USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1067 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 31 THR OG1 : rot 150:sc= -0.453 USER MOD Set 1.2: A 37 GLN : amide:sc= -2.37! C(o=-2.8!,f=-3.9!) USER MOD Set 2.1: A 30 ASN : amide:sc= 1.01 K(o=1.9,f=-4.9) USER MOD Set 2.2: C 261 TYR OH : rot -130:sc= -0.334 USER MOD Set 2.3: C 264 LYS NZ :NH3+ 149:sc= 1.22 (180deg=0) USER MOD Single : A 16 SER OG : rot -109:sc= 0.623 USER MOD Single : A 17 HIS :FLIP no HD1:sc= -0.308 F(o=-1,f=-0.31) USER MOD Single : A 22 ASN : amide:sc= -3.58! C(o=-3.6!,f=-8.3!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HE2:sc= -2.76 X(o=-2.8,f=-2.8!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -0.0181 X(o=-0.018,f=-0.43) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -0.614 K(o=-0.61,f=-1.4) USER MOD Single : A 54 LYS NZ :NH3+ 159:sc= 0.77 (180deg=0.429) USER MOD Single : A 56 LYS NZ :NH3+ 171:sc= -0.011 (180deg=-0.136) USER MOD Single : A 59 GLN : amide:sc= -2.04! C(o=-2!,f=-3.2!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 162:sc= -0.0709 (180deg=-0.42) USER MOD Single : A 67 ASN : amide:sc= -0.237 X(o=-0.24,f=-0.0053) USER MOD Single : B 123 SER OG : rot 53:sc= 1.22 USER MOD Single : B 124 MET CE :methyl 146:sc= -0.218 (180deg=-0.934) USER MOD Single : B 125 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0287) USER MOD Single : C 216 SER OG : rot 180:sc= 0 USER MOD Single : C 217 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : C 222 ASN : amide:sc= -2.3! C(o=-2.3!,f=-5.2!) USER MOD Single : C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 225 HIS :FLIP no HD1:sc= -0.816 F(o=-2.2,f=-0.82) USER MOD Single : C 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 230 ASN : amide:sc= 0.668 K(o=0.67,f=-0.004) USER MOD Single : C 231 THR OG1 : rot 19:sc= 0.529 USER MOD Single : C 233 ASN : amide:sc= -0.0434 K(o=-0.043,f=-1.1!) USER MOD Single : C 237 GLN : amide:sc= -5.06! C(o=-5.1!,f=-7.1!) USER MOD Single : C 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 248 GLN : amide:sc= -0.866 K(o=-0.87,f=-2.2) USER MOD Single : C 254 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 256 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 259 GLN : amide:sc= -0.716 X(o=-0.72,f=-0.67) USER MOD Single : C 267 ASN : amide:sc= -0.088 K(o=-0.088,f=-1.9!) USER MOD Single : D 323 SER OG : rot 48:sc= 1.21 USER MOD Single : D 324 MET CE :methyl 161:sc= -0.124 (180deg=-0.673) USER MOD Single : D 325 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0737) USER MOD ----------------------------------------------------------------- ATOM 115 N ARG A 8 1.058 12.143 -15.624 1.00 22.33 N ATOM 116 CA ARG A 8 -0.326 11.748 -15.515 1.00 3.32 C ATOM 117 C ARG A 8 -0.413 10.593 -14.516 1.00 44.41 C ATOM 118 O ARG A 8 0.603 9.950 -14.230 1.00 61.11 O ATOM 119 CB ARG A 8 -0.896 11.392 -16.903 1.00 14.23 C ATOM 120 CG ARG A 8 -2.378 11.034 -16.915 1.00 1.13 C ATOM 121 CD ARG A 8 -2.928 10.964 -18.327 1.00 31.44 C ATOM 122 NE ARG A 8 -2.824 12.274 -18.995 1.00 11.22 N ATOM 123 CZ ARG A 8 -3.565 12.686 -20.030 1.00 4.04 C ATOM 124 NH1 ARG A 8 -4.490 11.900 -20.563 1.00 44.44 N ATOM 125 NH2 ARG A 8 -3.372 13.897 -20.528 1.00 62.20 N ATOM 0 HA ARG A 8 -0.939 12.569 -15.143 1.00 3.32 H new ATOM 0 HB2 ARG A 8 -0.736 12.237 -17.573 1.00 14.23 H new ATOM 0 HB3 ARG A 8 -0.331 10.552 -17.307 1.00 14.23 H new ATOM 0 HG2 ARG A 8 -2.524 10.074 -16.420 1.00 1.13 H new ATOM 0 HG3 ARG A 8 -2.936 11.776 -16.344 1.00 1.13 H new ATOM 0 HD2 ARG A 8 -2.380 10.215 -18.899 1.00 31.44 H new ATOM 0 HD3 ARG A 8 -3.970 10.646 -18.301 1.00 31.44 H new ATOM 0 HE ARG A 8 -2.125 12.924 -18.636 1.00 11.22 H new ATOM 0 HH11 ARG A 8 -4.645 10.966 -20.184 1.00 44.44 H new ATOM 0 HH12 ARG A 8 -5.046 12.230 -21.352 1.00 44.44 H new ATOM 0 HH21 ARG A 8 -2.663 14.508 -20.123 1.00 62.20 H new ATOM 0 HH22 ARG A 8 -3.932 14.219 -21.317 1.00 62.20 H new ATOM 139 N CYS A 9 -1.577 10.332 -13.983 1.00 13.45 N ATOM 140 CA CYS A 9 -1.710 9.336 -12.947 1.00 0.13 C ATOM 141 C CYS A 9 -2.155 8.021 -13.560 1.00 61.33 C ATOM 142 O CYS A 9 -3.026 8.016 -14.398 1.00 20.24 O ATOM 143 CB CYS A 9 -2.767 9.804 -11.950 1.00 30.31 C ATOM 144 SG CYS A 9 -2.506 11.496 -11.342 1.00 15.20 S ATOM 0 H CYS A 9 -2.448 10.793 -14.247 1.00 13.45 H new ATOM 0 HA CYS A 9 -0.753 9.197 -12.445 1.00 0.13 H new ATOM 0 HB2 CYS A 9 -3.748 9.745 -12.421 1.00 30.31 H new ATOM 0 HB3 CYS A 9 -2.779 9.121 -11.101 1.00 30.31 H new ATOM 149 N PRO A 10 -1.505 6.888 -13.186 1.00 60.52 N ATOM 150 CA PRO A 10 -1.892 5.528 -13.631 1.00 41.04 C ATOM 151 C PRO A 10 -3.414 5.303 -13.591 1.00 52.14 C ATOM 152 O PRO A 10 -4.003 4.857 -14.573 1.00 22.34 O ATOM 153 CB PRO A 10 -1.190 4.645 -12.610 1.00 31.32 C ATOM 154 CG PRO A 10 0.057 5.386 -12.297 1.00 55.10 C ATOM 155 CD PRO A 10 -0.304 6.852 -12.346 1.00 21.10 C ATOM 0 HA PRO A 10 -1.615 5.330 -14.666 1.00 41.04 H new ATOM 0 HB2 PRO A 10 -1.802 4.499 -11.720 1.00 31.32 H new ATOM 0 HB3 PRO A 10 -0.976 3.656 -13.016 1.00 31.32 H new ATOM 0 HG2 PRO A 10 0.437 5.111 -11.313 1.00 55.10 H new ATOM 0 HG3 PRO A 10 0.840 5.153 -13.018 1.00 55.10 H new ATOM 0 HD2 PRO A 10 -0.500 7.249 -11.350 1.00 21.10 H new ATOM 0 HD3 PRO A 10 0.502 7.448 -12.774 1.00 21.10 H new ATOM 163 N CYS A 11 -4.035 5.622 -12.470 1.00 31.32 N ATOM 164 CA CYS A 11 -5.474 5.544 -12.373 1.00 70.11 C ATOM 165 C CYS A 11 -6.043 6.941 -12.600 1.00 74.41 C ATOM 166 O CYS A 11 -5.330 7.931 -12.460 1.00 41.40 O ATOM 167 CB CYS A 11 -5.930 4.983 -11.011 1.00 50.04 C ATOM 168 SG CYS A 11 -7.741 4.764 -10.868 1.00 12.50 S ATOM 0 H CYS A 11 -3.565 5.935 -11.621 1.00 31.32 H new ATOM 0 HA CYS A 11 -5.846 4.855 -13.131 1.00 70.11 H new ATOM 0 HB2 CYS A 11 -5.443 4.022 -10.844 1.00 50.04 H new ATOM 0 HB3 CYS A 11 -5.592 5.654 -10.221 1.00 50.04 H new ATOM 173 N ARG A 12 -7.302 7.023 -12.954 1.00 61.13 N ATOM 174 CA ARG A 12 -7.922 8.302 -13.261 1.00 45.51 C ATOM 175 C ARG A 12 -8.364 9.023 -11.978 1.00 0.12 C ATOM 176 O ARG A 12 -7.820 10.063 -11.606 1.00 34.53 O ATOM 177 CB ARG A 12 -9.146 8.094 -14.154 1.00 30.54 C ATOM 178 CG ARG A 12 -8.928 7.329 -15.466 1.00 31.24 C ATOM 179 CD ARG A 12 -7.982 8.021 -16.457 1.00 13.00 C ATOM 180 NE ARG A 12 -6.554 7.945 -16.098 1.00 65.24 N ATOM 181 CZ ARG A 12 -5.572 7.744 -17.002 1.00 41.03 C ATOM 182 NH1 ARG A 12 -5.861 7.575 -18.274 1.00 35.34 N ATOM 183 NH2 ARG A 12 -4.313 7.719 -16.637 1.00 71.35 N ATOM 0 H ARG A 12 -7.925 6.220 -13.039 1.00 61.13 H new ATOM 0 HA ARG A 12 -7.182 8.913 -13.778 1.00 45.51 H new ATOM 0 HB2 ARG A 12 -9.902 7.564 -13.575 1.00 30.54 H new ATOM 0 HB3 ARG A 12 -9.559 9.073 -14.397 1.00 30.54 H new ATOM 0 HG2 ARG A 12 -8.531 6.341 -15.234 1.00 31.24 H new ATOM 0 HG3 ARG A 12 -9.894 7.179 -15.949 1.00 31.24 H new ATOM 0 HD2 ARG A 12 -8.120 7.575 -17.442 1.00 13.00 H new ATOM 0 HD3 ARG A 12 -8.267 9.070 -16.539 1.00 13.00 H new ATOM 0 HE ARG A 12 -6.295 8.050 -15.117 1.00 65.24 H new ATOM 0 HH11 ARG A 12 -6.833 7.595 -18.583 1.00 35.34 H new ATOM 0 HH12 ARG A 12 -5.113 7.424 -18.951 1.00 35.34 H new ATOM 0 HH21 ARG A 12 -4.063 7.853 -15.657 1.00 71.35 H new ATOM 0 HH22 ARG A 12 -3.583 7.566 -17.333 1.00 71.35 H new ATOM 197 N PHE A 13 -9.345 8.445 -11.312 1.00 74.42 N ATOM 198 CA PHE A 13 -9.965 9.023 -10.129 1.00 21.53 C ATOM 199 C PHE A 13 -10.096 7.976 -9.057 1.00 33.54 C ATOM 200 O PHE A 13 -9.960 6.790 -9.334 1.00 5.22 O ATOM 201 CB PHE A 13 -11.337 9.634 -10.453 1.00 70.05 C ATOM 202 CG PHE A 13 -11.282 10.840 -11.351 1.00 15.23 C ATOM 203 CD1 PHE A 13 -11.316 10.701 -12.730 1.00 45.35 C ATOM 204 CD2 PHE A 13 -11.194 12.112 -10.812 1.00 0.40 C ATOM 205 CE1 PHE A 13 -11.265 11.809 -13.553 1.00 71.24 C ATOM 206 CE2 PHE A 13 -11.143 13.223 -11.628 1.00 54.21 C ATOM 207 CZ PHE A 13 -11.177 13.072 -12.999 1.00 14.02 C ATOM 0 H PHE A 13 -9.742 7.545 -11.580 1.00 74.42 H new ATOM 0 HA PHE A 13 -9.324 9.828 -9.769 1.00 21.53 H new ATOM 0 HB2 PHE A 13 -11.958 8.873 -10.925 1.00 70.05 H new ATOM 0 HB3 PHE A 13 -11.827 9.912 -9.520 1.00 70.05 H new ATOM 0 HD1 PHE A 13 -11.383 9.715 -13.166 1.00 45.35 H new ATOM 0 HD2 PHE A 13 -11.165 12.236 -9.740 1.00 0.40 H new ATOM 0 HE1 PHE A 13 -11.294 11.689 -14.626 1.00 71.24 H new ATOM 0 HE2 PHE A 13 -11.077 14.210 -11.194 1.00 54.21 H new ATOM 0 HZ PHE A 13 -11.135 13.941 -13.639 1.00 14.02 H new ATOM 217 N PHE A 14 -10.306 8.407 -7.847 1.00 35.43 N ATOM 218 CA PHE A 14 -10.392 7.506 -6.720 1.00 23.32 C ATOM 219 C PHE A 14 -11.841 7.210 -6.365 1.00 1.42 C ATOM 220 O PHE A 14 -12.689 8.083 -6.460 1.00 21.34 O ATOM 221 CB PHE A 14 -9.749 8.153 -5.498 1.00 10.41 C ATOM 222 CG PHE A 14 -8.337 8.614 -5.682 1.00 35.11 C ATOM 223 CD1 PHE A 14 -7.288 7.721 -5.621 1.00 45.21 C ATOM 224 CD2 PHE A 14 -8.059 9.958 -5.897 1.00 2.22 C ATOM 225 CE1 PHE A 14 -5.991 8.150 -5.770 1.00 51.22 C ATOM 226 CE2 PHE A 14 -6.761 10.395 -6.049 1.00 33.05 C ATOM 227 CZ PHE A 14 -5.724 9.490 -5.984 1.00 71.32 C ATOM 0 H PHE A 14 -10.423 9.391 -7.607 1.00 35.43 H new ATOM 0 HA PHE A 14 -9.882 6.583 -6.996 1.00 23.32 H new ATOM 0 HB2 PHE A 14 -10.356 9.008 -5.199 1.00 10.41 H new ATOM 0 HB3 PHE A 14 -9.776 7.440 -4.674 1.00 10.41 H new ATOM 0 HD1 PHE A 14 -7.488 6.673 -5.454 1.00 45.21 H new ATOM 0 HD2 PHE A 14 -8.870 10.669 -5.946 1.00 2.22 H new ATOM 0 HE1 PHE A 14 -5.179 7.440 -5.720 1.00 51.22 H new ATOM 0 HE2 PHE A 14 -6.557 11.442 -6.218 1.00 33.05 H new ATOM 0 HZ PHE A 14 -4.704 9.827 -6.100 1.00 71.32 H new ATOM 237 N GLU A 15 -12.103 5.987 -5.966 1.00 32.54 N ATOM 238 CA GLU A 15 -13.375 5.577 -5.412 1.00 43.20 C ATOM 239 C GLU A 15 -13.335 5.836 -3.914 1.00 34.15 C ATOM 240 O GLU A 15 -12.428 5.359 -3.218 1.00 72.35 O ATOM 241 CB GLU A 15 -13.657 4.078 -5.676 1.00 13.22 C ATOM 242 CG GLU A 15 -14.178 3.715 -7.075 1.00 24.44 C ATOM 243 CD GLU A 15 -13.275 4.067 -8.238 1.00 11.13 C ATOM 244 OE1 GLU A 15 -12.436 3.233 -8.642 1.00 55.04 O ATOM 245 OE2 GLU A 15 -13.434 5.149 -8.808 1.00 14.53 O ATOM 0 H GLU A 15 -11.421 5.230 -6.018 1.00 32.54 H new ATOM 0 HA GLU A 15 -14.174 6.145 -5.889 1.00 43.20 H new ATOM 0 HB2 GLU A 15 -12.737 3.521 -5.500 1.00 13.22 H new ATOM 0 HB3 GLU A 15 -14.384 3.733 -4.941 1.00 13.22 H new ATOM 0 HG2 GLU A 15 -14.368 2.642 -7.102 1.00 24.44 H new ATOM 0 HG3 GLU A 15 -15.137 4.212 -7.223 1.00 24.44 H new ATOM 252 N SER A 16 -14.292 6.573 -3.413 1.00 64.40 N ATOM 253 CA SER A 16 -14.243 6.987 -2.028 1.00 2.23 C ATOM 254 C SER A 16 -15.252 6.243 -1.139 1.00 13.11 C ATOM 255 O SER A 16 -15.277 6.439 0.065 1.00 62.13 O ATOM 256 CB SER A 16 -14.484 8.481 -1.946 1.00 14.21 C ATOM 257 OG SER A 16 -13.647 9.174 -2.854 1.00 70.02 O ATOM 0 H SER A 16 -15.107 6.898 -3.933 1.00 64.40 H new ATOM 0 HA SER A 16 -13.252 6.736 -1.649 1.00 2.23 H new ATOM 0 HB2 SER A 16 -15.529 8.699 -2.168 1.00 14.21 H new ATOM 0 HB3 SER A 16 -14.295 8.830 -0.931 1.00 14.21 H new ATOM 0 HG SER A 16 -12.953 9.656 -2.357 1.00 70.02 H new ATOM 263 N HIS A 17 -16.095 5.428 -1.718 1.00 33.13 N ATOM 264 CA HIS A 17 -17.054 4.660 -0.928 1.00 32.52 C ATOM 265 C HIS A 17 -16.970 3.192 -1.225 1.00 72.25 C ATOM 266 O HIS A 17 -17.721 2.648 -2.027 1.00 32.04 O ATOM 267 CB HIS A 17 -18.501 5.183 -1.010 1.00 60.24 C ATOM 268 CG HIS A 17 -18.756 6.481 -0.285 1.00 65.52 C ATOM 269 ND1 HIS A 17 -18.182 7.697 -0.403 1.00 41.23 N flip ATOM 270 CD2 HIS A 17 -19.739 6.628 0.660 1.00 72.44 C flip ATOM 271 CE1 HIS A 17 -18.824 8.546 0.456 1.00 5.25 C flip ATOM 272 NE2 HIS A 17 -19.759 7.873 1.087 1.00 42.50 N flip ATOM 0 H HIS A 17 -16.146 5.272 -2.725 1.00 33.13 H new ATOM 0 HA HIS A 17 -16.757 4.809 0.110 1.00 32.52 H new ATOM 0 HB2 HIS A 17 -18.764 5.314 -2.060 1.00 60.24 H new ATOM 0 HB3 HIS A 17 -19.169 4.422 -0.606 1.00 60.24 H new ATOM 0 HD2 HIS A 17 -20.396 5.842 1.002 1.00 72.44 H new ATOM 0 HE1 HIS A 17 -18.600 9.594 0.592 1.00 5.25 H new ATOM 0 HE2 HIS A 17 -20.394 8.252 1.790 1.00 42.50 H new ATOM 281 N VAL A 18 -16.005 2.588 -0.627 1.00 74.21 N ATOM 282 CA VAL A 18 -15.742 1.183 -0.730 1.00 2.11 C ATOM 283 C VAL A 18 -15.498 0.716 0.684 1.00 61.43 C ATOM 284 O VAL A 18 -15.163 1.536 1.529 1.00 54.23 O ATOM 285 CB VAL A 18 -14.472 0.915 -1.619 1.00 53.10 C ATOM 286 CG1 VAL A 18 -14.145 -0.572 -1.715 1.00 34.01 C ATOM 287 CG2 VAL A 18 -14.654 1.503 -3.023 1.00 53.34 C ATOM 0 H VAL A 18 -15.343 3.076 -0.023 1.00 74.21 H new ATOM 0 HA VAL A 18 -16.572 0.654 -1.199 1.00 2.11 H new ATOM 0 HB VAL A 18 -13.633 1.411 -1.131 1.00 53.10 H new ATOM 0 HG11 VAL A 18 -13.261 -0.711 -2.338 1.00 34.01 H new ATOM 0 HG12 VAL A 18 -13.952 -0.967 -0.718 1.00 34.01 H new ATOM 0 HG13 VAL A 18 -14.988 -1.102 -2.158 1.00 34.01 H new ATOM 0 HG21 VAL A 18 -13.763 1.305 -3.619 1.00 53.34 H new ATOM 0 HG22 VAL A 18 -15.519 1.043 -3.501 1.00 53.34 H new ATOM 0 HG23 VAL A 18 -14.809 2.579 -2.949 1.00 53.34 H new ATOM 297 N ALA A 19 -15.721 -0.524 0.968 1.00 24.41 N ATOM 298 CA ALA A 19 -15.484 -1.045 2.274 1.00 4.54 C ATOM 299 C ALA A 19 -14.221 -1.863 2.273 1.00 35.21 C ATOM 300 O ALA A 19 -13.977 -2.635 1.343 1.00 54.35 O ATOM 301 CB ALA A 19 -16.663 -1.866 2.758 1.00 72.33 C ATOM 0 H ALA A 19 -16.074 -1.208 0.298 1.00 24.41 H new ATOM 0 HA ALA A 19 -15.363 -0.211 2.966 1.00 4.54 H new ATOM 0 HB1 ALA A 19 -16.453 -2.250 3.756 1.00 72.33 H new ATOM 0 HB2 ALA A 19 -17.554 -1.239 2.790 1.00 72.33 H new ATOM 0 HB3 ALA A 19 -16.830 -2.700 2.076 1.00 72.33 H new ATOM 307 N ARG A 20 -13.394 -1.699 3.282 1.00 50.42 N ATOM 308 CA ARG A 20 -12.196 -2.515 3.383 1.00 54.14 C ATOM 309 C ARG A 20 -12.536 -3.991 3.559 1.00 25.42 C ATOM 310 O ARG A 20 -11.699 -4.862 3.376 1.00 12.51 O ATOM 311 CB ARG A 20 -11.171 -1.984 4.415 1.00 3.15 C ATOM 312 CG ARG A 20 -11.665 -1.744 5.840 1.00 75.43 C ATOM 313 CD ARG A 20 -12.001 -3.014 6.593 1.00 51.54 C ATOM 314 NE ARG A 20 -12.443 -2.691 7.957 1.00 64.12 N ATOM 315 CZ ARG A 20 -13.073 -3.508 8.812 1.00 74.44 C ATOM 316 NH1 ARG A 20 -13.309 -4.776 8.498 1.00 12.13 N ATOM 317 NH2 ARG A 20 -13.443 -3.050 10.000 1.00 11.30 N ATOM 0 H ARG A 20 -13.522 -1.022 4.034 1.00 50.42 H new ATOM 0 HA ARG A 20 -11.679 -2.430 2.427 1.00 54.14 H new ATOM 0 HB2 ARG A 20 -10.343 -2.691 4.461 1.00 3.15 H new ATOM 0 HB3 ARG A 20 -10.768 -1.045 4.036 1.00 3.15 H new ATOM 0 HG2 ARG A 20 -10.901 -1.197 6.392 1.00 75.43 H new ATOM 0 HG3 ARG A 20 -12.550 -1.108 5.806 1.00 75.43 H new ATOM 0 HD2 ARG A 20 -12.785 -3.560 6.068 1.00 51.54 H new ATOM 0 HD3 ARG A 20 -11.128 -3.666 6.630 1.00 51.54 H new ATOM 0 HE ARG A 20 -12.250 -1.746 8.287 1.00 64.12 H new ATOM 0 HH11 ARG A 20 -13.009 -5.142 7.594 1.00 12.13 H new ATOM 0 HH12 ARG A 20 -13.790 -5.384 9.161 1.00 12.13 H new ATOM 0 HH21 ARG A 20 -13.248 -2.082 10.257 1.00 11.30 H new ATOM 0 HH22 ARG A 20 -13.923 -3.665 10.657 1.00 11.30 H new ATOM 331 N ALA A 21 -13.783 -4.248 3.919 1.00 65.51 N ATOM 332 CA ALA A 21 -14.283 -5.583 4.069 1.00 71.05 C ATOM 333 C ALA A 21 -14.504 -6.266 2.704 1.00 23.44 C ATOM 334 O ALA A 21 -14.656 -7.479 2.637 1.00 73.12 O ATOM 335 CB ALA A 21 -15.572 -5.567 4.871 1.00 43.42 C ATOM 0 H ALA A 21 -14.473 -3.523 4.114 1.00 65.51 H new ATOM 0 HA ALA A 21 -13.534 -6.164 4.606 1.00 71.05 H new ATOM 0 HB1 ALA A 21 -15.945 -6.585 4.980 1.00 43.42 H new ATOM 0 HB2 ALA A 21 -15.382 -5.142 5.857 