USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1204 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: D 309 SER OG : rot -144:sc= -0.0799 USER MOD Set 1.2: D 311 ASN : amide:sc= 0.0433 X(o=-0.037,f=0.03) USER MOD Set 2.1: A 61 TYR OH : rot 66:sc= 1.72 USER MOD Set 2.2: D 307 TYR OH : rot -12:sc= -2.8! USER MOD Set 3.1: B 107 TYR OH : rot 104:sc= 0.505 USER MOD Set 3.2: C 261 TYR OH : rot 66:sc= 1.05 USER MOD Set 4.1: C 224 LYS NZ :NH3+ -179:sc= 1.24 (180deg=0) USER MOD Set 4.2: C 244 ASN : amide:sc= 1.11 K(o=2.3,f=-7.8!) USER MOD Set 5.1: B 109 SER OG : rot -109:sc= 0.378 USER MOD Set 5.2: B 111 ASN : amide:sc= 0.397 X(o=0.77,f=1.2) USER MOD Set 6.1: A 22 ASN : amide:sc= -1.13 X(o=-0.76,f=-0.59) USER MOD Set 6.2: A 45 ASN : amide:sc= 0.376 K(o=-0.76,f=-1.9) USER MOD Single : A 16 SER OG : rot -140:sc= 0.423 USER MOD Single : A 17 HIS : +bothHN:sc= -0.41 K(o=-0.41,f=-7.5!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.126 K(o=-0.13,f=-0.94) USER MOD Single : A 27 LYS NZ :NH3+ -173:sc= -1.2 (180deg=-1.46) USER MOD Single : A 30 ASN : amide:sc= -0.105 K(o=-0.1,f=-0.97) USER MOD Single : A 31 THR OG1 : rot 22:sc= -1.12! USER MOD Single : A 33 ASN :FLIP amide:sc=-0.00473 F(o=-0.66,f=-0.0047) USER MOD Single : A 37 GLN : amide:sc= -3.18! C(o=-3.2!,f=-4.5!) USER MOD Single : A 43 LYS NZ :NH3+ -146:sc= -1.61 (180deg=-3.92!) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 ASN : amide:sc= -0.0227 X(o=-0.023,f=-0.023) USER MOD Single : A 48 GLN : amide:sc= 1.07 K(o=1.1,f=-5.8!) USER MOD Single : A 54 LYS NZ :NH3+ -115:sc= 1.23 (180deg=-0.284) USER MOD Single : A 56 LYS NZ :NH3+ -172:sc= 0.827 (180deg=0.653) USER MOD Single : A 59 GLN : amide:sc= -2.68! K(o=-2.7!,f=-4.2) USER MOD Single : A 64 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0414) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 LYS NZ :NH3+ -164:sc= -0.0383 (180deg=-0.326) USER MOD Single : B 108 THR OG1 : rot 180:sc= 0 USER MOD Single : B 121 TYR OH : rot 180:sc= 0 USER MOD Single : B 123 SER OG : rot 180:sc= 0.159 USER MOD Single : B 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 125 LYS NZ :NH3+ 156:sc= 0.943 (180deg=-0.298) USER MOD Single : C 216 SER OG : rot -70:sc= 1.12 USER MOD Single : C 217 HIS : no HD1:sc= -0.388 X(o=-0.39,f=-0.65) USER MOD Single : C 222 ASN :FLIP amide:sc=-0.00713 F(o=-2.6!,f=-0.0071) USER MOD Single : C 225 HIS : no HD1:sc= -2.07 K(o=-2.1,f=-3.3!) USER MOD Single : C 227 LYS NZ :NH3+ -169:sc= -2.02! (180deg=-2.55!) USER MOD Single : C 230 ASN : amide:sc= -2.67! C(o=-2.7!,f=-3.5!) USER MOD Single : C 231 THR OG1 : rot 33:sc= -0.808 USER MOD Single : C 233 ASN : amide:sc= 0.497 K(o=0.5,f=-0.092) USER MOD Single : C 237 GLN :FLIP amide:sc= -1.85 F(o=-3.1!,f=-1.9) USER MOD Single : C 243 LYS NZ :NH3+ -133:sc= -0.617 (180deg=-2.54!) USER MOD Single : C 245 ASN : amide:sc= -1.19 K(o=-1.2,f=-2.8!) USER MOD Single : C 246 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 248 GLN : amide:sc= 1.02 K(o=1,f=-6!) USER MOD Single : C 254 LYS NZ :NH3+ -109:sc= 0.177 (180deg=-0.136) USER MOD Single : C 256 LYS NZ :NH3+ 179:sc= -0.063 (180deg=-0.0713) USER MOD Single : C 259 GLN :FLIP amide:sc= -1.88! C(o=-5.1!,f=-1.9!) USER MOD Single : C 264 LYS NZ :NH3+ -125:sc= 1.17 (180deg=0.909) USER MOD Single : C 267 ASN : amide:sc=-0.00835 X(o=-0.0084,f=-0.015) USER MOD Single : C 268 LYS NZ :NH3+ -165:sc= -0.0204 (180deg=-0.283) USER MOD Single : D 308 THR OG1 : rot 180:sc= 0 USER MOD Single : D 321 TYR OH : rot 180:sc= 0 USER MOD Single : D 323 SER OG : rot -94:sc= 1.37 USER MOD Single : D 324 