6.795 -2.368 1.00 0.00 H new ATOM 0 HG12 ILE A 182 4.594 -9.173 -2.638 1.00 0.00 H new ATOM 0 HG13 ILE A 182 2.972 -9.770 -2.929 1.00 0.00 H new ATOM 0 HG21 ILE A 182 4.314 -8.286 -0.551 1.00 0.00 H new ATOM 0 HG22 ILE A 182 2.887 -7.320 -0.102 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.703 -9.041 -0.517 1.00 0.00 H new ATOM 0 HD11 ILE A 182 4.186 -9.466 -5.037 1.00 0.00 H new ATOM 0 HD12 ILE A 182 2.800 -8.353 -4.953 1.00 0.00 H new ATOM 0 HD13 ILE A 182 4.447 -7.747 -4.657 1.00 0.00 H new ATOM 998 N THR A 183 0.558 -5.926 -1.014 1.00 0.00 N ATOM 999 CA THR A 183 -0.294 -5.535 0.104 1.00 0.00 C ATOM 1000 C THR A 183 -1.743 -5.912 -0.210 1.00 0.00 C ATOM 1001 O THR A 183 -2.362 -6.631 0.579 1.00 0.00 O ATOM 1002 CB THR A 183 -0.086 -4.032 0.370 1.00 0.00 C ATOM 1003 OG1 THR A 183 1.277 -3.758 0.614 1.00 0.00 O ATOM 1004 CG2 THR A 183 -0.884 -3.469 1.535 1.00 0.00 C ATOM 0 H THR A 183 1.107 -5.156 -1.395 1.00 0.00 H new ATOM 0 HA THR A 183 -0.032 -6.064 1.020 1.00 0.00 H new ATOM 0 HB THR A 183 -0.447 -3.546 -0.536 1.00 0.00 H new ATOM 0 HG1 THR A 183 1.748 -3.656 -0.239 1.00 0.00 H new ATOM 0 HG21 THR A 183 -0.670 -2.406 1.642 1.00 0.00 H new ATOM 0 HG22 THR A 183 -1.949 -3.608 1.348 1.00 0.00 H new ATOM 0 HG23 THR A 183 -0.606 -3.989 2.452 1.00 0.00 H new ATOM 1012 N ILE A 184 -2.243 -5.523 -1.384 1.00 0.00 N ATOM 1013 CA ILE A 184 -3.548 -5.953 -1.884 1.00 0.00 C ATOM 1014 C ILE A 184 -3.575 -7.465 -1.964 1.00 0.00 C ATOM 1015 O ILE A 184 -4.437 -8.051 -1.321 1.00 0.00 O ATOM 1016 CB ILE A 184 -3.900 -5.230 -3.209 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -4.462 -3.855 -2.799 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -4.886 -5.927 -4.164 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -4.578 -2.853 -3.951 1.00 0.00 C ATOM 0 H ILE A 184 -1.749 -4.896 -2.019 1.00 0.00 H new ATOM 0 HA ILE A 184 -4.339 -5.662 -1.193 1.00 0.00 H new ATOM 0 HB ILE A 184 -2.984 -5.198 -3.799 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -5.447 -3.996 -2.355 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -3.822 -3.430 -2.026 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -5.037 -5.306 -5.047 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -4.480 -6.893 -4.464 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -5.840 -6.076 -3.657 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.982 -1.912 -3.576 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -3.592 -2.679 -4.382 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -5.243 -3.254 -4.716 1.00 0.00 H new ATOM 1031 N LYS A 185 -2.651 -8.128 -2.663 1.00 0.00 N ATOM 1032 CA LYS A 185 -2.631 -9.577 -2.790 1.00 0.00 C ATOM 1033 C LYS A 185 -2.503 -10.329 -1.473 1.00 0.00 C ATOM 1034 O LYS A 185 -2.597 -11.553 -1.474 1.00 0.00 O ATOM 1035 CB LYS A 185 -1.509 -9.975 -3.738 1.00 0.00 C ATOM 1036 CG LYS A 185 -2.038 -9.840 -5.165 1.00 0.00 C ATOM 1037 CD LYS A 185 -0.968 -10.080 -6.222 1.00 0.00 C ATOM 1038 CE LYS A 185 -0.634 -11.571 -6.342 1.00 0.00 C ATOM 1039 NZ LYS A 185 0.212 -11.862 -7.516 1.00 0.00 N ATOM 0 H LYS A 185 -1.890 -7.664 -3.160 1.00 0.00 H new ATOM 0 HA LYS A 185 -3.604 -9.867 -3.187 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.639 -9.336 -3.591 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -1.189 -10.999 -3.544 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -2.853 -10.549 -5.313 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -2.456 -8.842 -5.299 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -1.313 -9.703 -7.185 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -0.067 -9.522 -5.965 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.123 -11.901 -5.438 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -1.559 -12.144 -6.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 0.412 -12.882 -7.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -0.285 -11.573 -8.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 1.106 -11.337 -7.438 1.00 0.00 H new ATOM 1053 N GLN A 186 -2.304 -9.654 -0.351 1.00 0.00 N ATOM 1054 CA GLN A 186 -2.587 -10.222 0.947 1.00 0.00 C ATOM 1055 C GLN A 186 -4.101 -10.155 1.129 1.00 0.00 C ATOM 1056 O GLN A 186 -4.779 -11.097 0.727 1.00 0.00 O ATOM 1057 CB GLN A 186 -1.711 -9.551 2.027 1.00 0.00 C ATOM 1058 CG GLN A 186 -0.189 -9.654 1.797 1.00 0.00 C ATOM 1059 CD GLN A 186 0.203 -10.855 0.940 1.00 0.00 C ATOM 1060 OE1 GLN A 186 0.729 -10.734 -0.159 1.00 0.00 O ATOM 1061 NE2 GLN A 186 -0.082 -12.069 1.378 1.00 0.00 N ATOM 0 H GLN A 186 -1.943 -8.701 -0.320 1.00 0.00 H new ATOM 0 HA GLN A 186 -2.311 -11.272 1.043 1.00 0.00 H new ATOM 0 HB2 GLN A 186 -1.982 -8.497 2.089 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -1.947 -9.998 2.993 1.00 0.00 H new ATOM 0 HG2 GLN A 186 0.163 -8.741 1.317 1.00 0.00 H new ATOM 0 HG3 GLN A 186 0.315 -9.722 2.761 1.00 0.00 H new ATOM 0 HE21 GLN A 186 -0.520 -12.192 2.291 1.00 0.00 H new ATOM 0 HE22 GLN A 186 0.136 -12.883 0.803 1.00 0.00 H new ATOM 1070 N HIS A 187 -4.652 -9.058 1.649 1.00 0.00 N ATOM 1071 CA HIS A 187 -6.058 -8.948 2.051 1.00 0.00 C ATOM 1072 C HIS A 187 -7.093 -9.114 0.926 1.00 0.00 C ATOM 1073 O HIS A 187 -8.288 -9.180 1.202 1.00 0.00 O ATOM 1074 CB HIS A 187 -6.257 -7.645 2.833 1.00 0.00 C ATOM 1075 CG HIS A 187 -5.532 -6.438 2.314 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -5.727 -5.774 1.137 1.00 0.00 N flip ATOM 1077 CD2 HIS A 187 -4.512 -5.811 2.978 1.00 0.00 C flip ATOM 1078 CE1 HIS A 187 -4.832 -4.703 1.097 1.00 0.00 C flip ATOM 1079 