1.00 43.42 H new ATOM 0 HB3 ALA A 21 -16.316 -4.962 4.353 1.00 43.42 H new ATOM 341 N ASN A 22 -14.519 -5.490 1.612 1.00 74.22 N ATOM 342 CA ASN A 22 -14.749 -6.086 0.289 1.00 75.42 C ATOM 343 C ASN A 22 -13.531 -5.944 -0.628 1.00 4.31 C ATOM 344 O ASN A 22 -13.596 -6.274 -1.825 1.00 34.14 O ATOM 345 CB ASN A 22 -16.037 -5.548 -0.399 1.00 3.20 C ATOM 346 CG ASN A 22 -15.993 -4.080 -0.816 1.00 44.03 C ATOM 347 OD1 ASN A 22 -16.359 -3.192 -0.065 1.00 54.43 O ATOM 348 ND2 ASN A 22 -15.572 -3.829 -2.020 1.00 72.22 N ATOM 0 H ASN A 22 -14.379 -4.480 1.614 1.00 74.22 H new ATOM 0 HA ASN A 22 -14.906 -7.150 0.466 1.00 75.42 H new ATOM 0 HB2 ASN A 22 -16.236 -6.153 -1.283 1.00 3.20 H new ATOM 0 HB3 ASN A 22 -16.878 -5.690 0.280 1.00 3.20 H new ATOM 0 HD21 ASN A 22 -15.541 -2.868 -2.360 1.00 72.22 H new ATOM 0 HD22 ASN A 22 -15.272 -4.593 -2.625 1.00 72.22 H new ATOM 355 N VAL A 23 -12.423 -5.488 -0.080 1.00 13.44 N ATOM 356 CA VAL A 23 -11.191 -5.392 -0.857 1.00 32.14 C ATOM 357 C VAL A 23 -10.241 -6.503 -0.441 1.00 1.45 C ATOM 358 O VAL A 23 -10.334 -7.001 0.676 1.00 14.10 O ATOM 359 CB VAL A 23 -10.483 -4.015 -0.710 1.00 63.22 C ATOM 360 CG1 VAL A 23 -11.384 -2.890 -1.184 1.00 22.13 C ATOM 361 CG2 VAL A 23 -10.038 -3.772 0.723 1.00 24.31 C ATOM 0 H VAL A 23 -12.344 -5.180 0.889 1.00 13.44 H new ATOM 0 HA VAL A 23 -11.466 -5.495 -1.907 1.00 32.14 H new ATOM 0 HB VAL A 23 -9.594 -4.034 -1.340 1.00 63.22 H new ATOM 0 HG11 VAL A 23 -10.867 -1.937 -1.071 1.00 22.13 H new ATOM 0 HG12 VAL A 23 -11.637 -3.044 -2.233 1.00 22.13 H new ATOM 0 HG13 VAL A 23 -12.297 -2.880 -0.589 1.00 22.13 H new ATOM 0 HG21 VAL A 23 -9.547 -2.801 0.792 1.00 24.31 H new ATOM 0 HG22 VAL A 23 -10.907 -3.787 1.381 1.00 24.31 H new ATOM 0 HG23 VAL A 23 -9.341 -4.554 1.025 1.00 24.31 H new ATOM 371 N LYS A 24 -9.359 -6.914 -1.346 1.00 40.45 N ATOM 372 CA LYS A 24 -8.386 -7.955 -1.030 1.00 51.04 C ATOM 373 C LYS A 24 -7.109 -7.413 -0.437 1.00 21.33 C ATOM 374 O LYS A 24 -6.430 -8.107 0.316 1.00 62.34 O ATOM 375 CB LYS A 24 -8.071 -8.841 -2.226 1.00 22.44 C ATOM 376 CG LYS A 24 -9.276 -9.551 -2.699 1.00 22.32 C ATOM 377 CD LYS A 24 -9.003 -10.627 -3.743 1.00 12.11 C ATOM 378 CE LYS A 24 -8.402 -10.094 -5.020 1.00 12.33 C ATOM 379 NZ LYS A 24 -8.196 -11.182 -6.004 1.00 32.42 N ATOM 0 H LYS A 24 -9.297 -6.547 -2.296 1.00 40.45 H new ATOM 0 HA LYS A 24 -8.869 -8.567 -0.269 1.00 51.04 H new ATOM 0 HB2 LYS A 24 -7.663 -8.234 -3.034 1.00 22.44 H new ATOM 0 HB3 LYS A 24 -7.303 -9.565 -1.953 1.00 22.44 H new ATOM 0 HG2 LYS A 24 -9.772 -10.009 -1.844 1.00 22.32 H new ATOM 0 HG3 LYS A 24 -9.971 -8.823 -3.118 1.00 22.32 H new ATOM 0 HD2 LYS A 24 -8.329 -11.371 -3.318 1.00 12.11 H new ATOM 0 HD3 LYS A 24 -9.936 -11.139 -3.977 1.00 12.11 H new ATOM 0 HE2 LYS A 24 -9.057 -9.334 -5.445 1.00 12.33 H new ATOM 0 HE3 LYS A 24 -7.450 -9.609 -4.804 1.00 12.33 H new ATOM 0 HZ1 LYS A 24 -7.782 -10.790 -6.874 1.00 32.42 H new ATOM 0 HZ2 LYS A 24 -7.552 -11.894 -5.604 1.00 32.42 H new ATOM 0 HZ3 LYS A 24 -9.109 -11.627 -6.226 1.00 32.42 H new ATOM 393 N HIS A 25 -6.766 -6.202 -0.800 1.00 1.33 N ATOM 394 CA HIS A 25 -5.569 -5.537 -0.244 1.00 4.40 C ATOM 395 C HIS A 25 -5.454 -4.133 -0.794 1.00 33.44 C ATOM 396 O HIS A 25 -6.237 -3.739 -1.655 1.00 33.41 O ATOM 397 CB HIS A 25 -4.246 -6.313 -0.566 1.00 44.34 C ATOM 398 CG HIS A 25 -3.748 -6.220 -1.997 1.00 35.31 C ATOM 399 ND1 HIS A 25 -3.862 -7.224 -2.922 1.00 2.44 N ATOM 400 CD2 HIS A 25 -3.088 -5.225 -2.629 1.00 1.10 C ATOM 401 CE1 HIS A 25 -3.289 -6.844 -4.046 1.00 25.50 C ATOM 402 NE2 HIS A 25 -2.822 -5.641 -3.894 1.00 71.40 N ATOM 0 H HIS A 25 -7.285 -5.641 -1.476 1.00 1.33 H new ATOM 0 HA HIS A 25 -5.695 -5.518 0.838 1.00 4.40 H new ATOM 0 HB2 HIS A 25 -3.462 -5.943 0.095 1.00 44.34 H new ATOM 0 HB3 HIS A 25 -4.398 -7.365 -0.323 1.00 44.34 H new ATOM 0 HD1 HIS A 25 -4.318 -8.123 -2.765 1.00 2.44 H new ATOM 0 HD2 HIS A 25 -2.820 -4.269 -2.204 1.00 1.10 H new ATOM 0 HE1 HIS A 25 -3.219 -7.436 -4.947 1.00 25.50 H new ATOM 411 N LEU A 26 -4.430 -3.417 -0.345 1.00 4.42 N ATOM 412 CA LEU A 26 -4.143 -2.077 -0.823 1.00 62.53 C ATOM 413 C LEU A 26 -2.791 -2.075 -1.510 1.00 75.11 C ATOM 414 O LEU A 26 -1.820 -2.605 -0.986 1.00 30.43 O ATOM 415 CB LEU A 26 -4.114 -1.043 0.331 1.00 44.12 C ATOM 416 CG LEU A 26 -5.438 -0.676 1.040 1.00 71.45 C ATOM 417 CD1 LEU A 26 -6.085 -1.870 1.726 1.00 72.21 C ATOM 418 CD2 LEU A 26 -5.186 0.428 2.038 1.00 40.42 C ATOM 0 H LEU A 26 -3.776 -3.753 0.362 1.00 4.42 H new ATOM 0 HA LEU A 26 -4.936 -1.793 -1.514 1.00 62.53 H new ATOM 0 HB2 LEU A 26 -3.426 -1.416 1.090 1.00 44.12 H new ATOM 0 HB3 LEU A 26 -3.685 -0.122 -0.063 1.00 44.12 H new ATOM 0 HG LEU A 26 -6.137 -0.336 0.276 1.00 71.45 H new ATOM 0 HD11 LEU A 26 -7.011 -1.555 2.207 1.00 72.21 H new ATOM 0 HD12 LEU A 26 -6.304 -2.640 0.986 1.00 72.21 H new ATOM 0 HD13 LEU A 26 -5.404 -2.271 2.477 1.00 72.21 H new ATOM 0 HD21 LEU A 26 -6.119 0.687 2.538 1.00 40.42 H new ATOM 0 HD22 LEU A 26 -4.460 0.091 2.778 1.00 40.42 H new ATOM 0 HD23 LEU A 26 -4.797 1.305 1.520 1.00 40.42 H new ATOM 430 N LYS A 27 -2.739 -1.544 -2.681 1.00 23.21 N ATOM 431 CA LYS A 27 -1.504 -1.425 -3.411 1.00 34.31 C ATOM 432 C LYS A 27 -1.251 0.044 -3.661 1.00 74.52 C ATOM 433 O LYS A 27 -2.049 0.709 -4.305 1.00 40.34 O ATOM 434 CB LYS A 27 -1.550 -2.251 -4.721 1.00 50.03 C ATOM 435 CG LYS A 27 -0.272 -2.175 -5.550 1.00 31.43 C ATOM 436 CD LYS A 27 -0.250 -3.156 -6.732 1.00 40.32 C ATOM 437 CE LYS A 27 -1.398 -2.960 -7.705 1.00 42.12 C ATOM 438 NZ LYS A 27 -1.270 -3.841 -8.903 1.00 75.44 N ATOM 0 H LYS A 27 -3.553 -1.174 -3.172 1.00 23.21 H new ATOM 0 HA LYS A 27 -0.676 -1.834 -2.832 1.00 34.31 H new ATOM 0 HB2 LYS A 27 -1.748 -3.294 -4.474 1.00 50.03 H new ATOM 0 HB3 LYS A 27 -2.386 -1.903 -5.328 1.00 50.03 H new ATOM 0 HG2 LYS A 27 -0.153 -1.160 -5.928 1.00 31.43 H new ATOM 0 HG3 LYS A 27 0.583 -2.377 -4.905 1.00 31.43 H new ATOM 0 HD2 LYS A 27 0.693 -3.045 -7.268 1.00 40.32 H new ATOM 0 HD3 LYS A 27 -0.280 -4.176 -6.348 1.00 40.32 H new ATOM 0 HE2 LYS A 27 -2.341 -3.169 -7.200 1.00 42.12 H new ATOM 0 HE3 LYS A 27 -1.430 -1.918 -8.023 1.00 42.12 H new ATOM 0 HZ1 LYS A 27 -2.074 -3.676 -9.542 1.00 75.44 H new ATOM 0 HZ2 LYS A 27 -0.382 -3.625 -9.400 1.00 75.44 H new ATOM 0 HZ3 LYS A 27 -1.265 -4.837 -8.603 1.00 75.44 H new ATOM 452 N ILE A 28 -0.163 0.540 -3.146 1.00 53.34 N ATOM 453 CA ILE A 28 0.107 1.952 -3.179 1.00 2.32 C ATOM 454 C ILE A 28 1.259 2.268 -4.123 1.00 11.05 C ATOM 455 O ILE A 28 2.326 1.637 -4.075 1.00 33.54 O ATOM 456 CB ILE A 28 0.444 2.488 -1.760 1.00 20.05 C ATOM 457 CG1 ILE A 28 -0.646 2.075 -0.757 1.00 23.32 C ATOM 458 CG2 ILE A 28 0.574 4.007 -1.792 1.00 1.04 C ATOM 459 CD1 ILE A 28 -0.383 2.527 0.669 1.00 14.12 C ATOM 0 H ILE A 28 0.560 -0.018 -2.693 1.00 53.34 H new ATOM 0 HA ILE A 28 -0.795 2.445 -3.542 1.00 2.32 H new ATOM 0 HB ILE A 28 1.393 2.056 -1.442 1.00 20.05 H new ATOM 0 HG12 ILE A 28 -1.601 2.485 -1.086 1.00 23.32 H new ATOM 0 HG13 ILE A 28 -0.744 0.989 -0.770 1.00 23.32 H new ATOM 0 HG21 ILE A 28 0.810 4.373 -0.793 1.00 1.04 H new ATOM 0 HG22 ILE A 28 1.371 4.290 -2.480 1.00 1.04 H new ATOM 0 HG23 ILE A 28 -0.366 4.446 -2.126 1.00 1.04 H new ATOM 0 HD11 ILE A 28 -1.198 2.195 1.312 1.00 14.12 H new ATOM 0 HD12 ILE A 28 0.554 2.096 1.020 1.00 14.12 H new ATOM 0 HD13 ILE A 28 -0.316 3.615 0.699 1.00 14.12 H new ATOM 471 N LEU A 29 1.034 3.211 -4.985 1.00 34.54 N ATOM 472 CA LEU A 29 2.037 3.665 -5.906 1.00 65.31 C ATOM 473 C LEU A 29 2.233 5.163 -5.697 1.00 51.41 C ATOM 474 O LEU A 29 1.288 5.864 -5.329 1.00 64.34 O ATOM 475 CB LEU A 29 1.660 3.345 -7.396 1.00 3.04 C ATOM 476 CG LEU A 29 1.565 1.835 -7.812 1.00 60.53 C ATOM 477 CD1 LEU A 29 0.372 1.107 -7.221 1.00 71.10 C ATOM 478 CD2 LEU A 29 1.617 1.647 -9.316 1.00 4.33 C ATOM 0 H LEU A 29 0.140 3.694 -5.072 1.00 34.54 H new ATOM 0 HA LEU A 29 2.968 3.134 -5.710 1.00 65.31 H new ATOM 0 HB2 LEU A 29 0.699 3.813 -7.607 1.00 3.04 H new ATOM 0 HB3 LEU A 29 2.397 3.825 -8.040 1.00 3.04 H new ATOM 0 HG LEU A 29 2.453 1.374 -7.379 1.00 60.53 H new ATOM 0 HD11 LEU A 29 0.377 0.070 -7.555 1.00 71.10 H new ATOM 0 HD12 LEU A 29 0.429 1.138 -6.133 1.00 71.10 H new ATOM 0 HD13 LEU A 29 -0.548 1.590 -7.550 1.00 71.10 H new ATOM 0 HD21 LEU A 29 1.548 0.585 -9.553 1.00 4.33 H new ATOM 0 HD22 LEU A 29 0.784 2.177 -9.778 1.00 4.33 H new ATOM 0 HD23 LEU A 29 2.557 2.044 -9.700 1.00 4.33 H new ATOM 490 N ASN A 30 3.437 5.665 -5.896 1.00 74.25 N ATOM 491 CA ASN A 30 3.656 7.088 -5.689 1.00 55.04 C ATOM 492 C ASN A 30 3.599 7.768 -7.022 1.00 3.14 C ATOM 493 O ASN A 30 4.553 7.714 -7.806 1.00 30.11 O ATOM 494 CB ASN A 30 5.003 7.360 -4.998 1.00 23.11 C ATOM 495 CG ASN A 30 5.232 8.838 -4.687 1.00 43.21 C ATOM 496 OD1 ASN A 30 4.871 9.332 -3.609 1.00 2.12 O ATOM 497 ND2 ASN A 30 5.837 9.549 -5.604 1.00 44.05 N ATOM 0 H ASN A 30 4.255 5.132 -6.191 1.00 74.25 H new ATOM 0 HA ASN A 30 2.881 7.480 -5.031 1.00 55.04 H new ATOM 0 HB2 ASN A 30 5.050 6.789 -4.071 1.00 23.11 H new ATOM 0 HB3 ASN A 30 5.810 7.000 -5.636 1.00 23.11 H new ATOM 0 HD21 ASN A 30 6.024 10.539 -5.441 1.00 44.05 H new ATOM 0 HD22 ASN A 30 6.122 9.114 -6.481 1.00 44.05 H new ATOM 504 N THR A 31 2.497 8.403 -7.276 1.00 2.40 N ATOM 505 CA THR A 31 2.239 8.982 -8.557 1.00 22.22 C ATOM 506 C THR A 31 2.216 10.500 -8.492 1.00 55.11 C ATOM 507 O THR A 31 1.837 11.069 -7.459 1.00 11.04 O ATOM 508 CB THR A 31 0.880 8.468 -9.074 1.00 21.12 C ATOM 509 OG1 THR A 31 -0.169 8.855 -8.162 1.00 22.23 O ATOM 510 CG2 THR A 31 0.901 6.954 -9.158 1.00 54.34 C ATOM 0 H THR A 31 1.748 8.535 -6.597 1.00 2.40 H new ATOM 0 HA THR A 31 3.042 8.690 -9.234 1.00 22.22 H new ATOM 0 HB THR A 31 0.698 8.897 -10.059 1.00 21.12 H new ATOM 0 HG1 THR A 31 -1.005 8.976 -8.658 1.00 22.23 H new ATOM 0 HG21 THR A 31 -0.062 6.597 -9.524 1.00 54.34 H new ATOM 0 HG22 THR A 31 1.689 6.638 -9.842 1.00 54.34 H new ATOM 0 HG23 THR A 31 1.091 6.537 -8.169 1.00 54.34 H new ATOM 518 N PRO A 32 2.626 11.168 -9.576 1.00 55.32 N ATOM 519 CA PRO A 32 2.571 12.622 -9.674 1.00 74.13 C ATOM 520 C PRO A 32 1.161 13.072 -10.062 1.00 25.42 C ATOM 521 O PRO A 32 0.360 12.255 -10.504 1.00 23.41 O ATOM 522 CB PRO A 32 3.545 12.918 -10.812 1.00 44.11 C ATOM 523 CG PRO A 32 3.407 11.743 -11.713 1.00 61.10 C ATOM 524 CD PRO A 32 3.183 10.559 -10.812 1.00 63.12 C ATOM 0 HA PRO A 32 2.817 13.131 -8.742 1.00 74.13 H new ATOM 0 HB2 PRO A 32 3.292 13.846 -11.324 1.00 44.11 H new ATOM 0 HB3 PRO A 32 4.566 13.024 -10.447 1.00 44.11 H new ATOM 0 HG2 PRO A 32 2.572 11.874 -12.401 1.00 61.10 H new ATOM 0 HG3 PRO A 32 4.302 11.609 -12.320 1.00 61.10 H new ATOM 0 HD2 PRO A 32 2.491 9.843 -11.254 1.00 63.12 H new ATOM 0 HD3 PRO A 32 4.112 10.024 -10.613 1.00 63.12 H new ATOM 532 N ASN A 33 0.859 14.357 -9.854 1.00 63.33 N ATOM 533 CA ASN A 33 -0.458 14.988 -10.201 1.00 62.31 C ATOM 534 C ASN A 33 -1.607 14.506 -9.284 1.00 41.21 C ATOM 535 O ASN A 33 -2.638 15.165 -9.161 1.00 52.40 O ATOM 536 CB ASN A 33 -0.831 14.769 -11.691 1.00 2.10 C ATOM 537 CG ASN A 33 -2.124 15.473 -12.111 1.00 33.02 C ATOM 538 OD1 ASN A 33 -2.460 16.550 -11.615 1.00 72.22 O ATOM 539 ND2 ASN A 33 -2.860 14.863 -13.010 1.00 41.33 N ATOM 0 H ASN A 33 1.518 15.013 -9.435 1.00 63.33 H new ATOM 0 HA ASN A 33 -0.329 16.057 -10.034 1.00 62.31 H new ATOM 0 HB2 ASN A 33 -0.013 15.126 -12.317 1.00 2.10 H new ATOM 0 HB3 ASN A 33 -0.933 13.700 -11.878 1.00 2.10 H new ATOM 0 HD21 ASN A 33 -3.739 15.280 -13.318 1.00 41.33 H new ATOM 0 HD22 ASN A 33 -2.553 13.972 -13.401 1.00 41.33 H new ATOM 546 N CYS A 34 -1.417 13.404 -8.629 1.00 11.44 N ATOM 547 CA CYS A 34 -2.421 12.851 -7.764 1.00 45.01 C ATOM 548 C CYS A 34 -1.865 12.643 -6.379 1.00 20.13 C ATOM 549 O CYS A 34 -0.675 12.326 -6.212 1.00 22.21 O ATOM 550 CB CYS A 34 -2.969 11.533 -8.339 1.00 62.21 C ATOM 551 SG CYS A 34 -3.905 11.723 -9.899 1.00 54.24 S ATOM 0 H CYS A 34 -0.558 12.857 -8.677 1.00 11.44 H new ATOM 0 HA CYS A 34 -3.248 13.558 -7.698 1.00 45.01 H new ATOM 0 HB2 CYS A 34 -2.136 10.851 -8.510 1.00 62.21 H new ATOM 0 HB3 CYS A 34 -3.616 11.067 -7.596 1.00 62.21 H new ATOM 556 N ALA A 35 -2.697 12.885 -5.396 1.00 33.45 N ATOM 557 CA ALA A 35 -2.342 12.730 -4.008 1.00 25.13 C ATOM 558 C ALA A 35 -2.146 11.271 -3.669 1.00 61.44 C ATOM 559 O ALA A 35 -3.107 10.578 -3.338 1.00 65.12 O ATOM 560 CB ALA A 35 -3.428 13.306 -3.143 1.00 4.10 C ATOM 0 H ALA A 35 -3.656 13.201 -5.541 1.00 33.45 H new ATOM 0 HA ALA A 35 -1.407 13.259 -3.826 1.00 25.13 H new ATOM 0 HB1 ALA A 35 -3.158 13.188 -2.094 1.00 4.10 H new ATOM 0 HB2 ALA A 35 -3.550 14.365 -3.369 1.00 4.10 H new ATOM 0 HB3 ALA A 35 -4.364 12.783 -3.338 1.00 4.10 H new ATOM 566 N CYS A 36 -0.903 10.798 -3.808 1.00 24.03 N ATOM 567 CA CYS A 36 -0.557 9.399 -3.552 1.00 65.33 C ATOM 568 C CYS A 36 -1.363 8.539 -4.558 1.00 54.42 C ATOM 569 O CYS A 36 -1.798 9.074 -5.596 1.00 62.34 O ATOM 570 CB CYS A 36 -0.879 9.045 -2.071 1.00 14.31 C ATOM 571 SG CYS A 36 -0.215 7.443 -1.491 1.00 4.42 S ATOM 0 H CYS A 36 -0.113 11.373 -4.100 1.00 24.03 H new ATOM 0 HA CYS A 36 0.507 9.208 -3.693 1.00 65.33 H new ATOM 0 HB2 CYS A 36 -0.486 9.836 -1.432 1.00 14.31 H new ATOM 0 HB3 CYS A 36 -1.961 9.039 -1.943 1.00 14.31 H new ATOM 576 N GLN A 37 -1.539 7.249 -4.312 1.00 74.23 N ATOM 577 CA GLN A 37 -2.331 6.433 -5.220 1.00 43.04 C ATOM 578 C GLN A 37 -2.619 5.087 -4.583 1.00 33.34 C ATOM 579 O GLN A 37 -1.715 4.273 -4.409 1.00 40.11 O ATOM 580 CB GLN A 37 -1.594 6.241 -6.550 1.00 44.33 C ATOM 581 CG GLN A 37 -2.475 5.790 -7.700 1.00 12.15 C ATOM 582 CD GLN A 37 -3.582 6.801 -8.022 1.00 52.43 C ATOM 583 OE1 GLN A 37 -4.642 6.434 -8.496 1.00 3.42 O ATOM 584 NE2 GLN A 37 -3.349 8.076 -7.735 1.00 31.15 N ATOM 0 H GLN A 37 -1.153 6.753 -3.509 1.00 74.23 H new ATOM 0 HA GLN A 37 -3.274 6.943 -5.419 1.00 43.04 H new ATOM 0 HB2 GLN A 37 -1.114 7.181 -6.824 1.00 44.33 H new ATOM 0 HB3 GLN A 37 -0.800 5.508 -6.408 1.00 44.33 H new ATOM 0 HG2 GLN A 37 -1.859 5.635 -8.586 1.00 12.15 H new ATOM 0 HG3 GLN A 37 -2.926 4.829 -7.453 1.00 12.15 H new ATOM 0 HE21 GLN A 37 -2.451 8.354 -7.339 1.00 31.15 H new ATOM 0 HE22 GLN A 37 -4.068 8.778 -7.911 1.00 31.15 H new ATOM 593 N ILE A 38 -3.863 4.863 -4.215 1.00 53.24 N ATOM 594 CA ILE A 38 -4.250 3.621 -3.582 1.00 62.33 C ATOM 595 C ILE A 38 -5.038 2.789 -4.589 1.00 61.24 C ATOM 596 O ILE A 38 -6.063 3.231 -5.082 1.00 32.13 O ATOM 597 CB ILE A 38 -5.180 3.867 -2.355 1.00 10.13 C ATOM 598 CG1 ILE A 38 -4.594 4.915 -1.379 1.00 31.41 C ATOM 599 CG2 ILE A 38 -5.445 2.551 -1.616 1.00 70.24 C ATOM 600 CD1 ILE A 38 -3.282 4.538 -0.733 1.00 72.35 C ATOM 0 H ILE A 38 -4.626 5.528 -4.344 1.00 53.24 H new ATOM 0 HA ILE A 38 -3.343 3.116 -3.249 1.00 62.33 H new ATOM 0 HB ILE A 38 -6.120 4.265 -2.737 1.00 10.13 H new ATOM 0 HG12 ILE A 38 -4.458 5.852 -1.918 1.00 31.41 H new ATOM 0 HG13 ILE A 38 -5.325 5.103 -0.593 1.00 31.41 H new ATOM 0 HG21 ILE A 38 -6.096 2.738 -0.762 1.00 70.24 H new ATOM 0 HG22 ILE A 38 -5.927 1.845 -2.292 1.00 70.24 H new ATOM 0 HG23 ILE A 38 -4.501 2.133 -1.268 1.00 70.24 H new ATOM 0 HD11 ILE A 38 -2.960 5.340 -0.069 1.00 72.35 H new ATOM 0 HD12 ILE A 38 -3.410 3.620 -0.159 1.00 72.35 H new ATOM 0 HD13 ILE A 38 -2.528 4.381 -1.505 1.00 72.35 H