USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 805 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 177 HIS : no HD1:sc= -0.98 X(o=-1.4,f=-0.99) USER MOD Set 1.2: A 181 ASN : amide:sc= -0.447 X(o=-1.4,f=-1.5!) USER MOD Set 2.1: A 171 ASN : amide:sc= -0.486 K(o=-0.65,f=-7.3!) USER MOD Set 2.2: A 174 ASN : amide:sc= -0.168 K(o=-0.65,f=-8.4) USER MOD Set 3.1: A 153 ASN : amide:sc= 2.35 K(o=3.4,f=-2.6) USER MOD Set 3.2: A 157 TYR OH : rot 62:sc= 1.1 USER MOD Single : A 128 TYR OH : rot 61:sc= 0 USER MOD Single : A 129 MET CE :methyl -143:sc= -2.13 (180deg=-5.12!) USER MOD Single : A 132 SER OG : rot 180:sc= 0.0324 USER MOD Single : A 134 MET CE :methyl -164:sc= -0.252 (180deg=-0.709) USER MOD Single : A 135 SER OG : rot 180:sc= 0.00927 USER MOD Single : A 138 MET CE :methyl -123:sc= -0.084 (180deg=-0.0935) USER MOD Single : A 140 HIS : no HD1:sc= -0.162 X(o=-0.16,f=-0.057) USER MOD Single : A 143 ASN : amide:sc= 1.01 K(o=1,f=-0.3) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 173:sc= 0.637 USER MOD Single : A 154 MET CE :methyl -150:sc= -2.76! (180deg=-4.01!) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= 1.12 K(o=1.1,f=-0.00093) USER MOD Single : A 160 GLN : amide:sc= 0.17 X(o=0.17,f=-0.017) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot -107:sc= 1.17 USER MOD Single : A 168 GLN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 172 GLN : amide:sc= -0.0148 K(o=-0.015,f=-0.96) USER MOD Single : A 173 ASN : amide:sc=-0.00109 X(o=-0.0011,f=-0.0065) USER MOD Single : A 183 THR OG1 : rot 82:sc= 1.13 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -1.8 K(o=-1.8,f=-4.5!) USER MOD Single : A 187 HIS : no HE2:sc= -0.568 K(o=-0.57,f=-3.7) USER MOD Single : A 188 THR OG1 : rot 80:sc= 1.18 USER MOD Single : A 190 THR OG1 : rot -44:sc= 0.00833 USER MOD Single : A 191 THR OG1 : rot -170:sc= 0 USER MOD Single : A 192 THR OG1 : rot 70:sc= 1.15 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= 0.0684 X(o=0.068,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -146:sc= -0.564 (180deg=-1.46) USER MOD Single : A 206 MET CE :methyl 165:sc= -0.199 (180deg=-0.586) USER MOD Single : A 212 GLN : amide:sc= -0.0164 X(o=-0.016,f=-0.072) USER MOD Single : A 213 MET CE :methyl 178:sc= -0.48 (180deg=-0.494) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.19) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 220 LYS NZ :NH3+ 167:sc=-0.000119 (180deg=-0.108) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 223 GLN : amide:sc= -1.01 X(o=-1,f=-0.62) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 9.084 -13.446 -2.907 1.00 0.00 N ATOM 66 CA LEU A 125 9.249 -12.299 -3.789 1.00 0.00 C ATOM 67 C LEU A 125 10.744 -12.124 -4.068 1.00 0.00 C ATOM 68 O LEU A 125 11.570 -12.701 -3.362 1.00 0.00 O ATOM 69 CB LEU A 125 8.623 -11.051 -3.172 1.00 0.00 C ATOM 70 CG LEU A 125 7.157 -11.149 -2.706 1.00 0.00 C ATOM 71 CD1 LEU A 125 6.637 -9.742 -2.430 1.00 0.00 C ATOM 72 CD2 LEU A 125 6.184 -11.781 -3.705 1.00 0.00 C ATOM 0 HA LEU A 125 8.731 -12.464 -4.734 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.230 -10.758 -2.315 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.691 -10.244 -3.902 1.00 0.00 H new ATOM 0 HG LEU A 125 7.186 -11.798 -1.830 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.600 -9.796 -2.099 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.242 -9.276 -1.652 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.697 -9.147 -3.341 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.182 -11.800 -3.275 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.174 -11.195 -4.624 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.502 -12.799 -3.928 1.00 0.00 H new ATOM 84 N GLY A 126 11.102 -11.279 -5.038 1.00 0.00 N ATOM 85 CA GLY A 126 12.463 -11.012 -5.491 1.00 0.00 C ATOM 86 C GLY A 126 13.188 -10.104 -4.514 1.00 0.00 C ATOM 87 O GLY A 126 13.486 -8.948 -4.819 1.00 0.00 O ATOM 0 H GLY A 126 10.410 -10.735 -5.554 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.007 -11.951 -5.595 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.438 -10.547 -6.477 1.00 0.00 H new ATOM 91 N GLY A 127 13.409 -10.631 -3.316 1.00 0.00 N ATOM 92 CA GLY A 127 14.109 -9.994 -2.211 1.00 0.00 C ATOM 93 C GLY A 127 13.373 -8.741 -1.751 1.00 0.00 C ATOM 94 O GLY A 127 13.994 -7.691 -1.586 1.00 0.00 O ATOM 0 H GLY A 127 13.085 -11.568 -3.078 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.198 -10.694 -1.380 1.00 0.00 H new ATOM 0 HA3 GLY A 127 15.122 -9.733 -2.519 1.00 0.00 H new ATOM 98 N TYR A 128 12.046 -8.824 -1.622 1.00 0.00 N ATOM 99 CA TYR A 128 11.251 -7.752 -1.040 1.00 0.00 C ATOM 100 C TYR A 128 11.389 -7.785 0.483 1.00 0.00 C ATOM 101 O TYR A 128 11.448 -8.855 1.099 1.00 0.00 O ATOM 102 CB TYR A 128 9.781 -7.901 -1.446 1.00 0.00 C ATOM 103 CG TYR A 128 9.437 -7.328 -2.805 1.00 0.00 C ATOM 104 CD1 TYR A 128 9.921 -7.954 -3.965 1.00 0.00 C ATOM 105 CD2 TYR A 128 8.620 -6.186 -2.918 1.00 0.00 C ATOM 106 CE1 TYR A 128 9.560 -7.476 -5.231 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.276 -5.678 -4.182 1.00 0.00 C ATOM 108 CZ TYR A 128 8.745 -6.329 -5.343 1.00 0.00 C ATOM 109 OH TYR A 128 8.516 -5.797 -6.567 1.00 0.00 O ATOM 0 H TYR A 128 11.500 -9.633 -1.918 1.00 0.00 H new ATOM 0 HA TYR A 128 11.613 -6.793 -1.411 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.522 -8.960 -1.437 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.160 -7.414 -0.694 1.00 0.00 H new ATOM 0 HD1 TYR A 128 10.575 -8.809 -3.880 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.255 -5.697 -2.027 1.00 0.00 H new ATOM 0 HE1 TYR A 128 9.904 -7.984 -6.120 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.658 -4.796 -4.264 1.00 0.00 H new ATOM 0 HH TYR A 128 8.064 -6.458 -7.132 1.00 0.00 H new ATOM 119 N MET A 129 11.391 -6.594 1.063 1.00 0.00 N ATOM 120 CA MET A 129 11.302 -6.257 2.472 1.00 0.00 C ATOM 121 C MET A 129 9.866 -5.888 2.792 1.00 0.00 C ATOM 122 O MET A 129 9.047 -5.811 1.876 1.00 0.00 O ATOM 123 CB MET A 129 12.220 -5.055 2.772 1.00 0.00 C ATOM 124 CG MET A 129 13.530 -4.935 1.969 1.00 0.00 C ATOM 125 SD MET A 129 14.554 -6.412 1.691 1.00 0.00 S ATOM 126 CE MET A 129 14.162 -7.384 3.164 1.00 0.00 C ATOM 0 H MET A 129 11.463 -5.751 0.494 1.00 0.00 H new ATOM 0 HA MET A 129 11.614 -7.107 3.079 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.643 -4.144 2.611 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.477 -5.086 3.831 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.276 -4.526 0.991 1.00 0.00 H new ATOM 0 HG3 MET A 129 14.154 -4.196 2.472 1.00 0.00 H new ATOM 0 HE1 MET A 129 15.057 -7.905 3.505 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.805 -6.722 3.953 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.388 -8.112 2.924 1.00 0.00 H new ATOM 136 N LEU A 130 9.556 -5.640 4.066 1.00 0.00 N ATOM 137 CA LEU A 130 8.250 -5.166 4.483 1.00 0.00 C ATOM 138 C LEU A 130 8.392 -4.089 5.560 1.00 0.00 C ATOM 139 O LEU A 130 9.192 -4.246 6.485 1.00 0.00 O ATOM 140 CB LEU A 130 7.401 -6.383 4.894 1.00 0.00 C ATOM 141 CG LEU A 130 6.047 -6.066 5.570 1.00 0.00 C ATOM 142 CD1 LEU A 130 4.845 -6.367 4.671 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.914 -6.902 6.843 1.00 0.00 C ATOM 0 H LEU A 130 10.213 -5.765 4.836 1.00 0.00 H new ATOM 0 HA LEU A 130 7.722 -4.673 3.667 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.209 -6.984 4.005 1.00 0.00 H new ATOM 0 HB3 LEU A 130 7.989 -6.999 5.574 1.00 0.00 H new ATOM 0 HG LEU A 130 6.043 -4.998 5.786 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.924 -6.124 5.201 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.910 -5.767 3.763 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.844 -7.425 4.407 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.961 -6.683 7.324 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.957 -7.961 6.589 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.729 -6.659 7.525 1.00 0.00 H new ATOM 155 N GLY A 131 7.619 -3.009 5.430 1.00 0.00 N ATOM 156 CA GLY A 131 7.585 -1.829 6.288 1.00 0.00 C ATOM 157 C GLY A 131 6.799 -2.034 7.584 1.00 0.00 C ATOM 158 O GLY A 131 6.412 -3.155 7.932 1.00 0.00 O ATOM 0 H GLY A 131 6.951 -2.934 4.663 1.00 0.00 H new ATOM 0 HA2 GLY A 131 8.607 -1.541 6.535 1.00 0.00 H new ATOM 0 HA3 GLY A 131 7.145 -1.000 5.734 1.00 0.00 H new ATOM 162 N SER A 132 6.577 -0.948 8.321 1.00 0.00 N ATOM 163 CA SER A 132 5.760 -0.901 9.525 1.00 0.00 C ATOM 164 C SER A 132 4.338 -0.426 9.246 1.00 0.00 C ATOM 165 O SER A 132 4.052 0.182 8.215 1.00 0.00 O ATOM 166 CB SER A 132 6.409 0.042 10.532 1.00 0.00 C ATOM 167 OG SER A 132 7.001 1.179 9.941 1.00 0.00 O ATOM 0 H SER A 132 6.979 -0.041 8.083 1.00 0.00 H new ATOM 0 HA SER A 132 5.699 -1.915 9.920 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.656 0.367 11.251 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.169 -0.504 11.091 1.00 0.00 H new ATOM 0 HG SER A 132 7.397 1.742 10.639 1.00 0.00 H new ATOM 173 N ALA A 133 3.454 -0.678 10.209 1.00 0.00 N ATOM 174 CA ALA A 133 2.056 -0.307 10.188 1.00 0.00 C ATOM 175 C ALA A 133 1.907 1.214 10.183 1.00 0.00 C ATOM 176 O ALA A 133 2.258 1.878 11.164 1.00 0.00 O ATOM 177 CB ALA A 133 1.372 -0.916 11.411 1.00 0.00 C ATOM 0 H ALA A 133 3.714 -1.171 11.063 1.00 0.00 H new ATOM 0 HA ALA A 133 1.585 -0.687 9.281 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.316 -0.645 11.410 1.00 0.00 H new ATOM 0 HB2 ALA A 133 1.468 -2.001 11.379 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.843 -0.537 12.318 1.00 0.00 H new ATOM 183 N MET A 134 1.411 1.766 9.079 1.00 0.00 N ATOM 184 CA MET A 134 1.046 3.173 8.927 1.00 0.00 C ATOM 185 C MET A 134 -0.347 3.442 9.506 1.00 0.00 C ATOM 186 O MET A 134 -1.049 2.512 9.912 1.00 0.00 O ATOM 187 CB MET A 134 1.042 3.543 7.437 1.00 0.00 C ATOM 188 CG MET A 134 2.420 3.424 6.794 1.00 0.00 C ATOM 189 SD MET A 134 2.662 4.613 5.454 1.00 0.00 S ATOM 190 CE MET A 134 4.065 3.795 4.687 1.00 0.00 C ATOM 0 H MET A 134 1.245 1.224 8.231 1.00 0.00 H new ATOM 0 HA MET A 134 1.777 3.776 9.466 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.343 2.895 6.909 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.680 4.565 7.322 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.187 3.576 7.554 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.551 2.413 6.407 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.564 4.488 4.010 1.00 0.00 H new ATOM 0 HE2 MET A 134 4.765 3.473 5.458 1.00 0.00 H new ATOM 0 HE3 MET A 134 3.718 2.927 4.127 1.00 0.00 H new ATOM 200 N SER A 135 -0.775 4.708 9.508 1.00 0.00 N ATOM 201 CA SER A 135 -2.185 5.092 9.581 1.00 0.00 C ATOM 202 C SER A 135 -2.681 5.449 8.181 1.00 0.00 C ATOM 203 O SER A 135 -1.905 5.493 7.221 1.00 0.00 O ATOM 204 CB SER A 135 -2.390 6.248 10.573 1.00 0.00 C ATOM 205 OG SER A 135 -3.738 6.312 10.994 1.00 0.00 O ATOM 0 H SER A 135 -0.141 5.505 9.458 1.00 0.00 H new ATOM 0 HA SER A 135 -2.772 4.252 9.954 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.740 6.112 11.437 1.00 0.00 H new ATOM 0 HB3 SER A 135 -2.105 7.190 10.105 1.00 0.00 H new ATOM 0 HG SER A 135 -3.848 7.053 11.626 1.00 0.00 H new ATOM 211 N ARG A 136 -3.990 5.660 8.066 1.00 0.00 N ATOM 212 CA ARG A 136 -4.686 5.728 6.798 1.00 0.00 C ATOM 213 C ARG A 136 -4.645 7.159 6.246 1.00 0.00 C ATOM 214 O ARG A 136 -4.968 8.104 6.971 1.00 0.00 O ATOM 215 CB ARG A 136 -6.110 5.192 6.959 1.00 0.00 C ATOM 216 CG ARG A 136 -7.024 6.097 7.787 1.00 0.00 C ATOM 217 CD ARG A 136 -8.007 5.299 8.646 1.00 0.00 C ATOM 218 NE ARG A 136 -7.522 5.153 10.022 1.00 0.00 N ATOM 219 CZ ARG A 136 -7.424 6.092 10.966 1.00 0.00 C ATOM 220 NH1 ARG A 136 -7.745 7.360 10.721 1.00 0.00 N ATOM 221 NH2 ARG A 136 -6.990 5.734 12.166 1.00 0.00 N ATOM 0 H ARG A 136 -4.602 5.790 8.871 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.186 5.096 6.064 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.550 5.055 5.971 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -6.067 4.209 7.428 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.416 6.733 8.430 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -7.580 6.756 7.120 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -8.976 5.799 8.652 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -8.159 4.313 8.206 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.222 4.216 10.292 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.075 7.633 9.795 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -7.662 8.059 11.459 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -6.741 4.762 12.349 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.905 6.430 12.906 1.00 0.00 H new ATOM 235 N PRO A 137 -4.273 7.338 4.975 1.00 0.00 N ATOM 236 CA PRO A 137 -4.273 8.648 4.338 1.00 0.00 C ATOM 237 C PRO A 137 -5.697 9.166 4.081 1.00 0.00 C ATOM 238 O PRO A 137 -6.691 8.484 4.366 1.00 0.00 O ATOM 239 CB PRO A 137 -3.410 8.485 3.075 1.00 0.00 C ATOM 240 CG PRO A 137 -3.441 6.979 2.794 