NE2 HIS A 187 -4.100 -4.791 2.216 1.00 0.00 N flip ATOM 0 H HIS A 187 -4.123 -8.201 1.807 1.00 0.00 H new ATOM 0 HA HIS A 187 -6.259 -9.808 2.690 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -7.323 -7.420 2.856 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.945 -7.814 3.864 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -6.406 -6.017 0.415 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -4.112 -6.089 3.942 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -4.747 -3.956 0.322 1.00 0.00 H new ATOM 1087 N THR A 188 -6.674 -9.235 -0.326 1.00 0.00 N ATOM 1088 CA THR A 188 -7.503 -9.462 -1.506 1.00 0.00 C ATOM 1089 C THR A 188 -7.474 -10.939 -1.916 1.00 0.00 C ATOM 1090 O THR A 188 -8.273 -11.353 -2.743 1.00 0.00 O ATOM 1091 CB THR A 188 -7.040 -8.511 -2.618 1.00 0.00 C ATOM 1092 OG1 THR A 188 -7.004 -7.209 -2.063 1.00 0.00 O ATOM 1093 CG2 THR A 188 -7.909 -8.482 -3.867 1.00 0.00 C ATOM 0 H THR A 188 -5.683 -9.174 -0.562 1.00 0.00 H new ATOM 0 HA THR A 188 -8.548 -9.241 -1.290 1.00 0.00 H new ATOM 0 HB THR A 188 -6.070 -8.876 -2.957 1.00 0.00 H new ATOM 0 HG1 THR A 188 -6.149 -7.073 -1.604 1.00 0.00 H new ATOM 0 HG21 THR A 188 -7.490 -7.778 -4.586 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.942 -9.477 -4.311 1.00 0.00 H new ATOM 0 HG23 THR A 188 -8.919 -8.170 -3.600 1.00 0.00 H new ATOM 1101 N VAL A 189 -6.616 -11.769 -1.316 1.00 0.00 N ATOM 1102 CA VAL A 189 -6.529 -13.200 -1.591 1.00 0.00 C ATOM 1103 C VAL A 189 -6.727 -14.013 -0.301 1.00 0.00 C ATOM 1104 O VAL A 189 -7.220 -15.144 -0.334 1.00 0.00 O ATOM 1105 CB VAL A 189 -5.210 -13.481 -2.347 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -5.138 -14.937 -2.832 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -5.049 -12.553 -3.577 1.00 0.00 C ATOM 0 H VAL A 189 -5.949 -11.455 -0.611 1.00 0.00 H new ATOM 0 HA VAL A 189 -7.337 -13.528 -2.245 1.00 0.00 H new ATOM 0 HB VAL A 189 -4.406 -13.290 -1.636 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -4.198 -15.099 -3.359 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -5.194 -15.609 -1.976 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -5.971 -15.138 -3.506 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -4.111 -12.779 -4.083 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -5.880 -12.712 -4.264 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -5.043 -11.513 -3.250 1.00 0.00 H new ATOM 1117 N THR A 190 -6.492 -13.405 0.856 1.00 0.00 N ATOM 1118 CA THR A 190 -6.742 -13.973 2.177 1.00 0.00 C ATOM 1119 C THR A 190 -8.154 -13.599 2.651 1.00 0.00 C ATOM 1120 O THR A 190 -8.386 -13.484 3.854 1.00 0.00 O ATOM 1121 CB THR A 190 -5.658 -13.511 3.176 1.00 0.00 C ATOM 1122 OG1 THR A 190 -5.613 -12.104 3.235 1.00 0.00 O ATOM 1123 CG2 THR A 190 -4.263 -14.019 2.799 1.00 0.00 C ATOM 0 H THR A 190 -6.105 -12.462 0.902 1.00 0.00 H new ATOM 0 HA THR A 190 -6.688 -15.060 2.118 1.00 0.00 H new ATOM 0 HB THR A 190 -5.932 -13.930 4.144 1.00 0.00 H new ATOM 0 HG1 THR A 190 -5.308 -11.750 2.374 1.00 0.00 H new ATOM 0 HG21 THR A 190 -3.537 -13.667 3.532 1.00 0.00 H new ATOM 0 HG22 THR A 190 -4.264 -15.109 2.784 1.00 0.00 H new ATOM 0 HG23 THR A 190 -3.993 -13.643 1.812 1.00 0.00 H new ATOM 1131 N THR A 191 -9.110 -13.308 1.762 1.00 0.00 N ATOM 1132 CA THR A 191 -10.480 -12.992 2.152 1.00 0.00 C ATOM 1133 C THR A 191 -11.411 -13.195 0.965 1.00 0.00 C ATOM 1134 O THR A 191 -12.490 -13.722 1.172 1.00 0.00 O ATOM 1135 CB THR A 191 -10.670 -11.605 2.825 1.00 0.00 C ATOM 1136 OG1 THR A 191 -9.439 -11.045 3.236 1.00 0.00 O ATOM 1137 CG2 THR A 191 -11.487 -11.761 4.112 1.00 0.00 C ATOM 0 H THR A 191 -8.952 -13.286 0.755 1.00 0.00 H new ATOM 0 HA THR A 191 -10.745 -13.693 2.944 1.00 0.00 H new ATOM 0 HB THR A 191 -11.158 -10.970 2.085 1.00 0.00 H new ATOM 0 HG1 THR A 191 -9.119 -10.420 2.552 1.00 0.00 H new ATOM 0 HG21 THR A 191 -11.618 -10.786 4.581 1.00 0.00 H new ATOM 0 HG22 THR A 191 -12.463 -12.183 3.874 1.00 0.00 H new ATOM 0 HG23 THR A 191 -10.962 -12.426 4.798 1.00 0.00 H new ATOM 1145 N THR A 192 -10.988 -12.915 -0.273 1.00 0.00 N ATOM 1146 CA THR A 192 -11.853 -13.089 -1.448 1.00 0.00 C ATOM 1147 C THR A 192 -12.242 -14.565 -1.643 1.00 0.00 C ATOM 1148 O THR A 192 -13.298 -14.892 -2.177 1.00 0.00 O ATOM 1149 CB THR A 192 -11.199 -12.452 -2.690 1.00 0.00 C ATOM 1150 OG1 THR A 192 -12.156 -11.981 -3.612 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.287 -13.421 -3.437 1.00 0.00 C ATOM 0 H THR A 192 -10.054 -12.567 -0.488 1.00 0.00 H new ATOM 0 HA THR A 192 -12.792 -12.561 -1.284 1.00 0.00 H new ATOM 0 HB THR A 192 -10.612 -11.622 -2.297 1.00 0.00 H new ATOM 0 HG1 THR A 192 -11.700 -11.584 -4.383 1.00 0.00 H new ATOM 0 HG21 THR A 192 -9.854 -12.919 -4.302 1.00 0.00 H new ATOM 0 HG22 THR A 192 -9.489 -13.754 -2.774 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.866 -14.283 -3.770 1.00 0.00 H new ATOM 1159 N THR A 193 -11.383 -15.479 -1.187 1.00 0.00 N ATOM 1160 CA THR A 193 -11.642 -16.910 -1.187 1.00 0.00 C ATOM 1161 C THR A 193 -12.363 -17.336 0.104 1.00 0.00 C ATOM 1162 O THR A 193 -12.830 -18.469 0.225 1.00 0.00 O ATOM 1163 CB THR A 193 -10.283 -17.592 -1.413 1.00 0.00 C ATOM 1164 OG1 THR A 193 -10.423 -18.820 -2.091 1.00 0.00 O ATOM 1165 CG2 THR A 193 -9.446 -17.735 -0.141 1.00 0.00 C ATOM 0 H THR A 193 -10.471 -15.234 -0.801 1.00 0.00 H new ATOM 0 HA THR A 193 -12.324 -17.213 -1.982 1.00 0.00 H new ATOM 0 HB THR A 193 -9.719 -16.918 -2.057 1.00 0.00 H new ATOM 0 HG1 THR A 193 -9.540 -19.225 -2.219 1.00 0.00 H new ATOM 