new ATOM 612 N VAL A 39 -4.553 1.634 -4.913 1.00 75.42 N ATOM 613 CA VAL A 39 -5.255 0.735 -5.807 1.00 73.54 C ATOM 614 C VAL A 39 -5.668 -0.510 -5.029 1.00 65.12 C ATOM 615 O VAL A 39 -4.836 -1.135 -4.361 1.00 63.23 O ATOM 616 CB VAL A 39 -4.372 0.324 -7.021 1.00 64.33 C ATOM 617 CG1 VAL A 39 -5.127 -0.610 -7.956 1.00 70.30 C ATOM 618 CG2 VAL A 39 -3.885 1.556 -7.779 1.00 42.21 C ATOM 0 H VAL A 39 -3.661 1.276 -4.572 1.00 75.42 H new ATOM 0 HA VAL A 39 -6.132 1.252 -6.197 1.00 73.54 H new ATOM 0 HB VAL A 39 -3.504 -0.210 -6.635 1.00 64.33 H new ATOM 0 HG11 VAL A 39 -4.486 -0.881 -8.795 1.00 70.30 H new ATOM 0 HG12 VAL A 39 -5.416 -1.511 -7.415 1.00 70.30 H new ATOM 0 HG13 VAL A 39 -6.020 -0.108 -8.329 1.00 70.30 H new ATOM 0 HG21 VAL A 39 -3.270 1.244 -8.623 1.00 42.21 H new ATOM 0 HG22 VAL A 39 -4.743 2.121 -8.144 1.00 42.21 H new ATOM 0 HG23 VAL A 39 -3.294 2.184 -7.112 1.00 42.21 H new ATOM 628 N ALA A 40 -6.921 -0.876 -5.103 1.00 75.52 N ATOM 629 CA ALA A 40 -7.404 -2.015 -4.372 1.00 55.55 C ATOM 630 C ALA A 40 -8.182 -2.954 -5.266 1.00 15.42 C ATOM 631 O ALA A 40 -9.031 -2.539 -6.059 1.00 73.02 O ATOM 632 CB ALA A 40 -8.255 -1.575 -3.196 1.00 13.42 C ATOM 0 H ALA A 40 -7.627 -0.399 -5.664 1.00 75.52 H new ATOM 0 HA ALA A 40 -6.538 -2.556 -3.992 1.00 55.55 H new ATOM 0 HB1 ALA A 40 -8.611 -2.452 -2.656 1.00 13.42 H new ATOM 0 HB2 ALA A 40 -7.659 -0.954 -2.527 1.00 13.42 H new ATOM 0 HB3 ALA A 40 -9.108 -1.002 -3.559 1.00 13.42 H new ATOM 638 N ARG A 41 -7.897 -4.219 -5.149 1.00 35.44 N ATOM 639 CA ARG A 41 -8.612 -5.194 -5.909 1.00 21.51 C ATOM 640 C ARG A 41 -9.705 -5.784 -5.080 1.00 54.45 C ATOM 641 O ARG A 41 -9.469 -6.229 -3.960 1.00 64.51 O ATOM 642 CB ARG A 41 -7.708 -6.289 -6.480 1.00 50.20 C ATOM 643 CG ARG A 41 -6.730 -5.792 -7.524 1.00 54.21 C ATOM 644 CD ARG A 41 -6.094 -6.949 -8.269 1.00 73.13 C ATOM 645 NE ARG A 41 -5.311 -6.487 -9.423 1.00 32.42 N ATOM 646 CZ ARG A 41 -5.241 -7.138 -10.600 1.00 64.31 C ATOM 647 NH1 ARG A 41 -5.881 -8.295 -10.767 1.00 23.23 N ATOM 648 NH2 ARG A 41 -4.533 -6.630 -11.604 1.00 5.03 N ATOM 0 H ARG A 41 -7.175 -4.596 -4.535 1.00 35.44 H new ATOM 0 HA ARG A 41 -9.044 -4.680 -6.767 1.00 21.51 H new ATOM 0 HB2 ARG A 41 -7.151 -6.749 -5.664 1.00 50.20 H new ATOM 0 HB3 ARG A 41 -8.330 -7.068 -6.920 1.00 50.20 H new ATOM 0 HG2 ARG A 41 -7.246 -5.141 -8.229 1.00 54.21 H new ATOM 0 HG3 ARG A 41 -5.955 -5.193 -7.045 1.00 54.21 H new ATOM 0 HD2 ARG A 41 -5.448 -7.507 -7.591 1.00 73.13 H new ATOM 0 HD3 ARG A 41 -6.871 -7.635 -8.607 1.00 73.13 H new ATOM 0 HE ARG A 41 -4.787 -5.617 -9.327 1.00 32.42 H new ATOM 0 HH11 ARG A 41 -6.427 -8.691 -10.002 1.00 23.23 H new ATOM 0 HH12 ARG A 41 -5.825 -8.784 -11.660 1.00 23.23 H new ATOM 0 HH21 ARG A 41 -4.041 -5.745 -11.484 1.00 5.03 H new ATOM 0 HH22 ARG A 41 -4.482 -7.126 -12.494 1.00 5.03 H new ATOM 662 N LEU A 42 -10.897 -5.751 -5.616 1.00 53.30 N ATOM 663 CA LEU A 42 -12.071 -6.254 -4.939 1.00 4.01 C ATOM 664 C LEU A 42 -12.045 -7.764 -4.869 1.00 22.32 C ATOM 665 O LEU A 42 -11.537 -8.429 -5.789 1.00 11.22 O ATOM 666 CB LEU A 42 -13.339 -5.815 -5.688 1.00 64.31 C ATOM 667 CG LEU A 42 -13.567 -4.317 -5.850 1.00 1.32 C ATOM 668 CD1 LEU A 42 -14.920 -4.071 -6.483 1.00 62.50 C ATOM 669 CD2 LEU A 42 -13.452 -3.590 -4.522 1.00 24.12 C ATOM 0 H LEU A 42 -11.085 -5.371 -6.544 1.00 53.30 H new ATOM 0 HA LEU A 42 -12.076 -5.848 -3.927 1.00 4.01 H new ATOM 0 HB2 LEU A 42 -13.317 -6.263 -6.681 1.00 64.31 H new ATOM 0 HB3 LEU A 42 -14.201 -6.234 -5.168 1.00 64.31 H new ATOM 0 HG LEU A 42 -12.790 -3.920 -6.504 1.00 1.32 H new ATOM 0 HD11 LEU A 42 -15.079 -2.999 -6.597 1.00 62.50 H new ATOM 0 HD12 LEU A 42 -14.956 -4.549 -7.462 1.00 62.50 H new ATOM 0 HD13 LEU A 42 -15.701 -4.488 -5.847 1.00 62.50 H new ATOM 0 HD21 LEU A 42 -13.620 -2.524 -4.675 1.00 24.12 H new ATOM 0 HD22 LEU A 42 -14.197 -3.979 -3.828 1.00 24.12 H new ATOM 0 HD23 LEU A 42 -12.456 -3.744 -4.108 1.00 24.12 H new ATOM 681 N LYS A 43 -12.561 -8.312 -3.797 1.00 43.12 N ATOM 682 CA LYS A 43 -12.705 -9.740 -3.696 1.00 50.55 C ATOM 683 C LYS A 43 -13.984 -10.201 -4.344 1.00 0.02 C ATOM 684 O LYS A 43 -14.981 -10.484 -3.684 1.00 44.14 O ATOM 685 CB LYS A 43 -12.513 -10.247 -2.270 1.00 52.11 C ATOM 686 CG LYS A 43 -13.115 -9.355 -1.216 1.00 22.44 C ATOM 687 CD LYS A 43 -12.832 -9.846 0.172 1.00 14.11 C ATOM 688 CE LYS A 43 -13.434 -11.222 0.430 1.00 1.13 C ATOM 689 NZ LYS A 43 -13.133 -11.724 1.789 1.00 62.00 N ATOM 0 H LYS A 43 -12.888 -7.790 -2.984 1.00 43.12 H new ATOM 0 HA LYS A 43 -11.894 -10.200 -4.261 1.00 50.55 H new ATOM 0 HB2 LYS A 43 -12.954 -11.240 -2.186 1.00 52.11 H new ATOM 0 HB3 LYS A 43 -11.446 -10.355 -2.074 1.00 52.11 H new ATOM 0 HG2 LYS A 43 -12.721 -8.345 -1.329 1.00 22.44 H new ATOM 0 HG3 LYS A 43 -14.193 -9.295 -1.366 1.00 22.44 H new ATOM 0 HD2 LYS A 43 -11.754 -9.888 0.328 1.00 14.11 H new ATOM 0 HD3 LYS A 43 -13.231 -9.135 0.895 1.00 14.11 H new ATOM 0 HE2 LYS A 43 -14.514 -11.174 0.294 1.00 1.13 H new ATOM 0 HE3 LYS A 43 -13.051 -11.927 -0.308 1.00 1.13 H new ATOM 0 HZ1 LYS A 43 -13.564 -12.662 1.916 1.00 62.00 H new ATOM 0 HZ2 LYS A 43 -12.103 -11.796 1.912 1.00 62.00 H new ATOM 0 HZ3 LYS A 43 -13.521 -11.067 2.496 1.00 62.00 H new ATOM 745 N ARG A 47 -14.338 -5.726 -10.918 1.00 35.12 N ATOM 746 CA ARG A 47 -13.352 -4.757 -11.367 1.00 12.15 C ATOM 747 C ARG A 47 -12.474 -4.308 -10.242 1.00 75.11 C ATOM 748 O ARG A 47 -12.773 -4.560 -9.078 1.00 51.10 O ATOM 749 CB ARG A 47 -13.937 -3.571 -12.223 1.00 71.12 C ATOM 750 CG ARG A 47 -15.103 -2.755 -11.646 1.00 52.03 C ATOM 751 CD ARG A 47 -14.747 -1.905 -10.435 1.00 71.51 C ATOM 752 NE ARG A 47 -13.718 -0.882 -10.720 1.00 61.31 N ATOM 753 CZ ARG A 47 -13.780 0.412 -10.325 1.00 30.01 C ATOM 754 NH1 ARG A 47 -14.944 0.953 -9.946 1.00 41.10 N ATOM 755 NH2 ARG A 47 -12.686 1.166 -10.367 1.00 70.52 N ATOM 0 HA ARG A 47 -12.717 -5.287 -12.077 1.00 12.15 H new ATOM 0 HB2 ARG A 47 -13.121 -2.880 -12.433 1.00 71.12 H new ATOM 0 HB3 ARG A 47 -14.261 -3.981 -13.179 1.00 71.12 H new ATOM 0 HG2 ARG A 47 -15.494 -2.104 -12.427 1.00 52.03 H new ATOM 0 HG3 ARG A 47 -15.905 -3.439 -11.369 1.00 52.03 H new ATOM 0 HD2 ARG A 47 -15.647 -1.412 -10.068 1.00 71.51 H new ATOM 0 HD3 ARG A 47 -14.391 -2.555 -9.636 1.00 71.51 H new ATOM 0 HE ARG A 47 -12.899 -1.173 -11.255 1.00 61.31 H new ATOM 0 HH11 ARG A 47 -15.794 0.390 -9.953 1.00 41.10 H new ATOM 0 HH12 ARG A 47 -14.981 1.928 -9.650 1.00 41.10 H new ATOM 0 HH21 ARG A 47 -11.806 0.769 -10.696 1.00 70.52 H new ATOM 0 HH22 ARG A 47 -12.727 2.141 -10.071 1.00 70.52 H new ATOM 769 N GLN A 48 -11.394 -3.678 -10.585 1.00 54.04 N ATOM 770 CA GLN A 48 -10.443 -3.212 -9.613 1.00 51.14 C ATOM 771 C GLN A 48 -10.689 -1.749 -9.378 1.00 24.12 C ATOM 772 O GLN A 48 -10.877 -0.993 -10.341 1.00 3.42 O ATOM 773 CB GLN A 48 -8.989 -3.449 -10.083 1.00 52.14 C ATOM 774 CG GLN A 48 -8.591 -4.924 -10.294 1.00 2.12 C ATOM 775 CD GLN A 48 -9.273 -5.624 -11.465 1.00 22.34 C ATOM 776 OE1 GLN A 48 -9.607 -5.011 -12.478 1.00 70.00 O ATOM 777 NE2 GLN A 48 -9.494 -6.909 -11.328 1.00 33.23 N ATOM 0 H GLN A 48 -11.142 -3.469 -11.551 1.00 54.04 H new ATOM 0 HA GLN A 48 -10.572 -3.771 -8.686 1.00 51.14 H new ATOM 0 HB2 GLN A 48 -8.836 -2.912 -11.019 1.00 52.14 H new ATOM 0 HB3 GLN A 48 -8.313 -3.010 -9.350 1.00 52.14 H new ATOM 0 HG2 GLN A 48 -7.512 -4.974 -10.441 1.00 2.12 H new ATOM 0 HG3 GLN A 48 -8.815 -5.477 -9.382 1.00 2.12 H new ATOM 0 HE21 GLN A 48 -9.205 -7.388 -10.475 1.00 33.23 H new ATOM 0 HE22 GLN A 48 -9.955 -7.430 -12.074 1.00 33.23 H new ATOM 786 N VAL A 49 -10.697 -1.332 -8.135 1.00 4.14 N ATOM 787 CA VAL A 49 -11.035 0.034 -7.831 1.00 4.24 C ATOM 788 C VAL A 49 -9.825 0.783 -7.331 1.00 31.42 C ATOM 789 O VAL A 49 -8.865 0.190 -6.822 1.00 2.41 O ATOM 790 CB VAL A 49 -12.215 0.182 -6.790 1.00 43.33 C ATOM 791 CG1 VAL A 49 -13.453 -0.576 -7.214 1.00 40.32 C ATOM 792 CG2 VAL A 49 -11.821 -0.211 -5.389 1.00 63.52 C ATOM 0 H VAL A 49 -10.476 -1.913 -7.326 1.00 4.14 H new ATOM 0 HA VAL A 49 -11.385 0.466 -8.769 1.00 4.24 H new ATOM 0 HB VAL A 49 -12.450 1.246 -6.778 1.00 43.33 H new ATOM 0 HG11 VAL A 49 -14.235 -0.443 -6.466 1.00 40.32 H new ATOM 0 HG12 VAL A 49 -13.801 -0.196 -8.175 1.00 40.32 H new ATOM 0 HG13 VAL A 49 -13.217 -1.636 -7.307 1.00 40.32 H new ATOM 0 HG21 VAL A 49 -12.675 -0.087 -4.723 1.00 63.52 H new ATOM 0 HG22 VAL A 49 -11.502 -1.253 -5.380 1.00 63.52 H new ATOM 0 HG23 VAL A 49 -11.001 0.423 -5.050 1.00 63.52 H new ATOM 802 N CYS A 50 -9.859 2.050 -7.479 1.00 64.32 N ATOM 803 CA CYS A 50 -8.823 2.882 -6.970 1.00 53.33 C ATOM 804 C CYS A 50 -9.403 3.514 -5.738 1.00 42.41 C ATOM 805 O CYS A 50 -10.530 3.922 -5.759 1.00 13.15 O ATOM 806 CB CYS A 50 -8.435 3.927 -8.025 1.00 14.31 C ATOM 807 SG CYS A 50 -7.941 3.183 -9.624 1.00 23.23 S ATOM 0 H CYS A 50 -10.608 2.550 -7.958 1.00 64.32 H new ATOM 0 HA CYS A 50 -7.911 2.335 -6.732 1.00 53.33 H new ATOM 0 HB2 CYS A 50 -9.277 4.600 -8.189 1.00 14.31 H new ATOM 0 HB3 CYS A 50 -7.613 4.532 -7.643 1.00 14.31 H new ATOM 812 N ILE A 51 -8.677 3.566 -4.674 1.00 31.23 N ATOM 813 CA ILE A 51 -9.238 4.014 -3.418 1.00 45.43 C ATOM 814 C ILE A 51 -8.766 5.395 -3.060 1.00 11.21 C ATOM 815 O ILE A 51 -7.592 5.733 -3.230 1.00 22.31 O ATOM 816 CB ILE A 51 -8.909 3.025 -2.255 1.00 35.42 C ATOM 817 CG1 ILE A 51 -9.493 1.640 -2.530 1.00 45.34 C ATOM 818 CG2 ILE A 51 -9.432 3.544 -0.920 1.00 42.32 C ATOM 819 CD1 ILE A 51 -11.003 1.611 -2.594 1.00 70.24 C ATOM 0 H ILE A 51 -7.691 3.306 -4.635 1.00 31.23 H new ATOM 0 HA ILE A 51 -10.319 4.042 -3.554 1.00 45.43 H new ATOM 0 HB ILE A 51 -7.823 2.947 -2.198 1.00 35.42 H new ATOM 0 HG12 ILE A 51 -9.092 1.269 -3.473 1.00 45.34 H new ATOM 0 HG13 ILE A 51 -9.159 0.955 -1.751 1.00 45.34 H new ATOM 0 HG21 ILE A 51 -9.187 2.832 -0.132 1.00 42.32 H new ATOM 0 HG22 ILE A 51 -8.970 4.506 -0.697 1.00 42.32 H new ATOM 0 HG23 ILE A 51 -10.514 3.665 -0.975 1.00 42.32 H new ATOM 0 HD11 ILE A 51 -11.339 0.593 -2.792 1.00 70.24 H new ATOM 0 HD12 ILE A 51 -11.414 1.950 -1.643 1.00 70.24 H new ATOM 0 HD13 ILE A 51 -11.346 2.269 -3.393 1.00 70.24 H new ATOM 831 N ASP A 52 -9.705 6.187 -2.602 1.00 50.22 N ATOM 832 CA ASP A 52 -9.467 7.524 -2.122 1.00 43.12 C ATOM 833 C ASP A 52 -8.538 7.451 -0.897 1.00 20.44 C ATOM 834 O ASP A 52 -8.872 6.811 0.097 1.00 72.15 O ATOM 835 CB ASP A 52 -10.814 8.118 -1.718 1.00 52.52 C ATOM 836 CG ASP A 52 -10.760 9.568 -1.349 1.00 10.14 C ATOM 837 OD1 ASP A 52 -10.202 9.889 -0.326 1.00 52.41 O ATOM 838 OD2 ASP A 52 -11.329 10.399 -2.098 1.00 5.41 O ATOM 0 H ASP A 52 -10.685 5.909 -2.552 1.00 50.22 H new ATOM 0 HA ASP A 52 -8.999 8.142 -2.888 1.00 43.12 H new ATOM 0 HB2 ASP A 52 -11.516 7.990 -2.542 1.00 52.52 H new ATOM 0 HB3 ASP A 52 -11.208 7.554 -0.873 1.00 52.52 H new ATOM 843 N PRO A 53 -7.357 8.093 -0.950 1.00 13.04 N ATOM 844 CA PRO A 53 -6.383 8.037 0.150 1.00 63.22 C ATOM 845 C PRO A 53 -6.771 8.926 1.333 1.00 63.42 C ATOM 846 O PRO A 53 -6.037 9.043 2.315 1.00 54.42 O ATOM 847 CB PRO A 53 -5.088 8.538 -0.494 1.00 74.35 C ATOM 848 CG PRO A 53 -5.525 9.414 -1.620 1.00 71.11 C ATOM 849 CD PRO A 53 -6.876 8.910 -2.077 1.00 60.53 C ATOM 0 HA PRO A 53 -6.309 7.034 0.569 1.00 63.22 H new ATOM 0 HB2 PRO A 53 -4.480 9.091 0.222 1.00 74.35 H new ATOM 0 HB3 PRO A 53 -4.480 7.708 -0.854 1.00 74.35 H new ATOM 0 HG2 PRO A 53 -5.591 10.453 -1.297 1.00 71.11 H new ATOM 0 HG3 PRO A 53 -4.804 9.379 -2.437 1.00 71.11 H new ATOM 0 HD2 PRO A 53 -7.557 9.734 -2.291 1.00 60.53 H new ATOM 0 HD3 PRO A 53 -6.793 8.320 -2.990 1.00 60.53 H new ATOM 857 N LYS A 54 -7.915 9.537 1.229 1.00 54.14 N ATOM 858 CA LYS A 54 -8.426 10.430 2.226 1.00 21.01 C ATOM 859 C LYS A 54 -9.647 9.775 2.887 1.00 61.15 C ATOM 860 O LYS A 54 -10.325 10.376 3.731 1.00 43.43 O ATOM 861 CB LYS A 54 -8.861 11.696 1.518 1.00 61.33 C ATOM 862 CG LYS A 54 -7.763 12.380 0.699 1.00 73.23 C ATOM 863 CD LYS A 54 -8.346 13.421 -0.256 1.00 63.11 C ATOM 864 CE LYS A 54 -9.149 12.745 -1.381 1.00 61.54 C ATOM 865 NZ LYS A 54 -9.861 13.716 -2.240 1.00 63.34 N ATOM 0 H LYS A 54 -8.534 9.424 0.426 1.00 54.14 H new ATOM 0 HA LYS A 54 -7.675 10.651 2.984 1.00 21.01 H new ATOM 0 HB2 LYS A 54 -9.694 11.458 0.857 1.00 61.33 H new ATOM 0 HB3 LYS A 54 -9.235 12.401 2.260 1.00 61.33 H new ATOM 0 HG2 LYS A 54 -7.051 12.859 1.371 1.00 73.23 H new ATOM 0 HG3 LYS A 54 -7.211 11.631 0.131 1.00 73.23 H new ATOM 0 HD2 LYS A 54 -8.990 14.106 0.295 1.00 63.11 H new ATOM 0 HD3 LYS A 54 -7.541 14.017 -0.686 1.00 63.11 H new ATOM 0 HE2 LYS A 54 -8.474 12.150 -1.996 1.00 61.54 H new ATOM 0 HE3 LYS A 54 -9.871 12.057 -0.942 1.00 61.54 H new ATOM 0 HZ1 LYS A 54 -10.081 13.274 -3.155 1.00 63.34 H new ATOM 0 HZ2 LYS A 54 -10.744 14.008 -1.775 1.00 63.34 H new ATOM 0 HZ3 LYS A 54 -9.259 14.550 -2.394 1.00 63.34 H new ATOM 879 N LEU A 55 -9.928 8.547 2.475 1.00 63.11 N ATOM 880 CA LEU A 55 -11.051 7.787 2.970 1.00 44.21 C ATOM 881 C LEU A 55 -10.813 7.443 4.445 1.00 50.21 C ATOM 882 O LEU A 55 -9.683 7.128 4.824 1.00 13.52 O ATOM 883 CB LEU A 55 -11.174 6.509 2.144 1.00 72.34 C ATOM 884 CG LEU A 55 -12.573 6.110 1.692 1.00 0.23 C ATOM 885 CD1 LEU A 55 -12.512 4.870 0.821 1.00 31.23 C ATOM 886 CD2 LEU A 55 -13.524 5.905 2.863 1.00 23.33 C ATOM 0 H LEU A 55 -9.372 8.051 1.779 1.00 63.11 H new ATOM 0 HA LEU A 55 -11.972 8.365 2.886 1.00 44.21 H new ATOM 0 HB2 LEU A 55 -10.549 6.617 1.257 1.00 72.34 H new ATOM 0 HB3 LEU A 55 -10.759 5.687 2.728 1.00 72.34 H new ATOM 0 HG LEU A 55 -12.973 6.936 1.104 1.00 0.23 H new ATOM 0 HD11 LEU A 55 -13.519 4.597 0.506 1.00 31.23 H new ATOM 0 HD12 LEU A 55 -11.899 5.072 -0.057 1.00 31.23 H new ATOM 0 HD13 LEU A 55 -12.074 4.048 1.388 1.00 31.23 H new ATOM 0 HD21 LEU A 55 -14.507 5.622 2.488 1.00 23.33 H new ATOM 0 HD22 LEU A 55 -13.141 5.115 3.509 1.00 23.33 H new ATOM 0 HD23 LEU A 55 -13.606 6.831 3.432 1.00 23.33 H new ATOM 898 N LYS A 56 -11.870 7.501 5.265 1.00 73.12 N ATOM 899 CA LYS A 56 -11.754 7.246 6.706 1.00 72.24 C ATOM 900 C LYS A 56 -11.078 5.918 7.029 1.00 31.33 C ATOM 901 O LYS A 56 -10.218 5.866 7.894 1.00 11.52 O ATOM 902 CB LYS A 56 -13.093 7.333 7.430 1.00 24.50 C ATOM 903 CG LYS A 56 -12.954 7.094 8.932 1.00 12.33 C ATOM 904 CD LYS A 56 -14.271 7.177 9.644 1.00 5.52 C ATOM 905 CE LYS A 56 -14.126 6.829 11.124 1.00 30.41 C ATOM 906 NZ LYS A 56 -13.193 7.733 11.840 1.00 62.12 N ATOM 0 H LYS A 56 -12.816 7.723 4.954 1.00 73.12 H new ATOM 0 HA LYS A 56 -11.112 8.046 7.075 1.00 72.24 H new ATOM 0 HB2 LYS A 56 -13.533 8.316 7.259 1.00 24.50 H new ATOM 0 HB3 LYS A 56 -13.780 6.599 7.009 1.00 24.50 H new ATOM 0 HG2 LYS A 56 -12.512 6.112 9.102 1.00 12.33 H new ATOM 0 HG3 LYS A 56 -12.268 7.829 9.353 1.00 12.33 H new ATOM 0 HD2 LYS A 56 -14.678 8.183 9.543 1.00 5.52 H new ATOM 0 HD3 LYS A 56 -14.983 6.497 9.177 1.00 5.52 H new ATOM 0 HE2 LYS A 56 -15.105 6.874 11.600 1.00 30.41 H new ATOM 0 HE3 LYS A 56 -13.773 5.802 11.218 1.00 30.41 H new ATOM 0 HZ1 LYS A 56 -13.248 7.550 12.862 1.00 62.12 H new ATOM 0 HZ2 LYS A 56 -12.222 7.562 11.510 1.00 62.12 H new ATOM 0 HZ3 LYS A 56 -13.454 8.722 11.651 1.00 62.12 H new ATOM 920 N TRP A 57 -11.441 4.843 6.342 1.00 71.42 N ATOM 921 CA TRP A 57 -10.784 3.579 6.637 1.00 71.52 C ATOM 922 C TRP A 57 -9.349 3.558 6.201 