1.00 0.00 C ATOM 241 CD PRO A 137 -3.778 6.292 4.105 1.00 0.00 C ATOM 0 HA PRO A 137 -3.849 9.423 4.977 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.815 9.055 2.239 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.392 8.839 3.239 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -4.185 6.744 2.033 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.478 6.637 2.415 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.529 5.515 3.959 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.899 5.810 4.532 1.00 0.00 H new ATOM 249 N MET A 138 -5.799 10.395 3.570 1.00 0.00 N ATOM 250 CA MET A 138 -7.041 11.121 3.318 1.00 0.00 C ATOM 251 C MET A 138 -7.166 11.269 1.806 1.00 0.00 C ATOM 252 O MET A 138 -6.341 11.951 1.198 1.00 0.00 O ATOM 253 CB MET A 138 -6.967 12.498 4.008 1.00 0.00 C ATOM 254 CG MET A 138 -7.552 12.529 5.426 1.00 0.00 C ATOM 255 SD MET A 138 -9.306 13.017 5.544 1.00 0.00 S ATOM 256 CE MET A 138 -10.115 11.404 5.633 1.00 0.00 C ATOM 0 H MET A 138 -4.975 10.936 3.308 1.00 0.00 H new ATOM 0 HA MET A 138 -7.910 10.596 3.714 1.00 0.00 H new ATOM 0 HB2 MET A 138 -5.925 12.814 4.051 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.496 13.227 3.394 1.00 0.00 H new ATOM 0 HG2 MET A 138 -7.438 11.539 5.869 1.00 0.00 H new ATOM 0 HG3 MET A 138 -6.960 13.218 6.029 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.839 11.315 4.823 1.00 0.00 H new ATOM 0 HE2 MET A 138 -9.367 10.616 5.540 1.00 0.00 H new ATOM 0 HE3 MET A 138 -10.628 11.306 6.590 1.00 0.00 H new ATOM 266 N ILE A 139 -8.159 10.643 1.173 1.00 0.00 N ATOM 267 CA ILE A 139 -8.259 10.538 -0.280 1.00 0.00 C ATOM 268 C ILE A 139 -9.619 11.071 -0.710 1.00 0.00 C ATOM 269 O ILE A 139 -10.656 10.439 -0.514 1.00 0.00 O ATOM 270 CB ILE A 139 -7.986 9.105 -0.781 1.00 0.00 C ATOM 271 CG1 ILE A 139 -6.806 8.474 -0.006 1.00 0.00 C ATOM 272 CG2 ILE A 139 -7.744 9.154 -2.306 1.00 0.00 C ATOM 273 CD1 ILE A 139 -6.226 7.230 -0.664 1.00 0.00 C ATOM 0 H ILE A 139 -8.928 10.188 1.665 1.00 0.00 H new ATOM 0 HA ILE A 139 -7.483 11.146 -0.745 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.847 8.464 -0.594 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -6.016 9.218 0.101 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -7.141 8.218 0.999 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.549 8.147 -2.676 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.627 9.558 -2.802 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -6.885 9.791 -2.518 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.403 6.848 -0.059 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -7.000 6.467 -0.746 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.858 7.482 -1.659 1.00 0.00 H new ATOM 285 N HIS A 140 -9.599 12.254 -1.314 1.00 0.00 N ATOM 286 CA HIS A 140 -10.793 12.957 -1.764 1.00 0.00 C ATOM 287 C HIS A 140 -10.949 12.772 -3.272 1.00 0.00 C ATOM 288 O HIS A 140 -10.529 13.596 -4.088 1.00 0.00 O ATOM 289 CB HIS A 140 -10.860 14.396 -1.227 1.00 0.00 C ATOM 290 CG HIS A 140 -9.959 15.468 -1.788 1.00 0.00 C ATOM 291 ND1 HIS A 140 -10.204 16.814 -1.659 1.00 0.00 N ATOM 292 CD2 HIS A 140 -8.749 15.331 -2.407 1.00 0.00 C ATOM 293 CE1 HIS A 140 -9.174 17.487 -2.187 1.00 0.00 C ATOM 294 NE2 HIS A 140 -8.277 16.621 -2.686 1.00 0.00 N ATOM 0 H HIS A 140 -8.735 12.760 -1.508 1.00 0.00 H new ATOM 0 HA HIS A 140 -11.688 12.515 -1.327 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -11.886 14.739 -1.356 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.672 14.348 -0.154 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -8.249 14.402 -2.638 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -9.079 18.563 -2.208 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -7.414 16.858 -3.176 1.00 0.00 H new ATOM 302 N PHE A 141 -11.493 11.615 -3.647 1.00 0.00 N ATOM 303 CA PHE A 141 -11.580 11.152 -5.026 1.00 0.00 C ATOM 304 C PHE A 141 -12.336 12.149 -5.902 1.00 0.00 C ATOM 305 O PHE A 141 -11.865 12.545 -6.965 1.00 0.00 O ATOM 306 CB PHE A 141 -12.325 9.825 -5.101 1.00 0.00 C ATOM 307 CG PHE A 141 -11.680 8.597 -4.505 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.416 8.497 -3.126 1.00 0.00 C ATOM 309 CD2 PHE A 141 -11.425 7.501 -5.348 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.779 7.360 -2.610 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.796 6.357 -4.829 1.00 0.00 C ATOM 312 CZ PHE A 141 -10.441 6.301 -3.467 1.00 0.00 C ATOM 0 H PHE A 141 -11.896 10.958 -2.979 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.556 11.042 -5.384 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.291 9.960 -4.614 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.524 9.617 -6.152 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.705 9.299 -2.463 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.711 7.538 -6.389 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.549 7.299 -1.557 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -10.584 5.518 -5.476 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.909 5.444 -3.082 1.00 0.00 H new ATOM 322 N GLY A 142 -13.547 12.516 -5.487 1.00 0.00 N ATOM 323 CA GLY A 142 -14.364 13.568 -6.068 1.00 0.00 C ATOM 324 C GLY A 142 -15.827 13.248 -5.807 1.00 0.00 C ATOM 325 O GLY A 142 -16.578 14.102 -5.333 1.00 0.00 O ATOM 0 H GLY A 142 -14.004 12.062 -4.696 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.104 14.533 -5.632 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.179 13.642 -7.140 1.00 0.00 H new ATOM 329 N ASN A 143 -16.223 11.992 -6.034 1.00 0.00 N ATOM 330 CA ASN A 143 -17.571 11.532 -5.737 1.00 0.00 C ATOM 331 C ASN A 143 -17.740 11.425 -4.235 1.00 0.00 C ATOM 332 O ASN A 143 -16.776 11.114 -3.528 1.00 0.00 O ATOM 333 CB ASN A 143 -17.832 10.144 -6.318 1.00 0.00 C ATOM 334 CG ASN A 143 -17.596 10.081 -7.810 1.00 0.00 C ATOM 335 OD1 ASN A 143 -18.486 10.382 -8.597 1.00 0.00 O ATOM 336 ND2 ASN A 143 -16.388 9.730 -8.193 1.00 0.00 N ATOM 0 H ASN A 143 -15.616 11.273 -6.427 1.00 0.00 H new ATOM 0 HA ASN A 143 -18.266 12.248 -6.176 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -17.186 9.420 -5.821 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.861 9.853 -6.105 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -16.157 9.699 -9.186 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -15.682 9.489 -7.497 1.00 0.00 H new ATOM 343 N ASP A 144 -18.971 11.588 -3.757 1.00 0.00 N ATOM 344 CA ASP A 144 -19.305 11.284 -2.369 1.00 0.00 C ATOM 345 C ASP A 144 -19.220 9.783 -2.111 1.00 0.00 C ATOM 346 O ASP A 144 -18.758 9.381 -1.046 1.00 0.00 O ATOM 347 CB ASP A 144 -20.709 11.786 -2.037 1.00 0.00 C ATOM 348 CG ASP A 144 -21.120 11.348 -0.632 1.00 0.00 C ATOM 349 OD1 ASP A 144 -20.565 11.884 0.354 1.00 0.00 O ATOM 350 OD2 ASP A 144 -22.021 10.486 -0.496 1.00 0.00 O ATOM 0 H ASP A 144 -19.755 11.930 -4.312 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.584 11.792 -1.728 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.738 12.873 -2.108 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -21.421 11.400 -2.767 1.00 0.00 H new ATOM 355 N TRP A 145 -19.640 8.955 -3.077 1.00 0.00 N ATOM 356 CA TRP A 145 -19.743 7.518 -2.869 1.00 0.00 C ATOM 357 C TRP A 145 -18.376 6.890 -2.610 1.00 0.00 C ATOM 358 O TRP A 145 -18.277 5.981 -1.787 1.00 0.00 O ATOM 359 CB TRP A 145 -20.471 6.843 -4.041 1.00 0.00 C ATOM 360 CG TRP A 145 -19.825 6.862 -5.397 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.185 7.681 -6.407 1.00 0.00 C ATOM 362 CD2 TRP A 145 -18.816 5.961 -5.962 1.00 0.00 C ATOM 363 NE1 TRP A 145 -19.446 7.386 -7.534 1.00 0.00 N ATOM 364 CE2 TRP A 145 -18.571 6.351 -7.313 1.00 0.00 C ATOM 365 CE3 TRP A 145 -18.112 4.829 -5.493 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -17.629 5.711 -8.130 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -17.209 4.136 -6.323 1.00 0.00 C ATOM 368 CH2 TRP A 145 -16.944 4.594 -7.627 1.00 0.00 C ATOM 0 H TRP A 145 -19.913 9.264 -4.010 1.00 0.00 H new ATOM 0 HA TRP A 145 -20.342 7.352 -1.973 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.640 5.801 -3.770 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -21.451 7.311 -4.135 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -20.939 8.452 -6.343 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -19.538 7.877 -8.423 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.269 4.489 -4.480 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -17.434 6.071 -9.129 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -16.717 3.247 -5.956 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -16.214 4.086 -8.240 1.00 0.00 H new ATOM 379 N GLU A 146 -17.333 7.359 -3.299 1.00 0.00 N ATOM 380 CA GLU A 146 -15.978 6.856 -3.108 1.00 0.00 C ATOM 381 C GLU A 146 -15.470 7.262 -1.727 1.00 0.00 C ATOM 382 O GLU A 146 -15.097 6.410 -0.924 1.00 0.00 O ATOM 383 CB GLU A 146 -15.037 7.399 -4.198 1.00 0.00 C ATOM 384 CG GLU A 146 -15.388 6.870 -5.591 1.00 0.00 C ATOM 385 CD GLU A 146 -14.481 7.421 -6.689 1.00 0.00 C ATOM 386 OE1 GLU A 146 -14.429 8.664 -6.801 1.00 0.00 O ATOM 387 OE2 GLU A 146 -13.884 6.642 -7.472 1.00 0.00 O ATOM 0 H GLU A 146 -17.407 8.095 -4.001 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.995 5.769 -3.182 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.083 8.488 -4.204 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.010 7.125 -3.957 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.323 5.782 -5.587 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.422 7.126 -5.820 1.00 0.00 H new ATOM 394 N ASP A 147 -15.499 8.570 -1.463 1.00 0.00 N ATOM 395 CA ASP A 147 -15.017 9.227 -0.251 1.00 0.00 C ATOM 396 C ASP A 147 -15.655 8.589 0.988 1.00 0.00 C ATOM 397 O ASP A 147 -14.970 8.235 1.945 1.00 0.00 O ATOM 398 CB ASP A 147 -15.396 10.711 -0.375 1.00 0.00 C ATOM 399 CG ASP A 147 -14.797 11.650 0.669 1.00 0.00 C ATOM 400 OD1 ASP A 147 -14.625 11.263 1.842 1.00 0.00 O ATOM 401 OD2 ASP A 147 -14.627 12.855 0.367 1.00 0.00 O ATOM 0 H ASP A 147 -15.883 9.237 -2.132 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.938 9.119 -0.140 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -15.095 11.060 -1.363 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -16.482 10.792 -0.326 1.00 0.00 H new ATOM 406 N ARG A 148 -16.976 8.382 0.953 1.00 0.00 N ATOM 407 CA ARG A 148 -17.757 7.780 2.018 1.00 0.00 C ATOM 408 C ARG A 148 -17.323 6.340 2.255 1.00 0.00 C ATOM 409 O ARG A 148 -17.070 5.975 3.395 1.00 0.00 O ATOM 410 CB ARG A 148 -19.233 7.804 1.589 1.00 0.00 C ATOM 411 CG ARG A 148 -20.162 7.230 2.654 1.00 0.00 C ATOM 412 CD ARG A 148 -21.590 7.195 2.105 1.00 0.00 C ATOM 413 NE ARG A 148 -22.604 7.299 3.164 1.00 0.00 N ATOM 414 CZ ARG A 148 -23.920 7.319 2.934 1.00 0.00 C ATOM 415 NH1 ARG A 148 -24.405 6.910 1.765 1.00 0.00 N ATOM 416 NH2 ARG A 148 -24.750 7.758 3.869 1.00 0.00 N ATOM 0 H ARG A 148 -17.544 8.642 0.147 1.00 0.00 H new ATOM 0 HA ARG A 148 -17.609 8.336 2.943 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.527 8.830 1.370 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.349 7.235 0.666 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.841 6.226 2.932 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -20.121 7.839 3.557 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.724 8.013 1.397 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.741 6.268 1.552 1.00 0.00 H new ATOM 0 HE ARG A 148 -22.284 7.359 4.131 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -23.771 6.579 1.038 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -25.411 6.928 1.596 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -24.384 8.081 4.765 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -25.755 7.773 3.693 1.00 0.00 H new ATOM 430 N TYR A 149 -17.316 5.509 1.212 1.00 0.00 N ATOM 431 CA TYR A 149 -17.007 4.083 1.308 1.00 0.00 C ATOM 432 C TYR A 149 -15.602 3.904 1.858 1.00 0.00 C ATOM 433 O TYR A 149 -15.406 3.100 2.764 1.00 0.00 O ATOM 434 CB TYR A 149 -17.142 3.470 -0.100 1.00 0.00 C ATOM 435 CG TYR A 149 -16.921 1.974 -0.273 1.00 0.00 C ATOM 436 CD1 TYR A 149 -17.973 1.068 -0.044 1.00 0.00 C ATOM 437 CD2 TYR A 149 -15.700 1.486 -0.781 1.00 0.00 C ATOM 438 CE1 TYR A 149 -17.814 -0.301 -0.325 1.00 0.00 C ATOM 439 CE2 TYR A 149 -15.528 0.117 -1.062 1.00 0.00 C ATOM 440 CZ TYR A 149 -16.594 -0.787 -0.846 1.00 0.00 C ATOM 441 OH TYR A 149 -16.464 -2.114 -1.133 1.00 0.00 O ATOM 0 H TYR A 149 -17.528 5.813 0.262 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.695 3.578 1.986 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.143 3.700 -0.466 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.438 3.985 -0.753 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -18.912 1.427 0.351 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -14.885 2.172 -0.957 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -18.630 -0.985 -0.141 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -14.583 -0.242 -1.442 1.00 0.00 H new