0 HG21 THR A 193 -8.502 -18.225 -0.380 1.00 0.00 H new ATOM 0 HG22 THR A 193 -9.247 -16.748 0.277 1.00 0.00 H new ATOM 0 HG23 THR A 193 -9.991 -18.334 0.588 1.00 0.00 H new ATOM 1173 N LYS A 194 -12.421 -16.438 1.092 1.00 0.00 N ATOM 1174 CA LYS A 194 -12.986 -16.645 2.419 1.00 0.00 C ATOM 1175 C LYS A 194 -14.183 -15.710 2.657 1.00 0.00 C ATOM 1176 O LYS A 194 -14.247 -15.043 3.695 1.00 0.00 O ATOM 1177 CB LYS A 194 -11.899 -16.435 3.480 1.00 0.00 C ATOM 1178 CG LYS A 194 -10.530 -17.072 3.222 1.00 0.00 C ATOM 1179 CD LYS A 194 -9.718 -17.194 4.516 1.00 0.00 C ATOM 1180 CE LYS A 194 -9.631 -15.881 5.306 1.00 0.00 C ATOM 1181 NZ LYS A 194 -9.362 -16.106 6.734 1.00 0.00 N ATOM 0 H LYS A 194 -12.052 -15.494 0.975 1.00 0.00 H new ATOM 0 HA LYS A 194 -13.353 -17.669 2.493 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -11.753 -15.362 3.605 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -12.275 -16.818 4.428 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -10.664 -18.059 2.780 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -9.978 -16.471 2.499 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -10.167 -17.960 5.147 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -8.710 -17.531 4.274 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -8.843 -15.257 4.884 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -10.566 -15.331 5.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -9.312 -15.191 7.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -10.126 -16.679 7.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -8.457 -16.607 6.842 1.00 0.00 H new ATOM 1195 N GLY A 195 -15.092 -15.621 1.688 1.00 0.00 N ATOM 1196 CA GLY A 195 -16.353 -14.899 1.807 1.00 0.00 C ATOM 1197 C GLY A 195 -16.325 -13.529 1.161 1.00 0.00 C ATOM 1198 O GLY A 195 -17.350 -13.080 0.649 1.00 0.00 O ATOM 0 H GLY A 195 -14.967 -16.061 0.776 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -17.147 -15.491 1.351 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -16.602 -14.790 2.862 1.00 0.00 H new ATOM 1202 N GLU A 196 -15.171 -12.869 1.196 1.00 0.00 N ATOM 1203 CA GLU A 196 -15.004 -11.532 0.667 1.00 0.00 C ATOM 1204 C GLU A 196 -15.023 -11.529 -0.854 1.00 0.00 C ATOM 1205 O GLU A 196 -15.161 -12.560 -1.508 1.00 0.00 O ATOM 1206 CB GLU A 196 -13.746 -10.870 1.250 1.00 0.00 C ATOM 1207 CG GLU A 196 -13.971 -9.435 1.752 1.00 0.00 C ATOM 1208 CD GLU A 196 -14.624 -9.418 3.141 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -15.826 -9.745 3.252 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -13.922 -9.144 4.141 1.00 0.00 O ATOM 0 H GLU A 196 -14.319 -13.258 1.599 1.00 0.00 H new ATOM 0 HA GLU A 196 -15.855 -10.928 0.981 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -13.377 -11.479 2.075 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -12.967 -10.859 0.488 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -13.017 -8.909 1.791 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -14.603 -8.897 1.046 1.00 0.00 H new ATOM 1217 N ASN A 197 -14.845 -10.333 -1.393 1.00 0.00 N ATOM 1218 CA ASN A 197 -14.782 -9.956 -2.788 1.00 0.00 C ATOM 1219 C ASN A 197 -14.593 -8.450 -2.846 1.00 0.00 C ATOM 1220 O ASN A 197 -15.508 -7.695 -3.168 1.00 0.00 O ATOM 1221 CB ASN A 197 -16.022 -10.360 -3.575 1.00 0.00 C ATOM 1222 CG ASN A 197 -15.786 -10.134 -5.068 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -16.364 -9.256 -5.696 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -14.880 -10.890 -5.668 1.00 0.00 N ATOM 0 H ASN A 197 -14.729 -9.516 -0.793 1.00 0.00 H new ATOM 0 HA ASN A 197 -13.950 -10.485 -3.253 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -16.256 -11.408 -3.389 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -16.881 -9.778 -3.241 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -14.663 -10.741 -6.654 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -14.399 -11.621 -5.145 1.00 0.00 H new ATOM 1231 N PHE A 198 -13.407 -8.014 -2.450 1.00 0.00 N ATOM 1232 CA PHE A 198 -12.930 -6.655 -2.676 1.00 0.00 C ATOM 1233 C PHE A 198 -13.117 -6.290 -4.155 1.00 0.00 C ATOM 1234 O PHE A 198 -12.410 -6.805 -5.023 1.00 0.00 O ATOM 1235 CB PHE A 198 -11.464 -6.525 -2.246 1.00 0.00 C ATOM 1236 CG PHE A 198 -11.237 -6.040 -0.825 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -11.767 -4.805 -0.398 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -10.434 -6.785 0.057 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -11.573 -4.373 0.928 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -10.240 -6.355 1.381 1.00 0.00 C ATOM 1241 CZ PHE A 198 -10.824 -5.156 1.821 1.00 0.00 C ATOM 0 H PHE A 198 -12.737 -8.602 -1.955 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.510 -5.958 -2.072 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.983 -7.496 -2.360 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -10.963 -5.839 -2.929 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -12.323 -4.189 -1.089 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -9.963 -7.694 -0.286 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -12.001 -3.438 1.259 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -9.642 -6.946 2.059 1.00 0.00 H new ATOM 0 HZ PHE A 198 -10.697 -4.837 2.845 1.00 0.00 H new ATOM 1251 N THR A 199 -14.100 -5.443 -4.426 1.00 0.00 N ATOM 1252 CA THR A 199 -14.460 -4.904 -5.728 1.00 0.00 C ATOM 1253 C THR A 199 -13.373 -3.963 -6.216 1.00 0.00 C ATOM 1254 O THR A 199 -12.685 -3.352 -5.407 1.00 0.00 O ATOM 1255 CB THR A 199 -15.789 -4.132 -5.575 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.866 -3.506 -4.306 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.929 -5.147 -5.647 1.00 0.00 C ATOM 0 H THR A 199 -14.710 -5.090 -3.688 1.00 0.00 H new ATOM 0 HA THR A 199 -14.571 -5.711 -6.453 1.00 0.00 H new ATOM 0 HB THR A 199 -15.852 -3.377 -6.358 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.715 -3.021 -4.231 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.883 -4.631 -5.542 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.899 -5.661 -6.608 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.820 -5.875 -4.843 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.290 -3.741 -7.525 1.00 0.00 N ATOM 1266 CA GLU A 200 -12.467 -2.745 -8.159 1.00 0.00 C ATOM 1267 C GLU A 200 -12.617 -1.377 -7.494 1.00 0.00 C ATOM 1268 O GLU A 200 -11.634 -0.715 -7.190 1.00 0.00 O ATOM 1269 CB GLU A 200 -12.921 -2.727 -9.609 1.00 0.00 C ATOM 1270 CG GLU A 200 -11.957 -1.961 -10.503 1.00 0.00 C ATOM 1271 CD GLU A 200 -12.564 -0.667 -11.058 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -13.698 -0.705 -11.592 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -11.951 0.412 -10.994 1.00 0.00 O ATOM 0 H GLU A 200 -13.829 -4.287 -8.198 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.406 -2.980 -8.073 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.015 -3.751 -9.971 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -13.911 -2.275 -9.673 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.056 -1.721 -9.938 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.652 -2.599 -11.332 1.00 0.00 H new ATOM 1280 N THR A 201 -13.849 -0.954 -7.226 1.00 0.00 N ATOM 1281 CA THR A 201 -14.133 0.343 -6.636 1.00 0.00 C ATOM 1282 C THR A 201 -13.648 0.456 -5.179 1.00 0.00 C ATOM 1283 O THR A 201 -13.443 1.565 -4.687 1.00 0.00 O ATOM 1284 CB THR A 201 -15.635 0.615 -6.805 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.015 0.298 -8.140 1.00 0.00 O ATOM 1286 CG2 THR A 201 -15.933 2.103 -6.578 1.00 0.00 C ATOM 0 H THR A 201 -14.683 -1.510 -7.415 1.00 0.00 H new ATOM 0 HA THR A 201 -13.569 1.118 -7.155 1.00 0.00 H new ATOM 0 HB THR A 201 -16.184 0.010 -6.083 1.00 0.00 H new ATOM 0 HG1 THR A 201 -16.973 0.467 -8.256 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.001 2.283 -6.701 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.631 2.385 -5.569 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.379 2.700 -7.303 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.427 -0.657 -4.479 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.873 -0.645 -3.126 1.00 0.00 C ATOM 1296 C ASP A 202 -11.364 -0.849 -3.196 1.00 0.00 C ATOM 1297 O ASP A 202 -10.623 -0.137 -2.525 1.00 0.00 O ATOM 1298 CB ASP A 202 -13.593 -1.668 -2.237 1.00 0.00 C ATOM 1299 CG ASP A 202 -14.901 -1.059 -1.729 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -14.820 -0.172 -0.846 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -16.005 -1.373 -2.240 1.00 0.00 O ATOM 0 H ASP A 202 -13.627 -1.592 -4.834 1.00 0.00 H new ATOM 0 HA ASP A 202 -13.043 0.324 -2.656 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -13.796 -2.578 -2.801 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.958 -1.949 -1.397 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.894 -1.719 -4.089 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.492 -1.890 -4.427 1.00 0.00 C ATOM 1308 C VAL A 203 -8.889 -0.539 -4.787 1.00 0.00 C ATOM 1309 O VAL A 203 -7.836 -0.216 -4.254 1.00 0.00 O ATOM 1310 CB VAL A 203 -9.348 -2.919 -5.571 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.990 -2.886 -6.278 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -9.534 -4.321 -4.992 1.00 0.00 C ATOM 0 H VAL A 203 -11.506 -2.344 -4.613 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.943 -2.281 -3.570 1.00 0.00 H new ATOM 0 HB VAL A 203 -10.105 -2.660 -6.311 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.972 -3.638 -7.067 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.830 -1.900 -6.714 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -7.200 -3.097 -5.558 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -9.435 -5.059 -5.788 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.775 -4.504 -4.231 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -10.524 -4.401 -4.544 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.538 0.276 -5.627 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.046 1.604 -5.988 1.00 0.00 C ATOM 1324 C LYS A 204 -8.751 2.447 -4.762 1.00 0.00 C ATOM 1325 O LYS A 204 -7.758 3.173 -4.775 1.00 0.00 O ATOM 1326 CB LYS A 204 -10.068 2.340 -6.863 1.00 0.00 C ATOM 1327 CG LYS A 204 -9.878 1.966 -8.338 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.792 2.792 -9.247 1.00 0.00 C ATOM 1329 CE LYS A 204 -12.265 2.497 -8.960 1.00 0.00 C ATOM 1330 NZ LYS A 204 -13.108 2.806 -10.128 1.00 0.00 N ATOM 0 H LYS A 204 -10.421 0.029 -6.075 1.00 0.00 H new ATOM 0 HA LYS A 204 -8.119 1.458 -6.543 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.079 2.086 -6.544 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -9.955 3.417 -6.737 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -8.838 2.125 -8.624 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -10.088 0.905 -8.476 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -10.595 3.854 -9.099 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -10.570 2.569 -10.291 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -12.383 1.447 -8.691 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -12.596 3.085 -8.