1.00 71.15 C ATOM 923 O TRP A 57 -8.563 2.855 6.770 1.00 31.25 O ATOM 924 CB TRP A 57 -11.554 2.328 6.232 1.00 11.34 C ATOM 925 CG TRP A 57 -11.935 2.222 4.811 1.00 3.43 C ATOM 926 CD1 TRP A 57 -13.086 2.647 4.268 1.00 72.22 C ATOM 927 CD2 TRP A 57 -11.182 1.620 3.740 1.00 0.41 C ATOM 928 NE1 TRP A 57 -13.113 2.355 2.949 1.00 1.13 N ATOM 929 CE2 TRP A 57 -11.967 1.726 2.591 1.00 33.25 C ATOM 930 CE3 TRP A 57 -9.929 1.003 3.642 1.00 24.33 C ATOM 931 CZ2 TRP A 57 -11.562 1.245 1.355 1.00 3.54 C ATOM 932 CZ3 TRP A 57 -9.523 0.520 2.407 1.00 72.54 C ATOM 933 CH2 TRP A 57 -10.344 0.648 1.278 1.00 52.21 C ATOM 0 H TRP A 57 -12.152 4.817 5.611 1.00 71.42 H new ATOM 0 HA TRP A 57 -10.784 3.530 7.726 1.00 71.52 H new ATOM 0 HB2 TRP A 57 -10.951 1.458 6.489 1.00 11.34 H new ATOM 0 HB3 TRP A 57 -12.462 2.276 6.834 1.00 11.34 H new ATOM 0 HD1 TRP A 57 -13.876 3.149 4.807 1.00 72.22 H new ATOM 0 HE1 TRP A 57 -13.882 2.575 2.316 1.00 1.13 H new ATOM 0 HE3 TRP A 57 -9.293 0.905 4.509 1.00 24.33 H new ATOM 0 HZ2 TRP A 57 -12.193 1.342 0.484 1.00 3.54 H new ATOM 0 HZ3 TRP A 57 -8.561 0.038 2.314 1.00 72.54 H new ATOM 0 HH2 TRP A 57 -10.002 0.264 0.328 1.00 52.21 H new ATOM 944 N ILE A 58 -9.008 4.343 5.188 1.00 0.43 N ATOM 945 CA ILE A 58 -7.611 4.511 4.805 1.00 11.15 C ATOM 946 C ILE A 58 -6.891 5.234 5.938 1.00 33.15 C ATOM 947 O ILE A 58 -5.769 4.873 6.318 1.00 43.03 O ATOM 948 CB ILE A 58 -7.457 5.319 3.474 1.00 2.25 C ATOM 949 CG1 ILE A 58 -8.002 4.528 2.285 1.00 0.41 C ATOM 950 CG2 ILE A 58 -6.008 5.724 3.225 1.00 75.14 C ATOM 951 CD1 ILE A 58 -7.295 3.216 2.045 1.00 73.44 C ATOM 0 H ILE A 58 -9.672 4.870 4.620 1.00 0.43 H new ATOM 0 HA ILE A 58 -7.176 3.527 4.631 1.00 11.15 H new ATOM 0 HB ILE A 58 -8.045 6.231 3.581 1.00 2.25 H new ATOM 0 HG12 ILE A 58 -9.062 4.333 2.446 1.00 0.41 H new ATOM 0 HG13 ILE A 58 -7.923 5.141 1.387 1.00 0.41 H new ATOM 0 HG21 ILE A 58 -5.942 6.283 2.292 1.00 75.14 H new ATOM 0 HG22 ILE A 58 -5.658 6.348 4.047 1.00 75.14 H new ATOM 0 HG23 ILE A 58 -5.387 4.831 3.158 1.00 75.14 H new ATOM 0 HD11 ILE A 58 -7.740 2.715 1.185 1.00 73.44 H new ATOM 0 HD12 ILE A 58 -6.239 3.402 1.850 1.00 73.44 H new ATOM 0 HD13 ILE A 58 -7.395 2.582 2.926 1.00 73.44 H new ATOM 963 N GLN A 59 -7.576 6.232 6.498 1.00 5.54 N ATOM 964 CA GLN A 59 -7.066 7.009 7.616 1.00 62.20 C ATOM 965 C GLN A 59 -6.809 6.104 8.818 1.00 12.24 C ATOM 966 O GLN A 59 -5.856 6.296 9.559 1.00 74.24 O ATOM 967 CB GLN A 59 -8.040 8.133 8.010 1.00 71.24 C ATOM 968 CG GLN A 59 -8.379 9.121 6.896 1.00 75.52 C ATOM 969 CD GLN A 59 -7.163 9.817 6.324 1.00 52.53 C ATOM 970 OE1 GLN A 59 -6.751 10.858 6.812 1.00 40.13 O ATOM 971 NE2 GLN A 59 -6.608 9.273 5.275 1.00 10.23 N ATOM 0 H GLN A 59 -8.502 6.521 6.184 1.00 5.54 H new ATOM 0 HA GLN A 59 -6.128 7.465 7.300 1.00 62.20 H new ATOM 0 HB2 GLN A 59 -8.966 7.681 8.367 1.00 71.24 H new ATOM 0 HB3 GLN A 59 -7.612 8.686 8.846 1.00 71.24 H new ATOM 0 HG2 GLN A 59 -8.897 8.592 6.096 1.00 75.52 H new ATOM 0 HG3 GLN A 59 -9.070 9.870 7.282 1.00 75.52 H new ATOM 0 HE21 GLN A 59 -6.980 8.402 4.895 1.00 10.23 H new ATOM 0 HE22 GLN A 59 -5.803 9.718 4.835 1.00 10.23 H new ATOM 980 N GLU A 60 -7.674 5.128 9.006 1.00 73.22 N ATOM 981 CA GLU A 60 -7.513 4.159 10.055 1.00 24.24 C ATOM 982 C GLU A 60 -6.416 3.155 9.692 1.00 12.20 C ATOM 983 O GLU A 60 -5.480 2.949 10.452 1.00 5.15 O ATOM 984 CB GLU A 60 -8.824 3.395 10.270 1.00 23.40 C ATOM 985 CG GLU A 60 -10.012 4.240 10.696 1.00 21.21 C ATOM 986 CD GLU A 60 -9.784 4.950 12.004 1.00 1.53 C ATOM 987 OE1 GLU A 60 -9.855 4.298 13.066 1.00 72.22 O ATOM 988 OE2 GLU A 60 -9.539 6.161 11.989 1.00 45.34 O ATOM 0 H GLU A 60 -8.506 4.990 8.433 1.00 73.22 H new ATOM 0 HA GLU A 60 -7.236 4.688 10.967 1.00 24.24 H new ATOM 0 HB2 GLU A 60 -9.080 2.880 9.344 1.00 23.40 H new ATOM 0 HB3 GLU A 60 -8.657 2.627 11.026 1.00 23.40 H new ATOM 0 HG2 GLU A 60 -10.225 4.976 9.921 1.00 21.21 H new ATOM 0 HG3 GLU A 60 -10.893 3.603 10.782 1.00 21.21 H new ATOM 995 N TYR A 61 -6.536 2.585 8.498 1.00 0.40 N ATOM 996 CA TYR A 61 -5.692 1.493 8.006 1.00 22.12 C ATOM 997 C TYR A 61 -4.203 1.854 8.013 1.00 11.14 C ATOM 998 O TYR A 61 -3.384 1.113 8.565 1.00 62.44 O ATOM 999 CB TYR A 61 -6.130 1.112 6.582 1.00 64.22 C ATOM 1000 CG TYR A 61 -5.603 -0.211 6.077 1.00 3.52 C ATOM 1001 CD1 TYR A 61 -4.324 -0.333 5.561 1.00 53.03 C ATOM 1002 CD2 TYR A 61 -6.409 -1.343 6.114 1.00 50.35 C ATOM 1003 CE1 TYR A 61 -3.858 -1.542 5.099 1.00 50.45 C ATOM 1004 CE2 TYR A 61 -5.959 -2.558 5.654 1.00 32.11 C ATOM 1005 CZ TYR A 61 -4.673 -2.655 5.145 1.00 32.14 C ATOM 1006 OH TYR A 61 -4.205 -3.863 4.674 1.00 0.53 O ATOM 0 H TYR A 61 -7.243 2.876 7.823 1.00 0.40 H new ATOM 0 HA TYR A 61 -5.820 0.647 8.682 1.00 22.12 H new ATOM 0 HB2 TYR A 61 -7.219 1.087 6.549 1.00 64.22 H new ATOM 0 HB3 TYR A 61 -5.808 1.897 5.898 1.00 64.22 H new ATOM 0 HD1 TYR A 61 -3.682 0.535 5.521 1.00 53.03 H new ATOM 0 HD2 TYR A 61 -7.410 -1.266 6.513 1.00 50.35 H new ATOM 0 HE1 TYR A 61 -2.857 -1.620 4.701 1.00 50.45 H new ATOM 0 HE2 TYR A 61 -6.600 -3.427 5.689 1.00 32.11 H new ATOM 0 HH TYR A 61 -4.900 -4.546 4.778 1.00 0.53 H new ATOM 1016 N LEU A 62 -3.855 2.981 7.414 1.00 43.32 N ATOM 1017 CA LEU A 62 -2.451 3.379 7.333 1.00 2.24 C ATOM 1018 C LEU A 62 -1.905 3.616 8.716 1.00 40.34 C ATOM 1019 O LEU A 62 -0.855 3.113 9.071 1.00 44.52 O ATOM 1020 CB LEU A 62 -2.276 4.645 6.491 1.00 33.23 C ATOM 1021 CG LEU A 62 -2.791 4.585 5.055 1.00 42.51 C ATOM 1022 CD1 LEU A 62 -2.520 5.901 4.345 1.00 64.24 C ATOM 1023 CD2 LEU A 62 -2.172 3.422 4.289 1.00 23.01 C ATOM 0 H LEU A 62 -4.511 3.631 6.981 1.00 43.32 H new ATOM 0 HA LEU A 62 -1.902 2.570 6.852 1.00 2.24 H new ATOM 0 HB2 LEU A 62 -2.781 5.466 7.000 1.00 33.23 H new ATOM 0 HB3 LEU A 62 -1.215 4.892 6.463 1.00 33.23 H new ATOM 0 HG LEU A 62 -3.868 4.419 5.089 1.00 42.51 H new ATOM 0 HD11 LEU A 62 -2.892 5.846 3.322 1.00 64.24 H new ATOM 0 HD12 LEU A 62 -3.026 6.710 4.872 1.00 64.24 H new ATOM 0 HD13 LEU A 62 -1.447 6.093 4.331 1.00 64.24 H new ATOM 0 HD21 LEU A 62 -2.561 3.409 3.271 1.00 23.01 H new ATOM 0 HD22 LEU A 62 -1.089 3.539 4.262 1.00 23.01 H new ATOM 0 HD23 LEU A 62 -2.423 2.485 4.785 1.00 23.01 H new ATOM 1035 N GLU A 63 -2.655 4.359 9.491 1.00 0.34 N ATOM 1036 CA GLU A 63 -2.304 4.712 10.831 1.00 61.11 C ATOM 1037 C GLU A 63 -2.159 3.440 11.732 1.00 3.15 C ATOM 1038 O GLU A 63 -1.237 3.354 12.534 1.00 0.31 O ATOM 1039 CB GLU A 63 -3.373 5.697 11.311 1.00 55.10 C ATOM 1040 CG GLU A 63 -3.102 6.468 12.577 1.00 71.22 C ATOM 1041 CD GLU A 63 -3.178 5.653 13.832 1.00 35.30 C ATOM 1042 OE1 GLU A 63 -4.294 5.271 14.225 1.00 45.30 O ATOM 1043 OE2 GLU A 63 -2.133 5.391 14.452 1.00 72.33 O ATOM 0 H GLU A 63 -3.551 4.743 9.192 1.00 0.34 H new ATOM 0 HA GLU A 63 -1.326 5.190 10.887 1.00 61.11 H new ATOM 0 HB2 GLU A 63 -3.548 6.417 10.512 1.00 55.10 H new ATOM 0 HB3 GLU A 63 -4.301 5.142 11.449 1.00 55.10 H new ATOM 0 HG2 GLU A 63 -2.110 6.915 12.509 1.00 71.22 H new ATOM 0 HG3 GLU A 63 -3.817 7.288 12.648 1.00 71.22 H new ATOM 1050 N LYS A 64 -3.032 2.439 11.556 1.00 3.41 N ATOM 1051 CA LYS A 64 -2.952 1.216 12.366 1.00 21.31 C ATOM 1052 C LYS A 64 -1.734 0.362 11.999 1.00 63.34 C ATOM 1053 O LYS A 64 -1.165 -0.334 12.849 1.00 74.14 O ATOM 1054 CB LYS A 64 -4.303 0.432 12.394 1.00 60.15 C ATOM 1055 CG LYS A 64 -4.848 -0.097 11.057 1.00 11.42 C ATOM 1056 CD LYS A 64 -4.214 -1.400 10.587 1.00 63.22 C ATOM 1057 CE LYS A 64 -4.619 -2.569 11.469 1.00 64.02 C ATOM 1058 NZ LYS A 64 -6.098 -2.804 11.464 1.00 13.31 N ATOM 0 H LYS A 64 -3.789 2.450 10.873 1.00 3.41 H new ATOM 0 HA LYS A 64 -2.786 1.519 13.400 1.00 21.31 H new ATOM 0 HB2 LYS A 64 -4.185 -0.417 13.068 1.00 60.15 H new ATOM 0 HB3 LYS A 64 -5.060 1.083 12.831 1.00 60.15 H new ATOM 0 HG2 LYS A 64 -5.924 -0.244 11.151 1.00 11.42 H new ATOM 0 HG3 LYS A 64 -4.696 0.663 10.291 1.00 11.42 H new ATOM 0 HD2 LYS A 64 -4.512 -1.600 9.558 1.00 63.22 H new ATOM 0 HD3 LYS A 64 -3.129 -1.299 10.591 1.00 63.22 H new ATOM 0 HE2 LYS A 64 -4.110 -3.471 11.129 1.00 64.02 H new ATOM 0 HE3 LYS A 64 -4.287 -2.382 12.490 1.00 64.02 H new ATOM 0 HZ1 LYS A 64 -6.298 -3.762 11.814 1.00 13.31 H new ATOM 0 HZ2 LYS A 64 -6.562 -2.106 12.080 1.00 13.31 H new ATOM 0 HZ3 LYS A 64 -6.462 -2.707 10.495 1.00 13.31 H new ATOM 1072 N CYS A 65 -1.326 0.430 10.750 1.00 44.10 N ATOM 1073 CA CYS A 65 -0.094 -0.233 10.324 1.00 22.11 C ATOM 1074 C CYS A 65 1.136 0.602 10.689 1.00 15.23 C ATOM 1075 O CYS A 65 2.236 0.081 10.832 1.00 53.33 O ATOM 1076 CB CYS A 65 -0.109 -0.576 8.820 1.00 34.31 C ATOM 1077 SG CYS A 65 -1.311 -1.870 8.359 1.00 12.31 S ATOM 0 H CYS A 65 -1.819 0.931 10.011 1.00 44.10 H new ATOM 0 HA CYS A 65 -0.035 -1.177 10.865 1.00 22.11 H new ATOM 0 HB2 CYS A 65 -0.332 0.329 8.255 1.00 34.31 H new ATOM 0 HB3 CYS A 65 0.888 -0.900 8.523 1.00 34.31 H new ATOM 1082 N LEU A 66 0.928 1.891 10.865 1.00 10.21 N ATOM 1083 CA LEU A 66 1.971 2.820 11.226 1.00 2.01 C ATOM 1084 C LEU A 66 2.260 2.689 12.726 1.00 22.44 C ATOM 1085 O LEU A 66 3.367 2.910 13.177 1.00 54.14 O ATOM 1086 CB LEU A 66 1.476 4.251 10.850 1.00 53.23 C ATOM 1087 CG LEU A 66 2.456 5.439 10.903 1.00 50.31 C ATOM 1088 CD1 LEU A 66 2.842 5.842 12.302 1.00 54.14 C ATOM 1089 CD2 LEU A 66 3.678 5.113 10.121 1.00 44.31 C ATOM 0 H LEU A 66 0.012 2.327 10.758 1.00 10.21 H new ATOM 0 HA LEU A 66 2.900 2.615 10.695 1.00 2.01 H new ATOM 0 HB2 LEU A 66 1.079 4.202 9.836 1.00 53.23 H new ATOM 0 HB3 LEU A 66 0.640 4.489 11.508 1.00 53.23 H new ATOM 0 HG LEU A 66 1.934 6.292 10.468 1.00 50.31 H new ATOM 0 HD11 LEU A 66 3.533 6.684 12.261 1.00 54.14 H new ATOM 0 HD12 LEU A 66 1.950 6.132 12.856 1.00 54.14 H new ATOM 0 HD13 LEU A 66 3.323 5.002 12.803 1.00 54.14 H new ATOM 0 HD21 LEU A 66 4.370 5.954 10.160 1.00 44.31 H new ATOM 0 HD22 LEU A 66 4.156 4.230 10.545 1.00 44.31 H new ATOM 0 HD23 LEU A 66 3.405 4.915 9.085 1.00 44.31 H new ATOM 1101 N ASN A 67 1.256 2.277 13.473 1.00 31.10 N ATOM 1102 CA ASN A 67 1.352 2.173 14.932 1.00 63.13 C ATOM 1103 C ASN A 67 2.025 0.857 15.343 1.00 72.41 C ATOM 1104 O ASN A 67 2.155 0.546 16.528 1.00 53.00 O ATOM 1105 CB ASN A 67 -0.049 2.234 15.530 1.00 51.12 C ATOM 1106 CG ASN A 67 -0.056 2.635 17.001 1.00 62.34 C ATOM 1107 OD1 ASN A 67 -0.129 3.826 17.322 1.00 54.23 O ATOM 1108 ND2 ASN A 67 -0.009 1.686 17.890 1.00 40.24 N ATOM 0 H ASN A 67 0.349 2.003 13.096 1.00 31.10 H new ATOM 0 HA ASN A 67 1.957 3.000 15.303 1.00 63.13 H new ATOM 0 HB2 ASN A 67 -0.649 2.946 14.963 1.00 51.12 H new ATOM 0 HB3 ASN A 67 -0.526 1.260 15.423 1.00 51.12 H new ATOM 0 HD21 ASN A 67 -0.032 1.916 18.883 1.00 40.24 H new ATOM 0 HD22 ASN A 67 0.051 0.712 17.593 1.00 40.24 H new ATOM 1404 N GLY B 119 -13.984 6.279 -11.383 1.00 60.03 N ATOM 1405 CA GLY B 119 -14.303 7.544 -10.756 1.00 50.34 C ATOM 1406 C GLY B 119 -15.706 7.434 -10.250 1.00 52.23 C ATOM 1407 O GLY B 119 -16.615 8.155 -10.690 1.00 63.52 O ATOM 0 HA2 GLY B 119 -13.613 7.755 -9.939 1.00 50.34 H new ATOM 0 HA3 GLY B 119 -14.213 8.363 -11.470 1.00 50.34 H new ATOM 1411 N ASP B 120 -15.891 6.507 -9.352 1.00 74.33 N ATOM 1412 CA ASP B 120 -17.206 6.113 -8.923 1.00 41.12 C ATOM 1413 C ASP B 120 -17.203 5.904 -7.407 1.00 42.22 C ATOM 1414 O ASP B 120 -16.217 6.241 -6.745 1.00 64.55 O ATOM 1415 CB ASP B 120 -17.507 4.812 -9.643 1.00 52.01 C ATOM 1416 CG ASP B 120 -18.945 4.343 -9.592 1.00 72.24 C ATOM 1417 OD1 ASP B 120 -19.324 3.593 -8.677 1.00 5.44 O ATOM 1418 OD2 ASP B 120 -19.710 4.685 -10.495 1.00 73.42 O ATOM 0 H ASP B 120 -15.132 6.001 -8.895 1.00 74.33 H new ATOM 0 HA ASP B 120 -17.958 6.868 -9.151 1.00 41.12 H new ATOM 0 HB2 ASP B 120 -17.219 4.923 -10.688 1.00 52.01 H new ATOM 0 HB3 ASP B 120 -16.876 4.031 -9.220 1.00 52.01 H new ATOM 1447 N ASP B 122 -19.033 7.482 -5.219 1.00 42.14 N ATOM 1448 CA ASP B 122 -18.948 8.900 -4.837 1.00 42.53 C ATOM 1449 C ASP B 122 -17.726 9.566 -5.392 1.00 41.42 C ATOM 1450 O ASP B 122 -17.819 10.630 -6.008 1.00 12.11 O ATOM 1451 CB ASP B 122 -19.069 9.152 -3.361 1.00 54.31 C ATOM 1452 CG ASP B 122 -20.487 9.074 -2.846 1.00 25.01 C ATOM 1453 OD1 ASP B 122 -21.181 10.111 -2.831 1.00 14.00 O ATOM 1454 OD2 ASP B 122 -20.929 7.991 -2.435 1.00 64.12 O ATOM 0 HA ASP B 122 -19.826 9.356 -5.294 1.00 42.53 H new ATOM 0 HB2 ASP B 122 -18.457 8.426 -2.826 1.00 54.31 H new ATOM 0 HB3 ASP B 122 -18.664 10.138 -3.135 1.00 54.31 H new ATOM 1459 N SER B 123 -16.585 8.956 -5.140 1.00 2.11 N ATOM 1460 CA SER B 123 -15.326 9.361 -5.702 1.00 12.01 C ATOM 1461 C SER B 123 -14.792 10.738 -5.158 1.00 11.42 C ATOM 1462 O SER B 123 -13.810 11.291 -5.676 1.00 43.31 O ATOM 1463 CB SER B 123 -15.418 9.252 -7.264 1.00 55.14 C ATOM 1464 OG SER B 123 -14.257 9.700 -7.935 1.00 64.01 O ATOM 0 H SER B 123 -16.513 8.147 -4.523 1.00 2.11 H new ATOM 0 HA SER B 123 -14.548 8.677 -5.363 1.00 12.01 H new ATOM 0 HB2 SER B 123 -15.606 8.213 -7.536 1.00 55.14 H new ATOM 0 HB3 SER B 123 -16.273 9.832 -7.610 1.00 55.14 H new ATOM 0 HG SER B 123 -13.471 9.242 -7.571 1.00 64.01 H new ATOM 1470 N MET B 124 -15.399 11.245 -4.071 1.00 1.11 N ATOM 1471 CA MET B 124 -14.949 12.513 -3.465 1.00 21.42 C ATOM 1472 C MET B 124 -15.040 12.510 -1.931 1.00 71.24 C ATOM 1473 O MET B 124 -16.139 12.632 -1.371 1.00 22.21 O ATOM 1474 CB MET B 124 -15.748 13.713 -3.999 1.00 12.45 C ATOM 1475 CG MET B 124 -15.543 14.025 -5.466 1.00 4.44 C ATOM 1476 SD MET B 124 -16.530 15.436 -6.019 1.00 61.33 S ATOM 1477 CE MET B 124 -15.942 16.715 -4.907 1.00 62.33 C ATOM 0 H MET B 124 -16.190 10.806 -3.599 1.00 1.11 H new ATOM 0 HA MET B 124 -13.901 12.609 -3.750 1.00 21.42 H new ATOM 0 HB2 MET B 124 -16.808 13.527 -3.829 1.00 12.45 H new ATOM 0 HB3 MET B 124 -15.481 14.595 -3.416 1.00 12.45 H new ATOM 0 HG2 MET B 124 -14.488 14.231 -5.646 1.00 4.44 H new ATOM 0 HG3 MET B 124 -15.803 13.149 -6.060 1.00 4.44 H new ATOM 0 HE1 MET B 124 -15.939 17.674 -5.425 1.00 62.33 H new ATOM 0 HE2 MET B 124 -16.599 16.773 -4.039 1.00 62.33 H new ATOM 0 HE3 MET B 124 -14.930 16.476 -4.580 1.00 62.33 H new ATOM 1487 N LYS B 125 -13.902 12.360 -1.255 1.00 72.23 N ATOM 1488 CA LYS B 125 -13.819 12.486 0.205 1.00 74.13 C ATOM 1489 C LYS B 125 -12.552 13.227 0.633 1.00 44.22 C ATOM 1490 O LYS B 125 -11.784 13.684 -0.201 1.00 33.12 O ATOM 1491 CB LYS B 125 -13.928 11.143 0.946 1.00 71.51 C ATOM 1492 CG LYS B 125 -15.307 10.509 0.973 1.00 34.24 C ATOM 1493 CD LYS B 125 -16.301 11.410 1.712 1.00 0.33 C ATOM 1494 CE LYS B 125 -15.965 11.631 3.195 1.00 34.30 C ATOM 1495 NZ LYS B 125 -15.961 10.380 3.966 1.00 75.14 N ATOM 0 H LYS B 125 -13.010 12.148 -1.701 1.00 72.23 H new ATOM 0 HA LYS B 125 -14.689 13.075 0.494 1.00 74.13 H new ATOM 0 HB2 LYS B 125 -13.235 10.439 0.485 1.00 71.51 H new ATOM 0 HB3 LYS B 125 -13.597 11.290 1.974 1.00 71.51 H new ATOM 0 HG2 LYS B 125 -15.653 10.336 -0.046 1.00 34.24 H new ATOM 0 HG3 LYS B 125 -15.256 9.536 1.462 1.00 34.24 H new ATOM 0 HD2 LYS B 125 -16.340 12.377 1.211 1.00 0.33 H new ATOM 0 HD3 LYS B 125 -17.297 10.972 1.637 1.00 0.33 H new ATOM 0 HE2 LYS B 125 -14.987 12.106 3.275 1.00 34.30 H new ATOM 0 HE3 LYS B 125 -16.690 12.319 3.629 1.00 34.30 H new ATOM 0 HZ1 LYS B 125 -15.779 10.590 4.968 1.00 75.14 H new ATOM 0 HZ2 LYS B 125 -16.885 9.912 3.873 1.00 75.14 H new ATOM 0 HZ3 LYS B 