USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 798 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 132 SER OG : rot -140:sc= 0.256 USER MOD Set 1.2: A 217 GLN : amide:sc= -0.419 K(o=0.061,f=-1.1!) USER MOD Set 1.3: A 220 LYS NZ :NH3+ 159:sc= 0.224 (180deg=0) USER MOD Set 2.1: A 187 HIS : no HD1:sc= -0.223 X(o=1,f=0.99) USER MOD Set 2.2: A 191 THR OG1 : rot 11:sc= 1.25 USER MOD Set 3.1: A 179 CYS SG : rot 87:sc= 0.548 USER MOD Set 3.2: A 214 CYS SG : rot 110:sc= -2 USER MOD Set 4.1: A 150 TYR OH : rot 123:sc= 1.31 USER MOD Set 4.2: A 154 MET CE :methyl -157:sc= -0.322 (180deg=-1.06) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl 143:sc= 0 (180deg=-0.437) USER MOD Single : A 134 MET CE :methyl -178:sc= -0.159 (180deg=-0.18) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl -150:sc= -0.601 (180deg=-2.61) USER MOD Single : A 140 HIS : no HD1:sc= -0.385 X(o=-0.38,f=-0.17) USER MOD Single : A 143 ASN : amide:sc= 0.519 K(o=0.52,f=-5.4!) USER MOD Single : A 149 TYR OH : rot 41:sc= 1.27 USER MOD Single : A 153 ASN : amide:sc= 0.292 X(o=0.29,f=-0.089) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 180:sc= -0.0154 USER MOD Single : A 159 ASN : amide:sc= 0.216 K(o=0.22,f=-4!) USER MOD Single : A 160 GLN : amide:sc= -1.44 K(o=-1.4,f=-0.91) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 16:sc= 0.705 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= 0.936 K(o=0.94,f=-5.7!) USER MOD Single : A 169 TYR OH : rot -144:sc= 1.27 USER MOD Single : A 170 SER OG : rot -73:sc= 0.483 USER MOD Single : A 171 ASN : amide:sc= 0.351 K(o=0.35,f=-4.8!) USER MOD Single : A 172 GLN : amide:sc= -0.365 X(o=-0.37,f=-0.25) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 ASN : amide:sc= -0.644 X(o=-0.64,f=-0.58) USER MOD Single : A 177 HIS : no HD1:sc= -0.115 X(o=-0.11,f=0.016) USER MOD Single : A 181 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 183 THR OG1 : rot 180:sc= 0 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.223 X(o=-0.22,f=-0.22) USER MOD Single : A 188 THR OG1 : rot 95:sc= 1.29 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 THR OG1 : rot -150:sc= -0.278 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 X(o=0,f=-0.031) USER MOD Single : A 199 THR OG1 : rot 180:sc= -0.374 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 -152:sc= -1.21 (180deg=-2.44) USER MOD Single : A 206 MET CE :methyl -179:sc= -2.47 (180deg=-2.47) USER MOD Single : A 212 GLN : amide:sc= -0.699 K(o=-0.7,f=0) USER MOD Single : A 213 MET CE :methyl 179:sc= -1.05 (180deg=-1.07) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= 0.717 K(o=0.72,f=0) USER MOD Single : A 222 SER OG : rot 73:sc= 1.21 USER MOD Single : A 223 GLN : amide:sc= -0.326 X(o=-0.33,f=-0.0089) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 58 N LEU A 125 4.632 13.684 -1.755 1.00 51.54 N ATOM 59 CA LEU A 125 5.339 12.819 -0.832 1.00 43.53 C ATOM 60 C LEU A 125 6.242 13.579 0.121 1.00 2.34 C ATOM 61 O LEU A 125 6.284 13.258 1.303 1.00 11.31 O ATOM 62 CB LEU A 125 6.227 11.864 -1.649 1.00 4.40 C ATOM 63 CG LEU A 125 5.508 10.701 -2.338 1.00 74.42 C ATOM 64 CD1 LEU A 125 4.659 9.920 -1.340 1.00 12.11 C ATOM 65 CD2 LEU A 125 4.663 11.159 -3.522 1.00 62.14 C ATOM 0 HA LEU A 125 4.588 12.295 -0.240 1.00 43.53 H new ATOM 0 HB2 LEU A 125 6.747 12.446 -2.410 1.00 4.40 H new ATOM 0 HB3 LEU A 125 6.989 11.453 -0.987 1.00 4.40 H new ATOM 0 HG LEU A 125 6.280 10.041 -2.733 1.00 74.42 H new ATOM 0 HD11 LEU A 125 4.158 9.099 -1.853 1.00 12.11 H new ATOM 0 HD12 LEU A 125 5.298 9.520 -0.553 1.00 12.11 H new ATOM 0 HD13 LEU A 125 3.913 10.582 -0.900 1.00 12.11 H new ATOM 0 HD21 LEU A 125 4.174 10.297 -3.976 1.00 62.14 H new ATOM 0 HD22 LEU A 125 3.907 11.865 -3.178 1.00 62.14 H new ATOM 0 HD23 LEU A 125 5.303 11.643 -4.260 1.00 62.14 H new ATOM 77 N GLY A 126 7.058 14.481 -0.421 1.00 52.21 N ATOM 78 CA GLY A 126 8.149 15.085 0.316 1.00 41.53 C ATOM 79 C GLY A 126 9.240 14.086 0.685 1.00 75.44 C ATOM 80 O GLY A 126 9.646 14.039 1.843 1.00 64.44 O ATOM 0 H GLY A 126 6.976 14.809 -1.383 1.00 52.21 H new ATOM 0 HA2 GLY A 126 8.584 15.887 -0.281 1.00 41.53 H new ATOM 0 HA3 GLY A 126 7.758 15.541 1.226 1.00 41.53 H new ATOM 84 N GLY A 127 9.762 13.341 -0.296 1.00 40.15 N ATOM 85 CA GLY A 127 11.005 12.576 -0.144 1.00 63.22 C ATOM 86 C GLY A 127 10.849 11.067 -0.310 1.00 22.01 C ATOM 87 O GLY A 127 11.837 10.338 -0.236 1.00 74.44 O ATOM 0 H GLY A 127 9.335 13.251 -1.218 1.00 40.15 H new ATOM 0 HA2 GLY A 127 11.729 12.935 -0.876 1.00 63.22 H new ATOM 0 HA3 GLY A 127 11.422 12.778 0.843 1.00 63.22 H new ATOM 91 N TYR A 128 9.638 10.585 -0.578 1.00 12.24 N ATOM 92 CA TYR A 128 9.347 9.176 -0.812 1.00 24.41 C ATOM 93 C TYR A 128 9.421 8.906 -2.321 1.00 54.53 C ATOM 94 O TYR A 128 9.314 9.827 -3.143 1.00 40.34 O ATOM 95 CB TYR A 128 7.955 8.805 -0.269 1.00 32.13 C ATOM 96 CG TYR A 128 7.651 9.145 1.186 1.00 64.32 C ATOM 97 CD1 TYR A 128 7.675 10.469 1.663 1.00 43.51 C ATOM 98 CD2 TYR A 128 7.344 8.114 2.089 1.00 53.52 C ATOM 99 CE1 TYR A 128 7.507 10.751 3.023 1.00 20.34 C ATOM 100 CE2 TYR A 128 7.181 8.382 3.457 1.00 15.43 C ATOM 101 CZ TYR A 128 7.293 9.704 3.943 1.00 53.44 C ATOM 102 OH TYR A 128 7.303 9.976 5.277 1.00 64.01 O ATOM 0 H TYR A 128 8.812 11.180 -0.640 1.00 12.24 H new ATOM 0 HA TYR A 128 10.079 8.562 -0.287 1.00 24.41 H new ATOM 0 HB2 TYR A 128 7.209 9.298 -0.892 1.00 32.13 H new ATOM 0 HB3 TYR A 128 7.819 7.731 -0.399 1.00 32.13 H new ATOM 0 HD1 TYR A 128 7.826 11.281 0.967 1.00 43.51 H new ATOM 0 HD2 TYR A 128 7.232 7.103 1.726 1.00 53.52 H new ATOM 0 HE1 TYR A 128 7.541 11.773 3.369 1.00 20.34 H new ATOM 0 HE2 TYR A 128 6.969 7.574 4.141 1.00 15.43 H new ATOM 0 HH TYR A 128 7.140 9.151 5.780 1.00 64.01 H new ATOM 112 N MET A 129 9.601 7.642 -2.677 1.00 22.22 N ATOM 113 CA MET A 129 9.490 7.051 -3.999 1.00 52.12 C ATOM 114 C MET A 129 8.083 6.460 -4.149 1.00 71.35 C ATOM 115 O MET A 129 7.332 6.348 -3.179 1.00 60.03 O ATOM 116 CB MET A 129 10.564 5.956 -4.131 1.00 33.12 C ATOM 117 CG MET A 129 11.963 6.561 -4.290 1.00 40.11 C ATOM 118 SD MET A 129 13.315 5.359 -4.274 1.00 64.21 S ATOM 119 CE MET A 129 13.453 5.130 -2.488 1.00 41.15 C ATOM 0 H MET A 129 9.852 6.940 -1.980 1.00 22.22 H new ATOM 0 HA MET A 129 9.645 7.794 -4.782 1.00 52.12 H new ATOM 0 HB2 MET A 129 10.541 5.314 -3.250 1.00 33.12 H new ATOM 0 HB3 MET A 129 10.339 5.325 -4.991 1.00 33.12 H new ATOM 0 HG2 MET A 129 11.999 7.115 -5.228 1.00 40.11 H new ATOM 0 HG3 MET A 129 12.126 7.281 -3.488 1.00 40.11 H new ATOM 0 HE1 MET A 129 13.681 4.086 -2.272 1.00 41.15 H new ATOM 0 HE2 MET A 129 14.251 5.764 -2.100 1.00 41.15 H new ATOM 0 HE3 MET A 129 12.510 5.401 -2.012 1.00 41.15 H new ATOM 129 N LEU A 130 7.720 6.092 -5.378 1.00 14.42 N ATOM 130 CA LEU A 130 6.428 5.544 -5.774 1.00 0.04 C ATOM 131 C LEU A 130 6.681 4.267 -6.567 1.00 63.32 C ATOM 132 O LEU A 130 7.369 4.305 -7.590 1.00 75.05 O ATOM 133 CB LEU A 130 5.711 6.625 -6.590 1.00 74.11 C ATOM 134 CG LEU A 130 4.356 6.309 -7.248 1.00 74.55 C ATOM 135 CD1 LEU A 130 4.519 5.975 -8.733 1.00 71.52 C ATOM 136 CD2 LEU A 130 3.523 5.263 -6.513 1.00 55.23 C ATOM 0 H LEU A 130 8.360 6.174 -6.168 1.00 14.42 H new ATOM 0 HA LEU A 130 5.795 5.280 -4.927 1.00 0.04 H new ATOM 0 HB2 LEU A 130 5.563 7.483 -5.935 1.00 74.11 H new ATOM 0 HB3 LEU A 130 6.391 6.941 -7.381 1.00 74.11 H new ATOM 0 HG LEU A 130 3.776 7.228 -7.168 1.00 74.55 H new ATOM 0 HD11 LEU A 130 3.543 5.757 -9.166 1.00 71.52 H new ATOM 0 HD12 LEU A 130 4.964 6.825 -9.250 1.00 71.52 H new ATOM 0 HD13 LEU A 130 5.166 5.105 -8.841 1.00 71.52 H new ATOM 0 HD21 LEU A 130 2.586 5.103 -7.047 1.00 55.23 H new ATOM 0 HD22 LEU A 130 4.077 4.326 -6.464 1.00 55.23 H new ATOM 0 HD23 LEU A 130 3.310 5.612 -5.503 1.00 55.23 H new ATOM 148 N GLY A 131 6.172 3.147 -6.059 1.00 43.45 N ATOM 149 CA GLY A 131 6.392 1.811 -6.577 1.00 63.23 C ATOM 150 C GLY A 131 5.582 1.510 -7.827 1.00 1.14 C ATOM 151 O GLY A 131 4.856 2.356 -8.363 1.00 2.41 O ATOM 0 H GLY A 131 5.568 3.153 -5.237 1.00 43.45 H new ATOM 0 HA2 GLY A 131 7.452 1.685 -6.800 1.00 63.23 H new ATOM 0 HA3 GLY A 131 6.140 1.084 -5.805 1.00 63.23 H new ATOM 155 N SER A 132 5.740 0.283 -8.304 1.00 14.12 N ATOM 156 CA SER A 132 5.226 -0.196 -9.561 1.00 1.44 C ATOM 157 C SER A 132 3.724 -0.413 -9.419 1.00 64.54 C ATOM 158 O SER A 132 3.227 -0.852 -8.378 1.00 31.41 O ATOM 159 CB SER A 132 5.941 -1.496 -9.948 1.00 32.54 C ATOM 160 OG SER A 132 7.242 -1.619 -9.375 1.00 20.53 O ATOM 0 H SER A 132 6.256 -0.433 -7.793 1.00 14.12 H new ATOM 0 HA SER A 132 5.406 0.533 -10.352 1.00 1.44 H new ATOM 0 HB2 SER A 132 5.332 -2.344 -9.634 1.00 32.54 H new ATOM 0 HB3 SER A 132 6.024 -1.547 -11.034 1.00 32.54 H new ATOM 0 HG SER A 132 7.855 -2.006 -10.035 1.00 20.53 H new ATOM 166 N ALA A 133 2.997 -0.096 -10.478 1.00 20.21 N ATOM 167 CA ALA A 133 1.563 -0.258 -10.532 1.00 44.43 C ATOM 168 C ALA A 133 1.240 -1.691 -10.913 1.00 75.25 C ATOM 169 O ALA A 133 1.576 -2.127 -12.020 1.00 64.51 O ATOM 170 CB ALA A 133 1.048 0.736 -11.549 1.00 40.42 C ATOM 0 H ALA A 133 3.398 0.286 -11.334 1.00 20.21 H new ATOM 0 HA ALA A 133 1.086 -0.068 -9.570 1.00 44.43 H new ATOM 0 HB1 ALA A 133 -0.036 0.650 -11.625 1.00 40.42 H new ATOM 0 HB2 ALA A 133 1.311 1.746 -11.236 1.00 40.42 H new ATOM 0 HB3 ALA A 133 1.497 0.529 -12.520 1.00 40.42 H new ATOM 176 N MET A 134 0.645 -2.430 -9.982 1.00 43.21 N ATOM 177 CA MET A 134 0.550 -3.881 -10.034 1.00 60.53 C ATOM 178 C MET A 134 -0.910 -4.329 -10.103 1.00 72.21 C ATOM 179 O MET A 134 -1.816 -3.495 -10.195 1.00 21.41 O ATOM 180 CB MET A 134 1.346 -4.489 -8.869 1.00 31.34 C ATOM 181 CG MET A 134 0.881 -4.070 -7.468 1.00 31.41 C ATOM 182 SD MET A 134 1.368 -5.218 -6.154 1.00 55.31 S ATOM 183 CE MET A 134 2.896 -4.384 -5.683 1.00 55.12 C ATOM 0 H MET A 134 0.207 -2.026 -9.154 1.00 43.21 H new ATOM 0 HA MET A 134 1.005 -4.258 -10.950 1.00 60.53 H new ATOM 0 HB2 MET A 134 1.293 -5.575 -8.942 1.00 31.34 H new ATOM 0 HB3 MET A 134 2.394 -4.213 -8.984 1.00 31.34 H new ATOM 0 HG2 MET A 134 1.286 -3.083 -7.242 1.00 31.41 H new ATOM 0 HG3 MET A 134 -0.205 -3.976 -7.470 1.00 31.41 H new ATOM 0 HE1 MET A 134 3.392 -4.951 -4.895 1.00 55.12 H new ATOM 0 HE2 MET A 134 3.554 -4.314 -6.549 1.00 55.12 H new ATOM 0 HE3 MET A 134 2.667 -3.382 -5.320 1.00 55.12 H new ATOM 193 N SER A 135 -1.158 -5.640 -10.132 1.00 33.51 N ATOM 194 CA SER A 135 -2.513 -6.152 -9.953 1.00 0.33 C ATOM 195 C SER A 135 -2.891 -5.935 -8.493 1.00 2.34 C ATOM 196 O SER A 135 -2.039 -6.016 -7.599 1.00 15.01 O ATOM 197 CB SER A 135 -2.608 -7.635 -10.330 1.00 13.30 C ATOM 198 OG SER A 135 -3.947 -8.093 -10.342 1.00 40.14 O ATOM 0 H SER A 135 -0.447 -6.357 -10.276 1.00 33.51 H new ATOM 0 HA SER A 135 -3.203 -5.623 -10.611 1.00 0.33 H new ATOM 0 HB2 SER A 135 -2.163 -7.789 -11.313 1.00 13.30 H new ATOM 0 HB3 SER A 135 -2.028 -8.227 -9.622 1.00 13.30 H new ATOM 0 HG SER A 135 -3.966 -9.041 -10.588 1.00 40.14 H new ATOM 204 N ARG A 136 -4.177 -5.695 -8.257 1.00 34.10 N ATOM 205 CA ARG A 136 -4.704 -5.622 -6.901 1.00 44.41 C ATOM 206 C ARG A 136 -4.916 -7.055 -6.403 1.00 44.03 C ATOM 207 O ARG A 136 -5.375 -7.883 -7.193 1.00 11.11 O ATOM 208 CB ARG A 136 -5.960 -4.729 -6.809 1.00 40.04 C ATOM 209 CG ARG A 136 -7.255 -5.205 -7.499 1.00 0.10 C ATOM 210 CD ARG A 136 -7.279 -4.923 -9.004 1.00 42.01 C ATOM 211 NE ARG A 136 -8.557 -5.308 -9.622 1.00 4.14 N ATOM 212 CZ ARG A 136 -8.888 -5.105 -10.901 1.00 52.21 C ATOM 213 NH1 ARG A 136 -8.101 -4.427 -11.728 1.00 31.23 N ATOM 214 NH2 ARG A 136 -10.017 -5.599 -11.387 1.00 11.32 N ATOM 0 H ARG A 136 -4.873 -5.548 -8.988 1.00 34.10 H new ATOM 0 HA ARG A 136 -3.990 -5.130 -6.240 1.00 44.41 H new ATOM 0 HB2 ARG A 136 -6.183 -4.579 -5.753 1.00 40.04 H new ATOM 0 HB3 ARG A 136 -5.704 -3.753 -7.222 1.00 40.04 H new ATOM 0 HG2 ARG A 136 -7.373 -6.276 -7.335 1.00 0.10 H new ATOM 0 HG3 ARG A 136 -8.109 -4.715 -7.031 1.00 0.10 H new ATOM 0 HD2 ARG A 136 -7.100 -3.862 -9.176 1.00 42.01 H new ATOM 0 HD3 ARG A 136 -6.466 -5.466 -9.486 1.00 42.01 H new ATOM 0 HE ARG A 136 -9.246 -5.767 -9.026 1.00 4.14 H new ATOM 0 HH11 ARG A 136 -7.217 -4.045 -11.392 1.00 31.23 H new ATOM 0 