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -14.107 2.826 -9.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -12.840 3.734 -10.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -12.973 2.076 -10.857 1.00 0.00 H new ATOM 1344 N MET A 205 -9.596 2.372 -3.740 1.00 0.00 N ATOM 1345 CA MET A 205 -9.398 3.104 -2.503 1.00 0.00 C ATOM 1346 C MET A 205 -8.126 2.589 -1.827 1.00 0.00 C ATOM 1347 O MET A 205 -7.242 3.385 -1.511 1.00 0.00 O ATOM 1348 CB MET A 205 -10.630 2.983 -1.599 1.00 0.00 C ATOM 1349 CG MET A 205 -11.945 3.356 -2.308 1.00 0.00 C ATOM 1350 SD MET A 205 -12.827 4.730 -1.550 1.00 0.00 S ATOM 1351 CE MET A 205 -13.396 5.483 -3.083 1.00 0.00 C ATOM 0 H MET A 205 -10.440 1.799 -3.750 1.00 0.00 H new ATOM 0 HA MET A 205 -9.272 4.167 -2.710 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.702 1.960 -1.230 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.499 3.627 -0.730 1.00 0.00 H new ATOM 0 HG2 MET A 205 -11.727 3.607 -3.346 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.598 2.483 -2.322 1.00 0.00 H new ATOM 0 HE1 MET A 205 -14.447 5.756 -2.986 1.00 0.00 H new ATOM 0 HE2 MET A 205 -12.807 6.376 -3.290 1.00 0.00 H new ATOM 0 HE3 MET A 205 -13.279 4.773 -3.902 1.00 0.00 H new ATOM 1361 N MET A 206 -7.992 1.267 -1.656 1.00 0.00 N ATOM 1362 CA MET A 206 -6.789 0.664 -1.082 1.00 0.00 C ATOM 1363 C MET A 206 -5.543 0.979 -1.903 1.00 0.00 C ATOM 1364 O MET A 206 -4.489 1.183 -1.310 1.00 0.00 O ATOM 1365 CB MET A 206 -6.907 -0.862 -0.982 1.00 0.00 C ATOM 1366 CG MET A 206 -7.818 -1.327 0.153 1.00 0.00 C ATOM 1367 SD MET A 206 -9.288 -2.236 -0.383 1.00 0.00 S ATOM 1368 CE MET A 206 -8.522 -3.717 -1.099 1.00 0.00 C ATOM 0 H MET A 206 -8.712 0.591 -1.911 1.00 0.00 H new ATOM 0 HA MET A 206 -6.694 1.097 -0.086 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.287 -1.252 -1.926 1.00 0.00 H new ATOM 0 HB3 MET A 206 -5.914 -1.287 -0.838 1.00 0.00 H new ATOM 0 HG2 MET A 206 -7.242 -1.960 0.827 1.00 0.00 H new ATOM 0 HG3 MET A 206 -8.135 -0.456 0.727 1.00 0.00 H new ATOM 0 HE1 MET A 206 -9.041 -3.986 -2.019 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.474 -3.514 -1.319 1.00 0.00 H new ATOM 0 HE3 MET A 206 -8.591 -4.541 -0.389 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.616 1.008 -3.233 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.492 1.350 -4.089 1.00 0.00 C ATOM 1380 C GLU A 207 -3.905 2.688 -3.673 1.00 0.00 C ATOM 1381 O GLU A 207 -2.689 2.804 -3.558 1.00 0.00 O ATOM 1382 CB GLU A 207 -4.899 1.401 -5.564 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.056 0.014 -6.181 1.00 0.00 C ATOM 1384 CD GLU A 207 -5.113 0.091 -7.703 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -6.035 0.726 -8.267 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -4.250 -0.518 -8.376 1.00 0.00 O ATOM 0 H GLU A 207 -6.469 0.791 -3.748 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.741 0.569 -3.973 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -5.839 1.944 -5.658 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.150 1.960 -6.124 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -4.222 -0.619 -5.877 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -5.965 -0.454 -5.804 1.00 0.00 H new ATOM 1393 N ARG A 208 -4.740 3.706 -3.450 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.254 5.009 -3.032 1.00 0.00 C ATOM 1395 C ARG A 208 -3.846 4.985 -1.570 1.00 0.00 C ATOM 1396 O ARG A 208 -2.821 5.570 -1.244 1.00 0.00 O ATOM 1397 CB ARG A 208 -5.296 6.100 -3.277 1.00 0.00 C ATOM 1398 CG ARG A 208 -5.429 6.492 -4.739 1.00 0.00 C ATOM 1399 CD ARG A 208 -6.151 5.485 -5.613 1.00 0.00 C ATOM 1400 NE ARG A 208 -6.003 5.797 -7.028 1.00 0.00 N ATOM 1401 CZ ARG A 208 -6.119 4.866 -7.981 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -6.603 3.665 -7.674 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -5.753 5.118 -9.227 1.00 0.00 N ATOM 0 H ARG A 208 -5.753 3.646 -3.554 1.00 0.00 H new ATOM 0 HA ARG A 208 -3.377 5.243 -3.636 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -6.264 5.756 -2.912 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.031 6.982 -2.695 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -5.957 7.444 -4.797 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -4.432 6.655 -5.147 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -5.760 4.487 -5.417 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -7.209 5.469 -5.352 1.00 0.00 H new ATOM 0 HE ARG A 208 -5.804 6.759 -7.302 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -6.884 3.458 -6.715 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -6.693 2.951 -8.397 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -5.376 6.033 -9.473 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -5.848 4.397 -9.942 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.612 4.342 -0.687 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.318 4.347 0.740 1.00 0.00 C ATOM 1419 C VAL A 209 -2.934 3.735 0.978 1.00 0.00 C ATOM 1420 O VAL A 209 -2.129 4.286 1.730 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.491 3.698 1.522 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.241 2.307 2.123 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.934 4.627 2.649 1.00 0.00 C ATOM 0 H VAL A 209 -5.444 3.810 -0.941 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.251 5.361 1.135 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.256 3.551 0.760 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -6.138 