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 325 LYS NZ :NH3+ 167:sc= 1.24 (180deg=1.11) USER MOD ----------------------------------------------------------------- ATOM 139 N CYS A 9 -10.793 -6.851 14.418 1.00 43.24 N ATOM 140 CA CYS A 9 -9.769 -6.757 13.413 1.00 2.44 C ATOM 141 C CYS A 9 -10.352 -6.965 12.050 1.00 71.00 C ATOM 142 O CYS A 9 -11.340 -7.698 11.882 1.00 3.30 O ATOM 143 CB CYS A 9 -8.563 -7.672 13.698 1.00 65.32 C ATOM 144 SG CYS A 9 -7.412 -6.981 14.944 1.00 41.21 S ATOM 0 HA CYS A 9 -9.365 -5.745 13.447 1.00 2.44 H new ATOM 0 HB2 CYS A 9 -8.924 -8.641 14.044 1.00 65.32 H new ATOM 0 HB3 CYS A 9 -8.020 -7.847 12.769 1.00 65.32 H new ATOM 149 N PRO A 10 -9.751 -6.272 11.048 1.00 40.41 N ATOM 150 CA PRO A 10 -10.325 -6.098 9.725 1.00 55.41 C ATOM 151 C PRO A 10 -10.704 -7.397 9.068 1.00 62.20 C ATOM 152 O PRO A 10 -11.892 -7.666 8.849 1.00 41.23 O ATOM 153 CB PRO A 10 -9.223 -5.337 8.967 1.00 41.14 C ATOM 154 CG PRO A 10 -7.990 -5.614 9.714 1.00 61.31 C ATOM 155 CD PRO A 10 -8.408 -5.664 11.128 1.00 0.03 C ATOM 0 HA PRO A 10 -11.272 -5.559 9.745 1.00 55.41 H new ATOM 0 HB2 PRO A 10 -9.145 -5.679 7.935 1.00 41.14 H new ATOM 0 HB3 PRO A 10 -9.433 -4.268 8.933 1.00 41.14 H new ATOM 0 HG2 PRO A 10 -7.541 -6.557 9.401 1.00 61.31 H new ATOM 0 HG3 PRO A 10 -7.245 -4.836 9.549 1.00 61.31 H new ATOM 0 HD2 PRO A 10 -7.727 -6.265 11.731 1.00 0.03 H new ATOM 0 HD3 PRO A 10 -8.439 -4.671 11.576 1.00 0.03 H new ATOM 163 N CYS A 11 -9.740 -8.188 8.752 1.00 55.23 N ATOM 164 CA CYS A 11 -10.021 -9.446 8.211 1.00 21.30 C ATOM 165 C CYS A 11 -9.875 -10.490 9.296 1.00 22.43 C ATOM 166 O CYS A 11 -8.921 -10.447 10.084 1.00 13.42 O ATOM 167 CB CYS A 11 -9.125 -9.733 7.058 1.00 10.40 C ATOM 168 SG CYS A 11 -9.661 -11.133 6.063 1.00 30.33 S ATOM 0 H CYS A 11 -8.749 -7.974 8.864 1.00 55.23 H new ATOM 0 HA CYS A 11 -11.044 -9.465 7.836 1.00 21.30 H new ATOM 0 HB2 CYS A 11 -9.067 -8.848 6.424 1.00 10.40 H new ATOM 0 HB3 CYS A 11 -8.119 -9.926 7.429 1.00 10.40 H new ATOM 173 N ARG A 12 -10.790 -11.416 9.339 1.00 3.11 N ATOM 174 CA ARG A 12 -10.802 -12.459 10.360 1.00 62.42 C ATOM 175 C ARG A 12 -9.820 -13.584 10.010 1.00 50.50 C ATOM 176 O ARG A 12 -9.455 -14.403 10.850 1.00 3.33 O ATOM 177 CB ARG A 12 -12.217 -13.019 10.447 1.00 45.13 C ATOM 178 CG ARG A 12 -13.256 -11.963 10.757 1.00 30.42 C ATOM 179 CD ARG A 12 -14.662 -12.510 10.671 1.00 72.22 C ATOM 180 NE ARG A 12 -15.667 -11.463 10.946 1.00 14.24 N ATOM 181 CZ ARG A 12 -16.999 -11.662 10.998 1.00 53.31 C ATOM 182 NH1 ARG A 12 -17.505 -12.867 10.765 1.00 52.11 N ATOM 183 NH2 ARG A 12 -17.811 -10.653 11.272 1.00 35.25 N ATOM 0 H ARG A 12 -11.558 -11.481 8.670 1.00 3.11 H new ATOM 0 HA ARG A 12 -10.495 -12.035 11.316 1.00 62.42 H new ATOM 0 HB2 ARG A 12 -12.469 -13.502 9.503 1.00 45.13 H new ATOM 0 HB3 ARG A 12 -12.250 -13.789 11.217 1.00 45.13 H new ATOM 0 HG2 ARG A 12 -13.082 -11.566 11.757 1.00 30.42 H new ATOM 0 HG3 ARG A 12 -13.147 -11.132 10.060 1.00 30.42 H new ATOM 0 HD2 ARG A 12 -14.831 -12.927 9.678 1.00 72.22 H new ATOM 0 HD3 ARG A 12 -14.780 -13.326 11.384 1.00 72.22 H new ATOM 0 HE ARG A 12 -15.326 -10.516 11.109 1.00 14.24 H new ATOM 0 HH11 ARG A 12 -16.885 -13.647 10.546 1.00 52.11 H new ATOM 0 HH12 ARG A 12 -18.514 -13.013 10.805 1.00 52.11 H new ATOM 0 HH21 ARG A 12 -17.429 -9.723 11.444 1.00 35.25 H new ATOM 0 HH22 ARG A 12 -18.819 -10.805 11.311 1.00 35.25 H new ATOM 197 N PHE A 13 -9.413 -13.610 8.778 1.00 13.21 N ATOM 198 CA PHE A 13 -8.577 -14.658 8.226 1.00 31.00 C ATOM 199 C PHE A 13 -7.495 -14.059 7.357 1.00 21.21 C ATOM 200 O PHE A 13 -7.558 -12.890 7.020 1.00 41.42 O ATOM 201 CB