125 -15.216 9.751 3.604 1.00 75.14 H new ATOM 1509 N GLU B 126 -12.366 13.353 1.939 1.00 71.55 N ATOM 1510 CA GLU B 126 -11.239 14.046 2.526 1.00 75.34 C ATOM 1511 C GLU B 126 -11.035 13.543 3.973 1.00 62.33 C ATOM 1512 O GLU B 126 -11.987 13.012 4.560 1.00 1.41 O ATOM 1513 CB GLU B 126 -11.470 15.560 2.448 1.00 11.41 C ATOM 1514 CG GLU B 126 -12.777 16.035 3.034 1.00 13.20 C ATOM 1515 CD GLU B 126 -12.973 17.495 2.801 1.00 13.14 C ATOM 1516 OE1 GLU B 126 -12.429 18.298 3.567 1.00 44.34 O ATOM 1517 OE2 GLU B 126 -13.656 17.874 1.815 1.00 41.22 O ATOM 0 H GLU B 126 -13.010 12.967 2.630 1.00 71.55 H new ATOM 0 HA GLU B 126 -10.323 13.836 1.974 1.00 75.34 H new ATOM 0 HB2 GLU B 126 -10.653 16.064 2.964 1.00 11.41 H new ATOM 0 HB3 GLU B 126 -11.425 15.866 1.403 1.00 11.41 H new ATOM 0 HG2 GLU B 126 -13.602 15.479 2.588 1.00 13.20 H new ATOM 0 HG3 GLU B 126 -12.795 15.829 4.104 1.00 13.20 H new ATOM 1524 N PRO B 127 -9.795 13.653 4.554 1.00 61.53 N ATOM 1525 CA PRO B 127 -9.482 13.124 5.895 1.00 73.31 C ATOM 1526 C PRO B 127 -10.329 13.697 7.019 1.00 23.45 C ATOM 1527 O PRO B 127 -10.975 14.746 6.883 1.00 43.50 O ATOM 1528 CB PRO B 127 -8.020 13.525 6.118 1.00 44.05 C ATOM 1529 CG PRO B 127 -7.757 14.599 5.141 1.00 71.33 C ATOM 1530 CD PRO B 127 -8.604 14.272 3.955 1.00 63.32 C ATOM 0 HA PRO B 127 -9.680 12.052 5.921 1.00 73.31 H new ATOM 0 HB2 PRO B 127 -7.859 13.873 7.138 1.00 44.05 H new ATOM 0 HB3 PRO B 127 -7.352 12.678 5.961 1.00 44.05 H new ATOM 0 HG2 PRO B 127 -8.015 15.575 5.551 1.00 71.33 H new ATOM 0 HG3 PRO B 127 -6.701 14.636 4.872 1.00 71.33 H new ATOM 0 HD2 PRO B 127 -8.858 15.165 3.383 1.00 63.32 H new ATOM 0 HD3 PRO B 127 -8.096 13.591 3.273 1.00 63.32 H new ATOM 1855 N CYS C 209 0.400 -16.654 5.444 1.00 3.22 N ATOM 1856 CA CYS C 209 1.040 -15.403 5.207 1.00 4.23 C ATOM 1857 C CYS C 209 1.834 -15.554 3.921 1.00 14.20 C ATOM 1858 O CYS C 209 2.545 -16.550 3.744 1.00 12.11 O ATOM 1859 CB CYS C 209 1.945 -15.030 6.387 1.00 42.52 C ATOM 1860 SG CYS C 209 1.042 -14.906 7.980 1.00 21.14 S ATOM 0 HA CYS C 209 0.312 -14.598 5.109 1.00 4.23 H new ATOM 0 HB2 CYS C 209 2.734 -15.776 6.481 1.00 42.52 H new ATOM 0 HB3 CYS C 209 2.431 -14.077 6.177 1.00 42.52 H new ATOM 1865 N PRO C 210 1.701 -14.592 2.998 1.00 72.33 N ATOM 1866 CA PRO C 210 2.334 -14.680 1.687 1.00 21.32 C ATOM 1867 C PRO C 210 3.855 -14.626 1.743 1.00 60.32 C ATOM 1868 O PRO C 210 4.535 -15.414 1.099 1.00 54.22 O ATOM 1869 CB PRO C 210 1.758 -13.490 0.919 1.00 41.14 C ATOM 1870 CG PRO C 210 1.275 -12.543 1.951 1.00 24.12 C ATOM 1871 CD PRO C 210 0.899 -13.365 3.149 1.00 32.44 C ATOM 0 HA PRO C 210 2.128 -15.639 1.212 1.00 21.32 H new ATOM 0 HB2 PRO C 210 2.516 -13.027 0.287 1.00 41.14 H new ATOM 0 HB3 PRO C 210 0.945 -13.803 0.264 1.00 41.14 H new ATOM 0 HG2 PRO C 210 2.050 -11.820 2.206 1.00 24.12 H new ATOM 0 HG3 PRO C 210 0.418 -11.977 1.586 1.00 24.12 H new ATOM 0 HD2 PRO C 210 1.132 -12.847 4.079 1.00 32.44 H new ATOM 0 HD3 PRO C 210 -0.169 -13.584 3.165 1.00 32.44 H new ATOM 1879 N CYS C 211 4.383 -13.706 2.497 1.00 52.33 N ATOM 1880 CA CYS C 211 5.799 -13.593 2.621 1.00 1.34 C ATOM 1881 C CYS C 211 6.239 -14.283 3.916 1.00 55.52 C ATOM 1882 O CYS C 211 5.403 -14.796 4.663 1.00 41.11 O ATOM 1883 CB CYS C 211 6.225 -12.122 2.579 1.00 63.50 C ATOM 1884 SG CYS C 211 8.013 -11.851 2.475 1.00 13.12 S ATOM 0 H CYS C 211 3.849 -13.023 3.035 1.00 52.33 H new ATOM 0 HA CYS C 211 6.290 -14.087 1.782 1.00 1.34 H new ATOM 0 HB2 CYS C 211 5.749 -11.645 1.722 1.00 63.50 H new ATOM 0 HB3 CYS C 211 5.848 -11.623 3.472 1.00 63.50 H new ATOM 1889 N ARG C 212 7.527 -14.316 4.171 1.00 0.21 N ATOM 1890 CA ARG C 212 8.039 -14.960 5.358 1.00 64.33 C ATOM 1891 C ARG C 212 8.619 -13.912 6.287 1.00 21.35 C ATOM 1892 O ARG C 212 8.119 -13.692 7.391 1.00 32.44 O ATOM 1893 CB ARG C 212 9.129 -15.977 4.995 1.00 33.31 C ATOM 1894 CG ARG C 212 8.715 -17.027 3.983 1.00 2.33 C ATOM 1895 CD ARG C 212 7.501 -17.831 4.431 1.00 32.10 C ATOM 1896 NE ARG C 212 7.158 -18.861 3.435 1.00 32.44 N ATOM 1897 CZ ARG C 212 5.931 -19.086 2.894 1.00 54.14 C ATOM 1898 NH1 ARG C 212 4.881 -18.323 3.229 1.00 71.14 N ATOM 1899 NH2 ARG C 212 5.783 -20.065 2.007 1.00 73.33 N ATOM 0 H ARG C 212 8.241 -13.903 3.570 1.00 0.21 H new ATOM 0 HA ARG C 212 7.221 -15.485 5.851 1.00 64.33 H new ATOM 0 HB2 ARG C 212 9.992 -15.438 4.604 1.00 33.31 H new ATOM 0 HB3 ARG C 212 9.453 -16.480 5.906 1.00 33.31 H new ATOM 0 HG2 ARG C 212 8.493 -16.542 3.032 1.00 2.33 H new ATOM 0 HG3 ARG C 212 9.550 -17.705 3.807 1.00 2.33 H new ATOM 0 HD2 ARG C 212 7.706 -18.302 5.392 1.00 32.10 H new ATOM 0 HD3 ARG C 212 6.652 -17.164 4.578 1.00 32.10 H new ATOM 0 HE ARG C 212 7.917 -19.466 3.120 1.00 32.44 H new ATOM 0 HH11 ARG C 212 4.997 -17.562 3.898 1.00 71.14 H new ATOM 0 HH12 ARG C 212 3.967 -18.504 2.815 1.00 71.14 H new ATOM 0 HH21 ARG C 212 6.584 -20.637 1.740 1.00 73.33 H new ATOM 0 HH22 ARG C 212 4.868 -20.245 1.593 1.00 73.33 H new ATOM 1913 N PHE C 213 9.669 -13.262 5.818 1.00 60.13 N ATOM 1914 CA PHE C 213 10.360 -12.242 6.572 1.00 74.25 C ATOM 1915 C PHE C 213 10.489 -11.013 5.694 1.00 72.11 C ATOM 1916 O PHE C 213 10.438 -11.129 4.469 1.00 42.01 O ATOM 1917 CB PHE C 213 11.735 -12.758 7.033 1.00 0.02 C ATOM 1918 CG PHE C 213 11.643 -13.992 7.903 1.00 44.31 C ATOM 1919 CD1 PHE C 213 11.528 -13.884 9.279 1.00 53.43 C ATOM 1920 CD2 PHE C 213 11.652 -15.257 7.334 1.00 12.11 C ATOM 1921 CE1 PHE C 213 11.423 -15.015 10.069 1.00 71.31 C ATOM 1922 CE2 PHE C 213 11.548 -16.388 8.115 1.00 24.12 C ATOM 1923 CZ PHE C 213 11.433 -16.269 9.486 1.00 30.15 C ATOM 0 H PHE C 213 10.066 -13.432 4.894 1.00 60.13 H new ATOM 0 HA PHE C 213 9.800 -11.984 7.470 1.00 74.25 H new ATOM 0 HB2 PHE C 213 12.345 -12.982 6.158 1.00 0.02 H new ATOM 0 HB3 PHE C 213 12.247 -11.969 7.584 1.00 0.02 H new ATOM 0 HD1 PHE C 213 11.520 -12.907 9.740 1.00 53.43 H new ATOM 0 HD2 PHE C 213 11.742 -15.357 6.262 1.00 12.11 H new ATOM 0 HE1 PHE C 213 11.333 -14.919 11.141 1.00 71.31 H new ATOM 0 HE2 PHE C 213 11.556 -17.365 7.656 1.00 24.12 H new ATOM 0 HZ PHE C 213 11.351 -17.153 10.101 1.00 30.15 H new ATOM 1933 N PHE C 214 10.655 -9.862 6.300 1.00 73.53 N ATOM 1934 CA PHE C 214 10.611 -8.599 5.573 1.00 71.05 C ATOM 1935 C PHE C 214 11.987 -7.983 5.407 1.00 12.21 C ATOM 1936 O PHE C 214 12.787 -8.024 6.318 1.00 75.31 O ATOM 1937 CB PHE C 214 9.770 -7.602 6.343 1.00 32.43 C ATOM 1938 CG PHE C 214 8.376 -8.033 6.668 1.00 40.32 C ATOM 1939 CD1 PHE C 214 7.372 -7.926 5.733 1.00 4.24 C ATOM 1940 CD2 PHE C 214 8.068 -8.523 7.926 1.00 73.50 C ATOM 1941 CE1 PHE C 214 6.090 -8.295 6.039 1.00 11.41 C ATOM 1942 CE2 PHE C 214 6.783 -8.898 8.239 1.00 0.51 C ATOM 1943 CZ PHE C 214 5.791 -8.783 7.295 1.00 52.23 C ATOM 0 H PHE C 214 10.823 -9.765 7.301 1.00 73.53 H new ATOM 0 HA PHE C 214 10.193 -8.816 4.590 1.00 71.05 H new ATOM 0 HB2 PHE C 214 10.283 -7.367 7.276 1.00 32.43 H new ATOM 0 HB3 PHE C 214 9.718 -6.678 5.766 1.00 32.43 H new ATOM 0 HD1 PHE C 214 7.598 -7.547 4.747 1.00 4.24 H new ATOM 0 HD2 PHE C 214 8.846 -8.612 8.670 1.00 73.50 H new ATOM 0 HE1 PHE C 214 5.311 -8.204 5.296 1.00 11.41 H new ATOM 0 HE2 PHE C 214 6.554 -9.281 9.222 1.00 0.51 H new ATOM 0 HZ PHE C 214 4.779 -9.074 7.535 1.00 52.23 H new ATOM 1953 N GLU C 215 12.226 -7.395 4.256 1.00 2.35 N ATOM 1954 CA GLU C 215 13.440 -6.656 3.967 1.00 75.30 C ATOM 1955 C GLU C 215 13.354 -5.269 4.599 1.00 32.12 C ATOM 1956 O GLU C 215 12.252 -4.743 4.818 1.00 51.52 O ATOM 1957 CB GLU C 215 13.680 -6.522 2.438 1.00 0.13 C ATOM 1958 CG GLU C 215 14.156 -7.791 1.705 1.00 14.35 C ATOM 1959 CD GLU C 215 13.208 -8.971 1.749 1.00 20.04 C ATOM 1960 OE1 GLU C 215 13.242 -9.703 2.719 1.00 60.11 O ATOM 1961 OE2 GLU C 215 12.472 -9.201 0.780 1.00 2.50 O ATOM 0 H GLU C 215 11.569 -7.416 3.476 1.00 2.35 H new ATOM 0 HA GLU C 215 14.280 -7.208 4.389 1.00 75.30 H new ATOM 0 HB2 GLU C 215 12.752 -6.188 1.975 1.00 0.13 H new ATOM 0 HB3 GLU C 215 14.418 -5.737 2.276 1.00 0.13 H new ATOM 0 HG2 GLU C 215 14.342 -7.537 0.661 1.00 14.35 H new ATOM 0 HG3 GLU C 215 15.110 -8.099 2.133 1.00 14.35 H new ATOM 1968 N SER C 216 14.485 -4.678 4.919 1.00 44.44 N ATOM 1969 CA SER C 216 14.458 -3.386 5.572 1.00 11.10 C ATOM 1970 C SER C 216 15.351 -2.338 4.874 1.00 3.10 C ATOM 1971 O SER C 216 14.916 -1.231 4.601 1.00 3.44 O ATOM 1972 CB SER C 216 14.832 -3.539 7.031 1.00 72.51 C ATOM 1973 OG SER C 216 14.033 -4.529 7.650 1.00 11.11 O ATOM 0 H SER C 216 15.414 -5.060 4.743 1.00 44.44 H new ATOM 0 HA SER C 216 13.439 -3.006 5.499 1.00 11.10 H new ATOM 0 HB2 SER C 216 15.885 -3.809 7.116 1.00 72.51 H new ATOM 0 HB3 SER C 216 14.705 -2.587 7.546 1.00 72.51 H new ATOM 0 HG SER C 216 14.290 -4.615 8.592 1.00 11.11 H new ATOM 1979 N HIS C 217 16.582 -2.675 4.578 1.00 32.54 N ATOM 1980 CA HIS C 217 17.451 -1.714 3.913 1.00 45.51 C ATOM 1981 C HIS C 217 17.253 -1.727 2.416 1.00 60.23 C ATOM 1982 O HIS C 217 18.057 -2.269 1.655 1.00 2.22 O ATOM 1983 CB HIS C 217 18.922 -1.833 4.307 1.00 41.11 C ATOM 1984 CG HIS C 217 19.246 -1.359 5.701 1.00 30.33 C ATOM 1985 ND1 HIS C 217 20.282 -0.499 5.973 1.00 62.12 N ATOM 1986 CD2 HIS C 217 18.689 -1.653 6.904 1.00 21.33 C ATOM 1987 CE1 HIS C 217 20.355 -0.285 7.270 1.00 62.41 C ATOM 1988 NE2 HIS C 217 19.400 -0.971 7.859 1.00 4.14 N ATOM 0 H HIS C 217 17.004 -3.582 4.777 1.00 32.54 H new ATOM 0 HA HIS C 217 17.142 -0.734 4.276 1.00 45.51 H new ATOM 0 HB2 HIS C 217 19.225 -2.876 4.214 1.00 41.11 H new ATOM 0 HB3 HIS C 217 19.521 -1.263 3.597 1.00 41.11 H new ATOM 0 HD2 HIS C 217 17.844 -2.303 7.077 1.00 21.33 H new ATOM 0 HE1 HIS C 217 21.077 0.347 7.766 1.00 62.41 H new ATOM 0 HE2 HIS C 217 19.218 -0.993 8.862 1.00 4.14 H new ATOM 1997 N VAL C 218 16.139 -1.199 2.031 1.00 20.31 N ATOM 1998 CA VAL C 218 15.722 -1.076 0.665 1.00 14.53 C ATOM 1999 C VAL C 218 15.457 0.392 0.444 1.00 43.21 C ATOM 2000 O VAL C 218 15.129 1.098 1.399 1.00 62.01 O ATOM 2001 CB VAL C 218 14.389 -1.874 0.431 1.00 32.04 C ATOM 2002 CG1 VAL C 218 13.913 -1.786 -1.016 1.00 22.04 C ATOM 2003 CG2 VAL C 218 14.538 -3.326 0.853 1.00 60.25 C ATOM 0 H VAL C 218 15.458 -0.822 2.690 1.00 20.31 H new ATOM 0 HA VAL C 218 16.479 -1.468 -0.014 1.00 14.53 H new ATOM 0 HB VAL C 218 13.628 -1.406 1.056 1.00 32.04 H new ATOM 0 HG11 VAL C 218 12.989 -2.352 -1.130 1.00 22.04 H new ATOM 0 HG12 VAL C 218 13.734 -0.743 -1.277 1.00 22.04 H new ATOM 0 HG13 VAL C 218 14.676 -2.200 -1.676 1.00 22.04 H new ATOM 0 HG21 VAL C 218 13.600 -3.853 0.680 1.00 60.25 H new ATOM 0 HG22 VAL C 218 15.331 -3.795 0.270 1.00 60.25 H new ATOM 0 HG23 VAL C 218 14.790 -3.373 1.912 1.00 60.25 H new ATOM 2013 N ALA C 219 15.620 0.868 -0.749 1.00 43.21 N ATOM 2014 CA ALA C 219 15.335 2.237 -1.023 1.00 22.04 C ATOM 2015 C ALA C 219 13.983 2.309 -1.658 1.00 23.21 C ATOM 2016 O ALA C 219 13.699 1.555 -2.584 1.00 61.34 O ATOM 2017 CB ALA C 219 16.387 2.829 -1.945 1.00 1.50 C ATOM 0 H ALA C 219 15.949 0.327 -1.549 1.00 43.21 H new ATOM 0 HA ALA C 219 15.348 2.813 -0.098 1.00 22.04 H new ATOM 0 HB1 ALA C 219 16.151 3.875 -2.142 1.00 1.50 H new ATOM 0 HB2 ALA C 219 17.366 2.761 -1.471 1.00 1.50 H new ATOM 0 HB3 ALA C 219 16.400 2.277 -2.885 1.00 1.50 H new ATOM 2023 N ARG C 220 13.135 3.201 -1.181 1.00 24.12 N ATOM 2024 CA ARG C 220 11.805 3.328 -1.750 1.00 41.33 C ATOM 2025 C ARG C 220 11.853 3.861 -3.173 1.00 22.21 C ATOM 2026 O ARG C 220 10.901 3.778 -3.903 1.00 73.14 O ATOM 2027 CB ARG C 220 10.807 4.083 -0.823 1.00 10.12 C ATOM 2028 CG ARG C 220 11.129 5.526 -0.428 1.00 24.21 C ATOM 2029 CD ARG C 220 10.973 6.489 -1.579 1.00 22.45 C ATOM 2030 NE ARG C 220 11.225 7.867 -1.177 1.00 1.32 N ATOM 2031 CZ ARG C 220 11.494 8.875 -2.012 1.00 73.51 C ATOM 2032 NH1 ARG C 220 11.556 8.663 -3.327 1.00 43.01 N ATOM 2033 NH2 ARG C 220 11.685 10.094 -1.529 1.00 22.43 N ATOM 0 H ARG C 220 13.338 3.840 -0.412 1.00 24.12 H new ATOM 0 HA ARG C 220 11.392 2.321 -1.819 1.00 41.33 H new ATOM 0 HB2 ARG C 220 9.833 4.082 -1.313 1.00 10.12 H new ATOM 0 HB3 ARG C 220 10.702 3.503 0.094 1.00 10.12 H new ATOM 0 HG2 ARG C 220 10.474 5.831 0.388 1.00 24.21 H new ATOM 0 HG3 ARG C 220 12.151 5.577 -0.052 1.00 24.21 H new ATOM 0 HD2 ARG C 220 11.661 6.213 -2.378 1.00 22.45 H new ATOM 0 HD3 ARG C 220 9.965 6.409 -1.985 1.00 22.45 H new ATOM 0 HE ARG C 220 11.194 8.079 -0.180 1.00 1.32 H new ATOM 0 HH11 ARG C 220 11.398 7.727 -3.701 1.00 43.01 H new ATOM 0 HH12 ARG C 220 11.762 9.437 -3.959 1.00 43.01 H new ATOM 0 HH21 ARG C 220 11.626 10.259 -0.524 1.00 22.43 H new ATOM 0 HH22 ARG C 220 11.891 10.867 -2.162 1.00 22.43 H new ATOM 2047 N ALA C 221 12.987 4.420 -3.536 1.00 65.11 N ATOM 2048 CA ALA C 221 13.219 4.893 -4.879 1.00 62.15 C ATOM 2049 C ALA C 221 13.604 3.726 -5.807 1.00 34.21 C ATOM 2050 O ALA C 221 13.659 3.882 -7.018 1.00 1.42 O ATOM 2051 CB ALA C 221 14.299 5.961 -4.881 1.00 52.01 C ATOM 0 H ALA C 221 13.775 4.559 -2.904 1.00 65.11 H new ATOM 0 HA ALA C 221 12.296 5.334 -5.256 1.00 62.15 H new ATOM 0 HB1 ALA C 221 14.464 6.309 -5.901 1.00 52.01 H new ATOM 0 HB2 ALA C 221 13.984 6.798 -4.258 1.00 52.01 H new ATOM 0 HB3 ALA C 221 15.225 5.543 -4.486 1.00 52.01 H new ATOM 2057 N ASN C 222 13.877 2.568 -5.220 1.00 64.52 N ATOM 2058 CA ASN C 222 14.290 1.387 -5.983 1.00 61.43 C ATOM 2059 C ASN C 222 13.126 0.410 -6.169 1.00 1.54 C ATOM 2060 O ASN C 222 13.231 -0.581 -6.886 1.00 64.33 O ATOM 2061 CB ASN C 222 15.512 0.710 -5.307 1.00 71.00 C ATOM 2062 CG ASN C 222 16.011 -0.539 -6.029 1.00 71.50 C ATOM 2063 OD1 ASN C 222 15.634 -1.660 -5.713 1.00 51.43 O ATOM 2064 ND2 ASN C 222 16.848 -0.354 -6.996 1.00 61.12 N ATOM 0 H ASN C 222 13.821 2.417 -4.213 1.00 64.52 H new ATOM 0 HA ASN C 222 14.594 1.707 -6.979 1.00 61.43 H new ATOM 0 HB2 ASN C 222 16.327 1.432 -5.247 1.00 71.00 H new ATOM 0 HB3 ASN C 222 15.246 0.444 -4.284 1.00 71.00 H new ATOM 0 HD21 ASN C 222 17.211 -1.153 -7.516 1.00 61.12 H new ATOM 0 HD22 ASN C 222 17.146 0.591 -7.239 1.00 61.12 H new ATOM 2071 N VAL C 223 12.012 0.701 -5.562 1.00 14.53 N ATOM 2072 CA VAL C 223 10.843 -0.142 -5.729 1.00 10.12 C ATOM 2073 C VAL C 223 9.885 0.493 -6.725 1.00 25.52 C ATOM 2074 O VAL C 223 9.867 1.696 -6.866 1.00 14.53 O ATOM 2075 CB VAL C 223 10.115 -0.436 -4.380 1.00 71.22 C ATOM 2076 CG1 VAL C 223 11.009 -1.238 -3.457 1.00 21.22 C ATOM 2077 CG2 VAL C 223 9.695 0.846 -3.692 1.00 33.15 C ATOM 0 H VAL C 223 11.879 1.506 -4.950 1.00 14.53 H new ATOM 0 HA VAL C 223 11.187 -1.102 -6.114 1.00 10.12 H new ATOM 0 HB VAL C 223 9.221 -1.016 -4.609 1.00 71.22 H new ATOM 0 HG11 VAL C 223 10.485 -1.433 -2.522 1.00 21.22 H new ATOM 0 HG12 VAL C 223 11.268 -2.184 -3.932 1.00 21.22 H new ATOM 0 HG13 VAL C 223 11.919 -0.674 -3.252 1.00 21.22 H new ATOM 0 HG21 VAL C 223 9.191 0.608 -2.755 1.00 33.15 H new ATOM 0 HG22 VAL C 223 10.576 1.454 -3.485 1.00 33.15 H new ATOM 0 HG23 VAL C 223 9.015 1.400 -4.339 1.00 33.15 H new ATOM 2087 N LYS C 224 9.143 -0.321 -7.459 1.00 0.02 N ATOM 2088 CA LYS C 224 8.140 0.209 -8.376 1.00 53.34 C ATOM 2089 C LYS C 224 6.950 0.745 -7.602 1.00 70.11 C ATOM 2090 O LYS C 224 6.369 1.779 -7.954 1.00 30.11 O ATOM 2091 CB LYS C 224 7.680 -0.841 -9.413 1.00 70.42 C ATOM 2092 CG LYS C 224 8.797 -1.282 -10.314 1.00 0.22 C ATOM 2093 CD LYS C 224 8.381 -2.214 -11.459 