HH12 ARG A 136 -8.381 -4.288 -12.699 1.00 31.23 H new ATOM 0 HH21 ARG A 136 -10.639 -6.138 -10.784 1.00 11.32 H new ATOM 0 HH22 ARG A 136 -10.264 -5.441 -12.364 1.00 11.32 H new ATOM 228 N PRO A 137 -4.611 -7.364 -5.132 1.00 62.34 N ATOM 229 CA PRO A 137 -4.813 -8.701 -4.584 1.00 20.41 C ATOM 230 C PRO A 137 -6.311 -9.006 -4.511 1.00 4.12 C ATOM 231 O PRO A 137 -7.106 -8.103 -4.266 1.00 74.23 O ATOM 232 CB PRO A 137 -4.174 -8.661 -3.188 1.00 62.35 C ATOM 233 CG PRO A 137 -4.272 -7.187 -2.794 1.00 23.53 C ATOM 234 CD PRO A 137 -4.094 -6.457 -4.119 1.00 40.23 C ATOM 0 HA PRO A 137 -4.366 -9.484 -5.196 1.00 20.41 H new ATOM 0 HB2 PRO A 137 -4.706 -9.301 -2.484 1.00 62.35 H new ATOM 0 HB3 PRO A 137 -3.139 -9.003 -3.210 1.00 62.35 H new ATOM 0 HG2 PRO A 137 -5.233 -6.957 -2.334 1.00 23.53 H new ATOM 0 HG3 PRO A 137 -3.500 -6.911 -2.076 1.00 23.53 H new ATOM 0 HD2 PRO A 137 -4.638 -5.512 -4.123 1.00 40.23 H new ATOM 0 HD3 PRO A 137 -3.045 -6.222 -4.300 1.00 40.23 H new ATOM 242 N MET A 138 -6.717 -10.265 -4.660 1.00 11.31 N ATOM 243 CA MET A 138 -8.063 -10.708 -4.337 1.00 20.34 C ATOM 244 C MET A 138 -8.108 -10.853 -2.819 1.00 60.13 C ATOM 245 O MET A 138 -7.490 -11.779 -2.290 1.00 55.11 O ATOM 246 CB MET A 138 -8.361 -12.018 -5.080 1.00 74.51 C ATOM 247 CG MET A 138 -9.670 -12.731 -4.719 1.00 11.41 C ATOM 248 SD MET A 138 -11.224 -11.914 -5.182 1.00 4.02 S ATOM 249 CE MET A 138 -11.407 -10.778 -3.793 1.00 15.34 C ATOM 0 H MET A 138 -6.114 -11.009 -5.011 1.00 11.31 H new ATOM 0 HA MET A 138 -8.832 -10.003 -4.653 1.00 20.34 H new ATOM 0 HB2 MET A 138 -8.371 -11.808 -6.150 1.00 74.51 H new ATOM 0 HB3 MET A 138 -7.536 -12.707 -4.899 1.00 74.51 H new ATOM 0 HG2 MET A 138 -9.656 -13.716 -5.185 1.00 11.41 H new ATOM 0 HG3 MET A 138 -9.681 -12.889 -3.641 1.00 11.41 H new ATOM 0 HE1 MET A 138 -12.466 -10.599 -3.607 1.00 15.34 H new ATOM 0 HE2 MET A 138 -10.951 -11.214 -2.904 1.00 15.34 H new ATOM 0 HE3 MET A 138 -10.915 -9.834 -4.028 1.00 15.34 H new ATOM 259 N ILE A 139 -8.756 -9.914 -2.124 1.00 54.45 N ATOM 260 CA ILE A 139 -8.934 -9.952 -0.678 1.00 13.30 C ATOM 261 C ILE A 139 -10.368 -10.364 -0.408 1.00 74.11 C ATOM 262 O ILE A 139 -11.303 -9.722 -0.881 1.00 75.35 O ATOM 263 CB ILE A 139 -8.564 -8.619 0.005 1.00 62.23 C ATOM 264 CG1 ILE A 139 -7.209 -8.140 -0.543 1.00 60.25 C ATOM 265 CG2 ILE A 139 -8.533 -8.842 1.526 1.00 14.44 C ATOM 266 CD1 ILE A 139 -6.366 -7.371 0.468 1.00 54.05 C ATOM 0 H ILE A 139 -9.177 -9.094 -2.562 1.00 54.45 H new ATOM 0 HA ILE A 139 -8.248 -10.678 -0.242 1.00 13.30 H new ATOM 0 HB ILE A 139 -9.300 -7.843 -0.207 1.00 62.23 H new ATOM 0 HG12 ILE A 139 -6.643 -9.005 -0.889 1.00 60.25 H new ATOM 0 HG13 ILE A 139 -7.384 -7.505 -1.412 1.00 60.25 H new ATOM 0 HG21 ILE A 139 -8.273 -7.909 2.025 1.00 14.44 H new ATOM 0 HG22 ILE A 139 -9.514 -9.174 1.865 1.00 14.44 H new ATOM 0 HG23 ILE A 139 -7.790 -9.602 1.767 1.00 14.44 H new ATOM 0 HD11 ILE A 139 -5.427 -7.069 0.004 1.00 54.05 H new ATOM 0 HD12 ILE A 139 -6.910 -6.486 0.797 1.00 54.05 H new ATOM 0 HD13 ILE A 139 -6.157 -8.008 1.327 1.00 54.05 H new ATOM 278 N HIS A 140 -10.531 -11.471 0.305 1.00 53.05 N ATOM 279 CA HIS A 140 -11.824 -12.106 0.531 1.00 41.43 C ATOM 280 C HIS A 140 -11.987 -12.579 1.971 1.00 15.24 C ATOM 281 O HIS A 140 -12.808 -13.465 2.195 1.00 54.41 O ATOM 282 CB HIS A 140 -12.076 -13.203 -0.513 1.00 33.33 C ATOM 283 CG HIS A 140 -10.923 -14.129 -0.842 1.00 53.22 C ATOM 284 ND1 HIS A 140 -10.791 -14.819 -2.027 1.00 53.13 N ATOM 285 CD2 HIS A 140 -9.813 -14.397 -0.083 1.00 31.23 C ATOM 286 CE1 HIS A 140 -9.620 -15.473 -1.995 1.00 1.11 C ATOM 287 NE2 HIS A 140 -8.990 -15.250 -0.829 1.00 24.44 N ATOM 0 H HIS A 140 -9.755 -11.962 0.750 1.00 53.05 H new ATOM 0 HA HIS A 140 -12.605 -11.358 0.392 1.00 41.43 H new ATOM 0 HB2 HIS A 140 -12.910 -13.813 -0.166 1.00 33.33 H new ATOM 0 HB3 HIS A 140 -12.396 -12.722 -1.437 1.00 33.33 H new ATOM 0 HD2 HIS A 140 -9.610 -14.020 0.908 1.00 31.23 H new ATOM 0 HE1 HIS A 140 -9.238 -16.091 -2.794 1.00 1.11 H new ATOM 0 HE2 HIS A 140 -8.087 -15.629 -0.543 1.00 24.44 H new ATOM 295 N PHE A 141 -11.215 -11.972 2.892 1.00 24.50 N ATOM 296 CA PHE A 141 -11.311 -11.820 4.363 1.00 4.22 C ATOM 297 C PHE A 141 -11.820 -13.025 5.178 1.00 14.23 C ATOM 298 O PHE A 141 -12.110 -12.904 6.373 1.00 12.04 O ATOM 299 CB PHE A 141 -12.111 -10.550 4.714 1.00 34.41 C ATOM 300 CG PHE A 141 -11.685 -9.264 4.024 1.00 23.34 C ATOM 301 CD1 PHE A 141 -12.008 -9.040 2.673 1.00 71.32 C ATOM 302 CD2 PHE A 141 -11.020 -8.253 4.743 1.00 31.53 C ATOM 303 CE1 PHE A 141 -11.645 -7.845 2.040 1.00 51.31 C ATOM 304 CE2 PHE A 141 -10.678 -7.045 4.116 1.00 61.12 C ATOM 305 CZ PHE A 141 -10.975 -6.845 2.760 1.00 51.33 C ATOM 0 H PHE A 141 -10.371 -11.499 2.568 1.00 24.50 H new ATOM 0 HA PHE A 141 -10.270 -11.740 4.676 1.00 4.22 H new ATOM 0 HB2 PHE A 141 -13.159 -10.732 4.478 1.00 34.41 H new ATOM 0 HB3 PHE A 141 -12.049 -10.395 5.791 1.00 34.41 H new ATOM 0 HD1 PHE A 141 -12.542 -9.798 2.118 1.00 71.32 H new ATOM 0 HD2 PHE A 141 -10.772 -8.408 5.783 1.00 31.53 H new ATOM 0 HE1 PHE A 141 -11.881 -7.693 0.997 1.00 51.31 H new ATOM 0 HE2 PHE A 141 -10.185 -6.267 4.679 1.00 61.12 H new ATOM 0 HZ PHE A 141 -10.689 -5.925 2.272 1.00 51.33 H new ATOM 315 N GLY A 142 -12.017 -14.182 4.556 1.00 53.02 N ATOM 316 CA GLY A 142 -12.959 -15.201 4.985 1.00 60.51 C ATOM 317 C GLY A 142 -14.413 -14.733 5.081 1.00 13.12 C ATOM 318 O GLY A 142 -15.251 -15.539 5.493 1.00 43.13 O ATOM 0 H GLY A 142 -11.507 -14.442 3.712 1.00 53.02 H new ATOM 0 HA2 GLY A 142 -12.907 -16.039 4.290 1.00 60.51 H new ATOM 0 HA3 GLY A 142 -12.648 -15.576 5.960 1.00 60.51 H new ATOM 322 N ASN A 143 -14.762 -13.474 4.787 1.00 44.43 N ATOM 323 CA ASN A 143 -16.102 -12.978 5.028 1.00 13.30 C ATOM 324 C ASN A 143 -16.988 -13.168 3.810 1.00 40.41 C ATOM 325 O ASN A 143 -16.511 -13.225 2.672 1.00 61.45 O ATOM 326 CB ASN A 143 -16.070 -11.495 5.411 1.00 42.02 C ATOM 327 CG ASN A 143 -16.959 -11.272 6.604 1.00 40.01 C ATOM 328 OD1 ASN A 143 -18.112 -11.679 6.598 1.00 74.45 O ATOM 329 ND2 ASN A 143 -16.439 -10.652 7.640 1.00 60.32 N ATOM 0 H ASN A 143 -14.126 -12.787 4.381 1.00 44.43 H new ATOM 0 HA ASN A 143 -16.518 -13.554 5.855 1.00 13.30 H new ATOM 0 HB2 ASN A 143 -15.050 -11.189 5.641 1.00 42.02 H new ATOM 0 HB3 ASN A 143 -16.405 -10.884 4.573 1.00 42.02 H new ATOM 0 HD21 ASN A 143 -17.002 -10.496 8.476 1.00 60.32 H new ATOM 0 HD22 ASN A 143 -15.473 -10.327 7.608 1.00 60.32 H new ATOM 336 N ASP A 144 -18.293 -13.126 4.042 1.00 12.13 N ATOM 337 CA ASP A 144 -19.271 -13.008 2.975 1.00 44.11 C ATOM 338 C ASP A 144 -19.317 -11.581 2.450 1.00 33.33 C ATOM 339 O ASP A 144 -19.233 -11.369 1.242 1.00 53.22 O ATOM 340 CB ASP A 144 -20.646 -13.437 3.488 1.00 44.35 C ATOM 341 CG ASP A 144 -21.621 -13.596 2.328 1.00 15.31 C ATOM 342 OD1 ASP A 144 -22.243 -12.604 1.877 1.00 64.41 O ATOM 343 OD2 ASP A 144 -21.812 -14.758 1.917 1.00 32.52 O ATOM 0 H ASP A 144 -18.701 -13.173 4.976 1.00 12.13 H new ATOM 0 HA ASP A 144 -18.981 -13.662 2.152 1.00 44.11 H new ATOM 0 HB2 ASP A 144 -20.561 -14.378 4.031 1.00 44.35 H new ATOM 0 HB3 ASP A 144 -21.026 -12.696 4.192 1.00 44.35 H new ATOM 348 N TRP A 145 -19.428 -10.597 3.343 1.00 12.11 N ATOM 349 CA TRP A 145 -19.760 -9.246 2.908 1.00 51.02 C ATOM 350 C TRP A 145 -18.502 -8.497 2.493 1.00 31.44 C ATOM 351 O TRP A 145 -18.526 -7.787 1.496 1.00 3.33 O ATOM 352 CB TRP A 145 -20.541 -8.486 3.978 1.00 33.11 C ATOM 353 CG TRP A 145 -19.798 -8.247 5.245 1.00 14.24 C ATOM 354 CD1 TRP A 145 -19.626 -9.157 6.220 1.00 52.23 C ATOM 355 CD2 TRP A 145 -19.026 -7.083 5.644 1.00 1.01 C ATOM 356 NE1 TRP A 145 -18.899 -8.599 7.252 1.00 1.01 N ATOM 357 CE2 TRP A 145 -18.504 -7.314 6.947 1.00 15.03 C ATOM 358 CE3 TRP A 145 -18.628 -5.902 4.990 1.00 15.12 C ATOM 359 CZ2 TRP A 145 -17.673 -6.384 7.581 1.00 73.21 C ATOM 360 CZ3 TRP A 145 -17.817 -4.949 5.631 1.00 60.11 C ATOM 361 CH2 TRP A 145 -17.354 -5.181 6.937 1.00 75.11 C ATOM 0 H TRP A 145 -19.296 -10.708 4.348 1.00 12.11 H new ATOM 0 HA TRP A 145 -20.411 -9.321 2.037 1.00 51.02 H new ATOM 0 HB2 TRP A 145 -20.849 -7.524 3.568 1.00 33.11 H new ATOM 0 HB3 TRP A 145 -21.451 -9.041 4.206 1.00 33.11 H new ATOM 0 HD1 TRP A 145 -20.000 -10.170 6.199 1.00 52.23 H new ATOM 0 HE1 TRP A 145 -18.682 -9.076 8.127 1.00 1.01 H new ATOM 0 HE3 TRP A 145 -18.952 -5.724 3.975 1.00 15.12 H new ATOM 0 HZ2 TRP A 145 -17.278 -6.593 8.564 1.00 73.21 H new ATOM 0 HZ3 TRP A 145 -17.549 -4.037 5.118 1.00 60.11 H new ATOM 0 HH2 TRP A 145 -16.756 -4.437 7.442 1.00 75.11 H new ATOM 372 N GLU A 146 -17.394 -8.672 3.220 1.00 23.43 N ATOM 373 CA GLU A 146 -16.129 -8.006 2.910 1.00 22.51 C ATOM 374 C GLU A 146 -15.607 -8.425 1.527 1.00 62.43 C ATOM 375 O GLU A 146 -14.887 -7.671 0.885 1.00 2.00 O ATOM 376 CB GLU A 146 -15.076 -8.267 4.004 1.00 33.10 C ATOM 377 CG GLU A 146 -15.430 -7.601 5.334 1.00 42.03 C ATOM 378 CD GLU A 146 -14.459 -7.917 6.484 1.00 23.21 C ATOM 379 OE1 GLU A 146 -14.266 -9.116 6.812 1.00 63.52 O ATOM 380 OE2 GLU A 146 -13.953 -6.968 7.119 1.00 2.14 O ATOM 0 H GLU A 146 -17.351 -9.279 4.039 1.00 23.43 H new ATOM 0 HA GLU A 146 -16.318 -6.933 2.884 1.00 22.51 H new ATOM 0 HB2 GLU A 146 -14.975 -9.342 4.156 1.00 33.10 H new ATOM 0 HB3 GLU A 146 -14.107 -7.900 3.665 1.00 33.10 H new ATOM 0 HG2 GLU A 146 -15.461 -6.521 5.188 1.00 42.03 H new ATOM 0 HG3 GLU A 146 -16.433 -7.912 5.626 1.00 42.03 H new ATOM 387 N ASP A 147 -16.011 -9.607 1.044 1.00 55.33 N ATOM 388 CA ASP A 147 -15.684 -10.125 -0.283 1.00 0.10 C ATOM 389 C ASP A 147 -16.308 -9.203 -1.309 1.00 61.24 C ATOM 390 O ASP A 147 -15.606 -8.539 -2.072 1.00 41.32 O ATOM 391 CB ASP A 147 -16.224 -11.544 -0.432 1.00 13.13 C ATOM 392 CG ASP A 147 -16.010 -12.155 -1.819 1.00 0.02 C ATOM 393 OD1 ASP A 147 -16.538 -11.636 -2.832 1.00 54.14 O ATOM 394 OD2 ASP A 147 -15.379 -13.234 -1.823 1.00 53.05 O ATOM 0 H ASP A 147 -16.592 -10.246 1.586 1.00 55.33 H new ATOM 0 HA ASP A 147 -14.604 -10.161 -0.428 1.00 0.10 H new ATOM 0 HB2 ASP A 147 -15.746 -12.182 0.311 1.00 13.13 H new ATOM 0 HB3 ASP A 147 -17.291 -11.540 -0.210 1.00 13.13 H new ATOM 399 N ARG A 148 -17.642 -9.125 -1.279 1.00 0.43 N ATOM 400 CA ARG A 148 -18.360 -8.333 -2.258 1.00 12.22 C ATOM 401 C ARG A 148 -18.007 -6.850 -2.118 1.00 12.01 C ATOM 402 O ARG A 148 -17.933 -6.161 -3.127 1.00 11.31 O ATOM 403 CB ARG A 148 -19.864 -8.647 -2.205 1.00 54.03 C ATOM 404 CG ARG A 148 -20.642 -7.670 -1.335 1.00 32.31 C ATOM 405 CD ARG A 148 -22.068 -8.140 -1.090 1.00 63.22 C ATOM 406 NE ARG A 148 -22.891 -6.966 -0.805 1.00 42.43 N ATOM 407 CZ ARG A 148 -23.724 -6.762 0.210 1.00 53.03 C ATOM 408 NH1 ARG A 148 -23.962 -7.692 1.128 1.00 72.11 N ATOM 409 NH2 ARG A 148 -24.306 -5.574 0.284 1.00 75.53 N ATOM 0 H ARG A 148 -18.232 -9.597 -0.594 1.00 0.43 H new ATOM 0 HA ARG A 148 -18.043 -8.607 -3.264 1.00 12.22 H new ATOM 0 HB2 ARG A 148 -20.270 -8.628 -3.216 1.00 54.03 H new ATOM 0 HB3 ARG A 148 -20.006 -9.658 -1.823 1.00 54.03 H new ATOM 0 HG2 ARG A 148 -20.131 -7.548 -0.380 1.00 32.31 H new ATOM 0 HG3 ARG A 148 -20.660 -6.691 -1.815 1.00 32.31 H new ATOM 0 HD2 ARG A 148 -22.450 -8.669 -1.963 1.00 63.22 H new ATOM 0 HD3 ARG A 148 -22.100 -8.839 -0.254 1.00 63.22 H new ATOM 0 HE ARG A 148 -22.816 -6.201 -1.475 1.00 42.43 H new ATOM 0 HH11 ARG A 148 -23.499 -8.599 1.068 1.00 72.11 H new ATOM 0 HH12 ARG A 148 -24.608 -7.499 1.893 1.00 72.11 H new ATOM 0 HH21 ARG A 148 -24.107 -4.864 -0.420 1.00 75.53 H new ATOM 0 HH22 ARG A 148 -24.953 -5.370 1.045 1.00 75.53 H new ATOM 423 N TYR A 149 -17.796 -6.368 -0.891 1.00 0.20 N ATOM 424 CA TYR A 149 -17.468 -4.991 -0.570 1.00 42.15 C ATOM 425 C TYR A 149 -16.158 -4.631 -1.269 1.00 64.41 C ATOM 426 O TYR A 149 -16.120 -3.675 -2.044 1.00 3.14 O ATOM 427 CB TYR A 149 -17.428 -4.860 0.965 1.00 34.50 C ATOM 428 CG TYR A 149 -17.199 -3.490 1.574 1.00 73.34 C ATOM 429 CD1 TYR A 149 -16.095 -2.720 1.180 1.00 55.04 C ATOM 430 CD2 TYR A 149 -18.011 -3.032 2.634 1.00 21.50 C ATOM 431 CE1 TYR A 149 -15.837 -1.485 1.770 1.00 13.13 C ATOM 432 CE2 TYR A 149 -17.737 -1.799 3.258 1.00 11.04 C ATOM 433 CZ TYR A 149 -16.690 -0.993 2.779 1.00 12.02 C ATOM 434 