PHE A 13 -9.445 -15.619 7.403 1.00 5.03 C ATOM 202 CG PHE A 13 -10.244 -14.935 6.319 1.00 62.50 C ATOM 203 CD1 PHE A 13 -11.483 -14.384 6.605 1.00 22.44 C ATOM 204 CD2 PHE A 13 -9.756 -14.836 5.025 1.00 65.25 C ATOM 205 CE1 PHE A 13 -12.215 -13.750 5.635 1.00 21.31 C ATOM 206 CE2 PHE A 13 -10.485 -14.200 4.044 1.00 23.20 C ATOM 207 CZ PHE A 13 -11.719 -13.658 4.349 1.00 20.50 C ATOM 0 H PHE A 13 -9.655 -12.887 8.101 1.00 13.21 H new ATOM 0 HA PHE A 13 -8.102 -15.207 9.039 1.00 31.00 H new ATOM 0 HB2 PHE A 13 -8.805 -16.375 6.949 1.00 5.03 H new ATOM 0 HB3 PHE A 13 -10.129 -16.141 8.072 1.00 5.03 H new ATOM 0 HD1 PHE A 13 -11.878 -14.455 7.608 1.00 22.44 H new ATOM 0 HD2 PHE A 13 -8.794 -15.262 4.783 1.00 65.25 H new ATOM 0 HE1 PHE A 13 -13.178 -13.323 5.876 1.00 21.31 H new ATOM 0 HE2 PHE A 13 -10.093 -14.125 3.040 1.00 23.20 H new ATOM 0 HZ PHE A 13 -12.296 -13.162 3.582 1.00 20.50 H new ATOM 217 N PHE A 14 -6.474 -14.810 7.064 1.00 74.24 N ATOM 218 CA PHE A 14 -5.502 -14.361 6.098 1.00 72.04 C ATOM 219 C PHE A 14 -5.174 -15.508 5.146 1.00 3.44 C ATOM 220 O PHE A 14 -5.252 -16.684 5.530 1.00 72.32 O ATOM 221 CB PHE A 14 -4.231 -13.769 6.750 1.00 23.35 C ATOM 222 CG PHE A 14 -3.389 -14.754 7.475 1.00 33.00 C ATOM 223 CD1 PHE A 14 -3.632 -15.064 8.792 1.00 3.02 C ATOM 224 CD2 PHE A 14 -2.359 -15.378 6.820 1.00 22.32 C ATOM 225 CE1 PHE A 14 -2.849 -15.989 9.450 1.00 73.53 C ATOM 226 CE2 PHE A 14 -1.574 -16.304 7.456 1.00 72.15 C ATOM 227 CZ PHE A 14 -1.817 -16.613 8.777 1.00 43.12 C ATOM 0 H PHE A 14 -6.289 -15.726 7.472 1.00 74.24 H new ATOM 0 HA PHE A 14 -5.941 -13.539 5.532 1.00 72.04 H new ATOM 0 HB2 PHE A 14 -3.628 -13.297 5.975 1.00 23.35 H new ATOM 0 HB3 PHE A 14 -4.528 -12.984 7.445 1.00 23.35 H new ATOM 0 HD1 PHE A 14 -4.443 -14.579 9.316 1.00 3.02 H new ATOM 0 HD2 PHE A 14 -2.163 -15.136 5.786 1.00 22.32 H new ATOM 0 HE1 PHE A 14 -3.042 -16.224 10.486 1.00 73.53 H new ATOM 0 HE2 PHE A 14 -0.769 -16.789 6.925 1.00 72.15 H new ATOM 0 HZ PHE A 14 -1.202 -17.341 9.285 1.00 43.12 H new ATOM 237 N GLU A 15 -4.841 -15.173 3.938 1.00 65.00 N ATOM 238 CA GLU A 15 -4.509 -16.121 2.911 1.00 20.44 C ATOM 239 C GLU A 15 -2.992 -16.155 2.742 1.00 65.13 C ATOM 240 O GLU A 15 -2.338 -15.107 2.726 1.00 35.31 O ATOM 241 CB GLU A 15 -5.122 -15.670 1.573 1.00 34.43 C ATOM 242 CG GLU A 15 -6.647 -15.494 1.532 1.00 11.42 C ATOM 243 CD GLU A 15 -7.461 -16.728 1.892 1.00 12.34 C ATOM 244 OE1 GLU A 15 -7.692 -16.979 3.080 1.00 44.11 O ATOM 245 OE2 GLU A 15 -7.921 -17.437 0.977 1.00 62.51 O ATOM 0 H GLU A 15 -4.790 -14.203 3.626 1.00 65.00 H new ATOM 0 HA GLU A 15 -4.893 -17.102 3.190 1.00 20.44 H new ATOM 0 HB2 GLU A 15 -4.663 -14.722 1.292 1.00 34.43 H new ATOM 0 HB3 GLU A 15 -4.844 -16.397 0.810 1.00 34.43 H new ATOM 0 HG2 GLU A 15 -6.920 -14.689 2.214 1.00 11.42 H new ATOM 0 HG3 GLU A 15 -6.931 -15.173 0.530 1.00 11.42 H new ATOM 252 N SER A 16 -2.437 -17.328 2.625 1.00 24.42 N ATOM 253 CA SER A 16 -1.028 -17.457 2.386 1.00 23.44 C ATOM 254 C SER A 16 -0.744 -17.676 0.903 1.00 31.10 C ATOM 255 O SER A 16 -1.252 -18.619 0.291 1.00 24.23 O ATOM 256 CB SER A 16 -0.438 -18.560 3.245 1.00 10.40 C ATOM 257 OG SER A 16 -1.199 -19.754 3.131 1.00 22.23 O ATOM 0 H SER A 16 -2.941 -18.212 2.692 1.00 24.42 H new ATOM 0 HA SER A 16 -0.542 -16.524 2.672 1.00 23.44 H new ATOM 0 HB2 SER A 16 0.592 -18.750 2.943 1.00 10.40 H new ATOM 0 HB3 SER A 16 -0.410 -18.240 4.287 1.00 10.40 H new ATOM 0 HG SER A 16 -1.273 -20.180 4.010 1.00 22.23 H new ATOM 263 N HIS A 17 0.058 -16.787 0.353 1.00 54.10 N ATOM 264 CA HIS A 17 0.461 -16.749 -1.055 1.00 1.44 C ATOM 265 