1.00 42.33 C ATOM 2094 CE LYS C 224 7.886 -3.578 -11.003 1.00 32.24 C ATOM 2095 NZ LYS C 224 7.567 -4.455 -12.170 1.00 52.13 N ATOM 0 H LYS C 224 9.212 -1.338 -7.441 1.00 0.02 H new ATOM 0 HA LYS C 224 8.606 1.024 -8.929 1.00 53.34 H new ATOM 0 HB2 LYS C 224 7.273 -1.708 -8.892 1.00 70.42 H new ATOM 0 HB3 LYS C 224 6.874 -0.423 -10.016 1.00 70.42 H new ATOM 0 HG2 LYS C 224 9.270 -0.397 -10.740 1.00 0.22 H new ATOM 0 HG3 LYS C 224 9.551 -1.787 -9.711 1.00 0.22 H new ATOM 0 HD2 LYS C 224 7.595 -1.730 -12.039 1.00 42.33 H new ATOM 0 HD3 LYS C 224 9.231 -2.353 -12.127 1.00 42.33 H new ATOM 0 HE2 LYS C 224 8.645 -4.055 -10.383 1.00 32.24 H new ATOM 0 HE3 LYS C 224 6.998 -3.457 -10.382 1.00 32.24 H new ATOM 0 HZ1 LYS C 224 7.232 -5.379 -11.829 1.00 52.13 H new ATOM 0 HZ2 LYS C 224 6.825 -4.009 -12.747 1.00 52.13 H new ATOM 0 HZ3 LYS C 224 8.421 -4.589 -12.748 1.00 52.13 H new ATOM 2109 N HIS C 225 6.598 0.038 -6.543 1.00 31.40 N ATOM 2110 CA HIS C 225 5.478 0.434 -5.691 1.00 22.55 C ATOM 2111 C HIS C 225 5.519 -0.303 -4.372 1.00 1.03 C ATOM 2112 O HIS C 225 6.370 -1.164 -4.164 1.00 13.15 O ATOM 2113 CB HIS C 225 4.116 0.169 -6.367 1.00 12.42 C ATOM 2114 CG HIS C 225 3.730 -1.286 -6.520 1.00 71.10 C ATOM 2115 ND1 HIS C 225 3.349 -2.214 -5.599 1.00 73.42 N flip ATOM 2116 CD2 HIS C 225 3.666 -1.917 -7.716 1.00 23.03 C flip ATOM 2117 CE1 HIS C 225 3.080 -3.358 -6.268 1.00 20.54 C flip ATOM 2118 NE2 HIS C 225 3.274 -3.150 -7.536 1.00 31.53 N flip ATOM 0 H HIS C 225 7.070 -0.817 -6.247 1.00 31.40 H new ATOM 0 HA HIS C 225 5.581 1.506 -5.520 1.00 22.55 H new ATOM 0 HB2 HIS C 225 3.341 0.672 -5.789 1.00 12.42 H new ATOM 0 HB3 HIS C 225 4.126 0.629 -7.355 1.00 12.42 H new ATOM 0 HD2 HIS C 225 3.902 -1.470 -8.671 1.00 23.03 H new ATOM 0 HE1 HIS C 225 2.758 -4.288 -5.823 1.00 20.54 H new ATOM 0 HE2 HIS C 225 3.141 -3.841 -8.275 1.00 31.53 H new ATOM 2127 N LEU C 226 4.544 -0.009 -3.537 1.00 1.11 N ATOM 2128 CA LEU C 226 4.398 -0.609 -2.243 1.00 4.22 C ATOM 2129 C LEU C 226 3.061 -1.373 -2.245 1.00 70.12 C ATOM 2130 O LEU C 226 2.104 -0.923 -2.857 1.00 72.43 O ATOM 2131 CB LEU C 226 4.328 0.513 -1.209 1.00 4.52 C ATOM 2132 CG LEU C 226 4.496 0.112 0.235 1.00 44.24 C ATOM 2133 CD1 LEU C 226 5.910 -0.389 0.452 1.00 73.45 C ATOM 2134 CD2 LEU C 226 4.184 1.283 1.153 1.00 4.21 C ATOM 0 H LEU C 226 3.816 0.673 -3.753 1.00 1.11 H new ATOM 0 HA LEU C 226 5.226 -1.279 -2.012 1.00 4.22 H new ATOM 0 HB2 LEU C 226 5.097 1.247 -1.450 1.00 4.52 H new ATOM 0 HB3 LEU C 226 3.365 1.013 -1.314 1.00 4.52 H new ATOM 0 HG LEU C 226 3.796 -0.689 0.474 1.00 44.24 H new ATOM 0 HD11 LEU C 226 6.037 -0.680 1.495 1.00 73.45 H new ATOM 0 HD12 LEU C 226 6.093 -1.250 -0.190 1.00 73.45 H new ATOM 0 HD13 LEU C 226 6.618 0.403 0.208 1.00 73.45 H new ATOM 0 HD21 LEU C 226 4.310 0.975 2.191 1.00 4.21 H new ATOM 0 HD22 LEU C 226 4.862 2.108 0.934 1.00 4.21 H new ATOM 0 HD23 LEU C 226 3.155 1.607 0.993 1.00 4.21 H new ATOM 2146 N LYS C 227 2.992 -2.520 -1.639 1.00 13.24 N ATOM 2147 CA LYS C 227 1.737 -3.238 -1.590 1.00 72.21 C ATOM 2148 C LYS C 227 1.500 -3.791 -0.189 1.00 44.33 C ATOM 2149 O LYS C 227 2.332 -4.507 0.344 1.00 50.22 O ATOM 2150 CB LYS C 227 1.707 -4.322 -2.687 1.00 55.34 C ATOM 2151 CG LYS C 227 0.419 -5.121 -2.760 1.00 72.01 C ATOM 2152 CD LYS C 227 0.360 -6.008 -4.006 1.00 21.01 C ATOM 2153 CE LYS C 227 1.513 -6.974 -4.086 1.00 12.52 C ATOM 2154 NZ LYS C 227 1.431 -7.852 -5.271 1.00 20.43 N ATOM 0 H LYS C 227 3.774 -2.981 -1.175 1.00 13.24 H new ATOM 0 HA LYS C 227 0.910 -2.559 -1.797 1.00 72.21 H new ATOM 0 HB2 LYS C 227 1.877 -3.846 -3.653 1.00 55.34 H new ATOM 0 HB3 LYS C 227 2.536 -5.010 -2.520 1.00 55.34 H new ATOM 0 HG2 LYS C 227 0.328 -5.742 -1.869 1.00 72.01 H new ATOM 0 HG3 LYS C 227 -0.431 -4.438 -2.761 1.00 72.01 H new ATOM 0 HD2 LYS C 227 -0.577 -6.566 -4.006 1.00 21.01 H new ATOM 0 HD3 LYS C 227 0.356 -5.378 -4.896 1.00 21.01 H new ATOM 0 HE2 LYS C 227 2.449 -6.416 -4.114 1.00 12.52 H new ATOM 0 HE3 LYS C 227 1.534 -7.586 -3.184 1.00 12.52 H new ATOM 0 HZ1 LYS C 227 2.246 -8.498 -5.281 1.00 20.43 H new ATOM 0 HZ2 LYS C 227 0.551 -8.405 -5.233 1.00 20.43 H new ATOM 0 HZ3 LYS C 227 1.438 -7.272 -6.134 1.00 20.43 H new ATOM 2168 N ILE C 228 0.364 -3.437 0.393 1.00 4.13 N ATOM 2169 CA ILE C 228 0.058 -3.769 1.774 1.00 71.03 C ATOM 2170 C ILE C 228 -1.092 -4.779 1.868 1.00 30.21 C ATOM 2171 O ILE C 228 -2.185 -4.568 1.288 1.00 45.31 O ATOM 2172 CB ILE C 228 -0.355 -2.498 2.571 1.00 61.14 C ATOM 2173 CG1 ILE C 228 0.711 -1.399 2.436 1.00 54.20 C ATOM 2174 CG2 ILE C 228 -0.591 -2.841 4.046 1.00 44.13 C ATOM 2175 CD1 ILE C 228 0.376 -0.118 3.177 1.00 21.44 C ATOM 0 H ILE C 228 -0.371 -2.911 -0.080 1.00 4.13 H new ATOM 0 HA ILE C 228 0.963 -4.204 2.198 1.00 71.03 H new ATOM 0 HB ILE C 228 -1.288 -2.121 2.151 1.00 61.14 H new ATOM 0 HG12 ILE C 228 1.662 -1.782 2.806 1.00 54.20 H new ATOM 0 HG13 ILE C 228 0.849 -1.170 1.379 1.00 54.20 H new ATOM 0 HG21 ILE C 228 -0.879 -1.940 4.588 1.00 44.13 H new ATOM 0 HG22 ILE C 228 -1.387 -3.582 4.125 1.00 44.13 H new ATOM 0 HG23 ILE C 228 0.325 -3.246 4.476 1.00 44.13 H new ATOM 0 HD11 ILE C 228 1.177 0.606 3.032 1.00 21.44 H new ATOM 0 HD12 ILE C 228 -0.558 0.292 2.792 1.00 21.44 H new ATOM 0 HD13 ILE C 228 0.267 -0.331 4.241 1.00 21.44 H new ATOM 2187 N LEU C 229 -0.840 -5.860 2.577 1.00 74.34 N ATOM 2188 CA LEU C 229 -1.839 -6.869 2.855 1.00 21.15 C ATOM 2189 C LEU C 229 -1.906 -7.104 4.373 1.00 4.04 C ATOM 2190 O LEU C 229 -0.959 -7.605 4.970 1.00 2.11 O ATOM 2191 CB LEU C 229 -1.542 -8.227 2.133 1.00 32.15 C ATOM 2192 CG LEU C 229 -1.513 -8.257 0.577 1.00 61.12 C ATOM 2193 CD1 LEU C 229 -0.312 -7.529 -0.004 1.00 64.25 C ATOM 2194 CD2 LEU C 229 -1.569 -9.683 0.058 1.00 11.40 C ATOM 0 H LEU C 229 0.074 -6.064 2.980 1.00 74.34 H new ATOM 0 HA LEU C 229 -2.792 -6.502 2.474 1.00 21.15 H new ATOM 0 HB2 LEU C 229 -0.576 -8.586 2.488 1.00 32.15 H new ATOM 0 HB3 LEU C 229 -2.290 -8.947 2.463 1.00 32.15 H new ATOM 0 HG LEU C 229 -2.403 -7.723 0.243 1.00 61.12 H new ATOM 0 HD11 LEU C 229 -0.345 -7.583 -1.092 1.00 64.25 H new ATOM 0 HD12 LEU C 229 -0.333 -6.485 0.308 1.00 64.25 H new ATOM 0 HD13 LEU C 229 0.605 -7.996 0.355 1.00 64.25 H new ATOM 0 HD21 LEU C 229 -1.547 -9.675 -1.032 1.00 11.40 H new ATOM 0 HD22 LEU C 229 -0.711 -10.241 0.434 1.00 11.40 H new ATOM 0 HD23 LEU C 229 -2.489 -10.158 0.399 1.00 11.40 H new ATOM 2206 N ASN C 230 -2.984 -6.705 5.001 1.00 74.23 N ATOM 2207 CA ASN C 230 -3.135 -6.949 6.436 1.00 13.34 C ATOM 2208 C ASN C 230 -3.701 -8.345 6.646 1.00 61.11 C ATOM 2209 O ASN C 230 -4.850 -8.616 6.347 1.00 63.32 O ATOM 2210 CB ASN C 230 -4.002 -5.859 7.102 1.00 45.40 C ATOM 2211 CG ASN C 230 -4.229 -6.041 8.612 1.00 4.41 C ATOM 2212 OD1 ASN C 230 -5.262 -5.625 9.137 1.00 3.22 O ATOM 2213 ND2 ASN C 230 -3.287 -6.629 9.315 1.00 12.34 N ATOM 0 H ASN C 230 -3.764 -6.217 4.561 1.00 74.23 H new ATOM 0 HA ASN C 230 -2.159 -6.896 6.919 1.00 13.34 H new ATOM 0 HB2 ASN C 230 -3.532 -4.890 6.935 1.00 45.40 H new ATOM 0 HB3 ASN C 230 -4.972 -5.833 6.605 1.00 45.40 H new ATOM 0 HD21 ASN C 230 -3.402 -6.750 10.321 1.00 12.34 H new ATOM 0 HD22 ASN C 230 -2.441 -6.964 8.854 1.00 12.34 H new ATOM 2220 N THR C 231 -2.871 -9.214 7.116 1.00 14.53 N ATOM 2221 CA THR C 231 -3.213 -10.603 7.268 1.00 15.22 C ATOM 2222 C THR C 231 -3.453 -10.969 8.746 1.00 45.41 C ATOM 2223 O THR C 231 -3.146 -10.182 9.644 1.00 63.14 O ATOM 2224 CB THR C 231 -2.075 -11.484 6.668 1.00 62.52 C ATOM 2225 OG1 THR C 231 -0.810 -11.090 7.229 1.00 24.03 O ATOM 2226 CG2 THR C 231 -2.009 -11.353 5.142 1.00 23.13 C ATOM 0 H THR C 231 -1.922 -8.985 7.411 1.00 14.53 H new ATOM 0 HA THR C 231 -4.143 -10.790 6.731 1.00 15.22 H new ATOM 0 HB THR C 231 -2.291 -12.523 6.916 1.00 62.52 H new ATOM 0 HG1 THR C 231 -0.962 -10.582 8.053 1.00 24.03 H new ATOM 0 HG21 THR C 231 -1.205 -11.980 4.757 1.00 23.13 H new ATOM 0 HG22 THR C 231 -2.957 -11.672 4.708 1.00 23.13 H new ATOM 0 HG23 THR C 231 -1.818 -10.314 4.874 1.00 23.13 H new ATOM 2234 N PRO C 232 -4.093 -12.113 9.018 1.00 35.55 N ATOM 2235 CA PRO C 232 -4.149 -12.648 10.368 1.00 53.41 C ATOM 2236 C PRO C 232 -2.804 -13.343 10.689 1.00 44.23 C ATOM 2237 O PRO C 232 -2.118 -13.819 9.770 1.00 51.15 O ATOM 2238 CB PRO C 232 -5.285 -13.674 10.298 1.00 51.23 C ATOM 2239 CG PRO C 232 -5.327 -14.110 8.875 1.00 2.02 C ATOM 2240 CD PRO C 232 -4.847 -12.941 8.053 1.00 53.52 C ATOM 0 HA PRO C 232 -4.316 -11.895 11.138 1.00 53.41 H new ATOM 0 HB2 PRO C 232 -5.097 -14.517 10.963 1.00 51.23 H new ATOM 0 HB3 PRO C 232 -6.234 -13.233 10.603 1.00 51.23 H new ATOM 0 HG2 PRO C 232 -4.691 -14.981 8.718 1.00 2.02 H new ATOM 0 HG3 PRO C 232 -6.338 -14.397 8.587 1.00 2.02 H new ATOM 0 HD2 PRO C 232 -4.215 -13.266 7.227 1.00 53.52 H new ATOM 0 HD3 PRO C 232 -5.681 -12.389 7.619 1.00 53.52 H new ATOM 2248 N ASN C 233 -2.404 -13.355 11.962 1.00 44.40 N ATOM 2249 CA ASN C 233 -1.124 -13.983 12.432 1.00 73.31 C ATOM 2250 C ASN C 233 0.136 -13.202 12.037 1.00 1.31 C ATOM 2251 O ASN C 233 1.149 -13.244 12.741 1.00 32.44 O ATOM 2252 CB ASN C 233 -1.011 -15.475 12.059 1.00 3.13 C ATOM 2253 CG ASN C 233 -2.020 -16.333 12.804 1.00 53.01 C ATOM 2254 OD1 ASN C 233 -2.405 -16.027 13.939 1.00 54.21 O ATOM 2255 ND2 ASN C 233 -2.450 -17.397 12.191 1.00 15.21 N ATOM 0 H ASN C 233 -2.947 -12.933 12.715 1.00 44.40 H new ATOM 0 HA ASN C 233 -1.180 -13.929 13.519 1.00 73.31 H new ATOM 0 HB2 ASN C 233 -1.161 -15.591 10.986 1.00 3.13 H new ATOM 0 HB3 ASN C 233 -0.004 -15.827 12.281 1.00 3.13 H new ATOM 0 HD21 ASN C 233 -3.127 -18.010 12.646 1.00 15.21 H new ATOM 0 HD22 ASN C 233 -2.111 -17.619 11.255 1.00 15.21 H new ATOM 2262 N CYS C 234 0.071 -12.501 10.939 1.00 15.41 N ATOM 2263 CA CYS C 234 1.140 -11.637 10.488 1.00 43.02 C ATOM 2264 C CYS C 234 0.505 -10.278 10.305 1.00 2.22 C ATOM 2265 O CYS C 234 -0.562 -10.202 9.759 1.00 11.45 O ATOM 2266 CB CYS C 234 1.694 -12.152 9.149 1.00 21.04 C ATOM 2267 SG CYS C 234 2.305 -13.878 9.199 1.00 4.02 S ATOM 0 H CYS C 234 -0.738 -12.510 10.318 1.00 15.41 H new ATOM 0 HA CYS C 234 1.970 -11.603 11.194 1.00 43.02 H new ATOM 0 HB2 CYS C 234 0.912 -12.078 8.393 1.00 21.04 H new ATOM 0 HB3 CYS C 234 2.508 -11.500 8.831 1.00 21.04 H new ATOM 2272 N ALA C 235 1.149 -9.225 10.741 1.00 13.12 N ATOM 2273 CA ALA C 235 0.507 -7.912 10.800 1.00 22.22 C ATOM 2274 C ALA C 235 0.229 -7.240 9.444 1.00 3.22 C ATOM 2275 O ALA C 235 -0.738 -7.581 8.738 1.00 13.32 O ATOM 2276 CB ALA C 235 1.252 -6.988 11.725 1.00 63.10 C ATOM 0 H ALA C 235 2.117 -9.239 11.063 1.00 13.12 H new ATOM 0 HA ALA C 235 -0.485 -8.114 11.204 1.00 22.22 H new ATOM 0 HB1 ALA C 235 0.754 -6.019 11.750 1.00 63.10 H new ATOM 0 HB2 ALA C 235 1.269 -7.414 12.728 1.00 63.10 H new ATOM 0 HB3 ALA C 235 2.274 -6.861 11.367 1.00 63.10 H new ATOM 2282 N CYS C 236 1.057 -6.309 9.072 1.00 23.01 N ATOM 2283 CA CYS C 236 0.858 -5.600 7.850 1.00 62.12 C ATOM 2284 C CYS C 236 1.909 -6.010 6.883 1.00 21.24 C ATOM 2285 O CYS C 236 2.993 -5.495 6.872 1.00 23.34 O ATOM 2286 CB CYS C 236 0.810 -4.081 8.074 1.00 20.42 C ATOM 2287 SG CYS C 236 -0.541 -3.557 9.209 1.00 75.23 S ATOM 0 H CYS C 236 1.880 -6.024 9.603 1.00 23.01 H new ATOM 0 HA CYS C 236 -0.115 -5.858 7.431 1.00 62.12 H new ATOM 0 HB2 CYS C 236 1.766 -3.750 8.480 1.00 20.42 H new ATOM 0 HB3 CYS C 236 0.682 -3.583 7.113 1.00 20.42 H new ATOM 2292 N GLN C 237 1.578 -7.002 6.142 1.00 10.33 N ATOM 2293 CA GLN C 237 2.454 -7.614 5.203 1.00 71.34 C ATOM 2294 C GLN C 237 2.713 -6.632 4.071 1.00 54.54 C ATOM 2295 O GLN C 237 1.813 -6.334 3.280 1.00 45.10 O ATOM 2296 CB GLN C 237 1.776 -8.874 4.670 1.00 65.14 C ATOM 2297 CG GLN C 237 2.699 -9.910 4.088 1.00 71.21 C ATOM 2298 CD GLN C 237 3.625 -10.504 5.139 1.00 32.20 C ATOM 2299 OE1 GLN C 237 4.722 -10.918 4.839 1.00 64.21 O ATOM 2300 NE2 GLN C 237 3.180 -10.534 6.383 1.00 34.23 N ATOM 0 H GLN C 237 0.653 -7.430 6.171 1.00 10.33 H new ATOM 0 HA GLN C 237 3.404 -7.882 5.666 1.00 71.34 H new ATOM 0 HB2 GLN C 237 1.210 -9.332 5.481 1.00 65.14 H new ATOM 0 HB3 GLN C 237 1.057 -8.582 3.905 1.00 65.14 H new ATOM 0 HG2 GLN C 237 2.109 -10.706 3.633 1.00 71.21 H new ATOM 0 HG3 GLN C 237 3.294 -9.460 3.293 1.00 71.21 H new ATOM 0 HE21 GLN C 237 2.250 -10.176 6.601 1.00 34.23 H new ATOM 0 HE22 GLN C 237 3.767 -10.915 7.125 1.00 34.23 H new ATOM 2309 N ILE C 238 3.899 -6.102 4.029 1.00 70.51 N ATOM 2310 CA ILE C 238 4.248 -5.134 3.035 1.00 51.31 C ATOM 2311 C ILE C 238 5.112 -5.829 2.002 1.00 20.33 C ATOM 2312 O ILE C 238 6.110 -6.450 2.347 1.00 2.02 O ATOM 2313 CB ILE C 238 5.080 -3.977 3.643 1.00 62.00 C ATOM 2314 CG1 ILE C 238 4.429 -3.386 4.908 1.00 23.54 C ATOM 2315 CG2 ILE C 238 5.281 -2.889 2.616 1.00 34.43 C ATOM 2316 CD1 ILE C 238 3.098 -2.721 4.692 1.00 71.31 C ATOM 0 H ILE C 238 4.650 -6.328 4.682 1.00 70.51 H new ATOM 0 HA ILE C 238 3.334 -4.723 2.606 1.00 51.31 H new ATOM 0 HB ILE C 238 6.043 -4.394 3.936 1.00 62.00 H new ATOM 0 HG12 ILE C 238 4.304 -4.184 5.640 1.00 23.54 H new ATOM 0 HG13 ILE C 238 5.114 -2.659 5.344 1.00 23.54 H new ATOM 0 HG21 ILE C 238 5.867 -2.080 3.053 1.00 34.43 H new ATOM 0 HG22 ILE C 238 5.810 -3.296 1.754 1.00 34.43 H new ATOM 0 HG23 ILE C 238 4.312 -2.505 2.299 1.00 34.43 H new ATOM 0 HD11 ILE C 238 2.724 -2.338 5.642 1.00 71.31 H new ATOM 0 HD12 ILE C 238 3.213 -1.896 3.989 1.00 71.31 H new ATOM 0 HD13 ILE C 238 2.390 -3.446 4.289 1.00 71.31 H new ATOM 2328 N VAL C 239 4.725 -5.751 0.767 1.00 52.32 N ATOM 2329 CA VAL C 239 5.469 -6.369 -0.303 1.00 14.31 C ATOM 2330 C VAL C 239 5.757 -5.322 -1.373 1.00 52.25 C ATOM 2331 O VAL C 239 4.874 -4.543 -1.731 1.00 20.51 O ATOM 2332 CB VAL C 239 4.679 -7.545 -0.935 1.00 41.21 C ATOM 2333 CG1 VAL C 239 5.510 -8.235 -1.995 1.00 14.42 C ATOM 2334 CG2 VAL C 239 4.220 -8.541 0.126 1.00 35.00 C ATOM 0 H VAL C 239 3.885 -5.258 0.465 1.00 52.32 H new ATOM 0 HA VAL C 239 6.398 -6.766 0.105 1.00 14.31 H new ATOM 0 HB VAL C 239 3.788 -7.133 -1.408 1.00 41.21 H new ATOM 0 HG11 VAL C 239 4.939 -9.057 -2.427 1.00 14.42 H new ATOM 0 HG12 VAL C 239 5.767 -7.521 -2.778 1.00 14.42 H new ATOM 0 HG13 VAL C 239 6.423 -8.624 -1.545 1.00 14.42 H new ATOM 0 HG21 VAL C 239 3.670 -9.352 -0.350 1.00 35.00 H new ATOM 0 HG22 VAL C 239 5.089 -8.947 0.644 1.00 35.00 H new ATOM 0 HG23 VAL C 239 3.573 -8.036 0.843 1.00 35.00 H new ATOM 2344 N ALA C 240 6.966 -5.292 -1.879 1.00 60.33 N ATOM 2345 CA ALA C 240 7.336 -4.320 -2.874 1.00 73.14 C ATOM 2346 C ALA C 240 8.163 -4.951 -3.981 1.00 75.20 C ATOM 2347 O ALA C 240 9.085 -5.722 -3.733 1.00 0.41 O ATOM 2348 CB ALA C 240 8.095 -3.175 -2.233 1.00 3.24 C ATOM 0 H ALA C 240 7.713 -5.934 -1.615 1.00 60.33 H new ATOM 0 HA ALA C 240 6.421 -3.931 -3.321 1.00 73.14 H new ATOM 0 HB1 ALA C 240 8.369 -2.447 -2.997 1.00 3.24 H new ATOM 0 HB2 ALA C 240 7.465 -2.695 -1.484 1.00 3.24 H new ATOM 0 HB3 ALA C 240 8.998 -3.558 -1.757 1.00 3.24 H new ATOM 2354 N ARG C 241 7.831 -4.636 -5.204 1.00 51.30 N ATOM 2355 CA ARG C 241 8.600 -5.143 -6.306 1.00 71.22 C ATOM 2356 C ARG C 241 9.592 -4.116 -6.762 1.00 4.31 C ATOM 2357 O ARG C 241 9.207 -3.006 -7.130 1.00 32.43 O ATOM 2358 CB ARG C 241 7.737 -5.619 -7.486 1.00 24.43 C ATOM 2359 CG ARG C 241 6.883 -6.826 -7.177 1.00 44.13 C ATOM 2360 CD ARG C 241 6.422 -7.498 -8.456 1.00 12.13 C ATOM 2361 NE ARG C 241 5.836 -8.824 -8.205 1.00 41.22 N ATOM 2362 CZ ARG C 241 5.485 -9.694 -9.164 1.00 71.42 C ATOM 2363 NH1 ARG C 241 5.618 -9.360 -10.433 1.00 30.41 N ATOM 2364 NH2 ARG C 241 5.012 -10.892 -8.839 1.00 51.52 N ATOM 0 H ARG C 241 7.044 -4.039 -5.460 1.00 51.30 H new ATOM 0 HA ARG C 241 9.126 -6.024 -5.938 1.00 71.22 H new ATOM 0 HB2 ARG C 241 7.090 -4.801 -7.803 1.00 24.43 H new ATOM 0 HB3 ARG C 241 8.389 -5.854 -8.328 1.00 24.43 H new ATOM 0 HG2 ARG C 241 7.450 -7.534 -6.572 1.00 44.13 H new ATOM 0 HG3 ARG C 241 6.018 -6.524 -6.587 1.00 44.13 H new ATOM 0 HD2 ARG C 241 5.686 -6.865 -8.952 1.00 12.13 H new ATOM 0 HD3 ARG C 241 7.267 -7.599 -9.137 1.00 12.13 H new ATOM 0 HE ARG C 241 5.686 -9.101 -7.235 1.00 41.22 H new ATOM 0 HH11 ARG C 241 5.987 -8.442 -10.683 1.00 30.41 H new ATOM 0 HH12 ARG C 241 5.352 -10.019 -11.164 1.00 30.41 H new ATOM 0 HH21 ARG C 241 4.915 -11.153 -7.858 1.00 51.52 H new ATOM 0 HH22 ARG C 241 4.746 -11.551 -9.571 1.00 51.52 H new ATOM 2378 N LEU C 242 10.866 -4.485 -6.715 1.00 52.33 N ATOM 2379 CA LEU C 242 11.961 -3.614 -7.135 1.00 2.54 C ATOM 2380 C LEU C 242 11.784 -3.207 -8.589 1.00 50.52 C ATOM 2381 O LEU C 242 11.263 -3.988 -9.395 1.00 30.30 O ATOM 2382 CB LEU C 242 13.310 -4.352 -7.004 1.00 13.02 C ATOM 2383 CG LEU C 242 13.698 -4.876 -5.621 1.00 2.54 C ATOM 2384 CD1 LEU C 242 15.087 -5.469 -5.671 1.00 34.14 C ATOM 2385 CD2 LEU C 242 13.619 -3.784 -4.571 1.00 31.25 C ATOM 0 H LEU C 242 11.172 -5.400 -6.384 1.00 52.33 H new ATOM 0 HA LEU C 242 11.952 -2.731 -6.496 1.00 2.54 H new ATOM 0 HB2 LEU C 242 13.299 -5.197 -7.693 1.00 13.02 H new ATOM 0 HB3 LEU C 242 14.097 -3.677 -7.340 1.00 13.02 H new ATOM 0 HG LEU C 242 12.988 -5.652 -5.337 1.00 2.54 H new ATOM 0 HD11 LEU C 242 15.359 -5.841 -4.683 1.00 34.14 H new ATOM 0 HD12 LEU C 242 15.106 -6.291 -6.387 1.00 34.14 H new ATOM 0 HD13 LEU C 242 15.799 -4.703 -5.979 1.00 34.14 H new ATOM 0 HD21 LEU C 242 13.901 -4.192 -3.600 1.00 31.25 H new ATOM 0 HD22 LEU C 242 14.299 -2.974 -4.836 1.00 31.25 H new ATOM 0 HD23 LEU C 242 12.600 -3.400 -4.521 1.00 31.25 H new ATOM 2397 N LYS C 243 12.219 -2.009 -8.938 1.00 52.13 N ATOM 2398 CA LYS C 243 12.166 -1.581 -10.319 1.00 70.34 C ATOM 2399 C LYS C 243 13.359 -2.116 -11.086 1.00 72.15 C ATOM 2400 O LYS C 243 13.481 -1.956 -12.312 1.00 33.04 O ATOM 2401 CB LYS C 243 11.961 -0.077 -10.444 1.00 70.43 C ATOM 2402 CG LYS C 243 12.886 0.751 -9.630 1.00 53.11 C ATOM 2403 CD LYS C 243 12.532 2.212 -9.720 1.00 61.52 C ATOM 2404 CE LYS C 243 12.645 2.752 -11.149 1.00 71.41 C ATOM 2405 NZ LYS C 243 12.220 4.168 -11.257 1.00 4.32 N ATOM 0 H LYS C 243 12.608 -1.324 -8.290 1.00 52.13 H new ATOM 0 HA LYS C 243 11.283 -2.015 -10.789 1.00 70.34 H new ATOM 0 HB2 LYS C 243 12.072 0.204 -11.491 1.00 70.43 H new ATOM 0 HB3 LYS C 243 10.937 0.160 -10.157 1.00 70.43 H new ATOM 0 HG2 LYS C 243 12.847 0.428 -8.590 1.00 53.11 H new ATOM 0 HG3 LYS C 243 13.910 0.600 -9.972 1.00 53.11 H new ATOM 0 HD2 LYS C 243 11.515 2.360 -9.358 1.00 61.52 H new ATOM 0 HD3 LYS C 243 13.190 2.784 -9.065 1.00 61.52 H new ATOM 0 HE2 LYS C 243 13.677 2.659 -11.488 1.00 71.41 H new ATOM 0 HE3 LYS C 243 12.034 2.141 -11.814 1.00 71.41 H new ATOM 0 HZ1 LYS C 243 12.316 4.485 -12.243 1.00 4.32 H new ATOM 0 HZ2 LYS C 243 11.227 4.256 -10.960 1.00 4.32 H new ATOM 0 HZ3 LYS C 243 12.819 4.758 -10.644 1.00 4.32 H new ATOM 2461 N ARG C 247 14.307 -9.291 -8.648 1.00 61.15 N ATOM 2462 CA ARG C 247 13.711 -9.970 -7.518 1.00 1.53 C ATOM 2463 C ARG C 247 12.820 -9.077 -6.721 1.00 40.23 C ATOM 2464 O ARG C 247 12.946 -7.854 -6.765 1.00 75.12 O ATOM 2465 CB ARG C 247 14.694 -10.840 -6.659 1.00 32.51 C ATOM 2466 CG ARG C 247 15.931 -10.164 -6.063 1.00 4.01 C ATOM 2467 CD ARG C 247 15.635 -9.158 -4.953 1.00 72.10 C ATOM 2468 NE ARG C 247 14.926 -9.751 -3.792 1.00 65.51 N ATOM 2469 CZ ARG C 247 15.349 -9.692 -2.509 1.00 53.04 C ATOM 2470 NH1 ARG C 247 16.609 -9.342 -2.220 1.00 2.30 N ATOM 2471 NH2 ARG C 247 14.509 -10.029 -1.531 1.00 35.13 N ATOM 0 HA ARG C 247 13.061 -10.725 -7.960 1.00 1.53 H new ATOM 0 HB2 ARG C 247 14.123 -11.272 -5.837 1.00 32.51 H new ATOM 0 HB3 ARG C 247 15.035 -11.668 -7.281 1.00 32.51 H new ATOM 0 HG2 ARG C 247 16.595 -10.934 -5.670 1.00 4.01 H new ATOM 0 HG3 ARG C 247 16.471 -9.655 -6.862 1.00 4.01 H new ATOM 0 HD2 ARG C 247 16.573 -8.720 -4.611 1.00 72.10 H new ATOM 0 HD3 ARG C 247 15.033 -8.346 -5.360 1.00 72.10 H new ATOM 0 HE ARG C 247 14.051 -10.242 -3.976 1.00 65.51 H new ATOM 0 HH11 ARG C 247 17.261 -9.116 -2.971 1.00 2.30 H new ATOM 0 HH12 ARG C 247 16.917 -9.301 -1.248 1.00 2.30 H new ATOM 0 HH21 ARG C 247 13.559 -10.327 -1.754 1.00 35.13 H new ATOM 0 HH22 ARG C 247 14.816 -9.989 -0.559 1.00 35.13 H new ATOM 2485 N GLN C 248 11.924 -9.683 -6.017 1.00 63.44 N ATOM 2486 CA GLN C 248 10.917 -8.982 -5.262 1.00 14.41 C ATOM 2487 C GLN C 248 11.318 -8.968 -3.814 1.00 25.13 C ATOM 2488 O GLN C 248 12.044 -9.872 -3.361 1.00 2.22 O ATOM 2489 CB GLN C 248 9.530 -9.661 -5.415 1.00 71.51 C ATOM 2490 CG GLN C 248 8.996 -9.785 -6.860 1.00 13.14 C ATOM 2491 CD GLN C 248 9.790 -10.753 -7.735 1.00 42.31 C ATOM 2492 OE1 GLN C 248 10.353 -11.733 -7.247 1.00 20.23 O ATOM 2493 NE2 GLN C 248 9.863 -10.472 -9.014 1.00 34.12 N ATOM 0 H GLN C 248 11.862 -10.698 -5.943 1.00 63.44 H new ATOM 0 HA GLN C 248 10.837 -7.963 -5.642 1.00 14.41 H new ATOM 0 HB2 GLN C 248 9.586 -10.660 -4.982 1.00 71.51 H new ATOM 0 HB3 GLN C 248 8.805 -9.099 -4.827 1.00 71.51 H new ATOM 0 HG2 GLN C 248 7.957 -10.112 -6.825 1.00 13.14 H new ATOM 0 HG3 GLN C 248 9.005 -8.799 -7.326 1.00 13.14 H new ATOM 0 HE21 GLN C 248 9.384 -9.651 -9.384 1.00 34.12 H new ATOM 0 HE22 GLN C 248 10.399 -11.074 -9.639 1.00 34.12 H new ATOM 2502 N VAL C 249 10.886 -7.970 -3.087 1.00 30.35 N ATOM 2503 CA VAL C 249 11.229 -7.878 -1.697 1.00 65.54 C ATOM 2504 C VAL C 249 9.989 -7.639 -0.867 1.00 31.33 C ATOM 2505 O VAL C 249 8.969 -7.147 -1.364 1.00 62.23 O ATOM 2506 CB VAL C 249 12.283 -6.750 -1.386 1.00 23.11 C ATOM 2507 CG1 VAL C 249 13.521 -6.880 -2.229 1.00 23.34 C ATOM 2508 CG2 VAL C 249 11.720 -5.354 -1.505 1.00 44.44 C ATOM 0 H VAL C 249 10.298 -7.213 -3.436 1.00 30.35 H new ATOM 0 HA VAL C 249 11.688 -8.831 -1.436 1.00 65.54 H new ATOM 0 HB VAL C 249 12.556 -6.902 -0.342 1.00 23.11 H new ATOM 0 HG11 VAL C 249 14.218 -6.080 -1.978 1.00 23.34 H new ATOM 0 HG12 VAL C 249 13.992 -7.844 -2.038 1.00 23.34 H new ATOM 0 HG13 VAL C 249 13.252 -6.810 -3.283 1.00 23.34 H new ATOM 0 HG21 VAL C 249 12.499 -4.627 -1.278 1.00 44.44 H new ATOM 0 HG22 VAL C 249 11.359 -5.193 -2.521 1.00 44.44 H new ATOM 0 HG23 VAL C 249 10.895 -5.233 -0.803 1.00 44.44 H new ATOM 2518 N CYS C 250 10.057 -8.002 0.345 1.00 73.25 N ATOM 2519 CA CYS C 250 9.012 -7.706 1.264 1.00 1.53 C ATOM 2520 C CYS C 250 9.527 -6.584 2.101 1.00 51.41 C ATOM 2521 O CYS C 250 10.700 -6.495 2.308 1.00 1.23 O ATOM 2522 CB CYS C 250 8.678 -8.931 2.111 1.00 60.30 C ATOM 2523 SG CYS C 250 8.145 -10.353 1.129 1.00 5.33 S ATOM 0 H CYS C 250 10.841 -8.518 0.745 1.00 73.25 H new ATOM 0 HA CYS C 250 8.087 -7.428 0.759 1.00 1.53 H new ATOM 0 HB2 CYS C 250 9.554 -9.210 2.696 1.00 60.30 H new ATOM 0 HB3 CYS C 250 7.891 -8.671 2.819 1.00 60.30 H new ATOM 2528 N ILE C 251 8.699 -5.720 2.542 1.00 13.40 N ATOM 2529 CA ILE C 251 9.173 -4.584 3.277 1.00 23.53 C ATOM 2530 C ILE C 251 8.660 -4.648 4.682 1.00 25.23 C ATOM 2531 O ILE C 251 7.517 -5.017 4.905 1.00 31.32 O ATOM 2532 CB ILE C 251 8.741 -3.252 2.612 1.00 50.24 C ATOM 2533 CG1 ILE C 251 9.239 -3.169 1.170 1.00 32.12 C ATOM 2534 CG2 ILE C 251 9.264 -2.070 3.394 1.00 34.53 C ATOM 2535 CD1 ILE C 251 10.748 -3.189 1.032 1.00 71.25 C ATOM 0 H ILE C 251 7.688 -5.764 2.415 1.00 13.40 H new ATOM 0 HA ILE C 251 10.263 -4.612 3.281 1.00 23.53 H new ATOM 0 HB ILE C 251 7.651 -3.226 2.609 1.00 50.24 H new ATOM 0 HG12 ILE C 251 8.823 -4.003 0.605 1.00 32.12 H new ATOM 0 HG13 ILE C 251 8.856 -2.254 0.717 1.00 32.12 H new ATOM 0 HG21 ILE C 251 8.949 -1.145 2.910 1.00 34.53 H new ATOM 0 HG22 ILE C 251 8.868 -2.101 4.409 1.00 34.53 H new ATOM 0 HG23 ILE C 251 10.353 -2.109 3.428 1.00 34.53 H new ATOM 0 HD11 ILE C 251 11.018 -3.127 -0.022 1.00 71.25 H new ATOM 0 HD12 ILE C 251 11.174 -2.340 1.566 1.00 71.25 H new ATOM 0 HD13 ILE C 251 11.140 -4.115 1.452 1.00 71.25 H new ATOM 2547 N ASP C 252 9.504 -4.326 5.625 1.00 32.32 N ATOM 2548 CA ASP C 252 9.115 -4.363 7.013 1.00 14.54 C ATOM 2549 C ASP C 252 8.136 -3.218 7.297 1.00 53.51 C ATOM 2550 O ASP C 252 8.427 -2.061 6.988 1.00 72.33 O ATOM 2551 CB ASP C 252 10.347 -4.253 7.909 1.00 33.31 C ATOM 2552 CG ASP C 252 10.033 -4.562 9.347 1.00 41.51 C ATOM 2553 OD1 ASP C 252 9.486 -3.712 10.028 1.00 23.31 O ATOM 2554 OD2 ASP C 252 10.348 -5.694 9.807 1.00 73.32 O ATOM 0 H ASP C 252 10.467 -4.034 5.459 1.00 32.32 H new ATOM 0 HA ASP C 252 8.623 -5.312 7.227 1.00 14.54 H new ATOM 0 HB2 ASP C 252 11.116 -4.938 7.552 1.00 33.31 H new ATOM 0 HB3 ASP C 252 10.758 -3.246 7.837 1.00 33.31 H new ATOM 2559 N PRO C 253 6.943 -3.520 7.865 1.00 25.20 N ATOM 2560 CA PRO C 253 5.928 -2.495 8.152 1.00 10.15 C ATOM 2561 C PRO C 253 6.374 -1.459 9.204 1.00 12.23 C ATOM 2562 O PRO C 253 5.705 -0.450 9.416 1.00 30.14 O ATOM 2563 CB PRO C 253 4.701 -3.277 8.654 1.00 62.12 C ATOM 2564 CG PRO C 253 5.118 -4.715 8.817 1.00 30.40 C ATOM 2565 CD PRO C 253 6.500 -4.880 8.231 1.00 71.21 C ATOM 0 HA PRO C 253 5.727 -1.907 7.256 1.00 10.15 H new ATOM 0 HB2 PRO C 253 4.348 -2.870 9.602 1.00 62.12 H new ATOM 0 HB3 PRO C 253 3.877 -3.194 7.945 1.00 62.12 H new ATOM 0 HG2 PRO C 253 5.117 -4.993 9.871 1.00 30.40 H new ATOM 0 HG3 PRO C 253 4.411 -5.374 8.313 1.00 30.40 H new ATOM 0 HD2 PRO C 253 7.180 -5.332 8.953 1.00 71.21 H new ATOM 0 HD3 PRO C 253 6.480 -5.533 7.359 1.00 71.21 H new ATOM 2573 N LYS C 254 7.494 -1.713 9.836 1.00 24.44 N ATOM 2574 CA LYS C 254 8.021 -0.848 10.873 1.00 20.15 C ATOM 2575 C LYS C 254 9.232 -0.059 10.347 1.00 15.23 C ATOM 2576 O LYS C 254 9.949 0.605 11.110 1.00 62.10 O ATOM 2577 CB LYS C 254 8.465 -1.718 12.026 1.00 11.45 C ATOM 2578 CG LYS C 254 7.370 -2.604 12.608 1.00 53.04 C ATOM 2579 CD LYS C 254 7.930 -3.588 13.630 1.00 40.14 C ATOM 2580 CE LYS C 254 8.949 -4.538 12.988 1.00 62.23 C ATOM 2581 NZ LYS C 254 9.490 -5.519 13.947 1.00 73.34 N ATOM 0 H LYS C 254 8.073 -2.531 9.646 1.00 24.44 H new ATOM 0 HA LYS C 254 7.253 -0.142 11.188 1.00 20.15 H new ATOM 0 HB2 LYS C 254 9.287 -2.351 11.692 1.00 11.45 H new ATOM 0 HB3 LYS C 254 8.856 -1.079 12.817 1.00 11.45 H new ATOM 0 HG2 LYS C 254 6.610 -1.982 13.080 1.00 53.04 H new ATOM 0 HG3 LYS C 254 6.879 -3.153 11.804 1.00 53.04 H new ATOM 0 HD2 LYS C 254 8.403 -3.040 14.444 1.00 40.14 H new ATOM 0 HD3 LYS C 254 7.115 -4.166 14.066 1.00 40.14 H new ATOM 0 HE2 LYS C 254 8.476 -5.067 12.160 1.00 62.23 H new ATOM 0 HE3 LYS C 254 9.769 -3.956 12.568 1.00 62.23 H new ATOM 0 HZ1 LYS C 254 10.173 -6.137 13.464 1.00 73.34 H new ATOM 0 HZ2 LYS C 254 9.966 -5.018 14.725 1.00 73.34 H new ATOM 0 HZ3 LYS C 254 8.713 -6.095 14.330 1.00 73.34 H new ATOM 2595 N LEU C 255 9.460 -0.145 9.057 1.00 43.03 N ATOM 2596 CA LEU C 255 10.571 0.514 8.421 1.00 34.42 C ATOM 2597 C LEU C 255 10.348 2.036 8.419 1.00 65.43 C ATOM 2598 O LEU C 255 9.227 2.507 8.206 1.00 13.30 O ATOM 2599 CB LEU C 255 10.681 0.002 7.000 1.00 74.24 C ATOM 2600 CG LEU C 255 12.071 -0.276 6.466 1.00 41.25 C ATOM 2601 CD1 LEU C 255 11.974 -0.811 5.070 1.00 55.12 C ATOM 2602 CD2 LEU C 255 12.973 0.941 6.514 1.00 24.04 C ATOM 0 H LEU C 255 8.873 -0.679 8.416 1.00 43.03 H new ATOM 0 HA LEU C 255 11.492 0.303 8.964 1.00 34.42 H new ATOM 0 HB2 LEU C 255 10.102 -0.919 6.928 1.00 74.24 H new ATOM 0 HB3 LEU C 255 10.206 0.730 6.342 1.00 74.24 H new ATOM 0 HG LEU C 255 12.530 -1.022 7.115 1.00 41.25 H new ATOM 0 HD11 LEU C 255 12.975 -1.011 4.687 1.00 55.12 H new ATOM 0 HD12 LEU C 255 11.396 -1.735 5.074 1.00 55.12 H new ATOM 0 HD13 LEU C 255 11.481 -0.077 4.433 1.00 55.12 H new ATOM 0 HD21 LEU C 255 13.955 0.682 6.119 1.00 24.04 H new ATOM 0 HD22 LEU C 255 12.539 1.739 5.912 1.00 24.04 H new ATOM 0 HD23 LEU C 255 13.074 1.278 7.546 1.00 24.04 H new ATOM 2614 N LYS C 256 11.421 2.785 8.647 1.00 50.42 N ATOM 2615 CA LYS C 256 11.385 4.241 8.738 1.00 71.44 C ATOM 2616 C LYS C 256 10.757 4.916 7.509 1.00 63.30 C ATOM 2617 O LYS C 256 9.896 5.783 7.660 1.00 23.33 O ATOM 2618 CB LYS C 256 12.768 4.794 9.024 1.00 4.12 C ATOM 2619 CG LYS C 256 12.763 6.284 9.281 1.00 42.41 C ATOM 2620 CD LYS C 256 14.107 6.780 9.742 1.00 72.20 C ATOM 2621 CE LYS C 256 15.192 6.572 8.694 1.00 52.04 C ATOM 2622 NZ LYS C 256 16.509 7.035 9.172 1.00 0.12 N ATOM 0 H LYS C 256 12.354 2.393 8.776 1.00 50.42 H new ATOM 0 HA LYS C 256 10.729 4.482 9.575 1.00 71.44 H new ATOM 0 HB2 LYS C 256 13.187 4.282 9.890 1.00 4.12 H new ATOM 0 HB3 LYS C 256 13.422 4.578 8.179 1.00 4.12 H new ATOM 0 HG2 LYS C 256 12.476 6.808 8.370 1.00 42.41 H new ATOM 0 HG3 LYS C 256 12.011 6.520 10.034 1.00 42.41 H new ATOM 0 HD2 LYS C 256 14.037 7.841 9.983 1.00 72.20 H new ATOM 0 HD3 LYS C 256 14.387 6.262 10.659 1.00 72.20 H new ATOM 0 HE2 LYS C 256 15.250 5.515 8.435 1.00 52.04 H new ATOM 0 HE3 LYS C 256 14.926 7.109 7.783 1.00 52.04 H new ATOM 0 HZ1 LYS C 256 17.222 6.877 8.432 1.00 0.12 H new ATOM 0 HZ2 LYS C 256 16.460 8.050 9.395 1.00 0.12 H new ATOM 0 HZ3 LYS C 256 16.774 6.505 10.027 1.00 0.12 H new ATOM 2636 N TRP C 257 11.161 4.529 6.293 1.00 45.32 N ATOM 2637 CA TRP C 257 10.540 5.140 5.121 1.00 73.11 C ATOM 2638 C TRP C 257 9.090 4.742 4.967 1.00 75.13 C ATOM 2639 O TRP C 257 8.318 5.485 4.410 1.00 54.02 O ATOM 2640 CB TRP C 257 11.338 5.034 3.806 1.00 54.43 C ATOM 2641 CG TRP C 257 11.741 3.668 3.364 1.00 11.30 C ATOM 2642 CD1 TRP C 257 12.926 3.061 3.611 1.00 41.15 C ATOM 2643 CD2 TRP C 257 10.979 2.753 2.563 1.00 11.24 C ATOM 2644 NE1 TRP C 257 12.957 1.835 3.020 1.00 0.53 N ATOM 2645 CE2 TRP C 257 11.779 1.619 2.367 1.00 23.51 C ATOM 2646 CE3 TRP C 257 9.703 2.784 1.991 1.00 42.51 C ATOM 2647 CZ2 TRP C 257 11.353 0.524 1.628 1.00 41.11 C ATOM 2648 CZ3 TRP C 257 9.283 1.689 1.253 1.00 4.55 C ATOM 2649 CH2 TRP C 257 10.112 0.576 1.079 1.00 43.44 C ATOM 0 H TRP C 257 11.879 3.830 6.102 1.00 45.32 H new ATOM 0 HA TRP C 257 10.563 6.208 5.338 1.00 73.11 H new ATOM 0 HB2 TRP C 257 10.743 5.485 3.012 1.00 54.43 H new ATOM 0 HB3 TRP C 257 12.241 5.636 3.909 1.00 54.43 H new ATOM 0 HD1 TRP C 257 13.730 3.488 4.193 1.00 41.15 H new ATOM 0 HE1 TRP C 257 13.738 1.181 3.059 1.00 0.53 H new ATOM 0 HE3 TRP C 257 9.060 3.642 2.122 1.00 42.51 H new ATOM 0 HZ2 TRP C 257 11.987 -0.340 1.494 1.00 41.11 H new ATOM 0 HZ3 TRP C 257 8.300 1.695 0.805 1.00 4.55 H new ATOM 0 HH2 TRP C 257 9.757 -0.261 0.495 1.00 43.44 H new ATOM 2660 N ILE C 258 8.726 3.568 5.476 1.00 71.41 N ATOM 2661 CA ILE C 258 7.325 3.157 5.505 1.00 33.40 C ATOM 2662 C ILE C 258 6.550 4.114 6.379 1.00 52.41 C ATOM 2663 O ILE C 258 5.486 4.578 6.004 1.00 54.43 O ATOM 2664 CB ILE C 258 7.142 1.690 6.027 1.00 62.14 C ATOM 2665 CG1 ILE C 258 7.673 0.682 5.017 1.00 4.40 C ATOM 2666 CG2 ILE C 258 5.682 1.381 6.380 1.00 32.13 C ATOM 2667 CD1 ILE C 258 6.945 0.714 3.691 1.00 70.41 C ATOM 0 H ILE C 258 9.376 2.889 5.871 1.00 71.41 H new ATOM 0 HA ILE C 258 6.947 3.181 