1.968 2.642 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -4.996 1.605 1.326 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.412 2.359 2.828 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.758 4.168 3.196 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -5.099 4.799 3.328 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.262 5.578 2.229 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.639 2.627 0.299 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.369 1.943 0.371 1.00 0.00 C ATOM 1435 C VAL A 210 -0.323 2.747 -0.388 1.00 0.00 C ATOM 1436 O VAL A 210 0.743 2.937 0.174 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.530 0.529 -0.191 1.00 0.00 C ATOM 1438 CG1 VAL A 210 -0.218 -0.247 -0.340 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -2.503 -0.304 0.668 1.00 0.00 C ATOM 0 H VAL A 210 -3.302 2.176 -0.331 1.00 0.00 H new ATOM 0 HA VAL A 210 -1.034 1.855 1.404 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.931 0.678 -1.194 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.425 -1.238 -0.744 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.447 0.289 -1.017 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.259 -0.346 0.635 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.598 -1.304 0.244 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -2.120 -0.376 1.686 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.480 0.178 0.682 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.583 3.237 -1.611 1.00 0.00 N ATOM 1450 CA GLU A 211 0.387 4.015 -2.372 1.00 0.00 C ATOM 1451 C GLU A 211 0.873 5.207 -1.554 1.00 0.00 C ATOM 1452 O GLU A 211 2.076 5.394 -1.440 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.207 4.455 -3.721 1.00 0.00 C ATOM 1454 CG GLU A 211 0.797 5.229 -4.587 1.00 0.00 C ATOM 1455 CD GLU A 211 0.404 6.673 -4.919 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -0.094 7.432 -4.054 1.00 0.00 O ATOM 1457 OE2 GLU A 211 0.647 7.097 -6.075 1.00 0.00 O ATOM 0 H GLU A 211 -1.472 3.101 -2.092 1.00 0.00 H new ATOM 0 HA GLU A 211 1.251 3.386 -2.586 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -0.549 3.576 -4.267 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.082 5.079 -3.541 1.00 0.00 H new ATOM 0 HG2 GLU A 211 1.759 5.241 -4.075 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.940 4.686 -5.521 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.029 5.958 -0.927 1.00 0.00 N ATOM 1465 CA GLN A 212 0.301 7.093 -0.074 1.00 0.00 C ATOM 1466 C GLN A 212 1.217 6.637 1.066 1.00 0.00 C ATOM 1467 O GLN A 212 2.276 7.215 1.306 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.003 7.676 0.490 1.00 0.00 C ATOM 1469 CG GLN A 212 -1.837 8.470 -0.532 1.00 0.00 C ATOM 1470 CD GLN A 212 -1.343 9.899 -0.733 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -0.951 10.572 0.215 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.376 10.406 -1.955 1.00 0.00 N ATOM 0 H GLN A 212 -1.032 5.789 -1.001 1.00 0.00 H new ATOM 0 HA GLN A 212 0.824 7.856 -0.650 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.611 6.861 0.883 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -0.762 8.328 1.330 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -1.819 7.949 -1.489 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -2.876 8.495 -0.202 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.704 9.836 -2.735 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.073 11.367 -2.117 1.00 0.00 H new ATOM 1481 N MET A 213 0.819 5.584 1.780 1.00 0.00 N ATOM 1482 CA MET A 213 1.607 5.049 2.879 1.00 0.00 C ATOM 1483 C MET A 213 2.952 4.475 2.398 1.00 0.00 C ATOM 1484 O MET A 213 3.941 4.569 3.122 1.00 0.00 O ATOM 1485 CB MET A 213 0.753 4.029 3.639 1.00 0.00 C ATOM 1486 CG MET A 213 -0.359 4.744 4.430 1.00 0.00 C ATOM 1487 SD MET A 213 -1.513 3.768 5.450 1.00 0.00 S ATOM 1488 CE MET A 213 -1.115 2.055 5.024 1.00 0.00 C ATOM 0 H MET A 213 -0.054 5.084 1.611 1.00 0.00 H new ATOM 0 HA MET A 213 1.877 5.852 3.564 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.312 3.320 2.938 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.381 3.455 4.320 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.123 5.469 5.086 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.956 5.310 3.714 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.878 1.392 5.432 1.00 0.00 H new ATOM 0 HE2 MET A 213 -1.083 1.948 3.940 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.144 1.792 5.443 1.00 0.00 H new ATOM 1498 N CYS A 214 3.040 3.945 1.178 1.00 0.00 N ATOM 1499 CA CYS A 214 4.279 3.483 0.563 1.00 0.00 C ATOM 1500 C CYS A 214 5.104 4.616 -0.032 1.00 0.00 C ATOM 1501 O CYS A 214 6.314 4.451 -0.116 1.00 0.00 O ATOM 1502 CB CYS A 214 4.028 2.361 -0.460 1.00 0.00 C ATOM 1503 SG CYS A 214 4.393 0.767 0.327 1.00 0.00 S ATOM 0 H CYS A 214 2.226 3.823 0.575 1.00 0.00 H new ATOM 0 HA CYS A 214 4.878 3.061 1.370 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.993 2.386 -0.802 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.658 2.502 -1.338 1.00 0.00 H new ATOM 1508 N VAL A 215 4.533 5.769 -0.372 1.00 0.00 N ATOM 1509 CA VAL A 215 5.301 6.965 -0.679 1.00 0.00 C ATOM 1510 C VAL A 215 6.053 7.387 0.580 1.00 0.00 C ATOM 1511 O VAL A 215 7.212 7.770 0.438 1.00 0.00 O ATOM 1512 CB VAL A 215 4.398 8.066 -1.277 1.00 0.00 C ATOM 1513 CG1 VAL A 215 5.015 9.474 -1.240 1.00 0.00 C ATOM 1514 CG2 VAL A 215 4.100 7.735 -2.749 1.00 0.00 C ATOM 0 H VAL A 215 3.523 5.897 -0.441 1.00 0.00 H new ATOM 0 HA VAL A 