C HIS A 17 -0.466 -15.960 -1.897 1.00 4.43 C ATOM 266 O HIS A 17 -0.296 -14.763 -1.992 1.00 4.25 O ATOM 267 CB HIS A 17 0.824 -18.099 -1.725 1.00 70.52 C ATOM 268 CG HIS A 17 2.114 -18.718 -1.286 1.00 2.14 C ATOM 269 ND1 HIS A 17 2.515 -19.977 -1.665 1.00 51.34 N ATOM 270 CD2 HIS A 17 3.119 -18.227 -0.550 1.00 55.13 C ATOM 271 CE1 HIS A 17 3.703 -20.217 -1.187 1.00 61.25 C ATOM 272 NE2 HIS A 17 4.095 -19.173 -0.506 1.00 12.03 N ATOM 0 H HIS A 17 0.472 -16.029 0.896 1.00 54.10 H new ATOM 0 HA HIS A 17 1.417 -16.228 -0.998 1.00 1.44 H new ATOM 0 HB2 HIS A 17 0.018 -18.807 -1.531 1.00 70.52 H new ATOM 0 HB3 HIS A 17 0.864 -17.949 -2.804 1.00 70.52 H new ATOM 0 HD1 HIS A 17 1.967 -20.623 -2.233 1.00 51.34 H new ATOM 0 HD2 HIS A 17 3.149 -17.256 -0.077 1.00 55.13 H new ATOM 0 HE1 HIS A 17 4.269 -21.126 -1.330 1.00 61.25 H new ATOM 0 HE2 HIS A 17 4.987 -19.082 -0.021 1.00 12.03 H new ATOM 281 N VAL A 18 -1.480 -16.619 -2.477 1.00 63.32 N ATOM 282 CA VAL A 18 -2.367 -15.981 -3.459 1.00 60.34 C ATOM 283 C VAL A 18 -1.545 -15.698 -4.744 1.00 74.14 C ATOM 284 O VAL A 18 -0.301 -15.638 -4.708 1.00 22.12 O ATOM 285 CB VAL A 18 -3.050 -14.669 -2.895 1.00 3.23 C ATOM 286 CG1 VAL A 18 -3.939 -13.979 -3.929 1.00 72.31 C ATOM 287 CG2 VAL A 18 -3.860 -14.995 -1.644 1.00 23.12 C ATOM 0 H VAL A 18 -1.706 -17.594 -2.282 1.00 63.32 H new ATOM 0 HA VAL A 18 -3.190 -16.657 -3.689 1.00 60.34 H new ATOM 0 HB VAL A 18 -2.249 -13.974 -2.645 1.00 3.23 H new ATOM 0 HG11 VAL A 18 -4.382 -13.085 -3.489 1.00 72.31 H new ATOM 0 HG12 VAL A 18 -3.339 -13.698 -4.795 1.00 72.31 H new ATOM 0 HG13 VAL A 18 -4.730 -14.660 -4.241 1.00 72.31 H new ATOM 0 HG21 VAL A 18 -4.325 -14.085 -1.265 1.00 23.12 H new ATOM 0 HG22 VAL A 18 -4.633 -15.723 -1.891 1.00 23.12 H new ATOM 0 HG23 VAL A 18 -3.201 -15.410 -0.882 1.00 23.12 H new ATOM 297 N ALA A 19 -2.183 -15.583 -5.859 1.00 4.52 N ATOM 298 CA ALA A 19 -1.449 -15.331 -7.052 1.00 24.35 C ATOM 299 C ALA A 19 -1.244 -13.848 -7.247 1.00 61.04 C ATOM 300 O ALA A 19 -2.203 -13.074 -7.331 1.00 41.54 O ATOM 301 CB ALA A 19 -2.098 -15.975 -8.265 1.00 22.42 C ATOM 0 H ALA A 19 -3.194 -15.658 -5.970 1.00 4.52 H new ATOM 0 HA ALA A 19 -0.468 -15.794 -6.943 1.00 24.35 H new ATOM 0 HB1 ALA A 19 -1.505 -15.757 -9.153 1.00 22.42 H new ATOM 0 HB2 ALA A 19 -2.151 -17.054 -8.119 1.00 22.42 H new ATOM 0 HB3 ALA A 19 -3.104 -15.576 -8.394 1.00 22.42 H new ATOM 307 N ARG A 20 0.005 -13.465 -7.324 1.00 24.03 N ATOM 308 CA ARG A 20 0.422 -12.086 -7.538 1.00 13.25 C ATOM 309 C ARG A 20 0.012 -11.665 -8.968 1.00 10.00 C ATOM 310 O ARG A 20 -0.129 -10.480 -9.295 1.00 71.04 O ATOM 311 CB ARG A 20 1.957 -12.032 -7.256 1.00 51.04 C ATOM 312 CG ARG A 20 2.710 -10.691 -7.354 1.00 33.15 C ATOM 313 CD ARG A 20 2.860 -10.157 -8.747 1.00 72.25 C ATOM 314 NE ARG A 20 3.545 -11.084 -9.652 1.00 31.33 N ATOM 315 CZ ARG A 20 3.904 -10.788 -10.908 1.00 53.14 C ATOM 316 NH1 ARG A 20 3.730 -9.562 -11.380 1.00 34.44 N ATOM 317 NH2 ARG A 20 4.467 -11.711 -11.671 1.00 72.43 N ATOM 0 H ARG A 20 0.787 -14.114 -7.238 1.00 24.03 H new ATOM 0 HA ARG A 20 -0.060 -11.371 -6.871 1.00 13.25 H new ATOM 0 HB2 ARG A 20 2.116 -12.421 -6.250 1.00 51.04 H new ATOM 0 HB3 ARG A 20 2.438 -12.726 -7.946 1.00 51.04 H new ATOM 0 HG2 ARG A 20 2.186 -9.950 -6.750 1.00 33.15 H new ATOM 0 HG3 ARG A 20 3.701 -10.814 -6.918 1.00 33.15 H new ATOM 0 HD2 ARG A 20 1.873 -9.929 -9.150 1.00 72.25 H new ATOM 0 HD3 ARG A 20 3.414 -9.219 -8.711 1.00 72.25 H new ATOM 0 HE ARG A 20 3.763 -12.017 -9.302 1.00 31.33 H new ATOM 0 HH11 ARG A 20 3.322 -8.840 -10.786 1.00 34.44 H new ATOM 0 HH12 ARG A 20 4.005 -9.340 -12.337 1.00 34.44 H new ATOM 0 HH21 ARG A 20 4.628 -12.649 -11.303 1.00 72.43 H new ATOM 0 HH22 ARG A 20 4.740 -11.485 -12.627 1.00 72.43 H new ATOM 331 N ALA A 21 -0.212 -12.655 -9.790 1.00 1.21 N ATOM 332 CA ALA A 21 -0.693 -12.465 -11.130 1.00 30.42 C ATOM 333 C ALA A 21 -2.222 -12.284 -11.162 1.00 52.12 C ATOM 334 O ALA A 21 -2.782 -11.919 -12.181 1.00 0.14 O ATOM 335 CB ALA A 21 -0.294 -13.653 -11.994 1.00 71.31 C ATOM 0 H ALA A 21 -0.062 -13.633 -9.542 1.00 1.21 H new ATOM 0 HA ALA A 21 -0.240 -11.555 -11.524 1.00 30.42 H new ATOM 0 HB1 ALA A 21 -0.661 -13.504 -13.009 1.00 71.31 H new ATOM 0 HB2 ALA A 21 0.792 -13.742 -12.010 1.00 71.31 H new ATOM 0 HB3 ALA A 21 -0.727 -14.564 -11.582 1.00 71.31 H new ATOM 341 N ASN A 22 -2.885 -12.536 -10.043 1.00 64.25 N ATOM 342 CA ASN A 22 -4.354 -12.569 -10.023 1.00 33.12 C ATOM 343 C ASN A 22 -4.939 -11.450 -9.121 1.00 54.23 C ATOM 344 O ASN A 22 -6.147 -11.381 -8.878 1.00 11.43 O ATOM 345 CB ASN A 22 -4.782 -13.966 -9.530 1.00 0.13 C ATOM 346 CG ASN A 22 -6.247 -14.275 -9.705 1.00 1.33 C ATOM 347 OD1 ASN A 22 -6.660 -14.758 -10.760 1.00 11.10 O ATOM 348 ND2 ASN A 22 -7.028 -14.056 -8.689 1.00 40.10 N ATOM 0 H ASN A 22 -2.442 -12.720 -9.143 1.00 64.25 H new ATOM 0 HA ASN A 22 -4.743 -12.386 -11.024 1.00 33.12 H new ATOM 0 HB2 ASN A 22 -4.200 -14.718 -10.063 1.00 0.13 H new ATOM 0 HB3 ASN A 22 -4.529 -14.057 -8.474 1.00 0.13 H new ATOM 0 HD21 ASN A 22 -8.020 -14.286 -8.749 1.00 40.10 H new ATOM 0 HD22 ASN A 22 -6.649 -13.654 -7.832 1.00 40.10 H new ATOM 355 N VAL A 23 -4.086 -10.577 -8.666 1.00 3.34 N ATOM 356 CA VAL A 23 -4.489 -9.491 -7.775 1.00 62.51 C ATOM 357 C VAL A 23 -4.693 -8.145 -8.531 1.00 15.33 C ATOM 358 O VAL A 23 -4.073 -7.907 -9.571 1.00 41.04 O ATOM 359 CB VAL A 23 -3.471 -9.339 -6.577 1.00 41.24 C ATOM 360 CG1 VAL A 23 -2.056 -9.338 -7.075 1.00 41.41 C ATOM 361 CG2 VAL A 23 -3.691 -8.054 -5.854 1.00 63.41 C ATOM 0 H VAL A 23 -3.092 -10.585 -8.893 1.00 3.34 H new ATOM 0 HA VAL A 23 -5.461 -9.759 -7.360 1.00 62.51 H new ATOM 0 HB VAL A 23 -3.638 -10.184 -5.909 1.00 41.24 H new ATOM 0 HG11 VAL A 23 -1.374 -9.232 -6.232 1.00 41.41 H new ATOM 0 HG12 VAL A 23 -1.852 -10.276 -7.592 1.00 41.41 H new ATOM 0 HG13 VAL A 23 -1.913 -8.505 -7.764 1.00 41.41 H new ATOM 0 HG21 VAL A 23 -2.978 -7.972 -5.033 1.00 63.41 H new ATOM 0 HG22 VAL A 23 -3.550 -7.221 -6.542 1.00 63.41 H new ATOM 0 HG23 VAL A 23 -4.706 -8.029 -5.457 1.00 63.41 H new ATOM 371 N LYS A 24 -5.615 -7.295 -8.023 1.00 45.11 N ATOM 372 CA LYS A 24 -5.839 -5.968 -8.594 1.00 33.41 C ATOM 373 C LYS A 24 -5.061 -4.856 -7.846 1.00 4.21 C ATOM 374 O LYS A 24 -4.556 -3.940 -8.469 1.00 55.55 O ATOM 375 CB LYS A 24 -7.322 -5.603 -8.608 1.00 0.21 C ATOM 376 CG LYS A 24 -8.163 -6.549 -9.432 1.00 44.40 C ATOM 377 CD LYS A 24 -9.595 -6.070 -9.583 1.00 11.24 C ATOM 378 CE LYS A 24 -10.309 -5.948 -8.252 1.00 65.21 C ATOM 379 NZ LYS A 24 -11.666 -5.396 -8.417 1.00 3.31 N ATOM 0 H LYS A 24 -6.208 -7.513 -7.222 1.00 45.11 H new ATOM 0 HA LYS A 24 -5.465 -6.026 -9.616 1.00 33.41 H new ATOM 0 HB2 LYS A 24 -7.696 -5.593 -7.584 1.00 0.21 H new ATOM 0 HB3 LYS A 24 -7.436 -4.592 -8.999 1.00 0.21 H new ATOM 0 HG2 LYS A 24 -7.715 -6.663 -10.419 1.00 44.40 H new ATOM 0 HG3 LYS A 24 -8.160 -7.534 -8.965 1.00 44.40 H new ATOM 0 HD2 LYS A 24 -9.600 -5.102 -10.085 1.00 11.24 H new ATOM 0 HD3 LYS A 24 -10.141 -6.763 -10.223 1.00 11.24 H new ATOM 0 HE2 LYS A 24 -10.369 -6.928 -7.778 1.00 65.21 H new ATOM 0 HE3 LYS A 24 -9.732 -5.306 -7.586 1.00 65.21 H new ATOM 0 HZ1 LYS A 24 -12.127 -5.325 -7.488 1.00 3.31 H new ATOM 0 HZ2 LYS A 24 -11.606 -4.451 -8.847 1.00 3.31 H new ATOM 0 HZ3 LYS A 24 -12.223 -6.022 -9.033 1.00 3.31 H new ATOM 393 N HIS A 25 -5.019 -4.934 -6.498 1.00 3.33 N ATOM 394 CA HIS A 25 -4.320 -3.918 -5.622 1.00 43.21 C ATOM 395 C HIS A 25 -4.364 -4.316 -4.147 1.00 25.14 C ATOM 396 O HIS A 25 -5.083 -5.255 -3.793 1.00 14.40 O ATOM 397 CB HIS A 25 -4.861 -2.465 -5.796 1.00 20.24 C ATOM 398 CG HIS A 25 -6.349 -2.282 -5.620 1.00 55.11 C ATOM 399 ND1 HIS A 25 -7.160 -3.151 -4.920 1.00 23.04 N ATOM 400 CD2 HIS A 25 -7.174 -1.345 -6.123 1.00 71.41 C ATOM 401 CE1 HIS A 25 -8.409 -2.760 -5.022 1.00 30.34 C ATOM 402 NE2 HIS A 25 -8.449 -1.666 -5.744 1.00 51.25 N ATOM 0 H HIS A 25 -5.459 -5.689 -5.972 1.00 3.33 H new ATOM 0 HA HIS A 25 -3.284 -3.917 -5.961 1.00 43.21 H new ATOM 0 HB2 HIS A 25 -4.350 -1.821 -5.080 1.00 20.24 H new ATOM 0 HB3 HIS A 25 -4.588 -2.115 -6.792 1.00 20.24 H new ATOM 0 HD2 HIS A 25 -6.882 -0.493 -6.719 1.00 71.41 H new ATOM 0 HE1 HIS A 25 -9.262 -3.257 -4.584 1.00 30.34 H new ATOM 0 HE2 HIS A 25 -9.291 -1.142 -5.983 1.00 51.25 H new ATOM 411 N LEU A 26 -3.633 -3.573 -3.294 1.00 64.03 N ATOM 412 CA LEU A 26 -3.541 -3.871 -1.842 1.00 72.13 C ATOM 413 C LEU A 26 -4.121 -2.738 -0.960 1.00 62.25 C ATOM 414 O LEU A 26 -4.098 -1.563 -1.329 1.00 23.05 O ATOM 415 CB LEU A 26 -2.059 -4.106 -1.385 1.00 1.24 C ATOM 416 CG LEU A 26 -1.316 -5.409 -1.798 1.00 24.23 C ATOM 417 CD1 LEU A 26 -1.168 -5.540 -3.294 1.00 65.20 C ATOM 418 CD2 LEU A 26 0.061 -5.469 -1.124 1.00 32.35 C ATOM 0 H LEU A 26 -3.093 -2.757 -3.582 1.00 64.03 H new ATOM 0 HA LEU A 26 -4.130 -4.778 -1.707 1.00 72.13 H new ATOM 0 HB2 LEU A 26 -1.469 -3.266 -1.752 1.00 1.24 H new ATOM 0 HB3 LEU A 26 -2.043 -4.055 -0.296 1.00 1.24 H new ATOM 0 HG LEU A 26 -1.926 -6.247 -1.460 1.00 24.23 H new ATOM 0 HD11 LEU A 26 -0.643 -6.466 -3.528 1.00 65.20 H new ATOM 0 HD12 LEU A 26 -2.155 -5.555 -3.757 1.00 65.20 H new ATOM 0 HD13 LEU A 26 -0.599 -4.693 -3.679 1.00 65.20 H new ATOM 0 HD21 LEU A 26 0.572 -6.385 -1.420 1.00 32.35 H new ATOM 0 HD22 LEU A 26 0.654 -4.607 -1.431 1.00 32.35 H new ATOM 0 HD23 LEU A 26 -0.063 -5.457 -0.041 1.00 32.35 H new ATOM 430 N LYS A 27 -4.648 -3.135 0.191 1.00 35.44 N ATOM 431 CA LYS A 27 -5.091 -2.238 1.266 1.00 34.13 C ATOM 432 C LYS A 27 -4.173 -2.512 2.420 1.00 40.41 C ATOM 433 O LYS A 27 -4.119 -3.651 2.872 1.00 24.35 O ATOM 434 CB LYS A 27 -6.523 -2.603 1.777 1.00 22.34 C ATOM 435 CG LYS A 27 -7.035 -1.719 2.947 1.00 63.43 C ATOM 436 CD LYS A 27 -7.573 -0.381 2.474 1.00 53.34 C ATOM 437 CE LYS A 27 -9.058 -0.475 2.075 1.00 45.11 C ATOM 438 NZ LYS A 27 -9.347 -1.504 1.050 1.00 53.54 N ATOM 0 H LYS A 27 -4.786 -4.120 0.415 1.00 35.44 H new ATOM 0 HA LYS A 27 -5.089 -1.211 0.902 1.00 34.13 H new ATOM 0 HB2 LYS A 27 -7.223 -2.523 0.945 1.00 22.34 H new ATOM 0 HB3 LYS A 27 -6.526 -3.645 2.097 1.00 22.34 H new ATOM 0 HG2 LYS A 27 -7.819 -2.252 3.485 1.00 63.43 H new ATOM 0 HG3 LYS A 27 -6.222 -1.551 3.653 1.00 63.43 H new ATOM 0 HD2 LYS A 27 -7.455 0.359 3.265 1.00 53.34 H new ATOM 0 HD3 LYS A 27 -6.988 -0.034 1.622 1.00 53.34 H new ATOM 0 HE2 LYS A 27 -9.649 -0.689 2.965 1.00 45.11 H new ATOM 0 HE3 LYS A 27 -9.384 0.496 1.702 1.00 45.11 H new ATOM 0 HZ1 LYS A 27 -10.340 -1.426 0.750 1.00 53.54 H new ATOM 0 HZ2 LYS A 27 -8.725 -1.361 0.229 1.00 53.54 H new ATOM 0 HZ3 LYS A 27 -9.180 -2.449 1.450 1.00 53.54 H new ATOM 452 N ILE A 28 -3.447 -1.544 2.883 1.00 50.30 N ATOM 453 CA ILE A 28 -2.643 -1.787 4.046 1.00 73.43 C ATOM 454 C ILE A 28 -3.170 -0.967 5.186 1.00 70.20 C ATOM 455 O ILE A 28 -3.372 0.257 5.053 1.00 63.24 O ATOM 456 CB ILE A 28 -1.132 -1.509 3.863 1.00 