4.483 1.00 33.40 H new ATOM 0 HB ILE C 258 7.725 1.604 6.944 1.00 62.14 H new ATOM 0 HG12 ILE C 258 8.732 0.875 4.846 1.00 4.40 H new ATOM 0 HG13 ILE C 258 7.596 -0.319 5.440 1.00 4.40 H new ATOM 0 HG21 ILE C 258 5.603 0.354 6.737 1.00 32.13 H new ATOM 0 HG22 ILE C 258 5.344 2.063 7.160 1.00 32.13 H new ATOM 0 HG23 ILE C 258 5.059 1.506 5.494 1.00 32.13 H new ATOM 0 HD11 ILE C 258 7.376 -0.030 3.021 1.00 70.41 H new ATOM 0 HD12 ILE C 258 5.890 0.491 3.850 1.00 70.41 H new ATOM 0 HD13 ILE C 258 7.044 1.704 3.246 1.00 70.41 H new ATOM 2679 N GLN C 259 7.129 4.445 7.526 1.00 3.14 N ATOM 2680 CA GLN C 259 6.498 5.344 8.476 1.00 62.13 C ATOM 2681 C GLN C 259 6.227 6.693 7.822 1.00 20.20 C ATOM 2682 O GLN C 259 5.103 7.201 7.840 1.00 23.21 O ATOM 2683 CB GLN C 259 7.393 5.538 9.707 1.00 1.14 C ATOM 2684 CG GLN C 259 7.795 4.253 10.417 1.00 72.32 C ATOM 2685 CD GLN C 259 6.611 3.423 10.883 1.00 42.22 C ATOM 2686 OE1 GLN C 259 6.117 3.594 11.981 1.00 45.53 O ATOM 2687 NE2 GLN C 259 6.177 2.508 10.059 1.00 12.30 N ATOM 0 H GLN C 259 8.043 4.099 7.820 1.00 3.14 H new ATOM 0 HA GLN C 259 5.553 4.902 8.792 1.00 62.13 H new ATOM 0 HB2 GLN C 259 8.297 6.065 9.401 1.00 1.14 H new ATOM 0 HB3 GLN C 259 6.874 6.181 10.418 1.00 1.14 H new ATOM 0 HG2 GLN C 259 8.408 3.652 9.745 1.00 72.32 H new ATOM 0 HG3 GLN C 259 8.416 4.502 11.278 1.00 72.32 H new ATOM 0 HE21 GLN C 259 6.617 2.394 9.146 1.00 12.30 H new ATOM 0 HE22 GLN C 259 5.398 1.907 10.328 1.00 12.30 H new ATOM 2696 N GLU C 260 7.255 7.229 7.210 1.00 64.20 N ATOM 2697 CA GLU C 260 7.192 8.496 6.520 1.00 0.14 C ATOM 2698 C GLU C 260 6.272 8.431 5.304 1.00 53.00 C ATOM 2699 O GLU C 260 5.547 9.388 5.009 1.00 12.45 O ATOM 2700 CB GLU C 260 8.591 8.894 6.077 1.00 43.50 C ATOM 2701 CG GLU C 260 9.555 9.186 7.203 1.00 41.33 C ATOM 2702 CD GLU C 260 9.175 10.425 7.973 1.00 15.44 C ATOM 2703 OE1 GLU C 260 9.496 11.542 7.505 1.00 75.44 O ATOM 2704 OE2 GLU C 260 8.547 10.316 9.036 1.00 62.12 O ATOM 0 H GLU C 260 8.175 6.790 7.176 1.00 64.20 H new ATOM 0 HA GLU C 260 6.785 9.238 7.208 1.00 0.14 H new ATOM 0 HB2 GLU C 260 9.004 8.093 5.463 1.00 43.50 H new ATOM 0 HB3 GLU C 260 8.518 9.777 5.442 1.00 43.50 H new ATOM 0 HG2 GLU C 260 9.586 8.334 7.882 1.00 41.33 H new ATOM 0 HG3 GLU C 260 10.559 9.307 6.797 1.00 41.33 H new ATOM 2711 N TYR C 261 6.307 7.324 4.590 1.00 51.54 N ATOM 2712 CA TYR C 261 5.510 7.192 3.399 1.00 63.13 C ATOM 2713 C TYR C 261 4.027 7.079 3.736 1.00 10.53 C ATOM 2714 O TYR C 261 3.183 7.702 3.073 1.00 2.13 O ATOM 2715 CB TYR C 261 5.958 6.020 2.518 1.00 41.23 C ATOM 2716 CG TYR C 261 5.275 6.023 1.176 1.00 43.43 C ATOM 2717 CD1 TYR C 261 5.781 6.785 0.138 1.00 24.01 C ATOM 2718 CD2 TYR C 261 4.120 5.292 0.950 1.00 43.44 C ATOM 2719 CE1 TYR C 261 5.160 6.828 -1.085 1.00 21.14 C ATOM 2720 CE2 TYR C 261 3.493 5.320 -0.270 1.00 71.03 C ATOM 2721 CZ TYR C 261 4.014 6.092 -1.287 1.00 34.13 C ATOM 2722 OH TYR C 261 3.384 6.129 -2.509 1.00 11.05 O ATOM 0 H TYR C 261 6.878 6.509 4.817 1.00 51.54 H new ATOM 0 HA TYR C 261 5.664 8.103 2.821 1.00 63.13 H new ATOM 0 HB2 TYR C 261 7.037 6.068 2.374 1.00 41.23 H new ATOM 0 HB3 TYR C 261 5.746 5.081 3.030 1.00 41.23 H new ATOM 0 HD1 TYR C 261 6.683 7.358 0.293 1.00 24.01 H new ATOM 0 HD2 TYR C 261 3.707 4.691 1.746 1.00 43.44 H new ATOM 0 HE1 TYR C 261 5.566 7.434 -1.882 1.00 21.14 H new ATOM 0 HE2 TYR C 261 2.596 4.741 -0.433 1.00 71.03 H new ATOM 0 HH TYR C 261 2.430 6.310 -2.380 1.00 11.05 H new ATOM 2732 N LEU C 262 3.701 6.299 4.768 1.00 15.14 N ATOM 2733 CA LEU C 262 2.316 6.159 5.175 1.00 53.52 C ATOM 2734 C LEU C 262 1.781 7.496 5.564 1.00 41.31 C ATOM 2735 O LEU C 262 0.745 7.906 5.072 1.00 31.14 O ATOM 2736 CB LEU C 262 2.138 5.164 6.326 1.00 44.21 C ATOM 2737 CG LEU C 262 2.593 3.731 6.052 1.00 41.01 C ATOM 2738 CD1 LEU C 262 2.311 2.836 7.248 1.00 52.53 C ATOM 2739 CD2 LEU C 262 1.951 3.173 4.788 1.00 44.23 C ATOM 0 H LEU C 262 4.369 5.766 5.324 1.00 15.14 H new ATOM 0 HA LEU C 262 1.759 5.761 4.327 1.00 53.52 H new ATOM 0 HB2 LEU C 262 2.686 5.538 7.191 1.00 44.21 H new ATOM 0 HB3 LEU C 262 1.083 5.143 6.601 1.00 44.21 H new ATOM 0 HG LEU C 262 3.671 3.752 5.890 1.00 41.01 H new ATOM 0 HD11 LEU C 262 2.643 1.821 7.029 1.00 52.53 H new ATOM 0 HD12 LEU C 262 2.846 3.213 8.119 1.00 52.53 H new ATOM 0 HD13 LEU C 262 1.241 2.831 7.454 1.00 52.53 H new ATOM 0 HD21 LEU C 262 2.297 2.153 4.624 1.00 44.23 H new ATOM 0 HD22 LEU C 262 0.867 3.175 4.899 1.00 44.23 H new ATOM 0 HD23 LEU C 262 2.229 3.792 3.935 1.00 44.23 H new ATOM 2751 N GLU C 263 2.509 8.188 6.426 1.00 12.01 N ATOM 2752 CA GLU C 263 2.129 9.533 6.820 1.00 62.42 C ATOM 2753 C GLU C 263 1.985 10.523 5.626 1.00 72.13 C ATOM 2754 O GLU C 263 1.045 11.307 5.599 1.00 64.13 O ATOM 2755 CB GLU C 263 3.043 10.092 7.894 1.00 60.32 C ATOM 2756 CG GLU C 263 2.985 9.335 9.206 1.00 20.42 C ATOM 2757 CD GLU C 263 3.639 10.091 10.329 1.00 11.53 C ATOM 2758 OE1 GLU C 263 4.865 10.225 10.345 1.00 25.02 O ATOM 2759 OE2 GLU C 263 2.904 10.606 11.205 1.00 53.04 O ATOM 0 H GLU C 263 3.363 7.841 6.864 1.00 12.01 H new ATOM 0 HA GLU C 263 1.131 9.432 7.247 1.00 62.42 H new ATOM 0 HB2 GLU C 263 4.069 10.082 7.525 1.00 60.32 H new ATOM 0 HB3 GLU C 263 2.779 11.134 8.075 1.00 60.32 H new ATOM 0 HG2 GLU C 263 1.945 9.136 9.462 1.00 20.42 H new ATOM 0 HG3 GLU C 263 3.475 8.369 9.088 1.00 20.42 H new ATOM 2766 N LYS C 264 2.881 10.467 4.629 1.00 52.32 N ATOM 2767 CA LYS C 264 2.794 11.413 3.491 1.00 53.21 C ATOM 2768 C LYS C 264 1.557 11.165 2.629 1.00 30.25 C ATOM 2769 O LYS C 264 1.122 12.034 1.894 1.00 2.01 O ATOM 2770 CB LYS C 264 4.105 11.467 2.665 1.00 2.32 C ATOM 2771 CG LYS C 264 4.501 10.200 1.884 1.00 10.11 C ATOM 2772 CD LYS C 264 3.769 10.016 0.538 1.00 64.32 C ATOM 2773 CE LYS C 264 4.101 11.135 -0.451 1.00 45.13 C ATOM 2774 NZ LYS C 264 3.486 10.913 -1.791 1.00 22.35 N ATOM 0 H LYS C 264 3.653 9.802 4.580 1.00 52.32 H new ATOM 0 HA LYS C 264 2.671 12.408 3.919 1.00 53.21 H new ATOM 0 HB2 LYS C 264 4.022 12.289 1.954 1.00 2.32 H new ATOM 0 HB3 LYS C 264 4.921 11.714 3.344 1.00 2.32 H new ATOM 0 HG2 LYS C 264 5.575 10.226 1.697 1.00 10.11 H new ATOM 0 HG3 LYS C 264 4.307 9.329 2.510 1.00 10.11 H new ATOM 0 HD2 LYS C 264 4.044 9.055 0.104 1.00 64.32 H new ATOM 0 HD3 LYS C 264 2.693 9.992 0.711 1.00 64.32 H new ATOM 0 HE2 LYS C 264 3.754 12.086 -0.048 1.00 45.13 H new ATOM 0 HE3 LYS C 264 5.183 11.211 -0.559 1.00 45.13 H new ATOM 0 HZ1 LYS C 264 3.272 11.831 -2.231 1.00 22.35 H new ATOM 0 HZ2 LYS C 264 4.149 10.386 -2.394 1.00 22.35 H new ATOM 0 HZ3 LYS C 264 2.607 10.367 -1.684 1.00 22.35 H new ATOM 2788 N CYS C 265 1.032 9.973 2.700 1.00 41.10 N ATOM 2789 CA CYS C 265 -0.232 9.656 2.035 1.00 30.33 C ATOM 2790 C CYS C 265 -1.428 9.877 2.979 1.00 22.23 C ATOM 2791 O CYS C 265 -2.463 10.389 2.564 1.00 22.12 O ATOM 2792 CB CYS C 265 -0.241 8.226 1.461 1.00 63.23 C ATOM 2793 SG CYS C 265 0.958 7.945 0.101 1.00 31.15 S ATOM 0 H CYS C 265 1.450 9.194 3.209 1.00 41.10 H new ATOM 0 HA CYS C 265 -0.330 10.343 1.194 1.00 30.33 H new ATOM 0 HB2 CYS C 265 -0.029 7.523 2.267 1.00 63.23 H new ATOM 0 HB3 CYS C 265 -1.243 8.000 1.097 1.00 63.23 H new ATOM 2798 N LEU C 266 -1.253 9.515 4.248 1.00 12.31 N ATOM 2799 CA LEU C 266 -2.279 9.632 5.273 1.00 2.45 C ATOM 2800 C LEU C 266 -2.683 11.087 5.461 1.00 24.04 C ATOM 2801 O LEU C 266 -3.869 11.411 5.531 1.00 23.10 O ATOM 2802 CB LEU C 266 -1.734 8.998 6.600 1.00 20.22 C ATOM 2803 CG LEU C 266 -2.655 8.920 7.843 1.00 34.25 C ATOM 2804 CD1 LEU C 266 -2.889 10.278 8.475 1.00 22.11 C ATOM 2805 CD2 LEU C 266 -3.966 8.304 7.458 1.00 21.41 C ATOM 0 H LEU C 266 -0.377 9.125 4.596 1.00 12.31 H new ATOM 0 HA LEU C 266 -3.177 9.094 4.970 1.00 2.45 H new ATOM 0 HB2 LEU C 266 -1.411 7.983 6.368 1.00 20.22 H new ATOM 0 HB3 LEU C 266 -0.844 9.558 6.888 1.00 20.22 H new ATOM 0 HG LEU C 266 -2.152 8.301 8.586 1.00 34.25 H new ATOM 0 HD11 LEU C 266 -3.541 10.168 9.342 1.00 22.11 H new ATOM 0 HD12 LEU C 266 -1.935 10.702 8.789 1.00 22.11 H new ATOM 0 HD13 LEU C 266 -3.360 10.941 7.749 1.00 22.11 H new ATOM 0 HD21 LEU C 266 -4.613 8.249 8.333 1.00 21.41 H new ATOM 0 HD22 LEU C 266 -4.443 8.914 6.691 1.00 21.41 H new ATOM 0 HD23 LEU C 266 -3.796 7.300 7.069 1.00 21.41 H new ATOM 2817 N ASN C 267 -1.703 11.953 5.518 1.00 55.21 N ATOM 2818 CA ASN C 267 -1.933 13.366 5.750 1.00 62.31 C ATOM 2819 C ASN C 267 -2.632 14.069 4.603 1.00 61.34 C ATOM 2820 O ASN C 267 -3.001 15.235 4.718 1.00 11.11 O ATOM 2821 CB ASN C 267 -0.642 14.084 6.096 1.00 12.05 C ATOM 2822 CG ASN C 267 -0.106 13.676 7.451 1.00 14.41 C ATOM 2823 OD1 ASN C 267 -0.253 12.540 7.900 1.00 24.42 O ATOM 2824 ND2 ASN C 267 0.468 14.593 8.130 1.00 60.13 N ATOM 0 H ASN C 267 -0.720 11.703 5.405 1.00 55.21 H new ATOM 0 HA ASN C 267 -2.612 13.412 6.602 1.00 62.31 H new ATOM 0 HB2 ASN C 267 0.106 13.871 5.332 1.00 12.05 H new ATOM 0 HB3 ASN C 267 -0.813 15.161 6.084 1.00 12.05 H new ATOM 0 HD21 ASN C 267 0.817 14.391 9.067 1.00 60.13 H new ATOM 0 HD22 ASN C 267 0.578 15.527 7.735 1.00 60.13 H new ATOM 3120 N GLY D 319 13.825 -12.111 3.386 1.00 44.30 N ATOM 3121 CA GLY D 319 14.350 -11.950 4.721 1.00 51.43 C ATOM 3122 C GLY D 319 15.746 -11.445 4.552 1.00 72.24 C ATOM 3123 O GLY D 319 16.712 -12.009 5.073 1.00 51.03 O ATOM 0 HA2 GLY D 319 13.747 -11.247 5.296 1.00 51.43 H new ATOM 0 HA3 GLY D 319 14.339 -12.896 5.262 1.00 51.43 H new ATOM 3127 N ASP D 320 15.839 -10.386 3.791 1.00 52.41 N ATOM 3128 CA ASP D 320 17.094 -9.869 3.280 1.00 62.43 C ATOM 3129 C ASP D 320 17.192 -8.355 3.506 1.00 12.52 C ATOM 3130 O ASP D 320 16.263 -7.760 4.046 1.00 15.30 O ATOM 3131 CB ASP D 320 17.090 -10.231 1.797 1.00 14.21 C ATOM 3132 CG ASP D 320 18.269 -9.774 0.974 1.00 64.33 C ATOM 3133 OD1 ASP D 320 19.395 -10.241 1.216 1.00 62.11 O ATOM 3134 OD2 ASP D 320 18.071 -8.986 0.033 1.00 21.20 O ATOM 0 H ASP D 320 15.028 -9.841 3.499 1.00 52.41 H new ATOM 0 HA ASP D 320 17.960 -10.293 3.788 1.00 62.43 H new ATOM 0 HB2 ASP D 320 17.020 -11.316 1.714 1.00 14.21 H new ATOM 0 HB3 ASP D 320 16.186 -9.818 1.351 1.00 14.21 H new ATOM 3163 N ASP D 322 19.219 -6.619 5.625 1.00 14.11 N ATOM 3164 CA ASP D 322 19.146 -6.542 7.097 1.00 24.35 C ATOM 3165 C ASP D 322 17.951 -7.278 7.631 1.00 42.23 C ATOM 3166 O ASP D 322 18.084 -8.163 8.475 1.00 4.20 O ATOM 3167 CB ASP D 322 19.173 -5.124 7.627 1.00 44.35 C ATOM 3168 CG ASP D 322 20.541 -4.491 7.605 1.00 53.10 C ATOM 3169 OD1 ASP D 322 21.017 -4.121 6.521 1.00 42.33 O ATOM 3170 OD2 ASP D 322 21.138 -4.321 8.690 1.00 44.00 O ATOM 0 HA ASP D 322 20.050 -7.031 7.459 1.00 24.35 H new ATOM 0 HB2 ASP D 322 18.491 -4.513 7.037 1.00 44.35 H new ATOM 0 HB3 ASP D 322 18.798 -5.122 8.651 1.00 44.35 H new ATOM 3175 N SER D 323 16.788 -6.886 7.157 1.00 74.32 N ATOM 3176 CA SER D 323 15.545 -7.540 7.442 1.00 62.52 C ATOM 3177 C SER D 323 15.062 -7.380 8.925 1.00 13.10 C ATOM 3178 O SER D 323 14.077 -7.991 9.338 1.00 3.32 O ATOM 3179 CB SER D 323 15.616 -9.017 6.923 1.00 64.42 C ATOM 3180 OG SER D 323 14.472 -9.786 7.235 1.00 43.14 O ATOM 0 H SER D 323 16.687 -6.077 6.544 1.00 74.32 H new ATOM 0 HA SER D 323 14.749 -7.034 6.895 1.00 62.52 H new ATOM 0 HB2 SER D 323 15.751 -9.006 5.841 1.00 64.42 H new ATOM 0 HB3 SER D 323 16.495 -9.500 7.350 1.00 64.42 H new ATOM 0 HG SER D 323 13.665 -9.284 6.996 1.00 43.14 H new ATOM 3186 N MET D 324 15.720 -6.508 9.697 1.00 53.52 N ATOM 3187 CA MET D 324 15.328 -6.284 11.098 1.00 42.25 C ATOM 3188 C MET D 324 15.366 -4.796 11.453 1.00 22.11 C ATOM 3189 O MET D 324 16.452 -4.225 11.570 1.00 61.31 O ATOM 3190 CB MET D 324 16.266 -7.032 12.065 1.00 4.30 C ATOM 3191 CG MET D 324 16.303 -8.539 11.908 1.00 54.31 C ATOM 3192 SD MET D 324 17.439 -9.331 13.084 1.00 10.24 S ATOM 3193 CE MET D 324 16.696 -8.871 14.655 1.00 13.10 C ATOM 0 H MET D 324 16.516 -5.952 9.384 1.00 53.52 H new ATOM 0 HA MET D 324 14.311 -6.662 11.202 1.00 42.25 H new ATOM 0 HB2 MET D 324 17.277 -6.646 11.933 1.00 4.30 H new ATOM 0 HB3 MET D 324 15.966 -6.798 13.087 1.00 4.30 H new ATOM 0 HG2 MET D 324 15.300 -8.941 12.050 1.00 54.31 H new ATOM 0 HG3 MET D 324 16.606 -8.788 10.891 1.00 54.31 H new ATOM 0 HE1 MET D 324 17.059 -9.537 15.438 1.00 13.10 H new ATOM 0 HE2 MET D 324 16.967 -7.844 14.898 1.00 13.10 H new ATOM 0 HE3 MET D 324 15.612 -8.953 14.582 1.00 13.10 H new ATOM 3203 N LYS D 325 14.192 -4.167 11.613 1.00 50.03 N ATOM 3204 CA LYS D 325 14.078 -2.763 12.028 1.00 73.44 C ATOM 3205 C LYS D 325 12.793 -2.521 12.839 1.00 64.41 C ATOM 3206 O LYS D 325 11.985 -3.429 13.023 1.00 54.22 O ATOM 3207 CB LYS D 325 14.121 -1.783 10.832 1.00 21.51 C ATOM 3208 CG LYS D 325 15.464 -1.651 10.124 1.00 73.30 C ATOM 3209 CD LYS D 325 16.513 -1.058 11.061 1.00 13.30 C ATOM 3210 CE LYS D 325 16.261 0.412 11.409 1.00 32.20 C ATOM 3211 NZ LYS D 325 16.387 1.296 10.236 1.00 60.21 N ATOM 0 H LYS D 325 13.292 -4.621 11.457 1.00 50.03 H new ATOM 0 HA LYS D 325 14.946 -2.566 12.657 1.00 73.44 H new ATOM 0 HB2 LYS D 325 13.377 -2.100 10.101 1.00 21.51 H new ATOM 0 HB3 LYS D 325 13.820 -0.797 11.185 1.00 21.51 H new ATOM 0 HG2 LYS D 325 15.794 -2.629 9.774 1.00 73.30 H new ATOM 0 HG3 LYS D 325 15.356 -1.017 9.244 1.00 73.30 H new ATOM 0 HD2 LYS D 325 16.538 -1.642 11.981 1.00 13.30 H new ATOM 0 HD3 LYS D 325 17.496 -1.150 10.598 1.00 13.30 H new ATOM 0 HE2 LYS D 325 15.263 0.516 11.834 1.00 32.20 H new ATOM 0 HE3 LYS D 325 16.968 0.727 12.176 1.00 32.20 H new ATOM 0 HZ1 LYS D 325 16.343 2.289 10.543 1.00 60.21 H new ATOM 0 HZ2 LYS D 325 17.297 1.120 9.765 1.00 60.21 H new ATOM 0 HZ3 LYS D 325 15.610 1.104 9.572 1.00 60.21 H new ATOM 3225 N GLU D 326 12.645 -1.301 13.341 1.00 74.43 N ATOM 3226 CA GLU D 326 11.468 -0.847 14.084 1.00 50.34 C ATOM 3227 C GLU D 326 11.439 0.691 14.038 1.00 55.24 C ATOM 3228 O GLU D 326 12.474 1.295 13.741 1.00 4.51 O ATOM 3229 CB GLU D 326 11.506 -1.363 15.535 1.00 73.11 C ATOM 3230 CG GLU D 326 12.780 -1.023 16.276 1.00 55.13 C ATOM 3231 CD GLU D 326 12.752 -1.464 17.705 1.00 72.12 C ATOM 3232 OE1 GLU D 326 12.999 -2.658 17.975 1.00 3.32 O ATOM 3233 OE2 GLU D 326 12.491 -0.623 18.588 1.00 22.35 O ATOM 0 H GLU D 326 13.358 -0.578 13.242 1.00 74.43 H new ATOM 0 HA GLU D 326 10.560 -1.244 13.630 1.00 50.34 H new ATOM 0 HB2 GLU D 326 10.659 -0.947 16.080 1.00 73.11 H new ATOM 0 HB3 GLU D 326 11.380 -2.446 15.528 1.00 73.11 H new ATOM 0 HG2 GLU D 326 13.625 -1.492 15.772 1.00 55.13 H new ATOM 0 HG3 GLU D 326 12.943 0.054 16.236 1.00 55.13 H new ATOM 3240 N PRO D 327 10.285 1.366 14.300 1.00 32.13 N ATOM 3241 CA PRO D 327 10.203 2.806 14.226 1.00 11.32 C ATOM 3242 C PRO D 327 10.499 3.461 15.560 1.00 34.45 C ATOM 3243 O PRO D 327 10.505 2.796 16.619 1.00 42.00 O ATOM 3244 CB PRO D 327 8.734 3.056 13.848 1.00 32.23 C ATOM 3245 CG PRO D 327 8.062 1.713 13.906 1.00 61.01 C ATOM 3246 CD PRO D 327 8.979 0.819 14.666 1.00 14.14 C ATOM 0 HA PRO D 327 10.925 3.219 13.522 1.00 11.32 H new ATOM 0 HB2 PRO D 327 8.266 3.757 14.539 1.00 32.23 H new ATOM 0 HB3 PRO D 327 8.655 3.490 12.851 1.00 32.23 H new ATOM 0 HG2 PRO D 327 7.092 1.784 14.398 1.00 61.01 H new ATOM 0 HG3 PRO D 327 7.883 1.324 12.904 1.00 61.01 H new ATOM 0 HD2 PRO D 327 8.801 0.865 15.740 1.00 14.14 H new ATOM 0 HD3 PRO D 327 8.873 -0.225 14.370 1.00 14.14 H new