215 6.041 6.766 -1.454 1.00 0.00 H new ATOM 0 HB VAL A 215 3.501 8.080 -0.659 1.00 0.00 H new ATOM 0 HG11 VAL A 215 4.318 10.188 -1.678 1.00 0.00 H new ATOM 0 HG12 VAL A 215 5.220 9.754 -0.207 1.00 0.00 H new ATOM 0 HG13 VAL A 215 5.945 9.479 -1.809 1.00 0.00 H new ATOM 0 HG21 VAL A 215 3.463 8.510 -3.174 1.00 0.00 H new ATOM 0 HG22 VAL A 215 5.035 7.687 -3.308 1.00 0.00 H new ATOM 0 HG23 VAL A 215 3.591 6.773 -2.810 1.00 0.00 H new ATOM 1524 N THR A 216 5.467 7.248 1.779 1.00 0.00 N ATOM 1525 CA THR A 216 6.189 7.424 3.027 1.00 0.00 C ATOM 1526 C THR A 216 7.236 6.321 3.157 1.00 0.00 C ATOM 1527 O THR A 216 8.430 6.618 3.223 1.00 0.00 O ATOM 1528 CB THR A 216 5.193 7.436 4.206 1.00 0.00 C ATOM 1529 OG1 THR A 216 4.210 8.446 4.085 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.856 7.552 5.583 1.00 0.00 C ATOM 0 H THR A 216 4.482 7.011 1.900 1.00 0.00 H new ATOM 0 HA THR A 216 6.711 8.381 3.039 1.00 0.00 H new ATOM 0 HB THR A 216 4.714 6.459 4.145 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.605 8.408 4.855 1.00 0.00 H new ATOM 0 HG21 THR A 216 5.089 7.554 6.357 1.00 0.00 H new ATOM 0 HG22 THR A 216 6.525 6.706 5.737 1.00 0.00 H new ATOM 0 HG23 THR A 216 6.426 8.480 5.635 1.00 0.00 H new ATOM 1538 N GLN A 217 6.796 5.060 3.230 1.00 0.00 N ATOM 1539 CA GLN A 217 7.656 3.948 3.608 1.00 0.00 C ATOM 1540 C GLN A 217 8.870 3.856 2.687 1.00 0.00 C ATOM 1541 O GLN A 217 9.984 3.703 3.173 1.00 0.00 O ATOM 1542 CB GLN A 217 6.861 2.628 3.651 1.00 0.00 C ATOM 1543 CG GLN A 217 7.119 1.869 4.961 1.00 0.00 C ATOM 1544 CD GLN A 217 8.573 1.434 5.109 1.00 0.00 C ATOM 1545 OE1 GLN A 217 9.214 1.066 4.138 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.127 1.483 6.309 1.00 0.00 N ATOM 0 H GLN A 217 5.834 4.788 3.028 1.00 0.00 H new ATOM 0 HA GLN A 217 8.031 4.132 4.615 1.00 0.00 H new ATOM 0 HB2 GLN A 217 5.796 2.838 3.553 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.142 2.003 2.804 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.846 2.503 5.804 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.475 0.991 5.001 1.00 0.00 H new ATOM 0 HE21 GLN A 217 8.579 1.793 7.112 1.00 0.00 H new ATOM 0 HE22 GLN A 217 10.102 1.211 6.432 1.00 0.00 H new ATOM 1555 N TYR A 218 8.678 4.054 1.384 1.00 0.00 N ATOM 1556 CA TYR A 218 9.747 4.054 0.407 1.00 0.00 C ATOM 1557 C TYR A 218 10.875 5.008 0.794 1.00 0.00 C ATOM 1558 O TYR A 218 12.035 4.609 0.699 1.00 0.00 O ATOM 1559 CB TYR A 218 9.188 4.414 -0.969 1.00 0.00 C ATOM 1560 CG TYR A 218 10.277 4.702 -1.971 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.183 3.693 -2.339 1.00 0.00 C ATOM 1562 CD2 TYR A 218 10.462 6.017 -2.425 1.00 0.00 C ATOM 1563 CE1 TYR A 218 12.279 4.001 -3.158 1.00 0.00 C ATOM 1564 CE2 TYR A 218 11.561 6.331 -3.232 1.00 0.00 C ATOM 1565 CZ TYR A 218 12.481 5.329 -3.596 1.00 0.00 C ATOM 1566 OH TYR A 218 13.529 5.651 -4.395 1.00 0.00 O ATOM 0 H TYR A 218 7.757 4.221 0.978 1.00 0.00 H new ATOM 0 HA TYR A 218 10.173 3.051 0.375 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.570 3.594 -1.333 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.540 5.286 -0.879 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.035 2.681 -1.991 1.00 0.00 H new ATOM 0 HD2 TYR A 218 9.756 6.787 -2.151 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.968 3.224 -3.454 1.00 0.00 H new ATOM 0 HE2 TYR A 218 11.704 7.344 -3.577 1.00 0.00 H new ATOM 0 HH TYR A 218 13.505 6.610 -4.595 1.00 0.00 H new ATOM 1576 N GLN A 219 10.578 6.239 1.235 1.00 0.00 N ATOM 1577 CA GLN A 219 11.635 7.152 1.665 1.00 0.00 C ATOM 1578 C GLN A 219 12.385 6.526 2.841 1.00 0.00 C ATOM 1579 O GLN A 219 13.615 6.504 2.839 1.00 0.00 O ATOM 1580 CB GLN A 219 11.116 8.531 2.102 1.00 0.00 C ATOM 1581 CG GLN A 219 10.078 9.217 1.217 1.00 0.00 C ATOM 1582 CD GLN A 219 10.370 9.281 -0.278 1.00 0.00 C ATOM 1583 OE1 GLN A 219 11.476 9.598 -0.714 1.00 0.00 O ATOM 1584 NE2 GLN A 219 9.354 9.072 -1.096 1.00 0.00 N ATOM 0 H GLN A 219 9.632 6.616 1.301 1.00 0.00 H new ATOM 0 HA GLN A 219 12.283 7.308 0.802 1.00 0.00 H new ATOM 0 HB2 GLN A 219 10.689 8.427 3.099 1.00 0.00 H new ATOM 0 HB3 GLN A 219 11.973 9.198 2.191 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.126 8.704 1.354 1.00 0.00 H new ATOM 0 HG3 GLN A 219 9.946 10.236 1.579 1.00 0.00 H new ATOM 0 HE21 GLN A 219 8.443 8.810 -0.721 1.00 0.00 H new ATOM 0 HE22 GLN A 219 9.481 9.173 -2.103 1.00 0.00 H new ATOM 1593 N LYS A 220 11.638 6.021 3.830 1.00 0.00 N ATOM 1594 CA LYS A 220 12.170 5.482 5.076 1.00 0.00 C ATOM 1595 C LYS A 220 13.109 4.323 4.803 1.00 0.00 C ATOM 1596 O LYS A 220 14.265 4.374 5.217 1.00 0.00 O ATOM 1597 CB LYS A 220 11.051 5.029 6.026 1.00 0.00 C ATOM 1598 CG LYS A 220 10.017 6.130 6.281 1.00 0.00 C ATOM 1599 CD LYS A 220 9.437 6.003 7.682 1.00 0.00 C ATOM 1600 CE LYS A 220 8.470 7.154 7.931 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.325 7.423 9.370 1.00 0.00 N ATOM 0 H LYS A 220 10.620 5.977 3.779 1.00 0.00 H new ATOM 0 HA LYS A 220 12.723 6.286 5.561 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.552 4.157 5.604 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.488 4.718 6.975 1.00 0.00 H new ATOM 0 HG2 LYS A 220 10.482 7.108 6.161 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.218 6.064 5.543 1.00 0.00 H new ATOM 0 HD2 LYS A 220 8.921 5.049 7.790 1.00 0.00 H new ATOM 0 HD3 LYS A 220 10.237 6.018 8.422 1.00 0.00 H new ATOM 0 HE2 LYS A 220 8.829 8.050 7.425 1.00 0.00 H new ATOM 0 HE3 LYS A 220 7.497 6.914 7.