ATOM 0 HH TYR A 149 -15.565 -2.286 -1.484 1.00 0.00 H new ATOM 451 N TYR A 150 -14.640 4.682 1.366 1.00 0.00 N ATOM 452 CA TYR A 150 -13.303 4.727 1.924 1.00 0.00 C ATOM 453 C TYR A 150 -13.390 5.129 3.403 1.00 0.00 C ATOM 454 O TYR A 150 -12.952 4.356 4.255 1.00 0.00 O ATOM 455 CB TYR A 150 -12.470 5.693 1.065 1.00 0.00 C ATOM 456 CG TYR A 150 -11.035 5.856 1.510 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.035 4.995 1.023 1.00 0.00 C ATOM 458 CD2 TYR A 150 -10.699 6.886 2.405 1.00 0.00 C ATOM 459 CE1 TYR A 150 -8.711 5.123 1.482 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.378 7.025 2.855 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.384 6.133 2.416 1.00 0.00 C ATOM 462 OH TYR A 150 -7.118 6.270 2.885 1.00 0.00 O ATOM 0 H TYR A 150 -14.773 5.299 0.565 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.808 3.756 1.902 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.479 5.340 0.034 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.952 6.671 1.071 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.283 4.235 0.297 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.460 7.572 2.747 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -7.946 4.451 1.122 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.124 7.820 3.541 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.059 7.079 3.435 1.00 0.00 H new ATOM 472 N ARG A 151 -14.014 6.266 3.751 1.00 0.00 N ATOM 473 CA ARG A 151 -14.210 6.638 5.156 1.00 0.00 C ATOM 474 C ARG A 151 -14.860 5.541 6.012 1.00 0.00 C ATOM 475 O ARG A 151 -14.509 5.434 7.190 1.00 0.00 O ATOM 476 CB ARG A 151 -14.975 7.954 5.281 1.00 0.00 C ATOM 477 CG ARG A 151 -13.986 9.109 5.101 1.00 0.00 C ATOM 478 CD ARG A 151 -14.739 10.422 4.898 1.00 0.00 C ATOM 479 NE ARG A 151 -15.333 10.896 6.166 1.00 0.00 N ATOM 480 CZ ARG A 151 -16.605 11.250 6.377 1.00 0.00 C ATOM 481 NH1 ARG A 151 -17.487 11.167 5.398 1.00 0.00 N ATOM 482 NH2 ARG A 151 -17.005 11.679 7.569 1.00 0.00 N ATOM 0 H ARG A 151 -14.388 6.938 3.081 1.00 0.00 H new ATOM 0 HA ARG A 151 -13.207 6.773 5.561 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.762 8.008 4.528 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -15.460 8.019 6.255 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.340 9.184 5.976 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.341 8.915 4.244 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -14.059 11.178 4.506 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -15.524 10.284 4.154 1.00 0.00 H new ATOM 0 HE ARG A 151 -14.704 10.960 6.967 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -17.199 10.832 4.479 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -18.457 11.438 5.561 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -16.338 11.742 8.338 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -17.979 11.946 7.715 1.00 0.00 H new ATOM 496 N GLU A 152 -15.770 4.729 5.476 1.00 0.00 N ATOM 497 CA GLU A 152 -16.288 3.551 6.154 1.00 0.00 C ATOM 498 C GLU A 152 -15.182 2.532 6.350 1.00 0.00 C ATOM 499 O GLU A 152 -14.800 2.280 7.491 1.00 0.00 O ATOM 500 CB GLU A 152 -17.525 2.941 5.471 1.00 0.00 C ATOM 501 CG GLU A 152 -18.797 3.757 5.753 1.00 0.00 C ATOM 502 CD GLU A 152 -20.040 2.865 5.850 1.00 0.00 C ATOM 503 OE1 GLU A 152 -20.206 2.161 6.879 1.00 0.00 O ATOM 504 OE2 GLU A 152 -20.859 2.854 4.910 1.00 0.00 O ATOM 0 H GLU A 152 -16.170 4.876 4.549 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.641 3.875 7.133 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.357 2.890 4.395 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -17.665 1.918 5.820 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.674 4.310 6.684 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -18.939 4.493 4.961 1.00 0.00 H new ATOM 511 N ASN A 153 -14.692 1.925 5.275 1.00 0.00 N ATOM 512 CA ASN A 153 -14.028 0.629 5.337 1.00 0.00 C ATOM 513 C ASN A 153 -12.505 0.680 5.235 1.00 0.00 C ATOM 514 O ASN A 153 -11.876 -0.375 5.320 1.00 0.00 O ATOM 515 CB ASN A 153 -14.642 -0.343 4.319 1.00 0.00 C ATOM 516 CG ASN A 153 -14.698 0.137 2.885 1.00 0.00 C ATOM 517 OD1 ASN A 153 -13.672 0.415 2.282 1.00 0.00 O ATOM 518 ND2 ASN A 153 -15.873 0.156 2.285 1.00 0.00 N ATOM 0 H ASN A 153 -14.744 2.318 4.335 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.213 0.252 6.343 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -14.073 -1.272 4.347 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -15.656 -0.580 4.641 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -15.938 0.406 1.298 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -16.716 -0.080 2.808 1.00 0.00 H new ATOM 525 N MET A 154 -11.887 1.860 5.127 1.00 0.00 N ATOM 526 CA MET A 154 -10.446 1.980 4.881 1.00 0.00 C ATOM 527 C MET A 154 -9.557 1.193 5.845 1.00 0.00 C ATOM 528 O MET A 154 -8.515 0.675 5.445 1.00 0.00 O ATOM 529 CB MET A 154 -9.967 3.430 4.805 1.00 0.00 C ATOM 530 CG MET A 154 -10.154 4.127 6.135 1.00 0.00 C ATOM 531 SD MET A 154 -9.967 5.906 5.971 1.00 0.00 S ATOM 532 CE MET A 154 -11.336 6.341 7.041 1.00 0.00 C ATOM 0 H MET A 154 -12.369 2.756 5.207 1.00 0.00 H new ATOM 0 HA MET A 154 -10.331 1.519 3.900 1.00 0.00 H new ATOM 0 HB2 MET A 154 -8.915 3.456 4.520 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.520 3.961 4.030 1.00 0.00 H new ATOM 0 HG2 MET A 154 -11.143 3.898 6.532 1.00 0.00 H new ATOM 0 HG3 MET A 154 -9.427 3.747 6.853 1.00 0.00 H new ATOM 0 HE1 MET A 154 -11.765 7.289 6.716 1.00 0.00 H new ATOM 0 HE2 MET A 154 -12.097 5.562 6.993 1.00 0.00 H new ATOM 0 HE3 MET A 154 -10.980 6.437 8.067 1.00 0.00 H new ATOM 542 N TYR A 155 -9.961 1.077 7.110 1.00 0.00 N ATOM 543 CA TYR A 155 -9.192 0.403 8.146 1.00 0.00 C ATOM 544 C TYR A 155 -8.963 -1.085 7.835 1.00 0.00 C ATOM 545 O TYR A 155 -8.069 -1.705 8.419 1.00 0.00 O ATOM 546 CB TYR A 155 -9.912 0.596 9.485 1.00 0.00 C ATOM 547 CG TYR A 155 -11.268 -0.083 9.574 1.00 0.00 C ATOM 548 CD1 TYR A 155 -12.443 0.574 9.155 1.00 0.00 C ATOM 549 CD2 TYR A 155 -11.348 -1.387 10.090 1.00 0.00 C ATOM 550 CE1 TYR A 155 -13.697 -0.059 9.268 1.00 0.00 C ATOM 551 CE2 TYR A 155 -12.590 -2.024 10.212 1.00 0.00 C ATOM 552 CZ TYR A 155 -13.768 -1.367 9.806 1.00 0.00 C ATOM 553 OH TYR A 155 -14.951 -2.012 9.990 1.00 0.00 O ATOM 0 H TYR A 155 -10.847 1.456 7.445 1.00 0.00 H new ATOM 0 HA TYR A 155 -8.198 0.847 8.193 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -9.276 0.215 10.284 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -10.042 1.664 9.663 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -12.382 1.571 8.744 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -10.448 -1.901 10.394 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -14.595 0.448 8.947 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -12.644 -3.023 10.619 1.00 0.00 H new ATOM 0 HH TYR A 155 -14.784 -2.900 10.369 1.00 0.00 H new ATOM 563 N ARG A 156 -9.748 -1.659 6.917 1.00 0.00 N ATOM 564 CA ARG A 156 -9.670 -3.056 6.513 1.00 0.00 C ATOM 565 C ARG A 156 -8.582 -3.279 5.457 1.00 0.00 C ATOM 566 O ARG A 156 -8.139 -4.414 5.303 1.00 0.00 O ATOM 567 CB ARG A 156 -11.046 -3.497 5.983 1.00 0.00 C ATOM 568 CG ARG A 156 -12.162 -3.362 7.037 1.00 0.00 C ATOM 569 CD ARG A 156 -13.566 -3.475 6.434 1.00 0.00 C ATOM 570 NE ARG A 156 -13.788 -4.746 5.730 1.00 0.00 N ATOM 571 CZ ARG A 156 -14.071 -5.919 6.300 1.00 0.00 C ATOM 572 NH1 ARG A 156 -14.183 -6.023 7.619 1.00 0.00 N ATOM 573 NH2 ARG A 156 -14.241 -6.975 5.519 1.00 0.00 N ATOM 0 H ARG A 156 -10.476 -1.143 6.423 1.00 0.00 H new ATOM 0 HA ARG A 156 -9.398 -3.660 7.379 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.303 -2.898 5.109 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -10.988 -4.534 5.653 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.034 -4.134 7.796 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.065 -2.401 7.541 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.306 -3.372 7.228 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.725 -2.649 5.741 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.719 -4.730 4.712 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -14.052 -5.201 8.208 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -14.400 -6.925 8.043 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -14.155 -6.880 4.507 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -14.458 -7.883 5.929 1.00 0.00 H new ATOM 587 N TYR A 157 -8.150 -2.246 4.729 1.00 0.00 N ATOM 588 CA TYR A 157 -6.957 -2.293 3.878 1.00 0.00 C ATOM 589 C TYR A 157 -5.705 -2.451 4.772 1.00 0.00 C ATOM 590 O TYR A 157 -5.794 -2.170 5.972 1.00 0.00 O ATOM 591 CB TYR A 157 -6.879 -1.000 3.041 1.00 0.00 C ATOM 592 CG TYR A 157 -8.145 -0.531 2.336 1.00 0.00 C ATOM 593 CD1 TYR A 157 -9.018 -1.446 1.720 1.00 0.00 C ATOM 594 CD2 TYR A 157 -8.433 0.846 2.265 1.00 0.00 C ATOM 595 CE1 TYR A 157 -10.218 -1.001 1.132 1.00 0.00 C ATOM 596 CE2 TYR A 157 -9.598 1.302 1.628 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.526 0.375 1.116 1.00 0.00 C ATOM 598 OH TYR A 157 -11.717 0.821 0.637 1.00 0.00 O ATOM 0 H TYR A 157 -8.624 -1.343 4.713 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.008 -3.143 3.197 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.544 -0.196 3.697 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.106 -1.137 2.285 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -8.767 -2.496 1.698 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -7.751 1.558 2.705 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.902 -1.713 0.694 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -9.782 2.362 1.531 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.446 0.452 1.178 1.00 0.00 H new ATOM 608 N PRO A 158 -4.529 -2.852 4.248 1.00 0.00 N ATOM 609 CA PRO A 158 -3.352 -3.072 5.084 1.00 0.00 C ATOM 610 C PRO A 158 -2.825 -1.758 5.661 1.00 0.00 C ATOM 611 O PRO A 158 -3.212 -0.663 5.238 1.00 0.00 O ATOM 612 CB PRO A 158 -2.310 -3.750 4.189 1.00 0.00 C ATOM 613 CG PRO A 158 -2.703 -3.337 2.777 1.00 0.00 C ATOM 614 CD PRO A 158 -4.211 -3.118 2.853 1.00 0.00 C ATOM 0 HA PRO A 158 -3.593 -3.698 5.943 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.300 -3.420 4.434 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -2.329 -4.833 4.307 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.184 -2.429 2.469 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.450 -4.110 2.052 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.512 -2.282 2.222 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.747 -3.997 2.495 1.00 0.00 H new ATOM 622 N ASN A 159 -1.896 -1.879 6.606 1.00 0.00 N ATOM 623 CA ASN A 159 -1.152 -0.781 7.209 1.00 0.00 C ATOM 624 C ASN A 159 0.299 -0.824 6.762 1.00 0.00 C ATOM 625 O ASN A 159 0.949 0.216 6.752 1.00 0.00 O ATOM 626 CB ASN A 159 -1.128 -0.933 8.736 1.00 0.00 C ATOM 627 CG ASN A 159 -2.473 -0.826 9.413 1.00 0.00 C ATOM 628 OD1 ASN A 159 -3.165 -1.810 9.645 1.00 0.00 O ATOM 629 ND2 ASN A 159 -2.839 0.384 9.778 1.00 0.00 N ATOM 0 H ASN A 159 -1.631 -2.787 6.988 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.637 0.147 6.907 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.691 -1.901 8.982 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -0.468 -0.171 9.151 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -3.722 0.523 10.269 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -2.240 1.183 9.570 1.00 0.00 H new ATOM 636 N GLN A 160 0.841 -2.006 6.477 1.00 0.00 N ATOM 637 CA GLN A 160 2.214 -2.158 6.026 1.00 0.00 C ATOM 638 C GLN A 160 2.210 -2.269 4.503 1.00 0.00 C ATOM 639 O GLN A 160 1.166 -2.526 3.891 1.00 0.00 O ATOM 640 CB GLN A 160 2.843 -3.416 6.648 1.00 0.00 C ATOM 641 CG GLN A 160 2.679 -3.559 8.167 1.00 0.00 C ATOM 642 CD GLN A 160 3.262 -4.871 8.680 1.00 0.00 C ATOM 643 OE1 GLN A 160 2.645 -5.926 8.569 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.467 -4.836 9.229 1.00 0.00 N ATOM 0 H GLN A 160 0.334 -2.887 6.554 1.00 0.00 H new ATOM 0 HA GLN A 160 2.805 -1.296 6.336 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.407 -4.293 6.170 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.907 -3.422 6.414 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.171 -2.724 8.666 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.621 -3.506 8.425 1.00 0.00 H new ATOM 0 HE21 GLN A 160 4.964 -3.949 9.312 1.00 0.00 H new ATOM 0 HE22 GLN A 160 4.898 -5.696 9.568 1.00 0.00 H new ATOM 653 N VAL A 161 3.385 -2.170 3.893 1.00 0.00 N ATOM 654 CA VAL A 161 3.610 -2.498 2.490 1.00 0.00 C ATOM 655 C VAL A 161 4.902 -3.304 2.400 1.00 0.00 C ATOM 656 O VAL A 161 5.773 -3.170 3.266 1.00 0.00 O ATOM 657 CB VAL A 161 3.642 -1.220 1.616 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.341 -0.405 1.721 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.808 -0.275 1.949 1.00 0.00 C ATOM 0 H VAL A 161 4.228 -1.852 4.371 1.00 0.00 H new ATOM 0 HA VAL A 161 2.789 -3.099 2.100 1.00 0.00 H new ATOM 0 HB VAL A 161 3.770 -1.601 0.603 