OH TYR A 149 -16.536 0.253 3.287 1.00 31.53 O ATOM 0 H TYR A 149 -17.853 -6.960 -0.062 1.00 0.20 H new ATOM 0 HA TYR A 149 -18.212 -4.280 -0.929 1.00 42.15 H new ATOM 0 HB2 TYR A 149 -18.372 -5.241 1.354 1.00 34.50 H new ATOM 0 HB3 TYR A 149 -16.643 -5.520 1.333 1.00 34.50 H new ATOM 0 HD1 TYR A 149 -15.436 -3.090 0.409 1.00 55.04 H new ATOM 0 HD2 TYR A 149 -18.846 -3.630 2.968 1.00 21.50 H new ATOM 0 HE1 TYR A 149 -14.983 -0.904 1.454 1.00 13.13 H new ATOM 0 HE2 TYR A 149 -18.329 -1.474 4.101 1.00 11.04 H new ATOM 0 HH TYR A 149 -16.326 0.878 2.562 1.00 31.53 H new ATOM 444 N TYR A 150 -15.076 -5.361 -0.989 1.00 64.54 N ATOM 445 CA TYR A 150 -13.815 -5.231 -1.707 1.00 42.33 C ATOM 446 C TYR A 150 -14.033 -5.329 -3.217 1.00 52.32 C ATOM 447 O TYR A 150 -13.675 -4.394 -3.926 1.00 52.45 O ATOM 448 CB TYR A 150 -12.778 -6.255 -1.221 1.00 72.55 C ATOM 449 CG TYR A 150 -11.466 -6.167 -1.980 1.00 11.00 C ATOM 450 CD1 TYR A 150 -10.688 -4.996 -1.905 1.00 64.12 C ATOM 451 CD2 TYR A 150 -11.060 -7.226 -2.810 1.00 24.34 C ATOM 452 CE1 TYR A 150 -9.563 -4.841 -2.740 1.00 0.40 C ATOM 453 CE2 TYR A 150 -9.943 -7.085 -3.645 1.00 61.52 C ATOM 454 CZ TYR A 150 -9.216 -5.877 -3.631 1.00 52.15 C ATOM 455 OH TYR A 150 -8.147 -5.727 -4.448 1.00 21.53 O ATOM 0 H TYR A 150 -15.055 -6.064 -0.250 1.00 64.54 H new ATOM 0 HA TYR A 150 -13.413 -4.241 -1.491 1.00 42.33 H new ATOM 0 HB2 TYR A 150 -12.590 -6.099 -0.159 1.00 72.55 H new ATOM 0 HB3 TYR A 150 -13.188 -7.259 -1.328 1.00 72.55 H new ATOM 0 HD1 TYR A 150 -10.953 -4.216 -1.207 1.00 64.12 H new ATOM 0 HD2 TYR A 150 -11.612 -8.154 -2.804 1.00 24.34 H new ATOM 0 HE1 TYR A 150 -8.973 -3.938 -2.698 1.00 0.40 H new ATOM 0 HE2 TYR A 150 -9.642 -7.895 -4.293 1.00 61.52 H new ATOM 0 HH TYR A 150 -7.517 -6.463 -4.301 1.00 21.53 H new ATOM 465 N ARG A 151 -14.635 -6.412 -3.720 1.00 40.33 N ATOM 466 CA ARG A 151 -14.825 -6.625 -5.157 1.00 42.34 C ATOM 467 C ARG A 151 -15.562 -5.476 -5.841 1.00 35.53 C ATOM 468 O ARG A 151 -15.291 -5.220 -7.013 1.00 73.43 O ATOM 469 CB ARG A 151 -15.608 -7.920 -5.402 1.00 62.31 C ATOM 470 CG ARG A 151 -14.747 -9.190 -5.336 1.00 22.10 C ATOM 471 CD ARG A 151 -15.447 -10.367 -6.027 1.00 60.34 C ATOM 472 NE ARG A 151 -15.552 -10.143 -7.483 1.00 33.20 N ATOM 473 CZ ARG A 151 -16.494 -10.605 -8.312 1.00 35.21 C ATOM 474 NH1 ARG A 151 -17.468 -11.403 -7.889 1.00 14.34 N ATOM 475 NH2 ARG A 151 -16.440 -10.257 -9.592 1.00 32.34 N ATOM 0 H ARG A 151 -15.004 -7.166 -3.141 1.00 40.33 H new ATOM 0 HA ARG A 151 -13.826 -6.687 -5.588 1.00 42.34 H new ATOM 0 HB2 ARG A 151 -16.406 -7.995 -4.664 1.00 62.31 H new ATOM 0 HB3 ARG A 151 -16.083 -7.866 -6.381 1.00 62.31 H new ATOM 0 HG2 ARG A 151 -13.784 -9.005 -5.812 1.00 22.10 H new ATOM 0 HG3 ARG A 151 -14.545 -9.443 -4.295 1.00 22.10 H new ATOM 0 HD2 ARG A 151 -14.893 -11.286 -5.836 1.00 60.34 H new ATOM 0 HD3 ARG A 151 -16.443 -10.501 -5.604 1.00 60.34 H new ATOM 0 HE ARG A 151 -14.822 -9.570 -7.905 1.00 33.20 H new ATOM 0 HH11 ARG A 151 -17.511 -11.679 -6.908 1.00 14.34 H new ATOM 0 HH12 ARG A 151 -18.173 -11.740 -8.545 1.00 14.34 H new ATOM 0 HH21 ARG A 151 -15.691 -9.650 -9.924 1.00 32.34 H new ATOM 0 HH22 ARG A 151 -17.148 -10.597 -10.243 1.00 32.34 H new ATOM 489 N GLU A 152 -16.493 -4.817 -5.157 1.00 75.45 N ATOM 490 CA GLU A 152 -17.141 -3.619 -5.660 1.00 32.21 C ATOM 491 C GLU A 152 -16.096 -2.506 -5.712 1.00 12.01 C ATOM 492 O GLU A 152 -15.743 -2.019 -6.787 1.00 53.44 O ATOM 493 CB GLU A 152 -18.346 -3.233 -4.771 1.00 40.24 C ATOM 494 CG GLU A 152 -19.542 -4.167 -5.031 1.00 2.10 C ATOM 495 CD GLU A 152 -20.602 -4.308 -3.926 1.00 41.34 C ATOM 496 OE1 GLU A 152 -20.675 -3.542 -2.930 1.00 2.12 O ATOM 497 OE2 GLU A 152 -21.432 -5.231 -4.086 1.00 42.23 O ATOM 0 H GLU A 152 -16.818 -5.104 -4.234 1.00 75.45 H new ATOM 0 HA GLU A 152 -17.537 -3.792 -6.661 1.00 32.21 H new ATOM 0 HB2 GLU A 152 -18.060 -3.286 -3.721 1.00 40.24 H new ATOM 0 HB3 GLU A 152 -18.635 -2.201 -4.971 1.00 40.24 H new ATOM 0 HG2 GLU A 152 -20.045 -3.822 -5.934 1.00 2.10 H new ATOM 0 HG3 GLU A 152 -19.149 -5.161 -5.245 1.00 2.10 H new ATOM 504 N ASN A 153 -15.605 -2.102 -4.538 1.00 63.13 N ATOM 505 CA ASN A 153 -14.932 -0.824 -4.305 1.00 55.13 C ATOM 506 C ASN A 153 -13.436 -0.849 -4.609 1.00 63.22 C ATOM 507 O ASN A 153 -12.767 0.159 -4.418 1.00 55.25 O ATOM 508 CB ASN A 153 -15.161 -0.380 -2.853 1.00 14.01 C ATOM 509 CG ASN A 153 -16.640 -0.186 -2.573 1.00 52.35 C ATOM 510 OD1 ASN A 153 -17.285 0.704 -3.122 1.00 43.12 O ATOM 511 ND2 ASN A 153 -17.241 -1.052 -1.784 1.00 0.02 N ATOM 0 H ASN A 153 -15.668 -2.675 -3.696 1.00 63.13 H new ATOM 0 HA ASN A 153 -15.372 -0.111 -5.002 1.00 55.13 H new ATOM 0 HB2 ASN A 153 -14.753 -1.126 -2.172 1.00 14.01 H new ATOM 0 HB3 ASN A 153 -14.626 0.551 -2.664 1.00 14.01 H new ATOM 0 HD21 ASN A 153 -18.247 -0.986 -1.626 1.00 0.02 H new ATOM 0 HD22 ASN A 153 -16.701 -1.789 -1.331 1.00 0.02 H new ATOM 518 N MET A 154 -12.882 -1.969 -5.069 1.00 32.31 N ATOM 519 CA MET A 154 -11.450 -2.182 -5.270 1.00 44.42 C ATOM 520 C MET A 154 -10.777 -1.080 -6.097 1.00 35.12 C ATOM 521 O MET A 154 -9.639 -0.714 -5.816 1.00 71.51 O ATOM 522 CB MET A 154 -11.224 -3.569 -5.888 1.00 33.33 C ATOM 523 CG MET A 154 -11.902 -3.735 -7.260 1.00 22.14 C ATOM 524 SD MET A 154 -12.203 -5.425 -7.849 1.00 22.34 S ATOM 525 CE MET A 154 -11.024 -6.438 -6.925 1.00 43.11 C ATOM 0 H MET A 154 -13.440 -2.785 -5.322 1.00 32.31 H new ATOM 0 HA MET A 154 -10.971 -2.134 -4.292 1.00 44.42 H new ATOM 0 HB2 MET A 154 -10.153 -3.743 -5.995 1.00 33.33 H new ATOM 0 HB3 MET A 154 -11.604 -4.330 -5.207 1.00 33.33 H new ATOM 0 HG2 MET A 154 -12.860 -3.215 -7.227 1.00 22.14 H new ATOM 0 HG3 MET A 154 -11.288 -3.225 -8.002 1.00 22.14 H new ATOM 0 HE1 MET A 154 -10.834 -7.363 -7.470 1.00 43.11 H new ATOM 0 HE2 MET A 154 -10.090 -5.890 -6.804 1.00 43.11 H new ATOM 0 HE3 MET A 154 -11.437 -6.673 -5.944 1.00 43.11 H new ATOM 535 N TYR A 155 -11.479 -0.530 -7.093 1.00 11.40 N ATOM 536 CA TYR A 155 -10.984 0.550 -7.943 1.00 1.24 C ATOM 537 C TYR A 155 -10.705 1.842 -7.173 1.00 15.24 C ATOM 538 O TYR A 155 -9.932 2.672 -7.644 1.00 44.43 O ATOM 539 CB TYR A 155 -11.988 0.832 -9.072 1.00 15.20 C ATOM 540 CG TYR A 155 -13.352 1.357 -8.644 1.00 71.14 C ATOM 541 CD1 TYR A 155 -14.326 0.490 -8.114 1.00 32.13 C ATOM 542 CD2 TYR A 155 -13.670 2.715 -8.826 1.00 40.14 C ATOM 543 CE1 TYR A 155 -15.596 0.971 -7.742 1.00 13.44 C ATOM 544 CE2 TYR A 155 -14.944 3.201 -8.488 1.00 42.25 C ATOM 545 CZ TYR A 155 -15.913 2.338 -7.932 1.00 2.43 C ATOM 546 OH TYR A 155 -17.121 2.851 -7.572 1.00 0.22 O ATOM 0 H TYR A 155 -12.424 -0.831 -7.333 1.00 11.40 H new ATOM 0 HA TYR A 155 -10.033 0.211 -8.355 1.00 1.24 H new ATOM 0 HB2 TYR A 155 -11.542 1.555 -9.755 1.00 15.20 H new ATOM 0 HB3 TYR A 155 -12.137 -0.089 -9.636 1.00 15.20 H new ATOM 0 HD1 TYR A 155 -14.096 -0.558 -7.991 1.00 32.13 H new ATOM 0 HD2 TYR A 155 -12.929 3.389 -9.229 1.00 40.14 H new ATOM 0 HE1 TYR A 155 -16.326 0.300 -7.313 1.00 13.44 H new ATOM 0 HE2 TYR A 155 -15.183 4.241 -8.654 1.00 42.25 H new ATOM 0 HH TYR A 155 -17.146 3.808 -7.782 1.00 0.22 H new ATOM 556 N ARG A 156 -11.336 2.035 -6.014 1.00 21.12 N ATOM 557 CA ARG A 156 -11.272 3.270 -5.241 1.00 74.13 C ATOM 558 C ARG A 156 -9.992 3.332 -4.400 1.00 71.23 C ATOM 559 O ARG A 156 -9.712 4.385 -3.825 1.00 44.41 O ATOM 560 CB ARG A 156 -12.549 3.401 -4.377 1.00 62.11 C ATOM 561 CG ARG A 156 -13.838 3.163 -5.196 1.00 74.45 C ATOM 562 CD ARG A 156 -15.145 3.407 -4.433 1.00 31.22 C ATOM 563 NE ARG A 156 -15.469 4.835 -4.431 1.00 20.30 N ATOM 564 CZ ARG A 156 -15.190 5.730 -3.487 1.00 40.03 C ATOM 565 NH1 ARG A 156 -14.806 5.343 -2.274 1.00 43.14 N ATOM 566 NH2 ARG A 156 -15.280 7.015 -3.810 1.00 12.14 N ATOM 0 H ARG A 156 -11.918 1.319 -5.579 1.00 21.12 H new ATOM 0 HA ARG A 156 -11.232 4.121 -5.921 1.00 74.13 H new ATOM 0 HB2 ARG A 156 -12.505 2.685 -3.557 1.00 62.11 H new ATOM 0 HB3 ARG A 156 -12.583 4.395 -3.931 1.00 62.11 H new ATOM 0 HG2 ARG A 156 -13.819 3.812 -6.071 1.00 74.45 H new ATOM 0 HG3 ARG A 156 -13.834 2.136 -5.561 1.00 74.45 H new ATOM 0 HD2 ARG A 156 -15.955 2.843 -4.895 1.00 31.22 H new ATOM 0 HD3 ARG A 156 -15.050 3.047 -3.409 1.00 31.22 H new ATOM 0 HE ARG A 156 -15.967 5.185 -5.250 1.00 20.30 H new ATOM 0 HH11 ARG A 156 -14.722 4.350 -2.058 1.00 43.14 H new ATOM 0 HH12 ARG A 156 -14.595 6.040 -1.559 1.00 43.14 H new ATOM 0 HH21 ARG A 156 -15.555 7.285 -4.754 1.00 12.14 H new ATOM 0 HH22 ARG A 156 -15.074 7.731 -3.114 1.00 12.14 H new ATOM 580 N TYR A 157 -9.224 2.238 -4.324 1.00 40.02 N ATOM 581 CA TYR A 157 -7.996 2.140 -3.546 1.00 2.32 C ATOM 582 C TYR A 157 -6.773 2.341 -4.450 1.00 20.30 C ATOM 583 O TYR A 157 -6.840 2.007 -5.640 1.00 0.00 O ATOM 584 CB TYR A 157 -7.931 0.758 -2.869 1.00 20.54 C ATOM 585 CG TYR A 157 -9.158 0.407 -2.051 1.00 34.43 C ATOM 586 CD1 TYR A 157 -9.730 1.345 -1.170 1.00 51.42 C ATOM 587 CD2 TYR A 157 -9.755 -0.853 -2.213 1.00 74.34 C ATOM 588 CE1 TYR A 157 -10.952 1.066 -0.533 1.00 73.41 C ATOM 589 CE2 TYR A 157 -10.969 -1.150 -1.572 1.00 74.14 C ATOM 590 CZ TYR A 157 -11.595 -0.173 -0.761 1.00 42.01 C ATOM 591 OH TYR A 157 -12.796 -0.438 -0.179 1.00 75.54 O ATOM 0 H TYR A 157 -9.452 1.375 -4.818 1.00 40.02 H new ATOM 0 HA TYR A 157 -7.992 2.919 -2.784 1.00 2.32 H new ATOM 0 HB2 TYR A 157 -7.790 -0.003 -3.636 1.00 20.54 H new ATOM 0 HB3 TYR A 157 -7.055 0.724 -2.221 1.00 20.54 H new ATOM 0 HD1 TYR A 157 -9.228 2.283 -0.983 1.00 51.42 H new ATOM 0 HD2 TYR A 157 -9.279 -1.598 -2.833 1.00 74.34 H new ATOM 0 HE1 TYR A 157 -11.398 1.795 0.128 1.00 73.41 H new ATOM 0 HE2 TYR A 157 -11.424 -2.121 -1.698 1.00 74.14 H new ATOM 0 HH TYR A 157 -13.097 -1.333 -0.442 1.00 75.54 H new ATOM 601 N PRO A 158 -5.633 2.785 -3.882 1.00 42.31 N ATOM 602 CA PRO A 158 -4.366 2.879 -4.585 1.00 51.31 C ATOM 603 C PRO A 158 -4.021 1.541 -5.240 1.00 52.15 C ATOM 604 O PRO A 158 -4.068 0.486 -4.603 1.00 43.44 O ATOM 605 CB PRO A 158 -3.309 3.308 -3.558 1.00 1.34 C ATOM 606 CG PRO A 158 -4.015 3.409 -2.211 1.00 1.43 C ATOM 607 CD PRO A 158 -5.484 3.152 -2.487 1.00 4.32 C ATOM 0 HA PRO A 158 -4.412 3.612 -5.390 1.00 51.31 H new ATOM 0 HB2 PRO A 158 -2.496 2.583 -3.515 1.00 1.34 H new ATOM 0 HB3 PRO A 158 -2.868 4.265 -3.835 1.00 1.34 H new ATOM 0 HG2 PRO A 158 -3.617 2.679 -1.506 1.00 1.43 H new ATOM 0 HG3 PRO A 158 -3.868 4.393 -1.767 1.00 1.43 H new ATOM 0 HD2 PRO A 158 -5.856 2.355 -1.844 1.00 4.32 H new ATOM 0 HD3 PRO A 158 -6.073 4.042 -2.265 1.00 4.32 H new ATOM 615 N ASN A 159 -3.674 1.596 -6.522 1.00 31.51 N ATOM 616 CA ASN A 159 -3.185 0.503 -7.364 1.00 22.42 C ATOM 617 C ASN A 159 -1.669 0.290 -7.218 1.00 53.21 C ATOM 618 O ASN A 159 -1.105 -0.613 -7.838 1.00 40.44 O ATOM 619 CB ASN A 159 -3.493 0.842 -8.832 1.00 41.34 C ATOM 620 CG ASN A 159 -2.673 2.040 -9.311 1.00 20.10 C ATOM 621 OD1 ASN A 159 -2.654 3.083 -8.662 1.00 54.13 O ATOM 622 ND2 ASN A 159 -1.958 1.908 -10.406 1.00 41.04 N ATOM 0 H ASN A 159 -3.731 2.472 -7.042 1.00 31.51 H new ATOM 0 HA ASN A 159 -3.684 -0.413 -7.049 1.00 22.42 H new ATOM 0 HB2 ASN A 159 -3.278 -0.023 -9.460 1.00 41.34 H new ATOM 0 HB3 ASN A 159 -4.556 1.059 -8.942 1.00 41.34 H new ATOM 0 HD21 ASN A 159 -1.374 2.679 -10.730 1.00 41.04 H new ATOM 0 HD22 ASN A 159 -1.987 1.034 -10.932 1.00 41.04 H new ATOM 629 N GLN A 160 -0.994 1.133 -6.435 1.00 23.32 N ATOM 630 CA GLN A 160 0.445 1.170 -6.255 1.00 64.31 C ATOM 631 C GLN A 160 0.737 1.842 -4.918 1.00 33.34 C ATOM 632 O GLN A 160 -0.156 2.467 -4.339 1.00 0.24 O ATOM 633 CB GLN A 160 1.081 1.940 -7.417 1.00 35.31 C ATOM 634 CG GLN A 160 0.673 3.416 -7.537 1.00 22.52 C ATOM 635 CD GLN A 160 1.144 4.023 -8.861 1.00 12.30 C ATOM 636 OE1 GLN A 160 0.444 4.815 -9.480 1.00 42.21 O ATOM 637 NE2 GLN A 160 2.322 3.656 -9.342 1.00 42.21 N ATOM 0 H GLN A 160 -1.470 1.845 -5.882 1.00 23.32 H new ATOM 0 HA GLN A 160 0.867 0.165 -6.249 1.00 64.31 H new ATOM 0 HB2 GLN A 160 2.165 1.888 -7.314 1.00 35.31 H new ATOM 0 HB3 GLN A 160 0.825 1.434 -8.348 1.00 35.31 H new ATOM 0 HG2 GLN A 160 -0.411 3.502 -7.461 1.00 22.52 H new ATOM 0 HG3 GLN A 160 1.096 3.980 -6.706 1.00 22.52 H new ATOM 0 HE21 GLN A 160 2.902 2.996 -8.823 1.00 42.21 H new ATOM 0 HE22 GLN A 160 2.650 4.033 -10.231 1.00 42.21 H new ATOM 646 N VAL A 161 1.969 1.731 -4.422 1.00 53.14 N ATOM 647 CA VAL A 161 2.291 2.095 -3.037 1.00 72.23 C ATOM 648 C VAL A 161 3.543 2.985 -2.994 1.00 20.44 C ATOM 649 O VAL A 161 4.395 2.884 -3.879 1.00 71.52 O ATOM 650 CB VAL A 161 2.345 0.828 -2.153 1.00 31.20 C ATOM 651 CG1 VAL A 161 1.193 -0.153 -2.444 1.00 14.34 C ATOM 652 CG2 VAL A 161 3.620 0.013 -2.312 1.00 23.34 C ATOM 0 H VAL A 161 2.766 1.390 -4.960 1.00 53.14 H new ATOM 0 HA VAL A 161 1.500 2.708 -2.605 1.00 72.23 H new ATOM 0 HB VAL A 161 2.281 1.239 -1.145 1.00 31.20 H new ATOM 0 HG11 VAL A 161 1.283 -1.023 -1.794 1.00 14.34 H new ATOM 0 HG12 VAL A 161 0.239 0.341 -2.259 1.00 14.34 H new ATOM 0 HG13 VAL A 161 1.241 -0.472 -3.485 1.00 14.34 H new ATOM 0 HG21 VAL A 161 3.579 -0.858 -1.658 1.00 23.34 H new ATOM 0 HG22 VAL A 161 3.716 -0.314 -3.347 1.00 23.34 H new ATOM 0 HG23 VAL A 161 4.480 0.627 -2.045 1.00 23.34 H new ATOM 662 N TYR A 162 3.654 3.873 -2.003 1.00 24.33 N ATOM 663 CA TYR A 162 4.792 4.784 -1.836 1.00 12.52 C ATOM 664 C TYR A 162 5.777 4.223 -0.811 1.00 23.23 C ATOM 665 O TYR A 162 5.355 3.490 0.072 1.00 22.02 O ATOM 666 CB TYR A 162 4.258 6.132 -1.334 1.00 53.12 C ATOM 667 CG TYR A 162 3.273 6.796 -2.272 1.00 4.23 C ATOM 668 CD1 TYR A 162 3.718 7.260 -3.522 1.00 20.52 C ATOM 669 CD2 TYR A 162 1.934 6.988 -1.887 1.00 11.21 C ATOM 670 CE1 TYR A 162 2.819 7.879 -4.403 1.00 43.01 C ATOM 671 CE2 TYR A 162 1.022 7.569 -2.780 1.00 71.54 C ATOM 672 CZ TYR A 162 1.462 8.000 -4.050 1.00 24.10 C ATOM 673 OH TYR A 162 0.602 8.595 -4.912 1.00 43.43 O ATOM 0 H TYR A 162 2.943 3.982 -1.280 1.00 24.33 H new ATOM 0 HA TYR A 162 5.308 4.902 -2.789 1.00 12.52 H new ATOM 0 HB2 TYR A 162 3.778 5.983 -0.367 1.00 53.12 H new ATOM 0 HB3 TYR A 162 5.099 6.806 -1.172 1.00 53.12 H new ATOM 0 HD1 TYR A 162 4.753 7.140 -3.804 1.00 20.52 H new ATOM 0 HD2 TYR A 162 1.608 6.688 -0.902 1.00 11.21 H new ATOM 0 HE1 TYR A 162 3.168 8.262 -5.351 1.00 43.01 H new ATOM 0 HE2 TYR A 162 -0.014 7.686 -2.497 1.00 71.54 H new ATOM 0 HH TYR A 162 -0.298 8.601 -4.524 1.00 43.43 H new ATOM 683 N TYR A 163 7.051 4.618 -0.798 1.00 63.23 N ATOM 684 CA TYR A 163 7.993 4.159 0.232 1.00 22.13 C ATOM 685 C TYR A 163 9.232 5.051 0.303 1.00 75.34 C ATOM 686 O TYR A 163 9.495 5.815 -0.624 1.00 23.22 O ATOM 687 CB TYR A 163 8.408 2.713 -0.068 1.00 44.12 C ATOM 688 CG TYR A 163 9.013 2.481 -1.442 1.00 14.20 C ATOM 689 CD1 TYR A 163 10.395 2.674 -1.643 1.00 35.04 C ATOM 690 CD2 TYR A 163 8.183 2.110 -2.521 1.00 0.33 C ATOM 691 CE1 TYR A 163 10.943 2.543 -2.929 1.00 54.11 C ATOM 692 CE2 TYR A 163 8.734 1.965 -3.806 1.00 2.41 C ATOM 693 CZ TYR A 163 10.113 2.200 -4.020 1.00 33.40 C ATOM 694 OH TYR A 163 10.634 2.072 -5.270 1.00 62.03 O ATOM 0 H TYR A 163 7.456 5.253 -1.486 1.00 63.23 H new ATOM 0 HA TYR A 163 7.492 4.212 1.199 1.00 22.13 H new ATOM 0 HB2 TYR A 163 9.128 2.396 0.686 1.00 44.12 H new ATOM 0 HB3 TYR A 163 7.533 2.072 0.038 1.00 44.12 H new ATOM 0 HD1 TYR A 163 11.032 2.923 -0.807 1.00 35.04 H new ATOM 0 HD2 TYR A 163 7.129 1.938 -2.360 1.00 0.33 H new ATOM 0 HE1 TYR A 163 11.999 2.704 -3.084 1.00 54.11 H new ATOM 0 HE2 TYR A 163 8.103 1.673 -4.633 1.00 2.41 H new ATOM 0 HH TYR A 163 11.609 1.996 -5.212 1.00 62.03 H new ATOM 704 N ARG A 164 10.041 4.935 1.357 1.00 62.41 N ATOM 705 CA ARG A 164 11.363 5.577 1.453 1.00 14.14 C ATOM 706 C ARG A 164 12.416 4.478 1.309 1.00 72.22 C ATOM 707 O ARG A 164 12.065 3.307 1.445 1.00 1.23 O ATOM 708 CB ARG A 164 11.516 6.376 2.766 1.00 53.22 C ATOM 709 CG ARG A 164 10.221 7.043 3.216 1.00 75.34 C ATOM 710 CD ARG A 164 10.379 8.251 4.132 1.00 1.42 C ATOM 711 NE ARG A 164 11.273 8.079 5.282 1.00 33.23 N ATOM 712 CZ ARG A 164 11.432 9.053 6.186 1.00 71.22 C ATOM 713 NH1 ARG A 164 10.593 10.089 6.209 1.00 11.51 N ATOM 714 NH2 ARG A 164 12.445 9.022 7.037 1.00 31.44 N ATOM 0 H ARG A 164 9.798 4.386 2.182 1.00 62.41 H new ATOM 0 HA ARG A 164 11.489 6.311 0.657 1.00 14.14 H new ATOM 0 HB2 ARG A 164 11.865 5.707 3.553 1.00 53.22 H new ATOM 0 HB3 ARG A 164 12.283 7.139 2.633 1.00 53.22 H new ATOM 0 HG2 ARG A 164 9.667 7.353 2.330 1.00 75.34 H new ATOM 0 HG3 ARG A 164 9.611 6.299 3.729 1.00 75.34 H new ATOM 0 HD2 ARG A 164 10.744 9.087 3.536 1.00 1.42 H new ATOM 0 HD3 ARG A 164 9.393 8.531 4.503 1.00 1.42 H new ATOM 0 HE ARG A 164 11.782 7.202 5.395 1.00 33.23 H new ATOM 0 HH11 ARG A 164 9.828 10.141 5.537 1.00 11.51 H new ATOM 0 HH12 ARG A 164 10.716 10.830 6.899 1.00 11.51 H new ATOM 0 HH21 ARG A 164 13.113 8.251 7.007 1.00 31.44 H new ATOM 0 HH22 ARG A 164 12.558 9.769 7.723 1.00 31.44 H new ATOM 728 N PRO A 165 13.685 4.789 1.005 1.00 14.12 N ATOM 729 CA PRO A 165 14.654 3.745 0.720 1.00 74.43 C ATOM 730 C PRO A 165 14.870 2.902 1.976 1.00 35.43 C ATOM 731 O PRO A 165 15.155 3.445 3.048 1.00 40.31 O ATOM 732 CB PRO A 165 15.917 4.462 0.245 1.00 23.41 C ATOM 733 CG PRO A 165 15.775 5.905 0.718 1.00 32.20 C ATOM 734 CD PRO A 165 14.274 6.114 0.890 1.00 33.30 C ATOM 0 HA PRO A 165 14.325 3.050 -0.053 1.00 74.43 H new ATOM 0 HB2 PRO A 165 16.811 3.999 0.663 1.00 23.41 H new ATOM 0 HB3 PRO A 165 16.011 4.413 -0.840 1.00 23.41 H new ATOM 0 HG2 PRO A 165 16.307 6.068 1.655 1.00 32.20 H new ATOM 0 HG3 PRO A 165 16.190 6.602 -0.010 1.00 32.20 H new ATOM 0 HD2 PRO A 165 14.064 6.711 1.778 1.00 33.30 H new ATOM 0 HD3 PRO A 165 13.857 6.652 0.039 1.00 33.30 H new ATOM 742 N VAL A 166 14.733 1.579 1.834 1.00 11.53 N ATOM 743 CA VAL A 166 15.000 0.573 2.851 1.00 64.34 C ATOM 744 C VAL A 166 16.400 0.714 3.477 1.00 31.14 C ATOM 745 O VAL A 166 16.588 0.216 4.586 1.00 21.34 O ATOM 746 CB VAL A 166 14.665 -0.829 2.289 1.00 23.41 C ATOM 747 CG1 VAL A 166 15.317 -1.114 0.934 1.00 53.33 C ATOM 748 CG2 VAL A 166 15.020 -1.971 3.251 1.00 72.34 C ATOM 0 H VAL A 166 14.416 1.166 0.957 1.00 11.53 H new ATOM 0 HA VAL A 166 14.339 0.733 3.703 1.00 64.34 H new ATOM 0 HB VAL A 166 13.583 -0.799 2.159 1.00 23.41 H new ATOM 0 HG11 VAL A 166 15.040 -2.114 0.600 1.00 53.33 H new ATOM 0 HG12 VAL A 166 14.976 -0.380 0.204 1.00 53.33 H new ATOM 0 HG13 VAL A 166 16.401 -1.052 1.031 1.00 53.33 H new ATOM 0 HG21 VAL A 166 14.759 -2.926 2.794 1.00 72.34 H new ATOM 0 HG22 VAL A 166 16.089 -1.950 3.462 1.00 72.34 H new ATOM 0 HG23 VAL A 166 14.464 -1.850 4.181 1.00 72.34 H new ATOM 758 N SER A 167 17.338 1.466 2.878 1.00 63.15 N ATOM 759 CA SER A 167 18.639 1.777 3.472 1.00 22.20 C ATOM 760 C SER A 167 18.558 2.232 4.931 1.00 21.33 C ATOM 761 O SER A 167 19.458 1.933 5.727 1.00 0.30 O ATOM 762 CB SER A 167 19.436 2.734 2.583 1.00 54.42 C ATOM 763 OG SER A 167 18.807 3.985 2.390 1.00 41.51 O ATOM 0 H SER A 167 17.207 1.879 1.954 1.00 63.15 H new ATOM 0 HA SER A 167 19.194 0.840 3.516 1.00 22.20 H new ATOM 0 HB2 SER A 167 20.418 2.896 3.027 1.00 54.42 H new ATOM 0 HB3 SER A 167 19.598 2.265 1.613 1.00 54.42 H new ATOM 0 HG SER A 167 19.368 4.548 1.816 1.00 41.51 H new ATOM 769 N GLN A 168 17.468 2.900 5.311 1.00 32.02 N ATOM 770 CA GLN A 168 17.303 3.429 6.654 1.00 62.02 C ATOM 771 C GLN A 168 16.511 2.523 7.608 1.00 2.42 C ATOM 772 O GLN A 168 16.472 2.824 8.800 1.00 31.13 O ATOM 773 CB GLN A 168 16.641 4.813 6.537 1.00 42.21 C ATOM 774 CG GLN A 168 15.142 4.708 6.277 1.00 40.31 C ATOM 775 CD GLN A 168 14.507 6.025 5.889 1.00 54.41 C ATOM 776 OE1 GLN A 168 14.053 6.783 6.743 1.00 42.33 O ATOM 777 NE2 GLN A 168 14.438 6.295 4.597 1.00 31.23 N ATOM 0 H GLN A 168 16.679 3.086 4.693 1.00 32.02 H new ATOM 0 HA GLN A 168 18.293 3.494 7.105 1.00 62.02 H new ATOM 0 HB2 GLN A 168 16.811 5.375 7.455 1.00 42.21 H new ATOM 0 HB3 GLN A 168 17.111 5.373 5.728 1.00 42.21 H new ATOM 0 HG2 GLN A 168 14.968 3.981 5.483 1.00 40.31 H new ATOM 0 HG3 GLN A 168 14.651 4.326 7.172 1.00 40.31 H new ATOM 0 HE21 GLN A 168 14.827 5.641 3.918 1.00 31.23 H new ATOM 0 HE22 GLN A 168 13.996 7.158 4.279 1.00 31.23 H new ATOM 786 N TYR A 169 15.851 1.481 7.102 1.00 62.23 N ATOM 787 CA TYR A 169 14.983 0.574 7.853 1.00 4.11 C ATOM 788 C TYR A 169 15.852 -0.620 8.277 1.00 73.11 C ATOM 789 O TYR A 169 17.076 -0.482 8.398 1.00 74.31 O ATOM 790 CB TYR A 169 13.744 0.226 6.988 1.00 63.01 C ATOM 791 CG TYR A 169 12.864 1.430 6.685 1.00 54.43 C ATOM 792 CD1 TYR A 169 13.188 2.289 5.624 1.00 41.53 C ATOM 793 CD2 TYR A 169 11.696 1.684 7.430 1.00 40.53 C ATOM 794 CE1 TYR A 169 12.346 3.354 5.274 1.00 15.20 C ATOM 795 CE2 TYR A 169 10.861 2.772 7.110 1.00 74.12 C ATOM 796 CZ TYR A 169 11.175 3.607 6.016 1.00 13.41 C ATOM 797 OH TYR A 169 10.365 4.639 5.651 1.00 54.23 O ATOM 0 H TYR A 169 15.909 1.235 6.114 1.00 62.23 H new ATOM 0 HA TYR A 169 14.571 1.011 8.763 1.00 4.11 H new ATOM 0 HB2 TYR A 169 14.078 -0.217 6.050 1.00 63.01 H new ATOM 0 HB3 TYR A 169 13.150 -0.529 7.503 1.00 63.01 H new ATOM 0 HD1 TYR A 169 14.100 2.127 5.068 1.00 41.53 H new ATOM 0 HD2 TYR A 169 11.438 1.037 8.256 1.00 40.53 H new ATOM 0 HE1 TYR A 169 12.596 3.983 4.432 1.00 15.20 H new ATOM 0 HE2 TYR A 169 9.979 2.968 7.702 1.00 74.12 H new ATOM 0 HH TYR A 169 9.985 5.056 6.452 1.00 54.23 H new ATOM 807 N SER A 170 15.244 -1.771 8.571 1.00 13.20 N ATOM 808 CA SER A 170 15.852 -3.106 8.491 1.00 73.23 C ATOM 809 C SER A 170 14.853 -4.202 8.891 1.00 1.21 C ATOM 810 O SER A 170 14.930 -5.327 8.385 1.00 3.21 O ATOM 811 CB SER A 170 17.207 -3.252 9.188 1.00 51.54 C ATOM 812 OG SER A 170 17.311 -2.432 10.333 1.00 73.22 O ATOM 0 H SER A 170 14.274 -1.803 8.885 1.00 13.20 H new ATOM 0 HA SER A 170 16.097 -3.242 7.438 1.00 73.23 H new ATOM 0 HB2 SER A 170 17.356 -4.293 9.475 1.00 51.54 H new ATOM 0 HB3 SER A 170 18.003 -2.997 8.488 1.00 51.54 H new ATOM 0 HG SER A 170 17.413 -1.497 10.058 1.00 73.22 H new ATOM 818 N ASN A 171 13.855 -3.872 9.721 1.00 24.02 N ATOM 819 CA ASN A 171 12.634 -4.665 9.793 1.00 62.02 C ATOM 820 C ASN A 171 11.769 -4.270 8.608 1.00 4.41 C ATOM 821 O ASN A 171 11.479 -3.095 8.379 1.00 1.43 O ATOM 822 CB ASN A 171 11.835 -4.401 11.066 1.00 41.35 C ATOM 823 CG ASN A 171 10.658 -5.334 11.305 1.00 75.45 C ATOM 824 OD1 ASN A 171 10.378 -6.238 10.522 1.00 20.01 O ATOM 825 ND2 ASN A 171 9.910 -5.121 12.369 1.00 51.13 N ATOM 0 H ASN A 171 13.874 -3.066 10.346 1.00 24.02 H new ATOM 0 HA ASN A 171 12.910 -5.720 9.788 1.00 62.02 H new ATOM 0 HB2 ASN A 171 12.510 -4.470 11.919 1.00 41.35 H new ATOM 0 HB3 ASN A 171 11.464 -3.377 11.035 1.00 41.35 H new ATOM 0 HD21 ASN A 171 9.095 -5.708 12.545 1.00 51.13 H new ATOM 0 HD22 ASN A 171 10.146 -4.369 13.016 1.00 51.13 H new ATOM 832 N GLN A 172 11.268 -5.289 7.944 1.00 63.31 N ATOM 833 CA GLN A 172 10.365 -5.195 6.809 1.00 74.34 C ATOM 834 C GLN A 172 9.047 -4.583 7.243 1.00 4.21 C ATOM 835 O GLN A 172 8.437 -3.847 6.481 1.00 53.32 O ATOM 836 CB GLN A 172 10.186 -6.611 6.229 1.00 35.00 C ATOM 837 CG GLN A 172 9.112 -6.903 5.154 1.00 21.40 C ATOM 838 CD GLN A 172 9.291 -8.341 4.645 1.00 53.33 C ATOM 839 OE1 GLN A 172 10.393 -8.768 4.313 1.00 72.22 O ATOM 840 NE2 GLN A 172 8.247 -9.150 4.633 1.00 62.12 N ATOM 0 H GLN A 172 11.488 -6.254 8.190 1.00 63.31 H new ATOM 0 HA GLN A 172 10.773 -4.545 6.035 1.00 74.34 H new ATOM 0 HB2 GLN A 172 11.147 -6.907 5.809 1.00 35.00 H new ATOM 0 HB3 GLN A 172 9.986 -7.277 7.069 1.00 35.00 H new ATOM 0 HG2 GLN A 172 8.114 -6.774 5.574 1.00 21.40 H new ATOM 0 HG3 GLN A 172 9.204 -6.197 4.328 1.00 21.40 H new ATOM 0 HE21 GLN A 172 7.329 -8.802 4.908 1.00 62.12 H new ATOM 0 HE22 GLN A 172 8.359 -10.123 4.349 1.00 62.12 H new ATOM 849 N ASN A 173 8.615 -4.843 8.475 1.00 75.34 N ATOM 850 CA ASN A 173 7.269 -4.482 8.889 1.00 12.12 C ATOM 851 C ASN A 173 7.239 -3.006 9.175 1.00 44.44 C ATOM 852 O ASN A 173 6.311 -2.318 8.791 1.00 32.33 O ATOM 853 CB ASN A 173 6.837 -5.267 10.126 1.00 0.53 C ATOM 854 CG ASN A 173 5.719 -6.207 9.735 1.00 43.43 C ATOM 855 OD1 ASN A 173 4.562 -5.953 10.018 1.00 31.32 O ATOM 856 ND2 ASN A 173 6.041 -7.274 9.033 1.00 73.33 N ATOM 0 H ASN A 173 9.175 -5.299 9.196 1.00 75.34 H new ATOM 0 HA ASN A 173 6.571 -4.727 8.088 1.00 12.12 H new ATOM 0 HB2 ASN A 173 7.679 -5.828 10.531 1.00 0.53 H new ATOM 0 HB3 ASN A 173 6.502 -4.586 10.908 1.00 0.53 H new ATOM 0 HD21 ASN A 173 5.313 -7.912 8.712 1.00 73.33 H new