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 7.661 8.211 9.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 7.960 6.574 9.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 9.251 7.675 9.771 1.00 0.00 H new ATOM 1615 N GLU A 221 12.621 3.284 4.134 1.00 0.00 N ATOM 1616 CA GLU A 221 13.422 2.123 3.807 1.00 0.00 C ATOM 1617 C GLU A 221 14.591 2.540 2.919 1.00 0.00 C ATOM 1618 O GLU A 221 15.714 2.127 3.181 1.00 0.00 O ATOM 1619 CB GLU A 221 12.562 1.063 3.113 1.00 0.00 C ATOM 1620 CG GLU A 221 12.312 -0.212 3.920 1.00 0.00 C ATOM 1621 CD GLU A 221 13.558 -0.818 4.580 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.444 -1.337 3.861 1.00 0.00 O ATOM 1623 OE2 GLU A 221 13.629 -0.768 5.833 1.00 0.00 O ATOM 0 H GLU A 221 11.657 3.229 3.805 1.00 0.00 H new ATOM 0 HA GLU A 221 13.818 1.689 4.725 1.00 0.00 H new ATOM 0 HB2 GLU A 221 11.599 1.508 2.862 1.00 0.00 H new ATOM 0 HB3 GLU A 221 13.041 0.789 2.173 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.578 0.005 4.696 1.00 0.00 H new ATOM 0 HG3 GLU A 221 11.868 -0.959 3.262 1.00 0.00 H new ATOM 1630 N SER A 222 14.376 3.413 1.926 1.00 0.00 N ATOM 1631 CA SER A 222 15.472 3.890 1.092 1.00 0.00 C ATOM 1632 C SER A 222 16.551 4.555 1.939 1.00 0.00 C ATOM 1633 O SER A 222 17.732 4.335 1.685 1.00 0.00 O ATOM 1634 CB SER A 222 14.988 4.824 -0.009 1.00 0.00 C ATOM 1635 OG SER A 222 14.143 4.100 -0.871 1.00 0.00 O ATOM 0 H SER A 222 13.461 3.796 1.687 1.00 0.00 H new ATOM 0 HA SER A 222 15.909 3.019 0.604 1.00 0.00 H new ATOM 0 HB2 SER A 222 14.454 5.671 0.421 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.836 5.229 -0.562 1.00 0.00 H new ATOM 0 HG SER A 222 13.214 4.193 -0.573 1.00 0.00 H new ATOM 1641 N GLN A 223 16.186 5.313 2.975 1.00 0.00 N ATOM 1642 CA GLN A 223 17.151 5.913 3.883 1.00 0.00 C ATOM 1643 C GLN A 223 17.948 4.839 4.630 1.00 0.00 C ATOM 1644 O GLN A 223 19.125 5.050 4.910 1.00 0.00 O ATOM 1645 CB GLN A 223 16.437 6.852 4.886 1.00 0.00 C ATOM 1646 CG GLN A 223 16.764 8.338 4.674 1.00 0.00 C ATOM 1647 CD GLN A 223 18.137 8.767 5.205 1.00 0.00 C ATOM 1648 OE1 GLN A 223 19.144 7.910 5.172 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 18.293 9.894 5.664 1.00 0.00 N flip ATOM 0 H GLN A 223 15.215 5.525 3.203 1.00 0.00 H new ATOM 0 HA GLN A 223 17.852 6.501 3.290 1.00 0.00 H new ATOM 0 HB2 GLN A 223 15.360 6.710 4.801 1.00 0.00 H new ATOM 0 HB3 GLN A 223 16.717 6.568 5.900 1.00 0.00 H new ATOM 0 HG2 GLN A 223 16.715 8.560 3.608 1.00 0.00 H new ATOM 0 HG3 GLN A 223 15.996 8.939 5.160 1.00 0.00 H new ATOM 0 HE21 GLN A 223 17.511 10.549 5.686 1.00 0.00 H new ATOM 0 HE22 GLN A 223 19.205 10.176 6.024 1.00 0.00 H new ATOM 1658 N ALA A 224 17.336 3.702 4.943 1.00 0.00 N ATOM 1659 CA ALA A 224 17.946 2.538 5.576 1.00 0.00 C ATOM 1660 C ALA A 224 18.671 1.630 4.567 1.00 0.00 C ATOM 1661 O ALA A 224 19.255 0.617 4.963 1.00 0.00 O ATOM 1662 CB ALA A 224 16.857 1.769 6.331 1.00 0.00 C ATOM 0 H ALA A 224 16.344 3.560 4.751 1.00 0.00 H new ATOM 0 HA ALA A 224 18.712 2.880 6.271 1.00 0.00 H new ATOM 0 HB1 ALA A 224 17.296 0.894 6.811 1.00 0.00 H new ATOM 0 HB2 ALA A 224 16.414 2.415 7.089 1.00 0.00 H new ATOM 0 HB3 ALA A 224 16.085 1.450 5.631 1.00 0.00 H new ATOM 1668 N TYR A 225 18.661 1.982 3.279 1.00 0.00 N ATOM 1669 CA TYR A 225 19.243 1.223 2.186 1.00 0.00 C ATOM 1670 C TYR A 225 20.471 1.968 1.677 1.00 0.00 C ATOM 1671 O TYR A 225 21.573 1.420 1.630 1.00 0.00 O ATOM 1672 CB TYR A 225 18.173 0.980 1.103 1.00 0.00 C ATOM 1673 CG TYR A 225 18.606 1.057 -0.355 1.00 0.00 C ATOM 1674 CD1 TYR A 225 18.532 2.278 -1.064 1.00 0.00 C ATOM 1675 CD2 TYR A 225 19.010 -0.112 -1.026 1.00 0.00 C ATOM 1676 CE1 TYR A 225 18.866 2.321 -2.431 1.00 0.00 C ATOM 1677 CE2 TYR A 225 19.320 -0.082 -2.397 1.00 0.00 C ATOM 1678 CZ TYR A 225 19.251 1.135 -3.102 1.00 0.00 C ATOM 1679 OH TYR A 225 19.539 1.150 -4.431 1.00 0.00 O ATOM 0 H TYR A 225 18.224 2.847 2.962 1.00 0.00 H new ATOM 0 HA TYR A 225 19.576 0.238 2.513 1.00 0.00 H new ATOM 0 HB2 TYR A 225 17.743 -0.007 1.273 1.00 0.00 H new ATOM 0 HB3 TYR A 225 17.374 1.706 1.253 1.00 0.00 H new ATOM 0 HD1 TYR A 225 18.219 3.178 -0.556 1.00 0.00 H new ATOM 0 HD2 TYR A 225 19.083 -1.042 -0.482 1.00 0.00 H new ATOM 0 HE1 TYR A 225 18.829 3.258 -2.967 1.00 0.00 H new ATOM 0 HE2 TYR A 225 19.610 -0.989 -2.907 1.00 0.00 H new ATOM 0 HH TYR A 225 19.785 0.247 -4.723 1.00 0.00 H new ATOM 1689 N TYR A 226 20.280 3.236 1.312 1.00 0.00 N ATOM 1690 CA TYR A 226 21.287 4.096 0.709 1.00 0.00 C ATOM 1691 C TYR A 226 22.256 4.638 1.760 1.00 0.00 C ATOM 1692 O TYR A 226 23.279 5.229 1.417 1.00 0.00 O ATOM 1693 CB TYR A 226 20.586 5.199 -0.110 1.00 0.00 C ATOM 1694 CG TYR A 226 20.579 6.605 0.463 1.00 0.00 C ATOM 1695 CD1 TYR A 226 21.733 7.408 0.420 1.00 0.00 C ATOM 1696 CD2 TYR A 226 19.420 7.085 1.093 1.00 0.00 C ATOM 1697 CE1 TYR A 226 21.789 8.591 1.177 1.00 0.00 C ATOM 1698 CE2 TYR A 226 19.457 8.293 1.818 1.00 0.00 C ATOM 1699 CZ TYR A 226 20.669 9.011 1.924 1.00 0.00 C ATOM 1700 OH TYR A 226 20.796 10.053 2.793 1.00 0.00 O ATOM 0 H TYR A 226 19.383 3.706 1.435 1.00 0.00 H new ATOM 0 HA TYR A 226 21.905 3.519 0.021 1.00 0.00 H new ATOM 0 HB2 TYR A 226 21.058 5.239 -1.092 1.00 0.00 H new ATOM 0 HB3 TYR A 226 19.551 4.895 -0.266 1.00 0.00 H new ATOM 0 HD1 TYR A 226 22.573 7.117 -0.193 1.00 0.00 H new ATOM 0 HD2 TYR A 226 18.498 6.527 1.022 1.00 0.00 H new ATOM 0 HE1 TYR A 226 22.694 9.181 1.187 1.00 0.00 H new ATOM 0 HE2 TYR A 226 18.562 8.669 2.291 1.00 0.00 H new ATOM 0 HH TYR A 226 19.935 10.221 3.230 1.00 0.00 H new