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.414 0.481 1.090 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.501 -1.017 1.392 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.185 -0.101 2.756 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.766 0.598 1.298 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.732 0.044 2.989 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.753 -0.796 1.797 1.00 0.00 H new ATOM 669 N TYR A 162 5.034 -4.137 1.371 1.00 0.00 N ATOM 670 CA TYR A 162 6.335 -4.659 0.976 1.00 0.00 C ATOM 671 C TYR A 162 7.108 -3.601 0.180 1.00 0.00 C ATOM 672 O TYR A 162 6.493 -2.689 -0.367 1.00 0.00 O ATOM 673 CB TYR A 162 6.137 -5.925 0.148 1.00 0.00 C ATOM 674 CG TYR A 162 5.640 -7.107 0.955 1.00 0.00 C ATOM 675 CD1 TYR A 162 6.573 -7.960 1.572 1.00 0.00 C ATOM 676 CD2 TYR A 162 4.262 -7.343 1.121 1.00 0.00 C ATOM 677 CE1 TYR A 162 6.142 -8.993 2.418 1.00 0.00 C ATOM 678 CE2 TYR A 162 3.819 -8.424 1.900 1.00 0.00 C ATOM 679 CZ TYR A 162 4.760 -9.236 2.572 1.00 0.00 C ATOM 680 OH TYR A 162 4.347 -10.218 3.411 1.00 0.00 O ATOM 0 H TYR A 162 4.256 -4.463 0.798 1.00 0.00 H new ATOM 0 HA TYR A 162 6.918 -4.905 1.864 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.427 -5.718 -0.652 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.082 -6.191 -0.325 1.00 0.00 H new ATOM 0 HD1 TYR A 162 7.629 -7.819 1.393 1.00 0.00 H new ATOM 0 HD2 TYR A 162 3.543 -6.690 0.648 1.00 0.00 H new ATOM 0 HE1 TYR A 162 6.863 -9.598 2.948 1.00 0.00 H new ATOM 0 HE2 TYR A 162 2.763 -8.634 1.985 1.00 0.00 H new ATOM 0 HH TYR A 162 3.368 -10.260 3.408 1.00 0.00 H new ATOM 690 N TYR A 163 8.430 -3.741 0.034 1.00 0.00 N ATOM 691 CA TYR A 163 9.224 -2.916 -0.875 1.00 0.00 C ATOM 692 C TYR A 163 10.484 -3.637 -1.335 1.00 0.00 C ATOM 693 O TYR A 163 11.030 -4.433 -0.578 1.00 0.00 O ATOM 694 CB TYR A 163 9.593 -1.591 -0.190 1.00 0.00 C ATOM 695 CG TYR A 163 10.451 -1.659 1.061 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.850 -1.717 2.332 1.00 0.00 C ATOM 697 CD2 TYR A 163 11.848 -1.532 0.958 1.00 0.00 C ATOM 698 CE1 TYR A 163 10.643 -1.699 3.494 1.00 0.00 C ATOM 699 CE2 TYR A 163 12.650 -1.500 2.108 1.00 0.00 C ATOM 700 CZ TYR A 163 12.050 -1.591 3.380 1.00 0.00 C ATOM 701 OH TYR A 163 12.830 -1.503 4.488 1.00 0.00 O ATOM 0 H TYR A 163 8.978 -4.432 0.546 1.00 0.00 H new ATOM 0 HA TYR A 163 8.619 -2.713 -1.759 1.00 0.00 H new ATOM 0 HB2 TYR A 163 10.112 -0.969 -0.919 1.00 0.00 H new ATOM 0 HB3 TYR A 163 8.667 -1.076 0.066 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.775 -1.776 2.416 1.00 0.00 H new ATOM 0 HD2 TYR A 163 12.308 -1.458 -0.017 1.00 0.00 H new ATOM 0 HE1 TYR A 163 10.181 -1.767 4.468 1.00 0.00 H new ATOM 0 HE2 TYR A 163 13.722 -1.406 2.019 1.00 0.00 H new ATOM 0 HH TYR A 163 13.164 -0.586 4.581 1.00 0.00 H new ATOM 711 N ARG A 164 11.008 -3.344 -2.530 1.00 0.00 N ATOM 712 CA ARG A 164 12.387 -3.742 -2.854 1.00 0.00 C ATOM 713 C ARG A 164 13.334 -2.681 -2.316 1.00 0.00 C ATOM 714 O ARG A 164 12.964 -1.505 -2.316 1.00 0.00 O ATOM 715 CB ARG A 164 12.617 -3.914 -4.360 1.00 0.00 C ATOM 716 CG ARG A 164 11.942 -5.198 -4.834 1.00 0.00 C ATOM 717 CD ARG A 164 12.144 -5.444 -6.333 1.00 0.00 C ATOM 718 NE ARG A 164 13.192 -6.443 -6.591 1.00 0.00 N ATOM 719 CZ ARG A 164 13.665 -6.776 -7.800 1.00 0.00 C ATOM 720 NH1 ARG A 164 13.302 -6.121 -8.902 1.00 0.00 N ATOM 721 NH2 ARG A 164 14.580 -7.728 -7.889 1.00 0.00 N ATOM 0 H ARG A 164 10.516 -2.847 -3.272 1.00 0.00 H new ATOM 0 HA ARG A 164 12.573 -4.711 -2.392 1.00 0.00 H new ATOM 0 HB2 ARG A 164 12.214 -3.058 -4.900 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.685 -3.952 -4.574 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.340 -6.043 -4.273 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.875 -5.146 -4.617 1.00 0.00 H new ATOM 0 HD2 ARG A 164 11.206 -5.780 -6.775 1.00 0.00 H new ATOM 0 HD3 ARG A 164 12.409 -4.506 -6.822 1.00 0.00 H new ATOM 0 HE ARG A 164 13.592 -6.922 -5.784 1.00 0.00 H new ATOM 0 HH11 ARG A 164 12.646 -5.342 -8.840 1.00 0.00 H new ATOM 0 HH12 ARG A 164 13.680 -6.399 -9.808 1.00 0.00 H new ATOM 0 HH21 ARG A 164 14.914 -8.195 -7.046 1.00 0.00 H new ATOM 0 HH22 ARG A 164 14.951 -7.995 -8.801 1.00 0.00 H new ATOM 735 N PRO A 165 14.562 -3.046 -1.922 1.00 0.00 N ATOM 736 CA PRO A 165 15.542 -2.075 -1.485 1.00 0.00 C ATOM 737 C PRO A 165 15.825 -1.108 -2.636 1.00 0.00 C ATOM 738 O PRO A 165 16.068 -1.524 -3.777 1.00 0.00 O ATOM 739 CB PRO A 165 16.778 -2.863 -1.034 1.00 0.00 C ATOM 740 CG PRO A 165 16.533 -4.318 -1.445 1.00 0.00 C ATOM 741 CD PRO A 165 15.149 -4.360 -2.082 1.00 0.00 C ATOM 0 HA PRO A 165 15.197 -1.467 -0.649 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.681 -2.473 -1.504 1.00 0.00 H new ATOM 0 HB3 PRO A 165 16.919 -2.782 0.044 1.00 0.00 H new ATOM 0 HG2 PRO A 165 17.294 -4.656 -2.148 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.582 -4.979 -0.580 1.00 0.00 H new ATOM 0 HD2 PRO A 165 15.219 -4.624 -3.137 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.529 -5.119 -1.605 1.00 0.00 H new ATOM 749 N VAL A 166 15.755 0.189 -2.350 1.00 0.00 N ATOM 750 CA VAL A 166 16.169 1.238 -3.264 1.00 0.00 C ATOM 751 C VAL A 166 17.679 1.134 -3.419 1.00 0.00 C ATOM 752 O VAL A 166 18.417 1.451 -2.493 1.00 0.00 O ATOM 753 CB VAL A 166 15.740 2.642 -2.777 1.00 0.00 C ATOM 754 CG1 VAL A 166 14.424 3.036 -3.451 1.00 0.00 C ATOM 755 CG2 VAL A 166 15.587 2.776 -1.257 1.00 0.00 C ATOM 0 H VAL A 166 15.402 0.542 -1.460 1.00 0.00 H new ATOM 0 HA VAL A 166 15.677 1.105 -4.228 1.00 0.00 H new ATOM 0 HB VAL A 166 16.553 3.312 -3.058 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.121 4.025 -3.108 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.560 3.053 -4.532 1.00 0.00 H new ATOM 0 HG13 VAL A 166 13.652 2.311 -3.193 1.00 0.00 H new ATOM 0 HG21 VAL A 166 15.284 3.794 -1.010 1.00 0.00 H new ATOM 0 HG22 VAL A 166 14.829 2.076 -0.904 1.00 0.00 H new ATOM 0 HG23 VAL A 166 16.539 2.554 -0.775 1.00 0.00 H new ATOM 765 N ASP A 167 18.114 0.646 -4.577 1.00 0.00 N ATOM 766 CA ASP A 167 19.447 0.881 -5.118 1.00 0.00 C ATOM 767 C ASP A 167 19.390 0.642 -6.623 1.00 0.00 C ATOM 768 O ASP A 167 19.839 1.490 -7.386 1.00 0.00 O ATOM 769 CB ASP A 167 20.515 -0.028 -4.487 1.00 0.00 C ATOM 770 CG ASP A 167 21.258 0.570 -3.289 1.00 0.00 C ATOM 771 OD1 ASP A 167 21.265 1.805 -3.067 1.00 0.00 O ATOM 772 OD2 ASP A 167 21.897 -0.229 -2.574 1.00 0.00 O ATOM 0 H ASP A 167 17.534 0.062 -5.179 1.00 0.00 H new ATOM 0 HA ASP A 167 19.737 1.906 -4.886 1.00 0.00 H new ATOM 0 HB2 ASP A 167 20.038 -0.956 -4.172 1.00 0.00 H new ATOM 0 HB3 ASP A 167 21.245 -0.289 -5.253 1.00 0.00 H new ATOM 777 N GLN A 168 18.788 -0.463 -7.088 1.00 0.00 N ATOM 778 CA GLN A 168 18.788 -0.820 -8.512 1.00 0.00 C ATOM 779 C GLN A 168 17.540 -0.364 -9.275 1.00 0.00 C ATOM 780 O GLN A 168 17.586 -0.290 -10.506 1.00 0.00 O ATOM 781 CB GLN A 168 18.931 -2.337 -8.684 1.00 0.00 C ATOM 782 CG GLN A 168 20.340 -2.862 -8.407 1.00 0.00 C ATOM 783 CD GLN A 168 20.435 -3.513 -7.042 1.00 0.00 C ATOM 784 OE1 GLN A 168 20.980 -2.813 -6.066 1.00 0.00 O flip ATOM 785 NE2 GLN A 168 19.990 -4.644 -6.863 1.00 0.00 N flip ATOM 0 H GLN A 168 18.293 -1.127 -6.493 1.00 0.00 H new ATOM 0 HA GLN A 168 19.640 -0.290 -8.937 1.00 0.00 H new ATOM 0 HB2 GLN A 168 18.230 -2.836 -8.015 1.00 0.00 H new ATOM 0 HB3 GLN A 168 18.647 -2.606 -9.702 1.00 0.00 H new ATOM 0 HG2 GLN A 168 20.617 -3.584 -9.175 1.00 0.00 H new ATOM 0 HG3 GLN A 168 21.054 -2.040 -8.469 1.00 0.00 H new ATOM 0 HE21 GLN A 168 19.575 -5.158 -7.640 1.00 0.00 H new ATOM 0 HE22 GLN A 168 20.036 -5.069 -5.937 1.00 0.00 H new ATOM 794 N ALA A 169 16.428 -0.083 -8.593 1.00 0.00 N ATOM 795 CA ALA A 169 15.142 0.255 -9.208 1.00 0.00 C ATOM 796 C ALA A 169 14.561 1.533 -8.598 1.00 0.00 C ATOM 797 O ALA A 169 13.358 1.585 -8.329 1.00 0.00 O ATOM 798 CB ALA A 169 14.174 -0.932 -9.097 1.00 0.00 C ATOM 0 H ALA A 169 16.395 -0.084 -7.574 1.00 0.00 H new ATOM 0 HA ALA A 169 15.299 0.456 -10.268 1.00 0.00 H new ATOM 0 HB1 ALA A 169 13.222 -0.669 -9.557 1.00 0.00 H new ATOM 0 HB2 ALA A 169 14.598 -1.796 -9.608 1.00 0.00 H new ATOM 0 HB3 ALA A 169 14.014 -1.174 -8.046 1.00 0.00 H new ATOM 804 N SER A 170 15.393 2.546 -8.333 1.00 0.00 N ATOM 805 CA SER A 170 14.937 3.825 -7.843 1.00 0.00 C ATOM 806 C SER A 170 14.195 4.573 -8.944 1.00 0.00 C ATOM 807 O SER A 170 14.767 5.086 -9.905 1.00 0.00 O ATOM 808 CB SER A 170 15.993 4.632 -7.099 1.00 0.00 C ATOM 809 OG SER A 170 17.259 4.699 -7.733 1.00 0.00 O ATOM 0 H SER A 170 16.404 2.488 -8.457 1.00 0.00 H new ATOM 0 HA SER A 170 14.214 3.639 -7.049 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.620 5.647 -6.959 1.00 0.00 H new ATOM 0 HB3 SER A 170 16.124 4.201 -6.106 1.00 0.00 H new ATOM 0 HG SER A 170 17.870 5.236 -7.187 1.00 0.00 H new ATOM 815 N ASN A 171 12.881 4.525 -8.820 1.00 0.00 N ATOM 816 CA ASN A 171 11.865 5.244 -9.586 1.00 0.00 C ATOM 817 C ASN A 171 10.673 5.529 -8.667 1.00 0.00 C ATOM 818 O ASN A 171 10.510 4.861 -7.647 1.00 0.00 O ATOM 819 CB ASN A 171 11.410 4.340 -10.738 1.00 0.00 C ATOM 820 CG ASN A 171 10.514 4.965 -11.799 1.00 0.00 C ATOM 821 OD1 ASN A 171 10.152 6.135 -11.760 1.00 0.00 O ATOM 822 ND2 ASN A 171 10.027 4.168 -12.728 1.00 0.00 N ATOM 0 H ASN A 171 12.452 3.926 -8.115 1.00 0.00 H new ATOM 0 HA ASN A 171 12.262 6.181 -9.976 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.299 3.950 -11.233 1.00 0.00 H new ATOM 0 HB3 ASN A 171 10.883 3.487 -10.311 1.00 0.00 H new ATOM 0 HD21 ASN A 171 9.355 4.526 -13.406 1.00 0.00 H new ATOM 0 HD22 ASN A 171 10.322 3.192 -12.769 1.00 0.00 H new ATOM 829 N GLN A 172 9.767 6.415 -9.073 1.00 0.00 N ATOM 830 CA GLN A 172 8.497 6.676 -8.400 1.00 0.00 C ATOM 831 C GLN A 172 7.345 5.980 -9.125 1.00 0.00 C ATOM 832 O GLN A 172 6.254 5.914 -8.578 1.00 0.00 O ATOM 833 CB GLN A 172 8.255 8.190 -8.298 1.00 0.00 C ATOM 834 CG GLN A 172 7.062 8.566 -7.382 1.00 0.00 C ATOM 835 CD GLN A 172 7.192 9.940 -6.714 1.00 0.00 C ATOM 836 OE1 GLN A 172 8.106 10.708 -6.979 1.00 0.00 O ATOM 837 NE2 GLN A 172 6.287 10.298 -5.814 1.00 0.00 N ATOM 0 H GLN A 172 9.901 6.989 -9.905 1.00 0.00 H new ATOM 0 HA GLN A 172 8.545 6.268 -7.391 1.00 0.00 H new ATOM 0 HB2 GLN A 172 9.158 8.669 -7.920 1.00 0.00 H new ATOM 0 HB3 GLN A 172 8.076 8.589 -9.296 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.145 8.546 -7.971 1.00 0.00 H new ATOM 0 HG3 GLN A 172 6.959 7.806 -6.607 1.00 0.00 H new ATOM 0 HE21 GLN A 172 5.519 9.667 -5.584 1.00 0.00 H new ATOM 0 HE22 GLN A 172 6.358 11.205 -5.352 1.00 0.00 H new ATOM 846 N ASN A 173 7.558 5.446 -10.331 1.00 0.00 N ATOM 847 CA ASN A 173 6.578 4.593 -10.982 1.00 0.00 C ATOM 848 C ASN A 173 6.779 3.167 -10.496 1.00 0.00 C ATOM 849 O ASN A 173 5.914 2.630 -9.814 1.00 0.00 O ATOM 850 CB ASN A 173 6.703 4.652 -12.507 1.00 0.00 C ATOM 851 CG ASN A 173 5.531 5.365 -13.152 1.00 0.00 C ATOM 852 OD1 ASN A 173 4.394 4.899 -13.110 1.00 0.00 O ATOM 853 ND2 ASN A 173 5.814 6.478 -13.793 1.00 0.00 N ATOM 0 H ASN A 173 8.409 5.595 -10.874 1.00 0.00 H new ATOM 0 HA ASN A 173 5.579 4.945 -10.725 1.00 0.00 H new ATOM 0 HB2 ASN A 173 7.628 5.163 -12.774 1.00 0.00 H new ATOM 0 HB3 ASN A 173 6.772 3.639 -12.903 1.00 0.00 H new ATOM 0 HD21 ASN A 173 5.077 6.988 -14.279 1.00 0.00 H new ATOM 0 HD22 ASN A 173 6.771 6.831 -13.804 1.00 0.00 H new ATOM 860 N ASN A 174 7.904 2.530 -10.863 1.00 0.00 N ATOM 861 CA ASN A 174 8.012 1.086 -10.734 1.00 0.00 C ATOM 862 C ASN A 174 8.022 0.639 -9.282 1.00 0.00 C ATOM 863 O ASN A 174 7.406 -0.369 -8.962 1.00 0.00 O ATOM 864 CB ASN A 174 9.202 0.523 -11.519 1.00 0.00 C ATOM 865 CG ASN A 174 10.594 1.046 -11.205 1.00 0.00 C ATOM 866 OD1 ASN A 174 11.209 1.671 -12.064 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.113 0.893 -10.003 1.00 0.00 N ATOM 0 H ASN A 174 8.731 2.991 -11.243 1.00 0.00 H new ATOM 0 HA ASN A 174 7.113 0.665 -11.184 1.00 0.00 H new ATOM 0 HB2 ASN A 174 9.214 -0.557 -11.373 1.00 0.00 H new ATOM 0 HB3 ASN A 174 9.013 0.699 -12.578 1.00 0.00 H new ATOM 0 HD21 ASN A 174 12.026 1.294 -9.787 1.00 0.00 H new ATOM 0 HD22 ASN A 174 10.602 0.374 -9.289 1.00 0.00 H new ATOM 874 N PHE A 175 8.674 1.406 -8.409 1.00 0.00 N ATOM 875 CA PHE A 175 8.708 1.131 -6.981 1.00 0.00 C ATOM 876 C PHE A 175 7.273 1.113 -6.453 1.00 0.00 C ATOM 877 O PHE A 175 6.816 0.113 -5.916 1.00 0.00 O ATOM 878 CB PHE A 175 9.595 2.181 -6.288 1.00 0.00 C ATOM 879 CG PHE A 175 9.821 1.974 -4.803 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.844 2.390 -3.882 1.00 0.00 C ATOM 881 CD2 PHE A 175 11.025 1.416 -4.329 1.00 0.00 C ATOM 882 CE1 PHE A 175 9.072 2.248 -2.504 1.00 0.00 C ATOM 883 CE2 PHE A 175 11.239 1.263 -2.950 1.00 0.00 C ATOM 884 CZ PHE A 175 10.273 1.698 -2.036 1.00 0.00 C ATOM 0 H PHE A 175 9.196 2.240 -8.679 1.00 0.00 H new ATOM 0 HA PHE A 175 9.146 0.155 -6.770 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.565 2.196 -6.786 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.146 