ATOM 0 HD22 ASN A 173 7.018 -7.462 8.810 1.00 73.33 H new ATOM 863 N ASN A 174 8.304 -2.514 9.791 1.00 24.34 N ATOM 864 CA ASN A 174 8.471 -1.094 10.045 1.00 24.04 C ATOM 865 C ASN A 174 8.384 -0.305 8.744 1.00 60.01 C ATOM 866 O ASN A 174 7.629 0.663 8.663 1.00 20.24 O ATOM 867 CB ASN A 174 9.822 -0.866 10.725 1.00 41.25 C ATOM 868 CG ASN A 174 9.722 -0.972 12.239 1.00 0.53 C ATOM 869 OD1 ASN A 174 8.790 -0.480 12.866 1.00 62.43 O ATOM 870 ND2 ASN A 174 10.666 -1.626 12.889 1.00 40.42 N ATOM 0 H ASN A 174 9.076 -3.090 10.128 1.00 24.34 H new ATOM 0 HA ASN A 174 7.673 -0.745 10.700 1.00 24.04 H new ATOM 0 HB2 ASN A 174 10.541 -1.598 10.357 1.00 41.25 H new ATOM 0 HB3 ASN A 174 10.202 0.119 10.455 1.00 41.25 H new ATOM 0 HD21 ASN A 174 10.616 -1.719 13.904 1.00 40.42 H new ATOM 0 HD22 ASN A 174 11.445 -2.039 12.377 1.00 40.42 H new ATOM 877 N PHE A 175 9.128 -0.740 7.722 1.00 44.55 N ATOM 878 CA PHE A 175 9.044 -0.160 6.389 1.00 31.41 C ATOM 879 C PHE A 175 7.614 -0.259 5.829 1.00 20.14 C ATOM 880 O PHE A 175 7.123 0.723 5.271 1.00 33.42 O ATOM 881 CB PHE A 175 10.155 -0.751 5.490 1.00 22.14 C ATOM 882 CG PHE A 175 9.908 -0.632 3.997 1.00 41.23 C ATOM 883 CD1 PHE A 175 8.901 -1.399 3.386 1.00 74.33 C ATOM 884 CD2 PHE A 175 10.651 0.274 3.215 1.00 63.31 C ATOM 885 CE1 PHE A 175 8.543 -1.171 2.050 1.00 34.44 C ATOM 886 CE2 PHE A 175 10.340 0.443 1.854 1.00 20.02 C ATOM 887 CZ PHE A 175 9.246 -0.236 1.287 1.00 21.32 C ATOM 0 H PHE A 175 9.802 -1.502 7.801 1.00 44.55 H new ATOM 0 HA PHE A 175 9.238 0.912 6.427 1.00 31.41 H new ATOM 0 HB2 PHE A 175 11.096 -0.254 5.727 1.00 22.14 H new ATOM 0 HB3 PHE A 175 10.280 -1.805 5.739 1.00 22.14 H new ATOM 0 HD1 PHE A 175 8.399 -2.171 3.951 1.00 74.33 H new ATOM 0 HD2 PHE A 175 11.458 0.838 3.660 1.00 63.31 H new ATOM 0 HE1 PHE A 175 7.723 -1.719 1.610 1.00 34.44 H new ATOM 0 HE2 PHE A 175 10.943 1.097 1.242 1.00 20.02 H new ATOM 0 HZ PHE A 175 8.951 -0.035 0.267 1.00 21.32 H new ATOM 897 N VAL A 176 6.940 -1.406 5.975 1.00 4.21 N ATOM 898 CA VAL A 176 5.604 -1.619 5.416 1.00 53.11 C ATOM 899 C VAL A 176 4.574 -0.725 6.110 1.00 31.21 C ATOM 900 O VAL A 176 3.863 0.000 5.423 1.00 40.51 O ATOM 901 CB VAL A 176 5.205 -3.113 5.423 1.00 44.31 C ATOM 902 CG1 VAL A 176 3.736 -3.329 5.029 1.00 14.14 C ATOM 903 CG2 VAL A 176 6.040 -3.937 4.429 1.00 11.42 C ATOM 0 H VAL A 176 7.307 -2.210 6.484 1.00 4.21 H new ATOM 0 HA VAL A 176 5.627 -1.324 4.367 1.00 53.11 H new ATOM 0 HB VAL A 176 5.380 -3.440 6.448 1.00 44.31 H new ATOM 0 HG11 VAL A 176 3.507 -4.394 5.049 1.00 14.14 H new ATOM 0 HG12 VAL A 176 3.090 -2.805 5.733 1.00 14.14 H new ATOM 0 HG13 VAL A 176 3.568 -2.941 4.024 1.00 14.14 H new ATOM 0 HG21 VAL A 176 5.726 -4.980 4.467 1.00 11.42 H new ATOM 0 HG22 VAL A 176 5.892 -3.550 3.421 1.00 11.42 H new ATOM 0 HG23 VAL A 176 7.095 -3.866 4.693 1.00 11.42 H new ATOM 913 N HIS A 177 4.509 -0.733 7.442 1.00 55.21 N ATOM 914 CA HIS A 177 3.646 0.118 8.252 1.00 40.24 C ATOM 915 C HIS A 177 3.789 1.564 7.821 1.00 13.41 C ATOM 916 O HIS A 177 2.798 2.250 7.578 1.00 2.40 O ATOM 917 CB HIS A 177 4.018 -0.003 9.736 1.00 11.20 C ATOM 918 CG HIS A 177 3.344 -1.121 10.488 1.00 64.44 C ATOM 919 ND1 HIS A 177 2.377 -0.948 11.450 1.00 64.02 N ATOM 920 CD2 HIS A 177 3.624 -2.460 10.424 1.00 31.40 C ATOM 921 CE1 HIS A 177 2.096 -2.152 11.968 1.00 13.41 C ATOM 922 NE2 HIS A 177 2.826 -3.106 11.372 1.00 61.14 N ATOM 0 H HIS A 177 5.082 -1.360 8.007 1.00 55.21 H new ATOM 0 HA HIS A 177 2.615 -0.206 8.111 1.00 40.24 H new ATOM 0 HB2 HIS A 177 5.097 -0.137 9.812 1.00 11.20 H new ATOM 0 HB3 HIS A 177 3.779 0.939 10.230 1.00 11.20 H new ATOM 0 HD2 HIS A 177 4.334 -2.932 9.760 1.00 31.40 H new ATOM 0 HE1 HIS A 177 1.380 -2.329 12.757 1.00 13.41 H new ATOM 0 HE2 HIS A 177 2.803 -4.106 11.571 1.00 61.14 H new ATOM 930 N ASP A 178 5.027 2.041 7.765 1.00 20.42 N ATOM 931 CA ASP A 178 5.301 3.428 7.451 1.00 40.23 C ATOM 932 C ASP A 178 4.930 3.730 6.002 1.00 1.33 C ATOM 933 O ASP A 178 4.512 4.843 5.721 1.00 21.02 O ATOM 934 CB ASP A 178 6.791 3.678 7.702 1.00 12.14 C ATOM 935 CG ASP A 178 7.260 5.122 7.566 1.00 32.32 C ATOM 936 OD1 ASP A 178 6.525 6.051 7.961 1.00 20.30 O ATOM 937 OD2 ASP A 178 8.465 5.318 7.274 1.00 42.41 O ATOM 0 H ASP A 178 5.860 1.478 7.935 1.00 20.42 H new ATOM 0 HA ASP A 178 4.703 4.088 8.080 1.00 40.23 H new ATOM 0 HB2 ASP A 178 7.033 3.332 8.707 1.00 12.14 H new ATOM 0 HB3 ASP A 178 7.364 3.064 7.007 1.00 12.14 H new ATOM 942 N CYS A 179 5.020 2.763 5.084 1.00 62.31 N ATOM 943 CA CYS A 179 4.564 2.950 3.715 1.00 73.25 C ATOM 944 C CYS A 179 3.048 3.053 3.703 1.00 12.52 C ATOM 945 O CYS A 179 2.519 4.027 3.171 1.00 54.31 O ATOM 946 CB CYS A 179 5.008 1.795 2.800 1.00 20.02 C ATOM 947 SG CYS A 179 3.855 1.415 1.434 1.00 2.20 S ATOM 0 H CYS A 179 5.408 1.839 5.272 1.00 62.31 H new ATOM 0 HA CYS A 179 5.011 3.867 3.332 1.00 73.25 H new ATOM 0 HB2 CYS A 179 5.983 2.039 2.377 1.00 20.02 H new ATOM 0 HB3 CYS A 179 5.139 0.899 3.407 1.00 20.02 H new ATOM 0 HG CYS A 179 4.136 2.163 0.408 1.00 2.20 H new ATOM 952 N VAL A 180 2.362 2.052 4.261 1.00 44.41 N ATOM 953 CA VAL A 180 0.917 1.953 4.294 1.00 32.22 C ATOM 954 C VAL A 180 0.385 3.268 4.840 1.00 63.11 C ATOM 955 O VAL A 180 -0.372 3.934 4.150 1.00 33.34 O ATOM 956 CB VAL A 180 0.499 0.709 5.114 1.00 12.04 C ATOM 957 CG1 VAL A 180 -0.955 0.790 5.593 1.00 35.51 C ATOM 958 CG2 VAL A 180 0.641 -0.567 4.271 1.00 41.24 C ATOM 0 H VAL A 180 2.823 1.264 4.716 1.00 44.41 H new ATOM 0 HA VAL A 180 0.486 1.805 3.304 1.00 32.22 H new ATOM 0 HB VAL A 180 1.161 0.680 5.980 1.00 12.04 H new ATOM 0 HG11 VAL A 180 -1.201 -0.106 6.163 1.00 35.51 H new ATOM 0 HG12 VAL A 180 -1.081 1.669 6.225 1.00 35.51 H new ATOM 0 HG13 VAL A 180 -1.618 0.865 4.731 1.00 35.51 H new ATOM 0 HG21 VAL A 180 0.342 -1.431 4.865 1.00 41.24 H new ATOM 0 HG22 VAL A 180 0.003 -0.494 3.390 1.00 41.24 H new ATOM 0 HG23 VAL A 180 1.679 -0.683 3.958 1.00 41.24 H new ATOM 968 N ASN A 181 0.839 3.706 6.013 1.00 3.32 N ATOM 969 CA ASN A 181 0.324 4.856 6.731 1.00 61.51 C ATOM 970 C ASN A 181 0.474 6.130 5.929 1.00 4.04 C ATOM 971 O ASN A 181 -0.281 7.076 6.124 1.00 75.13 O ATOM 972 CB ASN A 181 1.142 5.008 8.006 1.00 71.01 C ATOM 973 CG ASN A 181 0.496 5.932 9.019 1.00 42.45 C ATOM 974 OD1 ASN A 181 -0.724 6.020 9.142 1.00 0.40 O ATOM 975 ND2 ASN A 181 1.314 6.619 9.786 1.00 1.23 N ATOM 0 H ASN A 181 1.606 3.247 6.503 1.00 3.32 H new ATOM 0 HA ASN A 181 -0.735 4.697 6.932 1.00 61.51 H new ATOM 0 HB2 ASN A 181 1.286 4.027 8.458 1.00 71.01 H new ATOM 0 HB3 ASN A 181 2.131 5.390 7.753 1.00 71.01 H new ATOM 0 HD21 ASN A 181 0.940 7.242 10.502 1.00 1.23 H new ATOM 0 HD22 ASN A 181 2.323 6.529 9.665 1.00 1.23 H new ATOM 982 N ILE A 182 1.473 6.167 5.057 1.00 12.30 N ATOM 983 CA ILE A 182 1.687 7.245 4.111 1.00 24.54 C ATOM 984 C ILE A 182 0.701 7.106 2.966 1.00 73.42 C ATOM 985 O ILE A 182 0.004 8.070 2.707 1.00 64.15 O ATOM 986 CB ILE A 182 3.150 7.276 3.656 1.00 23.03 C ATOM 987 CG1 ILE A 182 4.039 7.598 4.870 1.00 34.33 C ATOM 988 CG2 ILE A 182 3.406 8.238 2.479 1.00 42.55 C ATOM 989 CD1 ILE A 182 4.088 9.055 5.272 1.00 20.31 C ATOM 0 H ILE A 182 2.172 5.428 4.989 1.00 12.30 H new ATOM 0 HA ILE A 182 1.501 8.209 4.583 1.00 24.54 H new ATOM 0 HB ILE A 182 3.405 6.291 3.265 1.00 23.03 H new ATOM 0 HG12 ILE A 182 3.686 7.016 5.721 1.00 34.33 H new ATOM 0 HG13 ILE A 182 5.054 7.264 4.654 1.00 34.33 H new ATOM 0 HG21 ILE A 182 4.462 8.210 2.209 1.00 42.55 H new ATOM 0 HG22 ILE A 182 2.804 7.934 1.623 1.00 42.55 H new ATOM 0 HG23 ILE A 182 3.134 9.252 2.772 1.00 42.55 H new ATOM 0 HD11 ILE A 182 4.741 9.172 6.137 1.00 20.31 H new ATOM 0 HD12 ILE A 182 4.473 9.648 4.443 1.00 20.31 H new ATOM 0 HD13 ILE A 182 3.085 9.396 5.527 1.00 20.31 H new ATOM 1001 N THR A 183 0.585 5.965 2.288 1.00 3.34 N ATOM 1002 CA THR A 183 -0.431 5.767 1.260 1.00 13.00 C ATOM 1003 C THR A 183 -1.825 6.133 1.791 1.00 0.31 C ATOM 1004 O THR A 183 -2.530 6.909 1.143 1.00 14.31 O ATOM 1005 CB THR A 183 -0.324 4.327 0.741 1.00 35.30 C ATOM 1006 OG1 THR A 183 0.872 4.187 -0.011 1.00 23.42 O ATOM 1007 CG2 THR A 183 -1.454 3.929 -0.203 1.00 11.43 C ATOM 0 H THR A 183 1.190 5.157 2.436 1.00 3.34 H new ATOM 0 HA THR A 183 -0.263 6.436 0.416 1.00 13.00 H new ATOM 0 HB THR A 183 -0.359 3.694 1.627 1.00 35.30 H new ATOM 0 HG1 THR A 183 0.944 3.268 -0.343 1.00 23.42 H new ATOM 0 HG21 THR A 183 -1.311 2.899 -0.528 1.00 11.43 H new ATOM 0 HG22 THR A 183 -2.409 4.016 0.315 1.00 11.43 H new ATOM 0 HG23 THR A 183 -1.451 4.587 -1.072 1.00 11.43 H new ATOM 1015 N ILE A 184 -2.202 5.650 2.978 1.00 75.44 N ATOM 1016 CA ILE A 184 -3.456 6.015 3.614 1.00 62.41 C ATOM 1017 C ILE A 184 -3.449 7.508 3.891 1.00 22.22 C ATOM 1018 O ILE A 184 -4.400 8.152 3.457 1.00 62.54 O ATOM 1019 CB ILE A 184 -3.762 5.195 4.882 1.00 42.32 C ATOM 1020 CG1 ILE A 184 -3.530 3.679 4.744 1.00 4.10 C ATOM 1021 CG2 ILE A 184 -5.221 5.457 5.291 1.00 44.01 C ATOM 1022 CD1 ILE A 184 -4.042 2.958 3.493 1.00 53.44 C ATOM 0 H ILE A 184 -1.640 4.994 3.520 1.00 75.44 H new ATOM 0 HA ILE A 184 -4.267 5.773 2.927 1.00 62.41 H new ATOM 0 HB ILE A 184 -3.056 5.527 5.643 1.00 42.32 H new ATOM 0 HG12 ILE A 184 -2.456 3.504 4.808 1.00 4.10 H new ATOM 0 HG13 ILE A 184 -3.984 3.197 5.610 1.00 4.10 H new ATOM 0 HG21 ILE A 184 -5.456 4.884 6.188 1.00 44.01 H new ATOM 0 HG22 ILE A 184 -5.357 6.519 5.493 1.00 44.01 H new ATOM 0 HG23 ILE A 184 -5.886 5.153 4.482 1.00 44.01 H new ATOM 0 HD11 ILE A 184 -3.795 1.898 3.557 1.00 53.44 H new ATOM 0 HD12 ILE A 184 -5.123 3.075 3.422 1.00 53.44 H new ATOM 0 HD13 ILE A 184 -3.572 3.387 2.608 1.00 53.44 H new ATOM 1034 N LYS A 185 -2.423 8.076 4.552 1.00 31.11 N ATOM 1035 CA LYS A 185 -2.372 9.521 4.786 1.00 0.21 C ATOM 1036 C LYS A 185 -2.651 10.245 3.479 1.00 42.23 C ATOM 1037 O LYS A 185 -3.609 11.005 3.433 1.00 63.31 O ATOM 1038 CB LYS A 185 -1.034 9.958 5.410 1.00 4.32 C ATOM 1039 CG LYS A 185 -0.857 11.486 5.390 1.00 11.01 C ATOM 1040 CD LYS A 185 0.558 11.965 5.711 1.00 64.52 C ATOM 1041 CE LYS A 185 0.833 11.929 7.205 1.00 63.05 C ATOM 1042 NZ LYS A 185 2.201 12.394 7.505 1.00 72.45 N ATOM 0 H LYS A 185 -1.629 7.558 4.928 1.00 31.11 H new ATOM 0 HA LYS A 185 -3.140 9.788 5.511 1.00 0.21 H new ATOM 0 HB2 LYS A 185 -0.981 9.601 6.438 1.00 4.32 H new ATOM 0 HB3 LYS A 185 -0.212 9.491 4.867 1.00 4.32 H new ATOM 0 HG2 LYS A 185 -1.138 11.859 4.405 1.00 11.01 H new ATOM 0 HG3 LYS A 185 -1.548 11.928 6.107 1.00 11.01 H new ATOM 0 HD2 LYS A 185 1.282 11.337 5.192 1.00 64.52 H new ATOM 0 HD3 LYS A 185 0.692 12.981 5.340 1.00 64.52 H new ATOM 0 HE2 LYS A 185 0.110 12.556 7.726 1.00 63.05 H new ATOM 0 HE3 LYS A 185 0.701 10.913 7.578 1.00 63.05 H new ATOM 0 HZ1 LYS A 185 2.362 12.359 8.532 1.00 72.45 H new ATOM 0 HZ2 LYS A 185 2.890 11.779 7.025 1.00 72.45 H new ATOM 0 HZ3 LYS A 185 2.317 13.372 7.169 1.00 72.45 H new ATOM 1056 N GLN A 186 -1.842 10.031 2.439 1.00 73.43 N ATOM 1057 CA GLN A 186 -1.952 10.704 1.161 1.00 14.01 C ATOM 1058 C GLN A 186 -3.384 10.553 0.656 1.00 23.53 C ATOM 1059 O GLN A 186 -4.035 11.559 0.459 1.00 63.53 O ATOM 1060 CB GLN A 186 -0.893 10.244 0.130 1.00 55.11 C ATOM 1061 CG GLN A 186 0.597 10.354 0.495 1.00 41.04 C ATOM 1062 CD GLN A 186 0.855 11.613 1.281 1.00 64.55 C ATOM 1063 OE1 GLN A 186 1.126 11.612 2.477 1.00 0.00 O ATOM 1064 NE2 GLN A 186 0.636 12.741 0.650 1.00 52.31 N ATOM 0 H GLN A 186 -1.072 9.363 2.473 1.00 73.43 H new ATOM 0 HA GLN A 186 -1.733 11.762 1.302 1.00 14.01 H new ATOM 0 HB2 GLN A 186 -1.097 9.200 -0.109 1.00 55.11 H new ATOM 0 HB3 GLN A 186 -1.052 10.817 -0.783 1.00 55.11 H new ATOM 0 HG2 GLN A 186 0.900 9.485 1.079 1.00 41.04 H new ATOM 0 HG3 GLN A 186 1.201 10.354 -0.412 1.00 41.04 H new ATOM 0 HE21 GLN A 186 0.411 12.734 -0.345 1.00 52.31 H new ATOM 0 HE22 GLN A 186 0.690 13.626 1.154 1.00 52.31 H new ATOM 1073 N HIS A 187 -3.969 9.371 0.518 1.00 23.20 N ATOM 1074 CA HIS A 187 -5.364 9.270 0.082 1.00 72.52 C ATOM 1075 C HIS A 187 -6.347 10.016 1.012 1.00 23.41 C ATOM 1076 O HIS A 187 -7.328 10.593 0.549 1.00 15.11 O ATOM 1077 CB HIS A 187 -5.722 7.795 -0.127 1.00 53.05 C ATOM 1078 CG HIS A 187 -5.245 7.312 -1.471 1.00 2.20 C