3.163 -6.435 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.918 2.819 -4.235 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.786 1.105 -5.029 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.317 2.565 -1.800 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.152 0.808 -2.594 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.452 1.610 -0.975 1.00 0.00 H new ATOM 894 N VAL A 176 6.557 2.218 -6.645 1.00 0.00 N ATOM 895 CA VAL A 176 5.214 2.455 -6.142 1.00 0.00 C ATOM 896 C VAL A 176 4.229 1.418 -6.699 1.00 0.00 C ATOM 897 O VAL A 176 3.442 0.861 -5.939 1.00 0.00 O ATOM 898 CB VAL A 176 4.855 3.911 -6.501 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.419 4.312 -6.149 1.00 0.00 C ATOM 900 CG2 VAL A 176 5.795 4.875 -5.740 1.00 0.00 C ATOM 0 H VAL A 176 6.918 3.007 -7.181 1.00 0.00 H new ATOM 0 HA VAL A 176 5.157 2.334 -5.060 1.00 0.00 H new ATOM 0 HB VAL A 176 4.965 3.978 -7.583 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.251 5.350 -6.435 1.00 0.00 H new ATOM 0 HG12 VAL A 176 2.720 3.670 -6.686 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.263 4.201 -5.076 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.542 5.905 -5.993 1.00 0.00 H new ATOM 0 HG22 VAL A 176 5.678 4.726 -4.667 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.828 4.675 -6.023 1.00 0.00 H new ATOM 910 N HIS A 177 4.279 1.141 -8.002 1.00 0.00 N ATOM 911 CA HIS A 177 3.339 0.257 -8.667 1.00 0.00 C ATOM 912 C HIS A 177 3.576 -1.172 -8.199 1.00 0.00 C ATOM 913 O HIS A 177 2.644 -1.832 -7.752 1.00 0.00 O ATOM 914 CB HIS A 177 3.501 0.408 -10.186 1.00 0.00 C ATOM 915 CG HIS A 177 2.467 -0.272 -11.058 1.00 0.00 C ATOM 916 ND1 HIS A 177 2.150 0.097 -12.346 1.00 0.00 N ATOM 917 CD2 HIS A 177 1.694 -1.362 -10.760 1.00 0.00 C ATOM 918 CE1 HIS A 177 1.229 -0.757 -12.815 1.00 0.00 C ATOM 919 NE2 HIS A 177 0.975 -1.711 -11.905 1.00 0.00 N ATOM 0 H HIS A 177 4.984 1.532 -8.627 1.00 0.00 H new ATOM 0 HA HIS A 177 2.312 0.519 -8.414 1.00 0.00 H new ATOM 0 HB2 HIS A 177 3.497 1.472 -10.423 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.483 0.023 -10.462 1.00 0.00 H new ATOM 0 HD2 HIS A 177 1.648 -1.865 -9.805 1.00 0.00 H new ATOM 0 HE1 HIS A 177 0.759 -0.688 -13.785 1.00 0.00 H new ATOM 0 HE2 HIS A 177 0.376 -2.528 -12.026 1.00 0.00 H new ATOM 927 N ASP A 178 4.802 -1.684 -8.314 1.00 0.00 N ATOM 928 CA ASP A 178 5.080 -3.066 -7.943 1.00 0.00 C ATOM 929 C ASP A 178 4.822 -3.281 -6.450 1.00 0.00 C ATOM 930 O ASP A 178 4.344 -4.340 -6.064 1.00 0.00 O ATOM 931 CB ASP A 178 6.508 -3.460 -8.344 1.00 0.00 C ATOM 932 CG ASP A 178 6.634 -4.869 -8.943 1.00 0.00 C ATOM 933 OD1 ASP A 178 5.633 -5.617 -9.052 1.00 0.00 O ATOM 934 OD2 ASP A 178 7.724 -5.178 -9.478 1.00 0.00 O ATOM 0 H ASP A 178 5.610 -1.165 -8.658 1.00 0.00 H new ATOM 0 HA ASP A 178 4.401 -3.721 -8.489 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.882 -2.736 -9.068 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.150 -3.393 -7.466 1.00 0.00 H new ATOM 939 N CYS A 179 5.056 -2.256 -5.623 1.00 0.00 N ATOM 940 CA CYS A 179 4.678 -2.206 -4.210 1.00 0.00 C ATOM 941 C CYS A 179 3.165 -2.375 -4.014 1.00 0.00 C ATOM 942 O CYS A 179 2.753 -3.227 -3.219 1.00 0.00 O ATOM 943 CB CYS A 179 5.193 -0.897 -3.601 1.00 0.00 C ATOM 944 SG CYS A 179 4.782 -0.569 -1.873 1.00 0.00 S ATOM 0 H CYS A 179 5.531 -1.408 -5.933 1.00 0.00 H new ATOM 0 HA CYS A 179 5.141 -3.045 -3.690 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.279 -0.884 -3.698 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.810 -0.072 -4.201 1.00 0.00 H new ATOM 949 N VAL A 180 2.339 -1.599 -4.726 1.00 0.00 N ATOM 950 CA VAL A 180 0.883 -1.755 -4.763 1.00 0.00 C ATOM 951 C VAL A 180 0.544 -3.182 -5.164 1.00 0.00 C ATOM 952 O VAL A 180 -0.053 -3.892 -4.358 1.00 0.00 O ATOM 953 CB VAL A 180 0.241 -0.650 -5.637 1.00 0.00 C ATOM 954 CG1 VAL A 180 -1.220 -0.930 -6.010 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.242 0.679 -4.874 1.00 0.00 C ATOM 0 H VAL A 180 2.673 -0.829 -5.305 1.00 0.00 H new ATOM 0 HA VAL A 180 0.445 -1.610 -3.776 1.00 0.00 H new ATOM 0 HB VAL A 180 0.839 -0.618 -6.548 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.602 -0.113 -6.622 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.280 -1.863 -6.571 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.818 -1.013 -5.102 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.211 1.454 -5.493 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.330 0.570 -3.953 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.267 0.960 -4.633 1.00 0.00 H new ATOM 965 N ASN A 181 0.968 -3.621 -6.350 1.00 0.00 N ATOM 966 CA ASN A 181 0.738 -4.954 -6.894 1.00 0.00 C ATOM 967 C ASN A 181 0.994 -6.019 -5.849 1.00 0.00 C ATOM 968 O ASN A 181 0.112 -6.836 -5.595 1.00 0.00 O ATOM 969 CB ASN A 181 1.644 -5.237 -8.103 1.00 0.00 C ATOM 970 CG ASN A 181 1.141 -4.609 -9.386 1.00 0.00 C ATOM 971 OD1 ASN A 181 -0.044 -4.337 -9.540 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.011 -4.389 -10.352 1.00 0.00 N ATOM 0 H ASN A 181 1.505 -3.028 -6.983 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.305 -4.984 -7.209 1.00 0.00 H new ATOM 0 HB2 ASN A 181 2.647 -4.864 -7.893 1.00 0.00 H new ATOM 0 HB3 ASN A 181 1.727 -6.315 -8.242 1.00 0.00 H new ATOM 0 HD21 ASN A 181 1.700 -3.989 -11.237 1.00 0.00 H new ATOM 0 HD22 ASN A 181 2.995 -4.619 -10.214 1.00 0.00 H new ATOM 979 N ILE A 182 2.193 -6.022 -5.273 1.00 0.00 N ATOM 980 CA ILE A 182 2.638 -6.990 -4.295 1.00 0.00 C ATOM 981 C ILE A 182 1.773 -6.930 -3.040 1.00 0.00 C ATOM 982 O ILE A 182 1.235 -7.951 -2.629 1.00 0.00 O ATOM 983 CB ILE A 182 4.152 -6.771 -4.033 1.00 0.00 C ATOM 984 CG1 ILE A 182 5.086 -7.477 -5.046 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.586 -7.260 -2.662 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.634 -8.866 -5.506 1.00 0.00 C ATOM 0 H ILE A 182 2.902 -5.321 -5.488 1.00 0.00 H new ATOM 0 HA ILE A 182 2.518 -8.006 -4.672 1.00 0.00 H new ATOM 0 HB ILE A 182 4.254 -5.690 -4.127 1.00 0.00 H new ATOM 0 HG12 ILE A 182 5.189 -6.839 -5.924 1.00 0.00 H new ATOM 0 HG13 ILE A 182 6.076 -7.566 -4.599 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.654 -7.082 -2.533 1.00 0.00 H new ATOM 0 HG22 ILE A 182 4.033 -6.722 -1.892 1.00 0.00 H new ATOM 0 HG23 ILE A 182 4.383 -8.328 -2.576 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.359 -9.269 -6.213 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.561 -9.529 -4.644 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.660 -8.790 -5.989 1.00 0.00 H new ATOM 998 N THR A 183 1.638 -5.774 -2.402 1.00 0.00 N ATOM 999 CA THR A 183 0.973 -5.676 -1.112 1.00 0.00 C ATOM 1000 C THR A 183 -0.496 -6.086 -1.280 1.00 0.00 C ATOM 1001 O THR A 183 -1.024 -6.862 -0.478 1.00 0.00 O ATOM 1002 CB THR A 183 1.170 -4.256 -0.567 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.551 -3.927 -0.541 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.617 -4.104 0.847 1.00 0.00 C ATOM 0 H THR A 183 1.984 -4.885 -2.762 1.00 0.00 H new ATOM 0 HA THR A 183 1.400 -6.356 -0.375 1.00 0.00 H new ATOM 0 HB THR A 183 0.626 -3.585 -1.232 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.833 -3.627 -1.430 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.778 -3.083 1.193 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.451 -4.322 0.845 1.00 0.00 H new ATOM 0 HG23 THR A 183 1.128 -4.798 1.514 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.118 -5.670 -2.386 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.395 -6.172 -2.852 1.00 0.00 C ATOM 1014 C ILE A 184 -2.323 -7.696 -2.985 1.00 0.00 C ATOM 1015 O ILE A 184 -3.127 -8.364 -2.346 1.00 0.00 O ATOM 1016 CB ILE A 184 -2.814 -5.411 -4.129 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.275 -3.995 -3.721 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -3.928 -6.103 -4.906 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.758 -3.107 -4.867 1.00 0.00 C ATOM 0 H ILE A 184 -0.727 -4.951 -2.995 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.192 -5.983 -2.133 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.949 -5.377 -4.792 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.081 -4.089 -2.993 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.448 -3.493 -3.219 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.174 -5.516 -5.791 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.597 -7.096 -5.210 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -4.811 -6.193 -4.274 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.058 -2.136 -4.473 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.952 -2.973 -5.588 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.609 -3.578 -5.359 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.369 -8.290 -3.708 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.195 -9.734 -3.844 1.00 0.00 C ATOM 1033 C LYS A 185 -0.960 -10.442 -2.502 1.00 0.00 C ATOM 1034 O LYS A 185 -0.941 -11.667 -2.446 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.027 -9.987 -4.810 1.00 0.00 C ATOM 1036 CG LYS A 185 0.026 -11.427 -5.323 1.00 0.00 C ATOM 1037 CD LYS A 185 -0.227 -11.566 -6.833 1.00 0.00 C ATOM 1038 CE LYS A 185 1.116 -11.767 -7.534 1.00 0.00 C ATOM 1039 NZ LYS A 185 1.121 -11.342 -8.946 1.00 0.00 N ATOM 0 H LYS A 185 -0.674 -7.758 -4.232 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.119 -10.156 -4.238 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.112 -9.308 -5.659 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.911 -9.752 -4.306 1.00 0.00 H new ATOM 0 HG2 LYS A 185 1.004 -11.849 -5.089 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.714 -12.020 -4.786 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -0.887 -12.411 -7.030 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -0.725 -10.676 -7.217 1.00 0.00 H new ATOM 0 HE2 LYS A 185 1.883 -11.212 -6.995 1.00 0.00 H new ATOM 0 HE3 LYS A 185 1.389 -12.821 -7.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 2.063 -11.508 -9.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 0.412 -11.889 -9.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 0.892 -10.329 -9.005 1.00 0.00 H new ATOM 1053 N GLN A 186 -0.788 -9.743 -1.387 1.00 0.00 N ATOM 1054 CA GLN A 186 -0.770 -10.325 -0.072 1.00 0.00 C ATOM 1055 C GLN A 186 -2.118 -10.100 0.606 1.00 0.00 C ATOM 1056 O GLN A 186 -2.658 -11.059 1.141 1.00 0.00 O ATOM 1057 CB GLN A 186 0.475 -9.807 0.665 1.00 0.00 C ATOM 1058 CG GLN A 186 1.690 -10.651 0.244 1.00 0.00 C ATOM 1059 CD GLN A 186 2.455 -10.169 -0.968 1.00 0.00 C ATOM 1060 OE1 GLN A 186 3.318 -9.327 -0.847 1.00 0.00 O ATOM 1061 NE2 GLN A 186 2.222 -10.741 -2.140 1.00 0.00 N ATOM 0 H GLN A 186 -0.655 -8.732 -1.384 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.665 -11.410 -0.084 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.645 -8.757 0.427 1.00 0.00 H new ATOM 0 HB3 GLN A 186 0.328 -9.869 1.743 1.00 0.00 H new ATOM 0 HG2 GLN A 186 2.380 -10.701 1.086 1.00 0.00 H new ATOM 0 HG3 GLN A 186 1.349 -11.668 0.051 1.00 0.00 H new ATOM 0 HE21 GLN A 186 1.492 -11.448 -2.226 1.00 0.00 H new ATOM 0 HE22 GLN A 186 2.773 -10.474 -2.956 1.00 0.00 H new ATOM 1070 N HIS A 187 -2.772 -8.947 0.479 1.00 0.00 N ATOM 1071 CA HIS A 187 -4.115 -8.782 1.033 1.00 0.00 C ATOM 1072 C HIS A 187 -5.175 -9.560 0.230 1.00 0.00 C ATOM 1073 O HIS A 187 -6.278 -9.823 0.707 1.00 0.00 O ATOM 1074 CB HIS A 187 -4.448 -7.290 1.181 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.587 -6.892 2.632 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -5.660 -6.250 3.210 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -3.691 -7.173 3.629 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -5.409 -6.137 4.526 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -4.232 -6.707 4.829 1.00 0.00 N ATOM 0 H HIS A 187 -2.401 -8.124 0.005 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.132 -9.221 2.031 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -3.665 -6.694 0.713 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.375 -7.069 0.652 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -6.495 -5.920 2.726 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -2.738 -7.666 3.509 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -6.062 -5.656 5.239 1.00 0.00 H new ATOM 1087 N THR A 188 -4.830 -10.030 -0.962 1.00 0.00 N ATOM 1088 CA THR A 188 -5.746 -10.672 -1.898 1.00 0.00 C ATOM 1089 C THR A 188 -5.534 -12.189 -1.840 1.00 0.00 C ATOM 1090 O THR A 188 -6.405 -12.960 -2.235 1.00 0.00 O ATOM 1091 CB THR A 188 -5.529 -10.066 -3.299 1.00 0.00 C ATOM 1092 OG1 THR A 188 -5.565 -8.654 -3.228 1.00 0.00 O ATOM 1093 CG2 THR A 188 -6.601 -10.442 -4.305 1.00 0.00 C ATOM 0 H THR A 188 -3.875 -9.973 -1.316 1.00 0.00 H new ATOM 0 HA THR A 188 -6.788 -10.492 -1.635 1.00 0.00 H new ATOM 0 HB THR A 188 -4.567 -10.460 -3.625 1.00 0.00 H new ATOM 0 HG1 THR A 188 -4.703 -8.321 -2.901 1.00 0.00 H new ATOM 0 HG21 THR A 188 -6.378 -9.977 -5.265 1.00 0.00 H new ATOM 0 HG22 THR A 188 -6.625 -11.525 -4.423 1.00 0.00 H new ATOM 0 HG23 THR A 188 -7.571 -10.094 -3.950 1.00 0.00 H new ATOM 1101 N VAL A 189 -4.410 -12.640 -1.271 1.00 0.00 N ATOM 1102 CA VAL A 189 -4.000 -14.031 -1.357 1.00 0.00 C ATOM 1103 C VAL A 189 -3.553 -14.566 -0.001 1.00 0.00 C ATOM 1104 O VAL A 189 -3.774 -15.744 0.249 1.00 0.00 O ATOM 1105 CB VAL A 189 -2.915 -14.210 -2.439 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -2.843 -15.675 -2.851 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -3.180 -13.396 -3.718 1.00 0.00 C ATOM 0 H VAL A 189 -3.768 -12.049 -0.743 1.00 0.00 H new ATOM 0 HA VAL A 189 -4.864 -14.624 -1.656 1.00 0.00 H new ATOM 0 HB VAL A 189 -1.987 -13.855 -1.991 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -2.076 -15.801 -3.615 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -2.593 -16.285 -1.983 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -3.808 -15.989 -3.250 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -2.377 -13.571 -4.434 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -4.129 -13.705 -4.155 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -3.222 -12.335 -3.472 1.00 0.00 H new ATOM 1117 N THR A 190 -2.993 -13.754 0.905 1.00 0.00 N ATOM 1118 CA THR A 190 -2.682 -14.250 2.266 1.00 0.00 C ATOM 1119 C THR A 190 -3.728 -13.820 3.307 1.00 0.00 C ATOM 1120 O THR A 190 -3.575 -14.053 4.508 1.00 0.00 O ATOM 1121 CB THR A 190 -1.216 -13.974 2.650 1.00 0.00 C ATOM 1122 OG1 THR A 190 -0.795 -14.973 3.560 1.00 0.00 O ATOM 1123 CG2 THR A 190 -0.935 -12.580 3.227 1.00 0.00 C ATOM 0 H THR A 190 -2.749 -12.778 0.736 1.00 0.00 H new ATOM 0 HA THR A 190 -2.766 -15.337 2.255 1.00 0.00 H new ATOM 0 HB THR A 190 -0.647 -14.002 1.721 1.00 0.00 H new ATOM 0 HG1 THR A 190 -1.493 -15.118 4.233 1.00 0.00 H new ATOM 0 HG21 THR A 190 0.125 -12.491 3.463 1.00 0.00 H new ATOM 0 HG22 THR A 190 -1.208 -11.821 2.494 1.00 0.00 H new ATOM 0 HG23 THR A 190 -1.522 -12.437 4.134 1.00 0.00 H new ATOM 1131 N THR A 191 -4.803 -13.189 2.842 1.00 0.00 N ATOM 1132 CA THR A 191 -5.788 -12.531 3.680 1.00 0.00 C ATOM 1133 C THR A 191 -7.188 -12.911 3.178 1.00 0.00 C ATOM 1134 O THR A 191 -7.964 -13.476 3.946 1.00 0.00 O ATOM 1135 CB THR A 191 -5.444 -11.030 3.666 1.00 0.00 C ATOM 1136 OG1 THR A 191 -4.156 -10.787 4.199 1.00 0.00 O ATOM 1137 CG2 THR A 191 -6.430 -10.132 4.374 1.00 0.00 C ATOM 0 H THR A 191 -5.014 -13.122 1.846 1.00 0.00 H new ATOM 0 HA THR A 191 -5.777 -12.844 4.724 1.00 0.00 H new ATOM 0 HB THR A 191 -5.486 -10.772 2.608 1.00 0.00 H new ATOM 0 HG1 THR A 191 -4.030 -9.823 4.323 1.00 0.00 H new ATOM 0 HG21 THR A 191 -6.094 -9.097 4.305 1.00 0.00 H new ATOM 0 HG22 THR A 191 -7.410 -10.227 3.906 1.00 0.00 H new ATOM 0 HG23 THR A 191 -6.499 -10.422 5.422 1.00 0.00 H new ATOM 1145 N THR A 192 -7.499 -12.741 1.884 1.00 0.00 N ATOM 1146 CA THR A 192 -8.842 -13.019 1.339 1.00 0.00 C ATOM 1147 C THR A 192 -9.135 -14.536 1.255 1.00 0.00 C ATOM 1148 O THR A 192 -10.237 -14.963 0.915 1.00 0.00 O ATOM 1149 CB THR A 192 -8.955 -12.322 -0.027 1.00 0.00 C ATOM 1150 OG1 THR A 192 -8.671 -10.945 0.106 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.312 -12.320 -0.739 1.00 0.00 C ATOM 0 H THR A 192 -6.833 -12.409 1.187 1.00 0.00 H new ATOM 0 HA THR A 192 -9.602 -12.621 2.012 1.00 0.00 H new ATOM 0 HB THR A 192 -8.259 -12.918 -0.617 1.00 0.00 H new ATOM 0 HG1 THR A 192 -7.718 -10.825 0.298 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.225 -11.790 -1.687 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.627 -13.347 -0.925 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.051 -11.822 -0.112 1.00 0.00 H new ATOM 1159 N THR A 193 -8.165 -15.378 1.597 1.00 0.00 N ATOM 1160 CA THR A 193 -8.297 -16.834 1.628 1.00 0.00 C ATOM 1161 C THR A 193 -8.401 -17.316 3.089 1.00 0.00 C ATOM 1162 O THR A 193 -8.575 -18.509 3.355 1.00 0.00 O ATOM 1163 CB THR A 193 -7.117 -17.417 0.816 1.00 0.00 C ATOM 1164 OG1 THR A 193 -7.455 -18.642 0.205 1.00 0.00 O ATOM 1165 CG2 THR A 193 -5.818 -17.567 1.612 1.00 0.00 C ATOM 0 H THR A 193 -7.236 -15.058 1.869 1.00 0.00 H new ATOM 0 HA THR A 193 -9.214 -17.191 1.160 1.00 0.00 H new ATOM 0 HB THR A 193 -6.922 -16.673 0.044 1.00 0.00 H new ATOM 0 HG1 THR A 193 -6.686 -18.979 -0.300 1.00 0.00 H new ATOM 0 HG21 THR A 193 -5.043 -17.982 0.968 1.00 0.00 H new ATOM 0 HG22 THR A 193 -5.501 -16.591 1.978 1.00 0.00 H new ATOM 0 HG23 THR A 193 -5.984 -18.235 2.457 1.00 0.00 H new ATOM 1173 N LYS A 194 -8.263 -16.392 4.046 1.00 0.00 N ATOM 1174 CA LYS A 194 -8.198 -16.619 5.464 1.00 0.00 C ATOM 1175 C LYS A 194 -9.340 -15.835 6.095 1.00 0.00 C ATOM 1176 O LYS A 194 -10.497 -16.134 5.814 1.00 0.00 O ATOM 1177 CB LYS A 194 -6.802 -16.230 5.960 1.00 0.00 C ATOM 1178 CG LYS A 194 -5.672 -17.113 5.418 1.00 0.00 C ATOM 1179 CD LYS A 194 -4.619 -17.422 6.490 1.00 0.00 C ATOM 1180 CE LYS A 194 -3.865 -16.200 7.027 1.00 0.00 C ATOM 1181 NZ LYS A 194 -2.644 -16.608 7.756 1.00 0.00 N ATOM 0 H LYS A 194 -8.190 -15.401 3.816 1.00 0.00 H new ATOM 0 HA LYS A 194 -8.329 -17.664 5.744 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.605 -15.195 5.680 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -6.791 -16.273 7.049 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -6.090 -18.046 5.041 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.195 -16.614 4.574 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -5.108 -17.924 7.325 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -3.895 -18.124 6.076 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -3.597 -15.542 6.201 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -4.515 -15.630 7.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -2.152 -15.763 8.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -2.905 -17.217 8.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -2.015 -17.132 7.114 1.00 0.00 H new ATOM 1195 N GLY A 195 -9.036 -14.832 6.911 1.00 0.00 N ATOM 1196 CA GLY A 195 -10.039 -14.132 7.696 1.00 0.00 C ATOM 1197 C GLY A 195 -10.840 -13.118 6.891 1.00 0.00 C ATOM 1198 O GLY A 195 -11.857 -12.641 7.391 1.00 0.00 O ATOM 0 H GLY A 195 -8.087 -14.483 7.045 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -10.723 -14.861 8.131 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -9.549 -13.621 8.525 1.00 0.00 H new ATOM 1202 N GLU A 196 -10.419 -12.759 5.673 1.00 0.00 N ATOM 1203 CA GLU A 196 -11.034 -11.673 4.918 1.00 0.00 C ATOM 1204 C GLU A 196 -11.746 -12.221 3.703 1.00 0.00 C ATOM 1205 O GLU A 196 -11.468 -13.329 3.236 1.00 0.00 O ATOM 1206 CB GLU A 196 -9.950 -10.675 4.480 1.00 0.00 C ATOM 1207 CG GLU A 196 -9.728 -9.510 5.455 1.00 0.00 C ATOM 1208 CD GLU A 196 -9.256 -9.914 6.858 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -10.087 -10.303 7.703 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -8.041 -9.794 7.142 1.00 0.00 O ATOM 0 H GLU A 196 -9.645 -13.214 5.189 1.00 0.00 H new ATOM 0 HA GLU A 196 -11.761 -11.165 5.552 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -9.009 -11.211 4.354 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.219 -10.270 3.505 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -8.993 -8.831 5.023 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -10.660 -8.953 5.549 1.00 0.00 H new ATOM 1217 N ASN A 197 -12.595 -11.371 3.133 1.00 0.00 N ATOM 1218 CA ASN A 197 -13.056 -11.506 1.773 1.00 0.00 C ATOM 1219 C ASN A 197 -13.351 -10.107 1.244 1.00 0.00 C ATOM 1220 O ASN A 197 -14.469 -9.607 1.352 1.00 0.00 O ATOM 1221 CB ASN A 197 -14.267 -12.428 1.703 1.00 0.00 C ATOM 1222 CG ASN A 197 -14.394 -13.063 0.325 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -14.415 -14.291 0.237 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -14.424 -12.317 -0.767 1.00 0.00 N ATOM 0 H ASN A 197 -12.982 -10.561 3.617 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.294 -11.969 1.146 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.178 -13.208 2.459 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.171 -11.864 1.931 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -14.465 -12.759 -1.685 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -14.406 -11.300 -0.691 1.00 0.00 H new ATOM 1231 N PHE A 198 -12.327 -9.439 0.726 1.00 0.00 N ATOM 1232 CA PHE A 198 -12.475 -8.201 -0.046 1.00 0.00 C ATOM 1233 C PHE A 198 -13.298 -8.459 -1.320 1.00 0.00 C ATOM 1234 O PHE A 198 -13.773 -9.573 -1.557 1.00 0.00 O ATOM 1235 CB PHE A 198 -11.095 -7.625 -0.384 1.00 0.00 C ATOM 1236 CG PHE A 198 -10.249 -7.254 0.818 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -10.668 -6.268 1.736 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -9.019 -7.906 1.011 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -9.918 -6.040 2.905 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -8.291 -7.702 2.193 1.00 0.00 C ATOM 1241 CZ PHE A 198 -8.763 -6.796 3.157 1.00 0.00 C ATOM 0 H PHE A 198 -11.358 -9.741 0.829 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.012 -7.468 0.556 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.550 -8.354 -0.983 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.229 -6.739 -1.004 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -11.560 -5.691 1.543 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -8.633 -8.566 0.248 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -10.232 -5.283 3.608 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -7.370 -8.240 2.361 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.237 -6.681 4.093 1.00 0.00 H new ATOM 1251 N THR A 199 -13.476 -7.415 -2.123 1.00 0.00 N ATOM 1252 CA THR A 199 -14.277 -7.376 -3.338 1.00 0.00 C ATOM 1253 C THR A 199 -13.517 -6.565 -4.396 1.00 0.00 C ATOM 1254 O THR A 199 -12.583 -5.844 -4.043 1.00 0.00 O ATOM 1255 CB THR A 199 -15.643 -6.749 -2.996 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.533 -5.692 -2.049 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.573 -7.797 -2.391 1.00 0.00 C ATOM 0 H THR A 199 -13.035 -6.516 -1.928 1.00 0.00 H new ATOM 0 HA THR A 199 -14.452 -8.374 -3.741 1.00 0.00 H new ATOM 0 HB THR A 199 -16.038 -6.357 -3.933 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.422 -5.324 -1.864 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.533 -7.338 -2.155 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.723 -8.606 -3.106 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.128 -8.196 -1.480 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.904 -6.610 -5.674 1.00 0.00 N ATOM 1266 CA GLU A 200 -13.275 -5.870 -6.760 1.00 0.00 C ATOM 1267 C GLU A 200 -13.159 -4.375 -6.417 1.00 0.00 C ATOM 1268 O GLU A 200 -12.111 -3.764 -6.638 1.00 0.00 O ATOM 1269 CB GLU A 200 -14.135 -6.114 -8.017 1.00 0.00 C ATOM 1270 CG GLU A 200 -13.417 -5.621 -9.266 1.00 0.00 C ATOM 1271 CD GLU A 200 -14.331 -5.458 -10.480 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -14.784 -6.472 -11.058 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -14.577 -4.296 -10.876 1.00 0.00 O ATOM 0 H GLU A 200 -14.689 -7.182 -5.986 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.254 -6.212 -6.931 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.353 -7.178 -8.113 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -15.091 -5.600 -7.915 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -12.944 -4.663 -9.048 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -12.619 -6.321 -9.515 1.00 0.00 H new ATOM 1280 N THR A 201 -14.212 -3.797 -5.842 1.00 0.00 N ATOM 1281 CA THR A 201 -14.285 -2.397 -5.453 1.00 0.00 C ATOM 1282 C THR A 201 -13.408 -2.079 -4.233 1.00 0.00 C ATOM 1283 O THR A 201 -12.945 -0.943 -4.124 1.00 0.00 O ATOM 1284 CB THR A 201 -15.766 -2.097 -5.180 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.514 -2.415 -6.340 1.00 0.00 O ATOM 1286 CG2 THR A 201 -16.075 -0.647 -4.791 1.00 0.00 C ATOM 0 H THR A 201 -15.066 -4.312 -5.628 1.00 0.00 H new ATOM 0 HA THR A 201 -13.897 -1.764 -6.250 1.00 0.00 H new ATOM 0 HB THR A 201 -16.038 -2.707 -4.319 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.463 -2.230 -6.179 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.146 -0.537 -4.619 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.533 -0.391 -3.881 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.766 0.019 -5.596 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.144 -3.033 -3.325 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.093 -2.852 -2.318 1.00 0.00 C ATOM 1296 C ASP A 202 -10.777 -2.616 -3.032 1.00 0.00 C ATOM 1297 O ASP A 202 -10.081 -1.667 -2.692 1.00 0.00 O ATOM 1298 CB ASP A 202 -11.962 -4.053 -1.365 1.00 0.00 C ATOM 1299 CG ASP A 202 -10.516 -4.294 -0.893 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -9.738 -4.955 -1.624 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -10.228 -3.893 0.251 1.00 0.00 O ATOM 0 H ASP A 202 -13.637 -3.924 -3.269 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.364 -1.995 -1.701 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.599 -3.891 -0.496 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.328 -4.949 -1.866 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.455 -3.439 -4.033 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.112 -3.429 -4.601 1.00 0.00 C ATOM 1308 C VAL A 203 -8.847 -2.052 -5.213 1.00 0.00 C ATOM 1309 O VAL A 203 -7.745 -1.524 -5.111 1.00 0.00 O ATOM 1310 CB VAL A 203 -8.945 -4.528 -5.671 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.484 -4.738 -6.069 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -9.525 -5.885 -5.266 1.00 0.00 C ATOM 0 H VAL A 203 -11.096 -4.109 -4.459 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.392 -3.633 -3.808 1.00 0.00 H new ATOM 0 HB VAL A 203 -9.515 -4.149 -6.519 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.422 -5.522 -6.824 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.080 -3.810 -6.475 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.907 -5.032 -5.192 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -9.368 -6.603 -6.071 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.028 -6.238 -4.363 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -10.593 -5.782 -5.076 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.864 -1.453 -5.835 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.796 -0.140 -6.471 1.00 0.00 C ATOM 1324 C LYS A 204 -9.423 0.928 -5.446 1.00 0.00 C ATOM 1325 O LYS A 204 -8.561 1.763 -5.710 1.00 0.00 O ATOM 1326 CB LYS A 204 -11.147 0.156 -7.147 1.00 0.00 C ATOM 1327 CG LYS A 204 -11.474 -0.859 -8.258 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.831 -0.492 -9.597 1.00 0.00 C ATOM 1329 CE LYS A 204 -10.843 -1.726 -10.503 1.00 0.00 C ATOM 1330 NZ LYS A 204 -10.180 -1.484 -11.794 1.00 0.00 N ATOM 0 H LYS A 204 -10.786 -1.883 -5.911 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.018 -0.132 -7.235 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.938 0.140 -6.397 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.128 1.161 -7.569 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -11.132 -1.848 -7.954 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.555 -0.920 -8.383 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.377 0.326 -10.066 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -9.809 -0.146 -9.443 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -10.347 -2.552 -9.993 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -11.874 -2.033 -10.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -10.215 -2.349 -12.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -10.667 -0.714 -12.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -9.188 -1.217 -11.630 1.00 0.00 H new ATOM 1344 N MET A 205 -10.050 0.902 -4.270 1.00 0.00 N ATOM 1345 CA MET A 205 -9.695 1.804 -3.183 1.00 0.00 C ATOM 1346 C MET A 205 -8.325 1.454 -2.612 1.00 0.00 C ATOM 1347 O MET A 205 -7.557 2.340 -2.233 1.00 0.00 O ATOM 1348 CB MET A 205 -10.724 1.693 -2.060 1.00 0.00 C ATOM 1349 CG MET A 205 -12.153 2.052 -2.458 1.00 0.00 C ATOM 1350 SD MET A 205 -12.294 3.642 -3.294 1.00 0.00 S ATOM 1351 CE MET A 205 -14.074 3.894 -3.242 1.00 0.00 C ATOM 0 H MET A 205 -10.811 0.260 -4.049 1.00 0.00 H new ATOM 0 HA MET A 205 -9.674 2.818 -3.583 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.715 0.672 -1.678 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.417 2.343 -1.240 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.546 1.272 -3.111 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.777 2.065 -1.565 1.00 0.00 H new ATOM 0 HE1 MET A 205 -14.394 4.417 -4.143 1.00 0.00 H new ATOM 0 HE2 MET A 205 -14.577 2.928 -3.185 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.332 4.489 -2.366 1.00 0.00 H new ATOM 1361 N MET A 206 -8.008 0.166 -2.521 1.00 0.00 N ATOM 1362 CA MET A 206 -6.767 -0.289 -1.943 1.00 0.00 C ATOM 1363 C MET A 206 -5.582 0.132 -2.810 1.00 0.00 C ATOM 1364 O MET A 206 -4.537 0.449 -2.252 1.00 0.00 O ATOM 1365 CB MET A 206 -6.811 -1.795 -1.689 1.00 0.00 C ATOM 1366 CG MET A 206 -5.441 -2.266 -1.192 1.00 0.00 C ATOM 1367 SD MET A 206 -5.342 -3.810 -0.232 1.00 0.00 S ATOM 1368 CE MET A 206 -6.876 -4.666 -0.686 1.00 0.00 C ATOM 0 H MET A 206 -8.613 -0.587 -2.850 1.00 0.00 H new ATOM 0 HA MET A 206 -6.630 0.188 -0.973 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.578 -2.028 -0.951 1.00 0.00 H new ATOM 0 HB3 MET A 206 -7.079 -2.322 -2.605 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.794 -2.376 -2.062 1.00 0.00 H new ATOM 0 HG3 MET A 206 -5.020 -1.469 -0.580 1.00 0.00 H new ATOM 0 HE1 MET A 206 -6.811 -5.712 -0.386 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.719 -4.195 -0.180 1.00 0.00 H new ATOM 0 HE3 MET A 206 -7.021 -4.606 -1.765 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.725 0.215 -4.134 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.674 0.757 -4.985 1.00 0.00 C ATOM 1380 C GLU A 207 -4.337 2.172 -4.524 1.00 0.00 C ATOM 1381 O GLU A 207 -3.169 2.521 -4.410 1.00 0.00 O ATOM 1382 CB GLU A 207 -5.072 0.793 -6.468 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.211 -0.583 -7.128 1.00 0.00 C ATOM 1384 CD GLU A 207 -5.077 -0.475 -8.648 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -3.939 -0.503 -9.160 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -6.132 -0.352 -9.322 1.00 0.00 O ATOM 0 H GLU A 207 -6.560 -0.087 -4.636 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.810 0.099 -4.895 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.019 1.324 -6.563 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.327 1.370 -7.016 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -4.448 -1.256 -6.738 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.178 -1.017 -6.874 1.00 0.00 H new ATOM 1393 N ARG A 208 -5.351 2.980 -4.207 1.00 0.00 N ATOM 1394 CA ARG A 208 -5.158 4.378 -3.838 1.00 0.00 C ATOM 1395 C ARG A 208 -4.431 4.452 -2.504 1.00 0.00 C ATOM 1396 O ARG A 208 -3.478 5.223 -2.360 1.00 0.00 O ATOM 1397 CB ARG A 208 -6.514 5.096 -3.747 1.00 0.00 C ATOM 1398 CG ARG A 208 -7.174 5.390 -5.101 1.00 0.00 C ATOM 1399 CD ARG A 208 -6.722 6.745 -5.650 1.00 0.00 C ATOM 1400 NE ARG A 208 -5.503 6.640 -6.465 1.00 0.00 N ATOM 1401 CZ ARG A 208 -5.445 6.619 -7.800 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -6.548 6.582 -8.541 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -4.261 6.607 -8.393 1.00 0.00 N ATOM 0 H ARG A 208 -6.326 2.681 -4.200 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.558 4.873 -4.602 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.194 4.487 -3.151 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.377 6.036 -3.213 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.920 4.603 -5.811 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -8.258 5.382 -4.990 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -7.522 7.176 -6.252 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -6.544 7.429 -4.820 1.00 0.00 H new ATOM 0 HE ARG A 208 -4.617 6.577 -5.964 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -7.464 6.569 -8.092 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -6.479 6.567 -9.559 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -3.409 6.614 -7.832 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -4.201 6.591 -9.411 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.912 3.683 -1.531 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.382 3.688 -0.177 1.00 0.00 C ATOM 1419 C VAL A 209 -2.953 3.153 -0.141 1.00 0.00 C ATOM 1420 O VAL A 209 -2.084 3.754 0.488 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.352 2.941 0.765 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.047 1.467 1.052 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.386 3.646 2.110 1.00 0.00 C ATOM 0 H VAL A 209 -5.688 3.034 -1.665 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.313 4.713 0.187 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.297 2.958 0.221 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.803 1.063 1.725 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.056 0.905 0.118 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.065 1.383 1.517 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.070 3.122 2.778 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.386 3.650 2.544 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.727 4.672 1.974 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.693 2.022 -0.795 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.389 1.394 -0.763 1.00 0.00 C ATOM 1435 C VAL A 210 -0.421 2.254 -1.575 1.00 0.00 C ATOM 1436 O VAL A 210 0.733 2.328 -1.196 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.504 -0.084 -1.202 1.00 0.00 C ATOM 1438 CG1 VAL A 210 -0.153 -0.773 -1.386 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -2.245 -0.909 -0.138 1.00 0.00 C ATOM 0 H VAL A 210 -3.382 1.523 -1.357 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.977 1.345 0.245 1.00 0.00 H new ATOM 0 HB VAL A 210 -2.034 -0.049 -2.154 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.311 -1.807 -1.694 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.421 -0.250 -2.151 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.396 -0.755 -0.444 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.316 -1.946 -0.466 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.699 -0.863 0.804 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.247 -0.504 0.003 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.871 2.992 -2.592 1.00 0.00 N ATOM 1450 CA GLU A 211 -0.068 3.925 -3.359 1.00 0.00 C ATOM 1451 C GLU A 211 0.384 5.032 -2.410 1.00 0.00 C ATOM 1452 O GLU A 211 1.581 5.233 -2.261 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.893 4.433 -4.552 1.00 0.00 C ATOM 1454 CG GLU A 211 -0.218 5.516 -5.386 1.00 0.00 C ATOM 1455 CD GLU A 211 -1.245 6.325 -6.181 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -2.069 5.775 -6.939 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -1.276 7.569 -6.008 1.00 0.00 O ATOM 0 H GLU A 211 -1.840 2.949 -2.909 1.00 0.00 H new ATOM 0 HA GLU A 211 0.825 3.462 -3.779 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.125 3.588 -5.200 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.842 4.820 -4.180 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.347 6.182 -4.733 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.497 5.059 -6.070 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.536 5.714 -1.716 1.00 0.00 N ATOM 1465 CA GLN A 212 -0.180 6.694 -0.690 1.00 0.00 C ATOM 1466 C GLN A 212 0.796 6.132 0.354 1.00 0.00 C ATOM 1467 O GLN A 212 1.687 6.861 0.800 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.446 7.172 0.028 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.349 8.099 -0.780 1.00 0.00 C ATOM 1470 CD GLN A 212 -1.691 9.441 -1.068 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -1.145 10.108 -0.193 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.707 9.874 -2.310 1.00 0.00 N ATOM 0 H GLN A 212 -1.541 5.601 -1.851 1.00 0.00 H new ATOM 0 HA GLN A 212 0.316 7.520 -1.200 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -2.025 6.298 0.326 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.152 7.687 0.943 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.612 7.616 -1.721 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.279 8.262 -0.235 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -2.160 9.321 -3.037 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.266 10.763 -2.546 1.00 0.00 H new ATOM 1481 N MET A 213 0.641 4.866 0.760 1.00 0.00 N ATOM 1482 CA MET A 213 1.569 4.276 1.729 1.00 0.00 C ATOM 1483 C MET A 213 2.938 4.075 1.065 1.00 0.00 C ATOM 1484 O MET A 213 3.923 4.638 1.537 1.00 0.00 O ATOM 1485 CB MET A 213 1.017 2.987 2.363 1.00 0.00 C ATOM 1486 CG MET A 213 -0.103 3.278 3.381 1.00 0.00 C ATOM 1487 SD MET A 213 -0.718 1.907 4.396 1.00 0.00 S ATOM 1488 CE MET A 213 -0.982 0.635 3.153 1.00 0.00 C ATOM 0 H MET A 213 -0.101 4.243 0.441 1.00 0.00 H new ATOM 0 HA MET A 213 1.691 4.968 2.562 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.634 2.333 1.580 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.827 2.451 2.858 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.254 4.057 4.055 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.950 3.693 2.834 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.327 -0.279 3.636 1.00 0.00 H new ATOM 0 HE2 MET A 213 -1.733 0.974 2.439 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.047 0.438 2.629 1.00 0.00 H new ATOM 1498 N CYS A 214 3.003 3.343 -0.051 1.00 0.00 N ATOM 1499 CA CYS A 214 4.201 3.079 -0.842 1.00 0.00 C ATOM 1500 C CYS A 214 4.932 4.371 -1.204 1.00 0.00 C ATOM 1501 O CYS A 214 6.152 4.385 -1.189 1.00 0.00 O ATOM 1502 CB CYS A 214 3.841 2.328 -2.135 1.00 0.00 C ATOM 1503 SG CYS A 214 3.166 0.650 -1.962 1.00 0.00 S ATOM 0 H CYS A 214 2.175 2.896 -0.445 1.00 0.00 H new ATOM 0 HA CYS A 214 4.860 2.464 -0.229 