ATOM 1079 ND1 HIS A 187 -6.007 7.165 -2.611 1.00 73.34 N ATOM 1080 CD2 HIS A 187 -3.939 7.116 -1.819 1.00 72.12 C ATOM 1081 CE1 HIS A 187 -5.165 6.850 -3.613 1.00 33.13 C ATOM 1082 NE2 HIS A 187 -3.901 6.794 -3.172 1.00 41.05 N ATOM 0 H HIS A 187 -3.511 8.477 0.698 1.00 23.20 H new ATOM 0 HA HIS A 187 -5.467 9.785 -0.873 1.00 72.52 H new ATOM 0 HB2 HIS A 187 -5.272 7.192 0.661 1.00 53.05 H new ATOM 0 HB3 HIS A 187 -6.801 7.664 -0.051 1.00 53.05 H new ATOM 0 HD2 HIS A 187 -3.087 7.197 -1.161 1.00 72.12 H new ATOM 0 HE1 HIS A 187 -5.467 6.667 -4.634 1.00 33.13 H new ATOM 0 HE2 HIS A 187 -3.073 6.561 -3.721 1.00 41.05 H new ATOM 1090 N THR A 188 -6.053 10.132 2.296 1.00 1.21 N ATOM 1091 CA THR A 188 -6.922 10.707 3.321 1.00 40.02 C ATOM 1092 C THR A 188 -6.634 12.219 3.477 1.00 62.15 C ATOM 1093 O THR A 188 -7.075 12.878 4.417 1.00 73.51 O ATOM 1094 CB THR A 188 -6.753 9.856 4.595 1.00 13.21 C ATOM 1095 OG1 THR A 188 -6.878 8.486 4.266 1.00 63.34 O ATOM 1096 CG2 THR A 188 -7.818 10.090 5.658 1.00 41.31 C ATOM 0 H THR A 188 -5.161 9.814 2.675 1.00 1.21 H new ATOM 0 HA THR A 188 -7.978 10.669 3.053 1.00 40.02 H new ATOM 0 HB THR A 188 -5.777 10.142 4.988 1.00 13.21 H new ATOM 0 HG1 THR A 188 -5.989 8.104 4.111 1.00 63.34 H new ATOM 0 HG21 THR A 188 -7.620 9.450 6.518 1.00 41.31 H new ATOM 0 HG22 THR A 188 -7.797 11.134 5.970 1.00 41.31 H new ATOM 0 HG23 THR A 188 -8.800 9.853 5.248 1.00 41.31 H new ATOM 1104 N VAL A 189 -5.858 12.785 2.551 1.00 13.03 N ATOM 1105 CA VAL A 189 -5.327 14.140 2.515 1.00 72.13 C ATOM 1106 C VAL A 189 -5.480 14.616 1.076 1.00 14.11 C ATOM 1107 O VAL A 189 -6.313 15.450 0.785 1.00 75.52 O ATOM 1108 CB VAL A 189 -3.861 14.085 3.014 1.00 74.15 C ATOM 1109 CG1 VAL A 189 -2.993 15.270 2.604 1.00 74.43 C ATOM 1110 CG2 VAL A 189 -3.777 13.896 4.534 1.00 21.50 C ATOM 0 H VAL A 189 -5.560 12.253 1.733 1.00 13.03 H new ATOM 0 HA VAL A 189 -5.847 14.847 3.161 1.00 72.13 H new ATOM 0 HB VAL A 189 -3.453 13.211 2.507 1.00 74.15 H new ATOM 0 HG11 VAL A 189 -1.986 15.138 3.001 1.00 74.43 H new ATOM 0 HG12 VAL A 189 -2.949 15.330 1.517 1.00 74.43 H new ATOM 0 HG13 VAL A 189 -3.422 16.190 3.001 1.00 74.43 H new ATOM 0 HG21 VAL A 189 -2.731 13.863 4.839 1.00 21.50 H new ATOM 0 HG22 VAL A 189 -4.274 14.728 5.032 1.00 21.50 H new ATOM 0 HG23 VAL A 189 -4.266 12.962 4.812 1.00 21.50 H new ATOM 1120 N THR A 190 -4.722 14.055 0.148 1.00 52.15 N ATOM 1121 CA THR A 190 -4.796 14.288 -1.282 1.00 71.52 C ATOM 1122 C THR A 190 -6.186 13.960 -1.803 1.00 55.31 C ATOM 1123 O THR A 190 -6.860 14.861 -2.291 1.00 3.23 O ATOM 1124 CB THR A 190 -3.658 13.507 -1.960 1.00 35.34 C ATOM 1125 OG1 THR A 190 -2.494 14.276 -1.752 1.00 44.24 O ATOM 1126 CG2 THR A 190 -3.857 13.152 -3.433 1.00 3.43 C ATOM 0 H THR A 190 -3.994 13.383 0.390 1.00 52.15 H new ATOM 0 HA THR A 190 -4.649 15.341 -1.523 1.00 71.52 H new ATOM 0 HB THR A 190 -3.604 12.517 -1.507 1.00 35.34 H new ATOM 0 HG1 THR A 190 -1.727 13.826 -2.163 1.00 44.24 H new ATOM 0 HG21 THR A 190 -2.988 12.603 -3.796 1.00 3.43 H new ATOM 0 HG22 THR A 190 -4.748 12.533 -3.541 1.00 3.43 H new ATOM 0 HG23 THR A 190 -3.978 14.066 -4.014 1.00 3.43 H new ATOM 1134 N THR A 191 -6.650 12.712 -1.736 1.00 2.40 N ATOM 1135 CA THR A 191 -7.921 12.433 -2.376 1.00 62.53 C ATOM 1136 C THR A 191 -9.052 13.159 -1.658 1.00 44.25 C ATOM 1137 O THR A 191 -9.924 13.749 -2.295 1.00 21.43 O ATOM 1138 CB THR A 191 -8.118 10.966 -2.799 1.00 63.54 C ATOM 1139 OG1 THR A 191 -7.893 9.957 -1.847 1.00 42.12 O ATOM 1140 CG2 THR A 191 -7.088 10.658 -3.879 1.00 12.12 C ATOM 0 H THR A 191 -6.194 11.926 -1.274 1.00 2.40 H new ATOM 0 HA THR A 191 -7.931 12.877 -3.372 1.00 62.53 H new ATOM 0 HB THR A 191 -9.174 10.930 -3.066 1.00 63.54 H new ATOM 0 HG1 THR A 191 -7.798 10.360 -0.959 1.00 42.12 H new ATOM 0 HG21 THR A 191 -7.199 9.623 -4.203 1.00 12.12 H new ATOM 0 HG22 THR A 191 -7.242 11.323 -4.729 1.00 12.12 H new ATOM 0 HG23 THR A 191 -6.085 10.807 -3.479 1.00 12.12 H new ATOM 1148 N THR A 192 -8.943 13.288 -0.344 1.00 61.21 N ATOM 1149 CA THR A 192 -9.871 14.012 0.484 1.00 52.01 C ATOM 1150 C THR A 192 -9.830 15.536 0.254 1.00 51.11 C ATOM 1151 O THR A 192 -10.844 16.195 0.478 1.00 13.04 O ATOM 1152 CB THR A 192 -9.565 13.580 1.926 1.00 4.14 C ATOM 1153 OG1 THR A 192 -9.507 12.167 1.978 1.00 3.11 O ATOM 1154 CG2 THR A 192 -10.602 13.991 2.950 1.00 55.12 C ATOM 0 H THR A 192 -8.176 12.873 0.185 1.00 61.21 H new ATOM 0 HA THR A 192 -10.903 13.770 0.230 1.00 52.01 H new ATOM 0 HB THR A 192 -8.627 14.076 2.177 1.00 4.14 H new ATOM 0 HG1 THR A 192 -9.787 11.861 2.866 1.00 3.11 H new ATOM 0 HG21 THR A 192 -10.298 13.641 3.936 1.00 55.12 H new ATOM 0 HG22 THR A 192 -10.691 15.077 2.962 1.00 55.12 H new ATOM 0 HG23 THR A 192 -11.565 13.551 2.690 1.00 55.12 H new ATOM 1162 N THR A 193 -8.741 16.110 -0.278 1.00 74.24 N ATOM 1163 CA THR A 193 -8.685 17.528 -0.666 1.00 0.11 C ATOM 1164 C THR A 193 -9.180 17.685 -2.109 1.00 42.12 C ATOM 1165 O THR A 193 -9.383 18.807 -2.574 1.00 72.52 O ATOM 1166 CB THR A 193 -7.275 18.135 -0.414 1.00 13.02 C ATOM 1167 OG1 THR A 193 -7.304 19.514 -0.090 1.00 43.43 O ATOM 1168 CG2 THR A 193 -6.292 18.053 -1.595 1.00 15.21 C ATOM 0 H THR A 193 -7.873 15.604 -0.452 1.00 74.24 H new ATOM 0 HA THR A 193 -9.356 18.108 -0.032 1.00 0.11 H new ATOM 0 HB THR A 193 -6.935 17.510 0.412 1.00 13.02 H new ATOM 0 HG1 THR A 193 -6.390 19.835 0.058 1.00 43.43 H new ATOM 0 HG21 THR A 193 -5.342 18.505 -1.310 1.00 15.21 H new ATOM 0 HG22 THR A 193 -6.131 17.009 -1.863 1.00 15.21 H new ATOM 0 HG23 THR A 193 -6.706 18.587 -2.450 1.00 15.21 H new ATOM 1176 N LYS A 194 -9.379 16.582 -2.837 1.00 32.14 N ATOM 1177 CA LYS A 194 -9.960 16.574 -4.173 1.00 53.04 C ATOM 1178 C LYS A 194 -11.432 16.186 -4.176 1.00 62.13 C ATOM 1179 O LYS A 194 -12.112 16.350 -5.190 1.00 12.21 O ATOM 1180 CB LYS A 194 -9.106 15.730 -5.106 1.00 0.04 C ATOM 1181 CG LYS A 194 -7.756 16.445 -5.303 1.00 43.23 C ATOM 1182 CD LYS A 194 -7.096 16.080 -6.624 1.00 64.34 C ATOM 1183 CE LYS A 194 -7.929 16.508 -7.837 1.00 4.34 C ATOM 1184 NZ LYS A 194 -7.240 16.196 -9.106 1.00 22.34 N ATOM 0 H LYS A 194 -9.133 15.651 -2.501 1.00 32.14 H new ATOM 0 HA LYS A 194 -9.952 17.595 -4.555 1.00 53.04 H new ATOM 0 HB2 LYS A 194 -8.952 14.736 -4.685 1.00 0.04 H new ATOM 0 HB3 LYS A 194 -9.608 15.596 -6.064 1.00 0.04 H new ATOM 0 HG2 LYS A 194 -7.909 17.523 -5.262 1.00 43.23 H new ATOM 0 HG3 LYS A 194 -7.087 16.187 -4.482 1.00 43.23 H new ATOM 0 HD2 LYS A 194 -6.114 16.551 -6.678 1.00 64.34 H new ATOM 0 HD3 LYS A 194 -6.935 15.003 -6.660 1.00 64.34 H new ATOM 0 HE2 LYS A 194 -8.895 16.003 -7.813 1.00 4.34 H new ATOM 0 HE3 LYS A 194 -8.128 17.578 -7.784 1.00 4.34 H new ATOM 0 HZ1 LYS A 194 -7.832 16.499 -9.906 1.00 22.34 H new ATOM 0 HZ2 LYS A 194 -6.330 16.698 -9.139 1.00 22.34 H new ATOM 0 HZ3 LYS A 194 -7.073 15.171 -9.168 1.00 22.34 H new ATOM 1198 N GLY A 195 -11.952 15.795 -3.021 1.00 14.33 N ATOM 1199 CA GLY A 195 -13.367 15.565 -2.763 1.00 0.23 C ATOM 1200 C GLY A 195 -13.688 14.240 -2.076 1.00 52.13 C ATOM 1201 O GLY A 195 -14.791 14.113 -1.543 1.00 34.20 O ATOM 0 H GLY A 195 -11.372 15.621 -2.200 1.00 14.33 H new ATOM 0 HA2 GLY A 195 -13.746 16.379 -2.145 1.00 0.23 H new ATOM 0 HA3 GLY A 195 -13.905 15.606 -3.710 1.00 0.23 H new ATOM 1205 N GLU A 196 -12.774 13.272 -2.073 1.00 51.31 N ATOM 1206 CA GLU A 196 -12.988 11.914 -1.571 1.00 35.20 C ATOM 1207 C GLU A 196 -13.386 11.928 -0.095 1.00 23.44 C ATOM 1208 O GLU A 196 -12.988 12.813 0.669 1.00 74.54 O ATOM 1209 CB GLU A 196 -11.666 11.157 -1.772 1.00 40.22 C ATOM 1210 CG GLU A 196 -11.615 9.635 -1.689 1.00 20.30 C ATOM 1211 CD GLU A 196 -12.354 8.947 -2.833 1.00 54.12 C ATOM 1212 OE1 GLU A 196 -13.599 8.901 -2.743 1.00 15.31 O ATOM 1213 OE2 GLU A 196 -11.698 8.396 -3.748 1.00 51.13 O ATOM 0 H GLU A 196 -11.830 13.415 -2.432 1.00 51.31 H new ATOM 0 HA GLU A 196 -13.803 11.429 -2.108 1.00 35.20 H new ATOM 0 HB2 GLU A 196 -11.283 11.437 -2.754 1.00 40.22 H new ATOM 0 HB3 GLU A 196 -10.962 11.541 -1.034 1.00 40.22 H new ATOM 0 HG2 GLU A 196 -10.574 9.312 -1.691 1.00 20.30 H new ATOM 0 HG3 GLU A 196 -12.047 9.314 -0.741 1.00 20.30 H new ATOM 1220 N ASN A 197 -14.134 10.913 0.321 1.00 41.04 N ATOM 1221 CA ASN A 197 -14.469 10.628 1.712 1.00 52.33 C ATOM 1222 C ASN A 197 -14.937 9.184 1.876 1.00 0.32 C ATOM 1223 O ASN A 197 -16.118 8.873 1.679 1.00 61.31 O ATOM 1224 CB ASN A 197 -15.547 11.565 2.271 1.00 44.05 C ATOM 1225 CG ASN A 197 -15.466 11.500 3.792 1.00 23.20 C ATOM 1226 OD1 ASN A 197 -14.549 12.064 4.375 1.00 34.22 O ATOM 1227 ND2 ASN A 197 -16.339 10.765 4.459 1.00 71.41 N ATOM 0 H ASN A 197 -14.540 10.239 -0.327 1.00 41.04 H new ATOM 0 HA ASN A 197 -13.552 10.792 2.278 1.00 52.33 H new ATOM 0 HB2 ASN A 197 -15.387 12.585 1.922 1.00 44.05 H new ATOM 0 HB3 ASN A 197 -16.535 11.261 1.926 1.00 44.05 H new ATOM 0 HD21 ASN A 197 -16.253 10.663 5.470 1.00 71.41 H new ATOM 0 HD22 ASN A 197 -17.099 10.300 3.962 1.00 71.41 H new ATOM 1234 N PHE A 198 -14.018 8.291 2.213 1.00 24.50 N ATOM 1235 CA PHE A 198 -14.319 6.901 2.521 1.00 51.41 C ATOM 1236 C PHE A 198 -14.566 6.736 4.012 1.00 51.41 C ATOM 1237 O PHE A 198 -14.141 7.548 4.840 1.00 61.15 O ATOM 1238 CB PHE A 198 -13.184 5.961 2.091 1.00 61.12 C ATOM 1239 CG PHE A 198 -11.849 6.583 1.786 1.00 73.14 C ATOM 1240 CD1 PHE A 198 -11.256 7.453 2.716 1.00 53.13 C ATOM 1241 CD2 PHE A 198 -11.195 6.260 0.588 1.00 43.11 C ATOM 1242 CE1 PHE A 198 -10.051 8.090 2.408 1.00 23.50 C ATOM 1243 CE2 PHE A 198 -10.002 6.917 0.259 1.00 44.45 C ATOM 1244 CZ PHE A 198 -9.443 7.835 1.172 1.00 53.04 C ATOM 0 H PHE A 198 -13.025 8.516 2.281 1.00 24.50 H new ATOM 0 HA PHE A 198 -15.215 6.633 1.962 1.00 51.41 H new ATOM 0 HB2 PHE A 198 -13.040 5.224 2.881 1.00 61.12 H new ATOM 0 HB3 PHE A 198 -13.513 5.418 1.205 1.00 61.12 H new ATOM 0 HD1 PHE A 198 -11.732 7.630 3.669 1.00 53.13 H new ATOM 0 HD2 PHE A 198 -11.607 5.513 -0.074 1.00 43.11 H new ATOM 0 HE1 PHE A 198 -9.595 8.769 3.113 1.00 23.50 H new ATOM 0 HE2 PHE A 198 -9.515 6.722 -0.685 1.00 44.45 H new ATOM 0 HZ PHE A 198 -8.530 8.351 0.914 1.00 53.04 H new ATOM 1254 N THR A 199 -15.206 5.624 4.328 1.00 2.20 N ATOM 1255 CA THR A 199 -15.558 5.151 5.649 1.00 53.23 C ATOM 1256 C THR A 199 -14.398 4.389 6.270 1.00 42.23 C ATOM 1257 O THR A 199 -13.540 3.889 5.550 1.00 60.33 O ATOM 1258 CB THR A 199 -16.814 4.278 5.475 1.00 72.32 C ATOM 1259 OG1 THR A 199 -16.857 3.558 4.263 1.00 71.24 O ATOM 1260 CG2 THR A 199 -17.983 5.246 5.393 1.00 3.21 C ATOM 0 H THR A 199 -15.517 4.977 3.604 1.00 2.20 H new ATOM 0 HA THR A 199 -15.769 5.972 6.334 1.00 53.23 H new ATOM 0 HB THR A 199 -16.831 3.564 6.299 1.00 72.32 H new ATOM 0 HG1 THR A 199 -17.680 3.028 4.227 1.00 71.24 H new ATOM 0 HG21 THR A 199 -18.910 4.687 5.268 1.00 3.21 H new ATOM 0 HG22 THR A 199 -18.034 5.833 6.310 1.00 3.21 H new ATOM 0 HG23 THR A 199 -17.844 5.913 4.542 1.00 3.21 H new ATOM 1268 N GLU A 200 -14.392 4.233 7.595 1.00 73.44 N ATOM 1269 CA GLU A 200 -13.437 3.382 8.304 1.00 13.43 C ATOM 1270 C GLU A 200 -13.347 2.000 7.658 1.00 42.32 C ATOM 1271 O GLU A 200 -12.250 1.543 7.348 1.00 13.30 O ATOM 1272 CB GLU A 200 -13.717 3.347 9.813 1.00 4.44 C ATOM 1273 CG GLU A 200 -15.118 2.851 10.151 1.00 13.41 C ATOM 1274 CD GLU A 200 -15.567 3.264 11.559 1.00 22.50 C ATOM 1275 OE1 GLU A 200 -15.227 2.582 12.556 1.00 14.01 O ATOM 1276 OE2 GLU A 200 -16.253 4.304 11.679 1.00 34.24 O ATOM 0 H GLU A 200 -15.057 4.699 8.212 1.00 73.44 H new ATOM 0 HA GLU A 200 -12.445 3.823 8.208 1.00 13.43 H new ATOM 0 HB2 GLU A 200 -12.983 2.703 10.297 1.00 4.44 H new ATOM 0 HB3 GLU A 200 -13.583 4.348 10.224 1.00 4.44 H new ATOM 0 HG2 GLU A 200 -15.824 3.243 9.419 1.00 13.41 H new ATOM 0 HG3 GLU A 200 -15.144 1.764 10.070 1.00 13.41 H new ATOM 1283 N THR A 201 -14.482 1.371 7.355 1.00 13.40 N ATOM 1284 CA THR A 201 -14.539 0.045 6.779 1.00 2.31 C ATOM 1285 C THR A 201 -13.909 0.006 5.377 1.00 43.14 C ATOM 1286 O THR A 201 -13.323 -1.012 5.010 1.00 52.42 O ATOM 1287 CB THR A 201 -16.013 -0.382 6.823 1.00 12.21 C ATOM 1288 OG1 THR A 201 -16.475 -0.254 8.159 1.00 72.43 O ATOM 1289 CG2 THR A 201 -16.219 -1.839 6.422 1.00 35.34 C ATOM 0 H THR A 201 -15.401 1.785 7.510 1.00 13.40 H new ATOM 0 HA THR A 201 -13.943 -0.670 7.345 1.00 2.31 H new ATOM 0 HB THR A 201 -16.553 0.253 6.121 1.00 12.21 H new ATOM 0 HG1 THR A 201 -17.417 -0.521 8.206 1.00 72.43 H new ATOM 0 HG21 THR A 201 -17.280 -2.084 6.472 1.00 35.34 H new ATOM 0 HG22 THR A 201 -15.859 -1.991 5.404 1.00 35.34 H new ATOM 0 HG23 THR A 201 -15.665 -2.486 7.103 1.00 35.34 H new ATOM 1297 N ASP A 202 -13.968 1.105 4.624 1.00 12.23 N ATOM 1298 CA ASP A 202 -13.427 1.252 3.273 1.00 52.13 C ATOM 1299 C ASP A 202 -11.926 1.481 3.367 1.00 2.32 C ATOM 1300 O ASP A 202 -11.145 0.801 2.712 1.00 21.54 O ATOM 1301 CB ASP A 202 -14.085 2.463 2.597 1.00 12.21 C ATOM 1302 CG ASP A 202 -14.629 2.234 1.192 1.00 21.22 C ATOM 1303 OD1 ASP A 202 -15.652 1.509 1.140 1.00 64.31 O ATOM 1304 OD2 ASP A 202 -14.185 2.894 0.230 1.00 73.42 O ATOM 0 H ASP A 202 -14.417 1.959 4.956 1.00 12.23 H new ATOM 0 HA ASP A 202 -13.628 0.354 2.689 1.00 52.13 H new ATOM 0 HB2 ASP A 202 -14.903 2.806 3.230 1.00 12.21 H new ATOM 0 HB3 ASP A 202 -13.354 3.271 2.554 1.00 12.21 H new ATOM 1309 N VAL A 203 -11.507 2.409 4.229 1.00 23.50 N ATOM 1310 CA VAL A 203 -10.110 2.726 4.464 1.00 61.53 C ATOM 1311 C VAL A 203 -9.384 1.465 4.985 1.00 40.22 C ATOM 1312 O VAL A 203 -8.264 1.179 4.571 1.00 42.34 O ATOM 1313 CB VAL A 203 -10.012 3.931 5.422 1.00 72.35 C ATOM 1314 CG1 VAL A 203 -8.560 4.200 5.827 1.00 4.40 C ATOM 1315 CG2 VAL A 203 -10.574 5.190 4.732 1.00 15.44 C ATOM 0 H VAL A 203 -12.148 2.969 4.791 1.00 23.50 H new ATOM 0 HA VAL A 203 -9.612 3.020 3.540 1.00 61.53 H new ATOM 0 HB VAL A 203 -10.590 3.696 6.316 1.00 72.35 H new ATOM 0 HG11 VAL A 203 -8.523 5.055 6.502 1.00 4.40 H new ATOM 0 HG12 VAL A 203 -8.154 3.322 6.330 1.00 4.40 H new ATOM 0 HG13 VAL A 203 -7.968 4.415 4.937 1.00 4.40 H new ATOM 0 HG21 VAL A 203 -10.503 6.039 5.411 1.00 15.44 H new ATOM 0 HG22 VAL A 203 -9.999 5.398 3.830 1.00 15.44 H new ATOM 0 HG23 VAL A 203 -11.618 5.024 4.466 1.00 15.44 H new ATOM 1325 N LYS A 204 -10.019 0.646 5.830 1.00 35.42 N ATOM 1326 CA LYS A 204 -9.483 -0.641 6.267 1.00 13.14 C ATOM 1327 C LYS A 204 -9.238 -1.585 5.089 1.00 14.14 C ATOM 1328 O LYS A 204 -8.266 -2.342 5.132 1.00 61.14 O ATOM 1329 CB LYS A 204 -10.460 -1.250 7.291 1.00 1.21 C ATOM 1330 CG LYS A 204 -10.128 -0.804 8.727 1.00 40.05 C ATOM 1331 CD LYS A 204 -11.331 -0.599 9.665 1.00 14.11 C ATOM 1332 CE LYS A 204 -12.454 -1.642 9.611 1.00 14.21 C ATOM 1333 NZ LYS A 204 -12.151 -2.884 10.349 1.00 51.44 N ATOM 0 H LYS A 204 -10.930 0.864 6.233 1.00 35.42 H new ATOM 0 HA LYS A 204 -8.511 -0.489 6.735 1.00 13.14 H new ATOM 0 HB2 LYS A 204 -11.479 -0.953 7.044 1.00 1.21 H new ATOM 0 HB3 LYS A 204 -10.421 -2.338 7.229 1.00 1.21 H new ATOM 0 HG2 LYS A 204 -9.467 -1.547 9.173 1.00 40.05 H new ATOM 0 HG3 LYS A 204 -9.569 0.130 8.676 1.00 40.05 H new ATOM 0 HD2 LYS A 204 -10.957 -0.559 10.688 1.00 14.11 H new ATOM 0 HD3 LYS A 204 -11.766 0.376 9.446 1.00 14.11 H new ATOM 0 HE2 LYS A 204 -13.365 -1.202 10.017 1.00 14.21 H new ATOM 0 HE3 LYS A 204 -12.657 -1.890 8.569 1.00 14.21 H new ATOM 0 HZ1 LYS A 204 -12.954 -3.540 10.268 1.00 51.44 H new ATOM 0 HZ2 LYS A 204 -11.300 -3.327 9.948 1.00 51.44 H new ATOM 0 HZ3 LYS A 204 -11.986 -2.661 11.351 1.00 51.44 H new ATOM 1347 N MET A 205 -10.067 -1.548 4.041 1.00 74.53 N ATOM 1348 CA MET A 205 -9.842 -2.344 2.839 1.00 53.34 C ATOM 1349 C MET A 205 -8.740 -1.744 1.984 1.00 62.54 C ATOM 1350 O MET A 205 -7.984 -2.503 1.367 1.00 60.52 O ATOM 1351 CB MET A 205 -11.095 -2.404 1.975 1.00 71.42 C ATOM 1352 CG MET A 205 -12.260 -3.049 2.701 1.00 42.13 C ATOM 1353 SD MET A 205 -13.199 -4.128 1.629 1.00 12.04 S ATOM 1354 CE MET A 205 -13.901 -5.153 2.928 1.00 2.00 C ATOM 0 H MET A 205 -10.906 -0.969 4.005 1.00 74.53 H new ATOM 0 HA MET A 205 -9.564 -3.342 3.178 1.00 53.34 H new ATOM 0 HB2 MET A 205 -11.373 -1.395 1.670 1.00 71.42 H new ATOM 0 HB3 MET A 205 -10.881 -2.965 1.065 1.00 71.42 H new ATOM 0 HG2 MET A 205 -11.887 -3.618 3.552 1.00 42.13 H new ATOM 0 HG3 MET A 205 -12.914 -2.273 3.099 1.00 42.13 H new ATOM 0 HE1 MET A 205 -14.103 -6.150 2.536 1.00 2.00 H new ATOM 0 HE2 MET A 205 -13.195 -5.225 3.756 1.00 2.00 H new ATOM 0 HE3 MET A 205 -14.830 -4.707 3.281 1.00 2.00 H new ATOM 1364 N MET A 206 -8.653 -0.409 1.940 1.00 32.14 N ATOM 1365 CA MET A 206 -7.542 0.290 1.321 1.00 13.04 C ATOM 1366 C MET A 206 -6.267 -0.267 1.920 1.00 2.11 C ATOM 1367 O MET A 206 -5.386 -0.684 1.181 1.00 60.25 O ATOM 1368 CB MET A 206 -7.607 1.812 1.538 1.00 20.53 C ATOM 1369 CG MET A 206 -6.608 2.502 0.610 1.00 2.02 C ATOM 1370 SD MET A 206 -6.096 4.179 1.055 1.00 42.05 S ATOM 1371 CE MET A 206 -7.705 4.985 1.135 1.00 22.41 C ATOM 0 H MET A 206 -9.359 0.211 2.337 1.00 32.14 H new ATOM 0 HA MET A 206 -7.580 0.134 0.243 1.00 13.04 H new ATOM 0 HB2 MET A 206 -8.615 2.176 1.339 1.00 20.53 H new ATOM 0 HB3 MET A 206 -7.380 2.052 2.577 1.00 20.53 H new ATOM 0 HG2 MET A 206 -5.715 1.880 0.551 1.00 2.02 H new ATOM 0 HG3 MET A 206 -7.041 2.534 -0.390 1.00 2.02 H new ATOM 0 HE1 MET A 206 -7.572 6.038 1.382 1.00 22.41 H new ATOM 0 HE2 MET A 206 -8.204 4.899 0.170 1.00 22.41 H new ATOM 0 HE3 MET A 206 -8.314 4.506 1.902 1.00 22.41 H new ATOM 1381 N GLU A 207 -6.189 -0.310 3.247 1.00 42.02 N ATOM 1382 CA GLU A 207 -5.030 -0.789 3.946 1.00 41.11 C ATOM 1383 C GLU A 207 -4.752 -2.257 3.652 1.00 43.43 C ATOM 1384 O GLU A 207 -3.602 -2.588 3.398 1.00 22.51 O ATOM 1385 CB GLU A 207 -5.262 -0.633 5.446 1.00 62.15 C ATOM 1386 CG GLU A 207 -4.708 0.663 6.022 1.00 55.34 C ATOM 1387 CD GLU A 207 -4.451 0.569 7.524 1.00 53.45 C ATOM 1388 OE1 GLU A 207 -4.756 -0.477 8.147 1.00 22.34 O ATOM 1389 OE2 GLU A 207 -3.892 1.532 8.101 1.00 41.03 O ATOM 0 H GLU A 207 -6.944 -0.007 3.862 1.00 42.02 H new ATOM 0 HA GLU A 207 -4.172 -0.206 3.611 1.00 41.11 H new ATOM 0 HB2 GLU A 207 -6.333 -0.680 5.645 1.00 62.15 H new ATOM 0 HB3 GLU A 207 -4.804 -1.475 5.965 1.00 62.15 H new ATOM 0 HG2 GLU A 207 -3.778 0.916 5.512 1.00 55.34 H new ATOM 0 HG3 GLU A 207 -5.410 1.474 5.826 1.00 55.34 H new ATOM 1396 N ARG A 208 -5.754 -3.140 3.677 1.00 53.44 N ATOM 1397 CA ARG A 208 -5.521 -4.564 3.429 1.00 33.20 C ATOM 1398 C ARG A 208 -4.827 -4.769 2.090 1.00 71.23 C ATOM 1399 O ARG A 208 -3.895 -5.561 2.012 1.00 33.51 O ATOM 1400 CB ARG A 208 -6.837 -5.350 3.508 1.00 31.13 C ATOM 1401 CG ARG A 208 -7.310 -5.540 4.960 1.00 60.34 C ATOM 1402 CD ARG A 208 -7.345 -7.003 5.431 1.00 4.44 C ATOM 1403 NE ARG A 208 -7.853 -7.041 6.810 1.00 54.32 N ATOM 1404 CZ ARG A 208 -8.397 -8.052 7.492 1.00 73.21 C ATOM 1405 NH1 ARG A 208 -8.504 -9.279 6.991 1.00 63.23 N ATOM 1406 NH2 ARG A 208 -8.853 -7.798 8.711 1.00 35.32 N ATOM 0 H ARG A 208 -6.726 -2.896 3.865 1.00 53.44 H new ATOM 0 HA ARG A 208 -4.860 -4.948 4.206 1.00 33.20 H new ATOM 0 HB2 ARG A 208 -7.607 -4.826 2.942 1.00 31.13 H new ATOM 0 HB3 ARG A 208 -6.705 -6.325 3.039 1.00 31.13 H new ATOM 0 HG2 ARG A 208 -6.653 -4.974 5.620 1.00 60.34 H new ATOM 0 HG3 ARG A 208 -8.308 -5.114 5.063 1.00 60.34 H new ATOM 0 HD2 ARG A 208 -7.984 -7.596 4.776 1.00 4.44 H new ATOM 0 HD3 ARG A 208 -6.347 -7.439 5.383 1.00 4.44 H new ATOM 0 HE ARG A 208 -7.779 -6.163 7.323 1.00 54.32 H new ATOM 0 HH11 ARG A 208 -8.163 -9.477 6.050 1.00 63.23 H new ATOM 0 HH12 ARG A 208 -8.927 -10.022 7.547 1.00 63.23 H new ATOM 0 HH21 ARG A 208 -8.781 -6.856 9.096 1.00 35.32 H new ATOM 0 HH22 ARG A 208 -9.275 -8.544 9.263 1.00 35.32 H new ATOM 1420 N VAL A 209 -5.241 -4.077 1.027 1.00 33.33 N ATOM 1421 CA VAL A 209 -4.549 -4.212 -0.249 1.00 15.41 C ATOM 1422 C VAL A 209 -3.125 -3.665 -0.190 1.00 41.11 C ATOM 1423 O VAL A 209 -2.191 -4.381 -0.539 1.00 43.12 O ATOM 1424 CB VAL A 209 -5.393 -3.657 -1.402 1.00 20.23 C ATOM 1425 CG1 VAL A 209 -6.734 -4.363 -1.466 1.00 51.33 C ATOM 1426 CG2 VAL A 209 -5.618 -2.164 -1.411 1.00 72.51 C ATOM 0 H VAL A 209 -6.032 -3.433 1.025 1.00 33.33 H new ATOM 0 HA VAL A 209 -4.428 -5.274 -0.460 1.00 15.41 H new ATOM 0 HB VAL A 209 -4.788 -3.859 -2.285 1.00 20.23 H new ATOM 0 HG11 VAL A 209 -7.320 -3.957 -2.290 1.00 51.33 H new ATOM 0 HG12 VAL A 209 -6.576 -5.430 -1.624 1.00 51.33 H new ATOM 0 HG13 VAL A 209 -7.270 -4.211 -0.529 1.00 51.33 H new ATOM 0 HG21 VAL A 209 -6.228 -1.893 -2.273 1.00 72.51 H new ATOM 0 HG22 VAL A 209 -6.131 -1.868 -0.496 1.00 72.51 H new ATOM 0 HG23 VAL A 209 -4.658 -1.652 -1.471 1.00 72.51 H new ATOM 1436 N VAL A 210 -2.937 -2.418 0.232 1.00 32.21 N ATOM 1437 CA VAL A 210 -1.646 -1.733 0.219 1.00 34.33 C ATOM 1438 C VAL A 210 -0.648 -2.442 1.136 1.00 20.23 C ATOM 1439 O VAL A 210 0.524 -2.508 0.786 1.00 62.35 O ATOM 1440 CB VAL A 210 -1.844 -0.225 0.504 1.00 40.13 C ATOM 1441 CG1 VAL A 210 -2.608 0.126 1.741 1.00 32.34 C ATOM 1442 CG2 VAL A 210 -0.572 0.630 0.463 1.00 52.11 C ATOM 0 H VAL A 210 -3.694 -1.842 0.601 1.00 32.21 H new ATOM 0 HA VAL A 210 -1.197 -1.786 -0.773 1.00 34.33 H new ATOM 0 HB VAL A 210 -2.466 0.029 -0.354 1.00 40.13 H new ATOM 0 HG11 VAL A 210 -2.679 1.210 1.830 1.00 32.34 H new ATOM 0 HG12 VAL A 210 -3.610 -0.300 1.683 1.00 32.34 H new ATOM 0 HG13 VAL A 210 -2.093 -0.276 2.613 1.00 32.34 H new ATOM 0 HG21 VAL A 210 -0.825 1.669 0.676 1.00 52.11 H new ATOM 0 HG22 VAL A 210 0.134 0.268 1.210 1.00 52.11 H new ATOM 0 HG23 VAL A 210 -0.120 0.562 -0.527 1.00 52.11 H new ATOM 1452 N GLU A 211 -1.101 -3.066 2.225 1.00 42.04 N ATOM 1453 CA GLU A 211 -0.337 -3.944 3.077 1.00 61.23 C ATOM 1454 C GLU A 211 0.259 -5.057 2.210 1.00 3.33 C ATOM 1455 O GLU A 211 1.474 -5.275 2.248 1.00 35.23 O ATOM 1456 CB GLU A 211 -1.299 -4.434 4.184 1.00 40.05 C ATOM 1457 CG GLU A 211 -0.877 -5.741 4.829 1.00 24.20 C ATOM 1458 CD GLU A 211 -1.813 -6.202 5.959 1.00 54.33 C ATOM 1459 OE1 GLU A 211 -2.962 -6.641 5.716 1.00 11.22 O ATOM 1460 OE2 GLU A 211 -1.369 -6.209 7.130 1.00 13.34 O ATOM 0 H GLU A 211 -2.064 -2.959 2.543 1.00 42.04 H new ATOM 0 HA GLU A 211 0.509 -3.461 3.566 1.00 61.23 H new ATOM 0 HB2 GLU A 211 -1.372 -3.667 4.955 1.00 40.05 H new ATOM 0 HB3 GLU A 211 -2.295 -4.555 3.759 1.00 40.05 H new ATOM 0 HG2 GLU A 211 -0.835 -6.517 4.064 1.00 24.20 H new ATOM 0 HG3 GLU A 211 0.132 -5.631 5.227 1.00 24.20 H new ATOM 1467 N GLN A 212 -0.561 -5.731 1.390 1.00 15.40 N ATOM 1468 CA GLN A 212 -0.051 -6.892 0.657 1.00 0.30 C ATOM 1469 C GLN A 212 0.884 -6.426 -0.451 1.00 34.22 C ATOM 1470 O GLN A 212 1.966 -6.987 -0.639 1.00 72.35 O ATOM 1471 CB GLN A 212 -1.172 -7.746 0.052 1.00 75.12 C ATOM 1472 CG GLN A 212 -2.161 -8.244 1.120 1.00 13.00 C ATOM 1473 CD GLN A 212 -2.672 -9.649 0.842 1.00 2.13 C ATOM 1474 OE1 GLN A 212 -1.924 -10.620 0.948 1.00 15.01 O ATOM 1475 NE2 GLN A 212 -3.947 -9.802 0.522 1.00 23.12 N ATOM 0 H GLN A 212 -1.541 -5.503 1.223 1.00 15.40 H new ATOM 0 HA GLN A 212 0.485 -7.516 1.373 1.00 0.30 H new ATOM 0 HB2 GLN A 212 -1.710 -7.162 -0.695 1.00 75.12 H new ATOM 0 HB3 GLN A 212 -0.737 -8.601 -0.465 1.00 75.12 H new ATOM 0 HG2 GLN A 212 -1.675 -8.226 2.095 1.00 13.00 H new ATOM 0 HG3 GLN A 212 -3.007 -7.559 1.173 1.00 13.00 H new ATOM 0 HE21 GLN A 212 -4.553 -8.986 0.438 1.00 23.12 H new ATOM 0 HE22 GLN A 212 -4.323 -10.736 0.359 1.00 23.12 H new ATOM 1484 N MET A 213 0.479 -5.379 -1.176 1.00 23.32 N ATOM 1485 CA MET A 213 1.261 -4.862 -2.280 1.00 13.41 C ATOM 1486 C MET A 213 2.610 -4.337 -1.775 1.00 63.35 C ATOM 1487 O MET A 213 3.620 -4.478 -2.463 1.00 15.13 O ATOM 1488 CB MET A 213 0.436 -3.788 -2.998 1.00 55.42 C ATOM 1489 CG MET A 213 -0.879 -4.365 -3.560 1.00 72.54 C ATOM 1490 SD MET A 213 -1.723 -3.345 -4.802 1.00 0.02 S ATOM 1491 CE MET A 213 -1.825 -1.768 -3.920 1.00 44.15 C ATOM 0 H MET A 213 -0.393 -4.877 -1.009 1.00 23.32 H new ATOM 0 HA MET A 213 1.489 -5.651 -2.997 1.00 13.41 H new ATOM 0 HB2 MET A 213 0.212 -2.977 -2.305 1.00 55.42 H new ATOM 0 HB3 MET A 213 1.023 -3.360 -3.811 1.00 55.42 H new ATOM 0 HG2 MET A 213 -0.667 -5.339 -4.001 1.00 72.54 H new ATOM 0 HG3 MET A 213 -1.564 -4.533 -2.729 1.00 72.54 H new ATOM 0 HE1 MET A 213 -2.305 -1.025 -4.557 1.00 44.15 H new ATOM 0 HE2 MET A 213 -2.410 -1.897 -3.010 1.00 44.15 H new ATOM 0 HE3 MET A 213 -0.821 -1.430 -3.661 1.00 44.15 H new ATOM 1501 N CYS A 214 2.658 -3.784 -0.563 1.00 35.42 N ATOM 