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.115 2.929 -2.683 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.738 2.269 -2.752 1.00 0.00 H new ATOM 1508 N VAL A 215 4.237 5.461 -1.531 1.00 0.00 N ATOM 1509 CA VAL A 215 4.852 6.738 -1.874 1.00 0.00 C ATOM 1510 C VAL A 215 5.571 7.321 -0.655 1.00 0.00 C ATOM 1511 O VAL A 215 6.705 7.778 -0.793 1.00 0.00 O ATOM 1512 CB VAL A 215 3.793 7.683 -2.478 1.00 0.00 C ATOM 1513 CG1 VAL A 215 4.272 9.135 -2.607 1.00 0.00 C ATOM 1514 CG2 VAL A 215 3.417 7.218 -3.893 1.00 0.00 C ATOM 0 H VAL A 215 3.218 5.479 -1.565 1.00 0.00 H new ATOM 0 HA VAL A 215 5.615 6.597 -2.639 1.00 0.00 H new ATOM 0 HB VAL A 215 2.948 7.648 -1.790 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.477 9.743 -3.039 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.530 9.522 -1.621 1.00 0.00 H new ATOM 0 HG13 VAL A 215 5.149 9.173 -3.253 1.00 0.00 H new ATOM 0 HG21 VAL A 215 2.669 7.892 -4.311 1.00 0.00 H new ATOM 0 HG22 VAL A 215 4.304 7.224 -4.526 1.00 0.00 H new ATOM 0 HG23 VAL A 215 3.011 6.208 -3.848 1.00 0.00 H new ATOM 1524 N THR A 216 4.976 7.305 0.537 1.00 0.00 N ATOM 1525 CA THR A 216 5.683 7.760 1.727 1.00 0.00 C ATOM 1526 C THR A 216 6.816 6.786 2.082 1.00 0.00 C ATOM 1527 O THR A 216 7.919 7.242 2.372 1.00 0.00 O ATOM 1528 CB THR A 216 4.661 7.951 2.867 1.00 0.00 C ATOM 1529 OG1 THR A 216 3.910 9.134 2.654 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.292 8.057 4.255 1.00 0.00 C ATOM 0 H THR A 216 4.021 6.987 0.701 1.00 0.00 H new ATOM 0 HA THR A 216 6.162 8.722 1.548 1.00 0.00 H new ATOM 0 HB THR A 216 4.037 7.058 2.845 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.263 9.246 3.381 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.509 8.190 5.001 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.849 7.146 4.472 1.00 0.00 H new ATOM 0 HG23 THR A 216 5.968 8.911 4.283 1.00 0.00 H new ATOM 1538 N GLN A 217 6.590 5.470 2.055 1.00 0.00 N ATOM 1539 CA GLN A 217 7.619 4.472 2.356 1.00 0.00 C ATOM 1540 C GLN A 217 8.779 4.566 1.356 1.00 0.00 C ATOM 1541 O GLN A 217 9.930 4.374 1.744 1.00 0.00 O ATOM 1542 CB GLN A 217 6.981 3.064 2.388 1.00 0.00 C ATOM 1543 CG GLN A 217 6.970 2.416 3.779 1.00 0.00 C ATOM 1544 CD GLN A 217 8.023 1.322 3.933 1.00 0.00 C ATOM 1545 OE1 GLN A 217 7.778 0.161 3.628 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.240 1.642 4.337 1.00 0.00 N ATOM 0 H GLN A 217 5.683 5.065 1.822 1.00 0.00 H new ATOM 0 HA GLN A 217 8.042 4.670 3.341 1.00 0.00 H new ATOM 0 HB2 GLN A 217 5.957 3.132 2.022 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.523 2.415 1.700 1.00 0.00 H new ATOM 0 HG2 GLN A 217 7.139 3.184 4.534 1.00 0.00 H new ATOM 0 HG3 GLN A 217 5.984 1.993 3.970 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.455 2.605 4.593 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.964 0.926 4.392 1.00 0.00 H new ATOM 1555 N TYR A 218 8.501 4.928 0.102 1.00 0.00 N ATOM 1556 CA TYR A 218 9.484 5.237 -0.921 1.00 0.00 C ATOM 1557 C TYR A 218 10.321 6.431 -0.483 1.00 0.00 C ATOM 1558 O TYR A 218 11.544 6.316 -0.409 1.00 0.00 O ATOM 1559 CB TYR A 218 8.792 5.528 -2.265 1.00 0.00 C ATOM 1560 CG TYR A 218 9.703 5.962 -3.390 1.00 0.00 C ATOM 1561 CD1 TYR A 218 10.998 5.433 -3.528 1.00 0.00 C ATOM 1562 CD2 TYR A 218 9.249 6.937 -4.293 1.00 0.00 C ATOM 1563 CE1 TYR A 218 11.852 5.927 -4.524 1.00 0.00 C ATOM 1564 CE2 TYR A 218 10.101 7.432 -5.289 1.00 0.00 C ATOM 1565 CZ TYR A 218 11.413 6.938 -5.404 1.00 0.00 C ATOM 1566 OH TYR A 218 12.240 7.433 -6.363 1.00 0.00 O ATOM 0 H TYR A 218 7.543 5.015 -0.236 1.00 0.00 H new ATOM 0 HA TYR A 218 10.138 4.375 -1.056 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.258 4.631 -2.580 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.044 6.305 -2.107 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.335 4.647 -2.868 1.00 0.00 H new ATOM 0 HD2 TYR A 218 8.237 7.307 -4.219 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.852 5.531 -4.618 1.00 0.00 H new ATOM 0 HE2 TYR A 218 9.750 8.194 -5.969 1.00 0.00 H new ATOM 0 HH TYR A 218 11.769 8.122 -6.877 1.00 0.00 H new ATOM 1576 N GLN A 219 9.676 7.567 -0.187 1.00 0.00 N ATOM 1577 CA GLN A 219 10.359 8.771 0.264 1.00 0.00 C ATOM 1578 C GLN A 219 11.239 8.455 1.460 1.00 0.00 C ATOM 1579 O GLN A 219 12.416 8.792 1.447 1.00 0.00 O ATOM 1580 CB GLN A 219 9.351 9.880 0.602 1.00 0.00 C ATOM 1581 CG GLN A 219 8.704 10.375 -0.685 1.00 0.00 C ATOM 1582 CD GLN A 219 7.665 11.470 -0.515 1.00 0.00 C ATOM 1583 OE1 GLN A 219 7.529 12.089 0.540 1.00 0.00 O ATOM 1584 NE2 GLN A 219 6.912 11.714 -1.571 1.00 0.00 N ATOM 0 H GLN A 219 8.664 7.670 -0.256 1.00 0.00 H new ATOM 0 HA GLN A 219 10.992 9.134 -0.546 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.590 9.501 1.284 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.854 10.703 1.111 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.488 10.742 -1.348 1.00 0.00 H new ATOM 0 HG3 GLN A 219 8.235 9.527 -1.185 1.00 0.00 H new ATOM 0 HE21 GLN A 219 7.051 11.182 -2.430 1.00 0.00 H new ATOM 0 HE22 GLN A 219 6.191 12.434 -1.528 1.00 0.00 H new ATOM 1593 N LYS A 220 10.693 7.805 2.484 1.00 0.00 N ATOM 1594 CA LYS A 220 11.375 7.468 3.707 1.00 0.00 C ATOM 1595 C LYS A 220 12.572 6.588 3.424 1.00 0.00 C ATOM 1596 O LYS A 220 13.659 6.970 3.853 1.00 0.00 O ATOM 1597 CB LYS A 220 10.423 6.817 4.705 1.00 0.00 C ATOM 1598 CG LYS A 220 9.394 7.848 5.201 1.00 0.00 C ATOM 1599 CD LYS A 220 8.235 7.200 5.963 1.00 0.00 C ATOM 1600 CE LYS A 220 8.564 6.920 7.423 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.619 8.168 8.210 1.00 0.00 N ATOM 0 H LYS A 220 9.723 7.491 2.473 1.00 0.00 H new ATOM 0 HA LYS A 220 11.739 8.389 4.161 1.00 0.00 H new ATOM 0 HB2 LYS A 220 9.911 5.977 4.236 1.00 0.00 H new ATOM 0 HB3 LYS A 220 10.985 6.417 5.549 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.891 8.570 5.848 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.000 8.402 4.349 1.00 0.00 H new ATOM 0 HD2 LYS A 220 7.364 7.853 5.912 1.00 0.00 H new ATOM 0 HD3 LYS A 220 7.962 6.266 5.472 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.812 6.254 7.846 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.521 6.403 7.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 8.625 7.939 9.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 9.484 8.693 7.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.787 8.753 7.992 1.00 0.00 H new ATOM 1615 N GLU A 221 12.412 5.487 2.687 1.00 0.00 N ATOM 1616 CA GLU A 221 13.534 4.632 2.329 1.00 0.00 C ATOM 1617 C GLU A 221 14.607 5.443 1.611 1.00 0.00 C ATOM 1618 O GLU A 221 15.771 5.354 1.991 1.00 0.00 O ATOM 1619 CB GLU A 221 13.118 3.442 1.452 1.00 0.00 C ATOM 1620 CG GLU A 221 12.651 2.188 2.205 1.00 0.00 C ATOM 1621 CD GLU A 221 13.748 1.555 3.073 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.934 1.511 2.660 1.00 0.00 O ATOM 1623 OE2 GLU A 221 13.430 1.158 4.219 1.00 0.00 O ATOM 0 H GLU A 221 11.511 5.170 2.328 1.00 0.00 H new ATOM 0 HA GLU A 221 13.930 4.229 3.261 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.315 3.766 0.790 1.00 0.00 H new ATOM 0 HB3 GLU A 221 13.962 3.169 0.819 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.802 2.448 2.837 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.298 1.451 1.484 1.00 0.00 H new ATOM 1630 N SER A 222 14.233 6.244 0.608 1.00 0.00 N ATOM 1631 CA SER A 222 15.171 7.075 -0.131 1.00 0.00 C ATOM 1632 C SER A 222 15.886 8.041 0.811 1.00 0.00 C ATOM 1633 O SER A 222 17.097 8.230 0.681 1.00 0.00 O ATOM 1634 CB SER A 222 14.446 7.862 -1.237 1.00 0.00 C ATOM 1635 OG SER A 222 15.215 7.879 -2.431 1.00 0.00 O ATOM 0 H SER A 222 13.268 6.330 0.290 1.00 0.00 H new ATOM 0 HA SER A 222 15.910 6.421 -0.594 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.473 7.411 -1.432 1.00 0.00 H new ATOM 0 HB3 SER A 222 14.263 8.883 -0.903 1.00 0.00 H new ATOM 0 HG SER A 222 14.736 8.383 -3.122 1.00 0.00 H new ATOM 1641 N GLN A 223 15.161 8.672 1.736 1.00 0.00 N ATOM 1642 CA GLN A 223 15.707 9.664 2.624 1.00 0.00 C ATOM 1643 C GLN A 223 16.677 8.945 3.537 1.00 0.00 C ATOM 1644 O GLN A 223 17.842 9.293 3.527 1.00 0.00 O ATOM 1645 CB GLN A 223 14.555 10.446 3.270 1.00 0.00 C ATOM 1646 CG GLN A 223 14.774 10.967 4.701 1.00 0.00 C ATOM 1647 CD GLN A 223 13.685 10.462 5.654 1.00 0.00 C ATOM 1648 OE1 GLN A 223 13.050 11.235 6.371 1.00 0.00 O ATOM 1649 NE2 GLN A 223 13.357 9.179 5.624 1.00 0.00 N ATOM 0 H GLN A 223 14.167 8.496 1.880 1.00 0.00 H new ATOM 0 HA GLN A 223 16.291 10.446 2.138 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.326 11.299 2.631 1.00 0.00 H new ATOM 0 HB3 GLN A 223 13.673 9.806 3.275 1.00 0.00 H new ATOM 0 HG2 GLN A 223 15.752 10.646 5.061 1.00 0.00 H new ATOM 0 HG3 GLN A 223 14.778 12.057 4.696 1.00 0.00 H new ATOM 0 HE21 GLN A 223 13.879 8.533 5.032 1.00 0.00 H new ATOM 0 HE22 GLN A 223 12.582 8.837 6.193 1.00 0.00 H new ATOM 1658 N ALA A 224 16.273 7.884 4.220 1.00 0.00 N ATOM 1659 CA ALA A 224 17.110 7.124 5.102 1.00 0.00 C ATOM 1660 C ALA A 224 18.255 6.402 4.346 1.00 0.00 C ATOM 1661 O ALA A 224 19.175 5.883 4.966 1.00 0.00 O ATOM 1662 CB ALA A 224 16.215 6.185 5.950 1.00 0.00 C ATOM 0 H ALA A 224 15.319 7.526 4.165 1.00 0.00 H new ATOM 0 HA ALA A 224 17.632 7.792 5.787 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.839 5.600 6.626 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.510 6.780 6.530 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.666 5.513 5.291 1.00 0.00 H new ATOM 1668 N ALA A 225 18.275 6.424 3.009 1.00 0.00 N ATOM 1669 CA ALA A 225 19.326 5.898 2.142 1.00 0.00 C ATOM 1670 C ALA A 225 20.202 7.008 1.537 1.00 0.00 C ATOM 1671 O ALA A 225 21.006 6.717 0.642 1.00 0.00 O ATOM 1672 CB ALA A 225 18.687 5.032 1.047 1.00 0.00 C ATOM 0 H ALA A 225 17.510 6.835 2.474 1.00 0.00 H new ATOM 0 HA ALA A 225 19.995 5.286 2.748 1.00 0.00 H new ATOM 0 HB1 ALA A 225 19.466 4.636 0.396 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.144 4.206 1.507 1.00 0.00 H new ATOM 0 HB3 ALA A 225 17.997 5.638 0.460 1.00 0.00 H new ATOM 1678 N ALA A 226 20.032 8.264 1.966 1.00 0.00 N ATOM 1679 CA ALA A 226 20.824 9.427 1.564 1.00 0.00 C ATOM 1680 C ALA A 226 21.105 10.379 2.730 1.00 0.00 C ATOM 1681 O ALA A 226 22.137 11.047 2.748 1.00 0.00 O ATOM 1682 CB ALA A 226 20.107 10.172 0.436 1.00 0.00 C ATOM 0 H ALA A 226 19.302 8.506 2.636 1.00 0.00 H new ATOM 0 HA ALA A 226 21.789 9.060 1.215 1.00 0.00 H new ATOM 0 HB1 ALA A 226 20.699 11.038 0.138 1.00 0.00 H new ATOM 0 HB2 ALA A 226 19.983 9.506 -0.418 1.00 0.00 H new ATOM 0 HB3 ALA A 226 19.128 10.503 0.783 1.00 0.00 H new ATOM 1688 N ASP A 227 20.227 10.418 3.730 1.00 0.00 N ATOM 1689 CA ASP A 227 20.473 11.008 5.030 1.00 0.00 C ATOM 1690 C ASP A 227 21.443 10.124 5.796 1.00 0.00 C ATOM 1691 O ASP A 227 22.212 10.616 6.627 1.00 0.00 O ATOM 1692 CB ASP A 227 19.167 11.291 5.791 1.00 0.00 C ATOM 1693 CG ASP A 227 18.612 10.292 6.745 1.00 0.00 C ATOM 1694 OD1 ASP A 227 18.978 9.122 6.628 1.00 0.00 O ATOM 1695 OD2 ASP A 227 17.766 10.707 7.570 1.00 0.00 O ATOM 0 H ASP A 227 19.291 10.022 3.647 1.00 0.00 H new ATOM 0 HA ASP A 227 20.936 11.987 4.906 1.00 0.00 H new ATOM 0 HB2 ASP A 227 19.313 12.218 6.346 1.00 0.00 H new ATOM 0 HB3 ASP A 227 18.396 11.485 5.045 1.00 0.00 H new ATOM 1700 N GLY A 228 21.460 8.840 5.430 1.00 0.00 N ATOM 1701 CA GLY A 228 22.363 7.832 5.906 1.00 0.00 C ATOM 1702 C GLY A 228 21.705 6.798 6.807 1.00 0.00 C ATOM 1703 O GLY A 228 22.360 5.825 7.179 1.00 0.00 O ATOM 0 H GLY A 228 20.795 8.471 4.750 1.00 0.00 H new ATOM 0 HA2 GLY A 228 22.810 7.324 5.051 1.00 0.00 H new ATOM 0 HA3 GLY A 228 23.175 8.313 6.452 1.00 0.00 H new ATOM 1707 N ARG A 229 20.448 6.972 7.211 1.00 0.00 N ATOM 1708 CA ARG A 229 19.976 6.399 8.458 1.00 0.00 C ATOM 1709 C ARG A 229 19.184 5.151 8.134 1.00 0.00 C ATOM 1710 O ARG A 229 18.042 5.029 8.574 1.00 0.00 O ATOM 1711 CB ARG A 229 19.126 7.438 9.199 1.00 0.00 C ATOM 1712 CG ARG A 229 19.735 8.840 9.338 1.00 0.00 C ATOM 1713 CD ARG A 229 20.371 9.251 10.633 1.00 0.00 C ATOM 1714 NE ARG A 229 19.354 9.262 11.684 1.00 0.00 N ATOM 1715 CZ ARG A 229 19.502 9.291 13.006 1.00 0.00 C ATOM 1716 NH1 ARG A 229 20.694 9.505 13.556 1.00 0.00 N ATOM 1717 NH2 ARG A 229 18.418 9.060 13.738 1.00 0.00 N ATOM 0 H ARG A 229 19.747 7.502 6.693 1.00 0.00 H new ATOM 0 HA ARG A 229 20.806 6.126 9.109 1.00 0.00 H new ATOM 0 HB2 ARG A 229 18.170 7.530 8.683 1.00 0.00 H new ATOM 0 HB3 ARG A 229 18.913 7.057 10.198 1.00 0.00 H new ATOM 0 HG2 ARG A 229 20.488 8.946 8.558 1.00 0.00 H new ATOM 0 HG3 ARG A 229 18.946 9.560 9.120 1.00 0.00 H new ATOM 0 HD2 ARG A 229 21.173 8.561 10.893 1.00 0.00 H new ATOM 0 HD3 ARG A 229 20.820 10.239 10.534 1.00 0.00 H new ATOM 0 HE ARG A 229 18.389 9.245 11.355 1.00 0.00 H new ATOM 0 HH11 ARG A 229 21.511 9.650 12.963 1.00 0.00 H new ATOM 0 HH12 ARG A 229 20.791 9.524 14.571 1.00 0.00 H new ATOM 0 HH21 ARG A 229 17.525 8.872 13.282 1.00 0.00 H new ATOM 0 HH22 ARG A 229 18.478 9.071 14.756 1.00 0.00 H new