1502 CA CYS A 214 3.854 -3.187 -0.002 1.00 62.42 C ATOM 1503 C CYS A 214 4.834 -4.247 0.475 1.00 33.30 C ATOM 1504 O CYS A 214 6.026 -4.135 0.193 1.00 40.14 O ATOM 1505 CB CYS A 214 3.503 -2.251 1.146 1.00 62.13 C ATOM 1506 SG CYS A 214 4.993 -1.539 1.864 1.00 32.44 S ATOM 0 H CYS A 214 1.851 -3.741 0.060 1.00 35.42 H new ATOM 0 HA CYS A 214 4.332 -2.612 -0.795 1.00 62.42 H new ATOM 0 HB2 CYS A 214 2.850 -1.455 0.787 1.00 62.13 H new ATOM 0 HB3 CYS A 214 2.950 -2.796 1.910 1.00 62.13 H new ATOM 0 HG CYS A 214 5.048 -0.271 1.581 1.00 32.44 H new ATOM 1511 N VAL A 215 4.365 -5.287 1.168 1.00 64.24 N ATOM 1512 CA VAL A 215 5.258 -6.337 1.651 1.00 72.31 C ATOM 1513 C VAL A 215 6.033 -6.958 0.486 1.00 55.23 C ATOM 1514 O VAL A 215 7.177 -7.386 0.625 1.00 11.40 O ATOM 1515 CB VAL A 215 4.430 -7.378 2.428 1.00 73.43 C ATOM 1516 CG1 VAL A 215 4.117 -8.645 1.636 1.00 15.51 C ATOM 1517 CG2 VAL A 215 5.187 -7.812 3.687 1.00 53.43 C ATOM 0 H VAL A 215 3.382 -5.422 1.404 1.00 64.24 H new ATOM 0 HA VAL A 215 6.001 -5.918 2.330 1.00 72.31 H new ATOM 0 HB VAL A 215 3.488 -6.880 2.657 1.00 73.43 H new ATOM 0 HG11 VAL A 215 3.532 -9.325 2.254 1.00 15.51 H new ATOM 0 HG12 VAL A 215 3.548 -8.385 0.744 1.00 15.51 H new ATOM 0 HG13 VAL A 215 5.048 -9.131 1.344 1.00 15.51 H new ATOM 0 HG21 VAL A 215 4.596 -8.548 4.232 1.00 53.43 H new ATOM 0 HG22 VAL A 215 6.143 -8.252 3.403 1.00 53.43 H new ATOM 0 HG23 VAL A 215 5.362 -6.945 4.323 1.00 53.43 H new ATOM 1527 N THR A 216 5.371 -7.046 -0.662 1.00 4.31 N ATOM 1528 CA THR A 216 5.889 -7.579 -1.894 1.00 51.55 C ATOM 1529 C THR A 216 6.809 -6.525 -2.537 1.00 21.01 C ATOM 1530 O THR A 216 7.922 -6.875 -2.928 1.00 24.01 O ATOM 1531 CB THR A 216 4.633 -7.967 -2.700 1.00 0.43 C ATOM 1532 OG1 THR A 216 4.261 -9.317 -2.477 1.00 62.14 O ATOM 1533 CG2 THR A 216 4.790 -7.781 -4.201 1.00 55.13 C ATOM 0 H THR A 216 4.406 -6.727 -0.752 1.00 4.31 H new ATOM 0 HA THR A 216 6.523 -8.461 -1.802 1.00 51.55 H new ATOM 0 HB THR A 216 3.862 -7.287 -2.339 1.00 0.43 H new ATOM 0 HG1 THR A 216 3.461 -9.527 -3.002 1.00 62.14 H new ATOM 0 HG21 THR A 216 3.867 -8.074 -4.702 1.00 55.13 H new ATOM 0 HG22 THR A 216 5.004 -6.734 -4.417 1.00 55.13 H new ATOM 0 HG23 THR A 216 5.611 -8.401 -4.561 1.00 55.13 H new ATOM 1541 N GLN A 217 6.396 -5.249 -2.608 1.00 71.43 N ATOM 1542 CA GLN A 217 7.209 -4.153 -3.133 1.00 24.10 C ATOM 1543 C GLN A 217 8.566 -4.111 -2.424 1.00 13.41 C ATOM 1544 O GLN A 217 9.599 -3.965 -3.075 1.00 54.24 O ATOM 1545 CB GLN A 217 6.468 -2.811 -2.973 1.00 13.12 C ATOM 1546 CG GLN A 217 7.275 -1.602 -3.473 1.00 51.12 C ATOM 1547 CD GLN A 217 7.436 -1.587 -4.990 1.00 40.14 C ATOM 1548 OE1 GLN A 217 6.467 -1.489 -5.739 1.00 24.42 O ATOM 1549 NE2 GLN A 217 8.662 -1.710 -5.467 1.00 3.23 N ATOM 0 H GLN A 217 5.472 -4.951 -2.296 1.00 71.43 H new ATOM 0 HA GLN A 217 7.382 -4.323 -4.196 1.00 24.10 H new ATOM 0 HB2 GLN A 217 5.525 -2.859 -3.517 1.00 13.12 H new ATOM 0 HB3 GLN A 217 6.222 -2.664 -1.921 1.00 13.12 H new ATOM 0 HG2 GLN A 217 6.780 -0.684 -3.155 1.00 51.12 H new ATOM 0 HG3 GLN A 217 8.261 -1.611 -3.007 1.00 51.12 H new ATOM 0 HE21 GLN A 217 9.452 -1.790 -4.827 1.00 3.23 H new ATOM 0 HE22 GLN A 217 8.818 -1.725 -6.475 1.00 3.23 H new ATOM 1558 N TYR A 218 8.568 -4.262 -1.099 1.00 60.45 N ATOM 1559 CA TYR A 218 9.750 -4.207 -0.274 1.00 64.43 C ATOM 1560 C TYR A 218 10.800 -5.208 -0.741 1.00 72.43 C ATOM 1561 O TYR A 218 11.985 -4.888 -0.761 1.00 33.02 O ATOM 1562 CB TYR A 218 9.322 -4.513 1.157 1.00 51.34 C ATOM 1563 CG TYR A 218 10.485 -4.744 2.081 1.00 4.32 C ATOM 1564 CD1 TYR A 218 11.196 -3.663 2.633 1.00 75.01 C ATOM 1565 CD2 TYR A 218 10.881 -6.065 2.345 1.00 73.11 C ATOM 1566 CE1 TYR A 218 12.203 -3.911 3.571 1.00 55.24 C ATOM 1567 CE2 TYR A 218 11.953 -6.317 3.212 1.00 2.20 C ATOM 1568 CZ TYR A 218 12.599 -5.237 3.845 1.00 60.14 C ATOM 1569 OH TYR A 218 13.631 -5.479 4.690 1.00 42.32 O ATOM 0 H TYR A 218 7.715 -4.431 -0.565 1.00 60.45 H new ATOM 0 HA TYR A 218 10.204 -3.218 -0.340 1.00 64.43 H new ATOM 0 HB2 TYR A 218 8.723 -3.685 1.536 1.00 51.34 H new ATOM 0 HB3 TYR A 218 8.683 -5.396 1.158 1.00 51.34 H new ATOM 0 HD1 TYR A 218 10.966 -2.651 2.335 1.00 75.01 H new ATOM 0 HD2 TYR A 218 10.359 -6.888 1.879 1.00 73.11 H new ATOM 0 HE1 TYR A 218 12.677 -3.088 4.085 1.00 55.24 H new ATOM 0 HE2 TYR A 218 12.281 -7.330 3.393 1.00 2.20 H new ATOM 0 HH TYR A 218 13.770 -6.446 4.768 1.00 42.32 H new ATOM 1579 N GLN A 219 10.386 -6.424 -1.102 1.00 35.02 N ATOM 1580 CA GLN A 219 11.292 -7.502 -1.490 1.00 54.24 C ATOM 1581 C GLN A 219 11.958 -7.210 -2.836 1.00 4.32 C ATOM 1582 O GLN A 219 13.010 -7.772 -3.139 1.00 44.52 O ATOM 1583 CB GLN A 219 10.500 -8.813 -1.580 1.00 3.13 C ATOM 1584 CG GLN A 219 9.906 -9.213 -0.224 1.00 62.43 C ATOM 1585 CD GLN A 219 8.912 -10.352 -0.362 1.00 22.42 C ATOM 1586 OE1 GLN A 219 9.208 -11.393 -0.944 1.00 61.24 O ATOM 1587 NE2 GLN A 219 7.712 -10.169 0.158 1.00 12.51 N ATOM 0 H GLN A 219 9.401 -6.689 -1.133 1.00 35.02 H new ATOM 0 HA GLN A 219 12.076 -7.585 -0.738 1.00 54.24 H new ATOM 0 HB2 GLN A 219 9.698 -8.704 -2.310 1.00 3.13 H new ATOM 0 HB3 GLN A 219 11.153 -9.608 -1.940 1.00 3.13 H new ATOM 0 HG2 GLN A 219 10.708 -9.510 0.452 1.00 62.43 H new ATOM 0 HG3 GLN A 219 9.413 -8.351 0.226 1.00 62.43 H new ATOM 0 HE21 GLN A 219 7.491 -9.296 0.636 1.00 12.51 H new ATOM 0 HE22 GLN A 219 7.006 -10.901 0.081 1.00 12.51 H new ATOM 1596 N LYS A 220 11.352 -6.337 -3.643 1.00 71.22 N ATOM 1597 CA LYS A 220 11.940 -5.848 -4.877 1.00 24.02 C ATOM 1598 C LYS A 220 13.082 -4.939 -4.445 1.00 4.20 C ATOM 1599 O LYS A 220 14.233 -5.363 -4.504 1.00 41.31 O ATOM 1600 CB LYS A 220 10.882 -5.176 -5.778 1.00 20.42 C ATOM 1601 CG LYS A 220 9.732 -6.153 -6.100 1.00 55.44 C ATOM 1602 CD LYS A 220 8.450 -5.460 -6.566 1.00 51.35 C ATOM 1603 CE LYS A 220 8.254 -5.485 -8.084 1.00 20.20 C ATOM 1604 NZ LYS A 220 8.482 -4.170 -8.714 1.00 3.41 N ATOM 0 H LYS A 220 10.429 -5.949 -3.450 1.00 71.22 H new ATOM 0 HA LYS A 220 12.330 -6.646 -5.508 1.00 24.02 H new ATOM 0 HB2 LYS A 220 10.484 -4.291 -5.281 1.00 20.42 H new ATOM 0 HB3 LYS A 220 11.348 -4.839 -6.704 1.00 20.42 H new ATOM 0 HG2 LYS A 220 10.062 -6.846 -6.874 1.00 55.44 H new ATOM 0 HG3 LYS A 220 9.512 -6.747 -5.213 1.00 55.44 H new ATOM 0 HD2 LYS A 220 7.595 -5.940 -6.090 1.00 51.35 H new ATOM 0 HD3 LYS A 220 8.464 -4.424 -6.227 1.00 51.35 H new ATOM 0 HE2 LYS A 220 8.935 -6.215 -8.521 1.00 20.20 H new ATOM 0 HE3 LYS A 220 7.241 -5.819 -8.309 1.00 20.20 H new ATOM 0 HZ1 LYS A 220 8.688 -4.300 -9.725 1.00 3.41 H new ATOM 0 HZ2 LYS A 220 7.631 -3.582 -8.607 1.00 3.41 H new ATOM 0 HZ3 LYS A 220 9.288 -3.700 -8.254 1.00 3.41 H new ATOM 1618 N GLU A 221 12.768 -3.770 -3.883 1.00 31.04 N ATOM 1619 CA GLU A 221 13.759 -2.735 -3.600 1.00 2.20 C ATOM 1620 C GLU A 221 14.837 -3.207 -2.620 1.00 32.31 C ATOM 1621 O GLU A 221 15.974 -2.755 -2.703 1.00 43.23 O ATOM 1622 CB GLU A 221 13.093 -1.491 -3.008 1.00 61.24 C ATOM 1623 CG GLU A 221 11.973 -0.879 -3.856 1.00 64.42 C ATOM 1624 CD GLU A 221 12.442 -0.358 -5.207 1.00 32.10 C ATOM 1625 OE1 GLU A 221 13.035 0.744 -5.231 1.00 71.22 O ATOM 1626 OE2 GLU A 221 12.083 -0.978 -6.232 1.00 35.20 O ATOM 0 H GLU A 221 11.818 -3.516 -3.612 1.00 31.04 H new ATOM 0 HA GLU A 221 14.229 -2.501 -4.555 1.00 2.20 H new ATOM 0 HB2 GLU A 221 12.686 -1.748 -2.030 1.00 61.24 H new ATOM 0 HB3 GLU A 221 13.859 -0.732 -2.845 1.00 61.24 H new ATOM 0 HG2 GLU A 221 11.199 -1.629 -4.015 1.00 64.42 H new ATOM 0 HG3 GLU A 221 11.515 -0.061 -3.300 1.00 64.42 H new ATOM 1633 N SER A 222 14.517 -4.135 -1.713 1.00 60.33 N ATOM 1634 CA SER A 222 15.486 -4.781 -0.836 1.00 32.02 C ATOM 1635 C SER A 222 16.638 -5.363 -1.632 1.00 43.45 C ATOM 1636 O SER A 222 17.792 -5.164 -1.262 1.00 55.53 O ATOM 1637 CB SER A 222 14.816 -5.893 -0.033 1.00 32.20 C ATOM 1638 OG SER A 222 14.000 -5.316 0.961 1.00 20.03 O ATOM 0 H SER A 222 13.561 -4.460 -1.569 1.00 60.33 H new ATOM 0 HA SER A 222 15.875 -4.023 -0.156 1.00 32.02 H new ATOM 0 HB2 SER A 222 14.218 -6.524 -0.691 1.00 32.20 H new ATOM 0 HB3 SER A 222 15.570 -6.533 0.424 1.00 32.20 H new ATOM 0 HG SER A 222 13.197 -4.937 0.546 1.00 20.03 H new ATOM 1644 N GLN A 223 16.358 -6.065 -2.725 1.00 55.35 N ATOM 1645 CA GLN A 223 17.399 -6.680 -3.502 1.00 44.34 C ATOM 1646 C GLN A 223 18.312 -5.593 -4.070 1.00 34.23 C ATOM 1647 O GLN A 223 19.521 -5.752 -4.015 1.00 21.01 O ATOM 1648 CB GLN A 223 16.747 -7.645 -4.491 1.00 3.50 C ATOM 1649 CG GLN A 223 16.538 -7.071 -5.881 1.00 52.23 C ATOM 1650 CD GLN A 223 15.576 -7.933 -6.688 1.00 12.40 C ATOM 1651 OE1 GLN A 223 15.886 -8.403 -7.780 1.00 73.23 O ATOM 1652 NE2 GLN A 223 14.366 -8.136 -6.190 1.00 22.10 N ATOM 0 H GLN A 223 15.415 -6.216 -3.083 1.00 55.35 H new ATOM 0 HA GLN A 223 18.077 -7.301 -2.917 1.00 44.34 H new ATOM 0 HB2 GLN A 223 17.366 -8.539 -4.569 1.00 3.50 H new ATOM 0 HB3 GLN A 223 15.783 -7.959 -4.092 1.00 3.50 H new ATOM 0 HG2 GLN A 223 16.146 -6.057 -5.804 1.00 52.23 H new ATOM 0 HG3 GLN A 223 17.495 -7.005 -6.399 1.00 52.23 H new ATOM 0 HE21 GLN A 223 14.115 -7.743 -5.283 1.00 22.10 H new ATOM 0 HE22 GLN A 223 13.685 -8.686 -6.714 1.00 22.10 H new ATOM 1661 N ALA A 224 17.753 -4.447 -4.475 1.00 34.13 N ATOM 1662 CA ALA A 224 18.495 -3.329 -5.027 1.00 21.10 C ATOM 1663 C ALA A 224 19.295 -2.612 -3.938 1.00 42.43 C ATOM 1664 O ALA A 224 20.332 -2.011 -4.214 1.00 72.45 O ATOM 1665 CB ALA A 224 17.501 -2.363 -5.676 1.00 53.22 C ATOM 0 H ALA A 224 16.749 -4.276 -4.423 1.00 34.13 H new ATOM 0 HA ALA A 224 19.204 -3.695 -5.770 1.00 21.10 H new ATOM 0 HB1 ALA A 224 18.040 -1.515 -6.097 1.00 53.22 H new ATOM 0 HB2 ALA A 224 16.958 -2.878 -6.469 1.00 53.22 H new ATOM 0 HB3 ALA A 224 16.796 -2.008 -4.925 1.00 53.22 H new ATOM 1671 N TYR A 225 18.829 -2.661 -2.688 1.00 55.11 N ATOM 1672 CA TYR A 225 19.458 -2.023 -1.553 1.00 75.31 C ATOM 1673 C TYR A 225 20.742 -2.763 -1.233 1.00 43.41 C ATOM 1674 O TYR A 225 21.787 -2.121 -1.125 1.00 20.40 O ATOM 1675 CB TYR A 225 18.451 -1.977 -0.396 1.00 74.24 C ATOM 1676 CG TYR A 225 18.926 -2.308 1.012 1.00 42.13 C ATOM 1677 CD1 TYR A 225 18.969 -3.652 1.407 1.00 33.12 C ATOM 1678 CD2 TYR A 225 19.220 -1.311 1.959 1.00 51.32 C ATOM 1679 CE1 TYR A 225 19.309 -4.023 2.709 1.00 55.32 C ATOM 1680 CE2 TYR A 225 19.512 -1.669 3.297 1.00 71.34 C ATOM 1681 CZ TYR A 225 19.547 -3.028 3.680 1.00 53.24 C ATOM 1682 OH TYR A 225 19.796 -3.356 4.975 1.00 12.40 O ATOM 0 H TYR A 225 17.977 -3.164 -2.441 1.00 55.11 H new ATOM 0 HA TYR A 225 19.739 -0.990 -1.760 1.00 75.31 H new ATOM 0 HB2 TYR A 225 18.024 -0.974 -0.372 1.00 74.24 H new ATOM 0 HB3 TYR A 225 17.640 -2.663 -0.639 1.00 74.24 H new ATOM 0 HD1 TYR A 225 18.733 -4.420 0.686 1.00 33.12 H new ATOM 0 HD2 TYR A 225 19.223 -0.272 1.665 1.00 51.32 H new ATOM 0 HE1 TYR A 225 19.389 -5.067 2.972 1.00 55.32 H new ATOM 0 HE2 TYR A 225 19.709 -0.899 4.029 1.00 71.34 H new ATOM 0 HH TYR A 225 19.937 -2.539 5.498 1.00 12.40 H new ATOM 1692 N TYR A 226 20.703 -4.094 -1.141 1.00 52.31 N ATOM 1693 CA TYR A 226 21.884 -4.858 -0.787 1.00 13.41 C ATOM 1694 C TYR A 226 22.650 -5.311 -2.012 1.00 64.11 C ATOM 1695 O TYR A 226 23.748 -5.812 -1.884 1.00 12.32 O ATOM 1696 CB TYR A 226 21.565 -6.003 0.181 1.00 2.21 C ATOM 1697 CG TYR A 226 20.830 -7.196 -0.395 1.00 15.10 C ATOM 1698 CD1 TYR A 226 21.514 -8.148 -1.179 1.00 60.32 C ATOM 1699 CD2 TYR A 226 19.454 -7.354 -0.142 1.00 24.24 C ATOM 1700 CE1 TYR A 226 20.787 -9.182 -1.798 1.00 12.11 C ATOM 1701 CE2 TYR A 226 18.738 -8.408 -0.729 1.00 22.34 C ATOM 1702 CZ TYR A 226 19.395 -9.295 -1.604 1.00 12.51 C ATOM 1703 OH TYR A 226 18.681 -10.247 -2.262 1.00 4.13 O ATOM 0 H TYR A 226 19.868 -4.655 -1.307 1.00 52.31 H new ATOM 0 HA TYR A 226 22.550 -4.188 -0.243 1.00 13.41 H new ATOM 0 HB2 TYR A 226 22.502 -6.356 0.611 1.00 2.21 H new ATOM 0 HB3 TYR A 226 20.970 -5.600 1.001 1.00 2.21 H new ATOM 0 HD1 TYR A 226 22.585 -8.084 -1.303 1.00 60.32 H new ATOM 0 HD2 TYR A 226 18.946 -6.658 0.509 1.00 24.24 H new ATOM 0 HE1 TYR A 226 21.300 -9.895 -2.427 1.00 12.11 H new ATOM 0 HE2 TYR A 226 17.688 -8.539 -0.511 1.00 22.34 H new ATOM 0 HH TYR A 226 17.737 -10.181 -2.008 1.00 4.13 H new