64.25 C ATOM 457 CG1 ILE A 28 -0.591 -2.224 2.634 1.00 4.33 C ATOM 458 CG2 ILE A 28 -0.380 -2.010 5.097 1.00 1.41 C ATOM 459 CD1 ILE A 28 0.900 -2.070 2.459 1.00 1.43 C ATOM 0 H ILE A 28 -3.391 -0.604 2.491 1.00 50.30 H new ATOM 0 HA ILE A 28 -2.720 -2.855 4.247 1.00 73.43 H new ATOM 0 HB ILE A 28 -0.990 -0.436 3.734 1.00 64.25 H new ATOM 0 HG12 ILE A 28 -0.834 -3.284 2.703 1.00 4.33 H new ATOM 0 HG13 ILE A 28 -1.095 -1.839 1.748 1.00 4.33 H new ATOM 0 HG21 ILE A 28 0.686 -1.818 4.976 1.00 1.41 H new ATOM 0 HG22 ILE A 28 -0.745 -1.489 5.982 1.00 1.41 H new ATOM 0 HG23 ILE A 28 -0.545 -3.081 5.213 1.00 1.41 H new ATOM 0 HD11 ILE A 28 1.218 -2.604 1.564 1.00 1.43 H new ATOM 0 HD12 ILE A 28 1.147 -1.013 2.358 1.00 1.43 H new ATOM 0 HD13 ILE A 28 1.413 -2.481 3.329 1.00 1.43 H new ATOM 471 N LEU A 29 -3.433 -1.634 6.269 1.00 62.10 N ATOM 472 CA LEU A 29 -3.918 -1.025 7.461 1.00 24.21 C ATOM 473 C LEU A 29 -3.357 -1.744 8.697 1.00 30.24 C ATOM 474 O LEU A 29 -3.632 -2.914 8.949 1.00 15.33 O ATOM 475 CB LEU A 29 -5.491 -0.860 7.411 1.00 20.04 C ATOM 476 CG LEU A 29 -6.340 -2.066 6.986 1.00 41.13 C ATOM 477 CD1 LEU A 29 -6.425 -3.089 8.061 1.00 21.31 C ATOM 478 CD2 LEU A 29 -7.720 -1.620 6.564 1.00 11.43 C ATOM 0 H LEU A 29 -3.311 -2.644 6.345 1.00 62.10 H new ATOM 0 HA LEU A 29 -3.546 -0.004 7.544 1.00 24.21 H new ATOM 0 HB2 LEU A 29 -5.824 -0.553 8.402 1.00 20.04 H new ATOM 0 HB3 LEU A 29 -5.717 -0.039 6.730 1.00 20.04 H new ATOM 0 HG LEU A 29 -5.846 -2.531 6.133 1.00 41.13 H new ATOM 0 HD11 LEU A 29 -7.035 -3.926 7.720 1.00 21.31 H new ATOM 0 HD12 LEU A 29 -5.424 -3.445 8.305 1.00 21.31 H new ATOM 0 HD13 LEU A 29 -6.879 -2.648 8.948 1.00 21.31 H new ATOM 0 HD21 LEU A 29 -8.308 -2.488 6.266 1.00 11.43 H new ATOM 0 HD22 LEU A 29 -8.211 -1.118 7.398 1.00 11.43 H new ATOM 0 HD23 LEU A 29 -7.638 -0.931 5.723 1.00 11.43 H new ATOM 490 N ASN A 30 -2.500 -1.067 9.411 1.00 2.30 N ATOM 491 CA ASN A 30 -1.896 -1.647 10.588 1.00 23.31 C ATOM 492 C ASN A 30 -2.798 -1.483 11.778 1.00 1.23 C ATOM 493 O ASN A 30 -3.323 -0.406 12.028 1.00 64.52 O ATOM 494 CB ASN A 30 -0.511 -1.043 10.881 1.00 52.52 C ATOM 495 CG ASN A 30 0.155 -1.649 12.114 1.00 34.32 C ATOM 496 OD1 ASN A 30 0.863 -2.655 12.024 1.00 24.11 O ATOM 497 ND2 ASN A 30 -0.055 -1.044 13.262 1.00 1.20 N ATOM 0 H ASN A 30 -2.202 -0.114 9.202 1.00 2.30 H new ATOM 0 HA ASN A 30 -1.756 -2.710 10.391 1.00 23.31 H new ATOM 0 HB2 ASN A 30 0.135 -1.192 10.016 1.00 52.52 H new ATOM 0 HB3 ASN A 30 -0.612 0.033 11.021 1.00 52.52 H new ATOM 0 HD21 ASN A 30 0.373 -1.405 14.114 1.00 1.20 H new ATOM 0 HD22 ASN A 30 -0.646 -0.214 13.300 1.00 1.20 H new ATOM 504 N THR A 31 -2.996 -2.546 12.488 1.00 62.50 N ATOM 505 CA THR A 31 -3.786 -2.515 13.673 1.00 21.44 C ATOM 506 C THR A 31 -2.880 -2.728 14.882 1.00 0.43 C ATOM 507 O THR A 31 -1.852 -3.385 14.760 1.00 24.31 O ATOM 508 CB THR A 31 -4.862 -3.602 13.610 1.00 30.35 C ATOM 509 OG1 THR A 31 -4.243 -4.870 13.414 1.00 53.32 O ATOM 510 CG2 THR A 31 -5.813 -3.339 12.456 1.00 52.32 C ATOM 0 H THR A 31 -2.612 -3.463 12.260 1.00 62.50 H new ATOM 0 HA THR A 31 -4.280 -1.548 13.762 1.00 21.44 H new ATOM 0 HB THR A 31 -5.421 -3.595 14.546 1.00 30.35 H new ATOM 0 HG1 THR A 31 -3.307 -4.825 13.701 1.00 53.32 H new ATOM 0 HG21 THR A 31 -6.572 -4.121 12.425 1.00 52.32 H new ATOM 0 HG22 THR A 31 -6.294 -2.371 12.595 1.00 52.32 H new ATOM 0 HG23 THR A 31 -5.256 -3.336 11.519 1.00 52.32 H new ATOM 518 N PRO A 32 -3.223 -2.176 16.044 1.00 44.43 N ATOM 519 CA PRO A 32 -2.393 -2.313 17.243 1.00 32.21 C ATOM 520 C PRO A 32 -2.424 -3.721 17.864 1.00 32.13 C ATOM 521 O PRO A 32 -1.498 -4.106 18.573 1.00 11.14 O ATOM 522 CB PRO A 32 -2.993 -1.295 18.211 1.00 52.31 C ATOM 523 CG PRO A 32 -4.406 -1.137 17.773 1.00 35.20 C ATOM 524 CD PRO A 32 -4.412 -1.333 16.284 1.00 54.30 C ATOM 0 HA PRO A 32 -1.342 -2.147 17.008 1.00 32.21 H new ATOM 0 HB2 PRO A 32 -2.936 -1.648 19.241 1.00 52.31 H new ATOM 0 HB3 PRO A 32 -2.458 -0.346 18.169 1.00 52.31 H new ATOM 0 HG2 PRO A 32 -5.049 -1.868 18.264 1.00 35.20 H new ATOM 0 HG3 PRO A 32 -4.786 -0.150 18.036 1.00 35.20 H new ATOM 0 HD2 PRO A 32 -5.326 -1.822 15.947 1.00 54.30 H new ATOM 0 HD3 PRO A 32 -4.345 -0.383 15.754 1.00 54.30 H new ATOM 532 N ASN A 33 -3.472 -4.483 17.590 1.00 2.13 N ATOM 533 CA ASN A 33 -3.617 -5.800 18.227 1.00 5.41 C ATOM 534 C ASN A 33 -3.468 -6.948 17.212 1.00 42.01 C ATOM 535 O ASN A 33 -3.340 -8.102 17.585 1.00 44.03 O ATOM 536 CB ASN A 33 -4.954 -5.870 19.003 1.00 33.22 C ATOM 537 CG ASN A 33 -5.152 -7.131 19.864 1.00 74.45 C ATOM 538 OD1 ASN A 33 -4.087 -7.695 20.366 1.00 45.12 O flip ATOM 539 ND2 ASN A 33 -6.290 -7.565 20.091 1.00 54.11 N flip ATOM 0 H ASN A 33 -4.223 -4.228 16.948 1.00 2.13 H new ATOM 0 HA ASN A 33 -2.806 -5.927 18.944 1.00 5.41 H new ATOM 0 HB2 ASN A 33 -5.026 -4.995 19.649 1.00 33.22 H new ATOM 0 HB3 ASN A 33 -5.774 -5.807 18.287 1.00 33.22 H new ATOM 0 HD21 ASN A 33 -7.103 -7.102 19.684 1.00 54.11 H new ATOM 0 HD22 ASN A 33 -6.414 -8.385 20.685 1.00 54.11 H new ATOM 546 N CYS A 34 -3.452 -6.619 15.946 1.00 3.01 N ATOM 547 CA CYS A 34 -3.285 -7.618 14.894 1.00 55.55 C ATOM 548 C CYS A 34 -2.160 -7.188 13.971 1.00 53.44 C ATOM 549 O CYS A 34 -1.769 -6.009 13.985 1.00 24.41 O ATOM 550 CB CYS A 34 -4.597 -7.843 14.106 1.00 51.21 C ATOM 551 SG CYS A 34 -5.990 -8.415 15.140 1.00 53.55 S ATOM 0 H CYS A 34 -3.553 -5.663 15.606 1.00 3.01 H new ATOM 0 HA CYS A 34 -3.028 -8.572 15.355 1.00 55.55 H new ATOM 0 HB2 CYS A 34 -4.879 -6.911 13.616 1.00 51.21 H new ATOM 0 HB3 CYS A 34 -4.416 -8.575 13.319 1.00 51.21 H new ATOM 556 N ALA A 35 -1.621 -8.126 13.205 1.00 4.44 N ATOM 557 CA ALA A 35 -0.522 -7.862 12.267 1.00 1.44 C ATOM 558 C ALA A 35 -0.851 -6.721 11.286 1.00 35.42 C ATOM 559 O ALA A 35 -2.018 -6.336 11.141 1.00 23.00 O ATOM 560 CB ALA A 35 -0.188 -9.132 11.499 1.00 73.12 C ATOM 0 H ALA A 35 -1.930 -9.098 13.212 1.00 4.44 H new ATOM 0 HA ALA A 35 0.341 -7.544 12.852 1.00 1.44 H new ATOM 0 HB1 ALA A 35 0.628 -8.933 10.804 1.00 73.12 H new ATOM 0 HB2 ALA A 35 0.113 -9.912 12.199 1.00 73.12 H new ATOM 0 HB3 ALA A 35 -1.066 -9.463 10.943 1.00 73.12 H new ATOM 566 N CYS A 36 0.190 -6.173 10.634 1.00 21.42 N ATOM 567 CA CYS A 36 0.020 -5.122 9.615 1.00 15.43 C ATOM 568 C CYS A 36 -0.777 -5.729 8.456 1.00 73.24 C ATOM 569 O CYS A 36 -0.236 -6.375 7.587 1.00 41.13 O ATOM 570 CB CYS A 36 1.410 -4.593 9.153 1.00 13.35 C ATOM 571 SG CYS A 36 1.401 -3.159 8.000 1.00 30.41 S ATOM 0 H CYS A 36 1.161 -6.442 10.796 1.00 21.42 H new ATOM 0 HA CYS A 36 -0.522 -4.266 10.017 1.00 15.43 H new ATOM 0 HB2 CYS A 36 1.981 -4.315 10.039 1.00 13.35 H new ATOM 0 HB3 CYS A 36 1.945 -5.413 8.674 1.00 13.35 H new ATOM 576 N GLN A 37 -2.068 -5.556 8.523 1.00 53.44 N ATOM 577 CA GLN A 37 -3.003 -6.241 7.677 1.00 54.51 C ATOM 578 C GLN A 37 -2.960 -5.721 6.256 1.00 53.12 C ATOM 579 O GLN A 37 -2.936 -4.504 6.022 1.00 24.20 O ATOM 580 CB GLN A 37 -4.410 -6.055 8.220 1.00 43.51 C ATOM 581 CG GLN A 37 -5.432 -7.028 7.666 1.00 1.34 C ATOM 582 CD GLN A 37 -5.470 -8.357 8.420 1.00 62.23 C ATOM 583 OE1 GLN A 37 -6.503 -9.002 8.465 1.00 53.51 O ATOM 584 NE2 GLN A 37 -4.389 -8.735 9.073 1.00 31.23 N ATOM 0 H GLN A 37 -2.509 -4.918 9.185 1.00 53.44 H new ATOM 0 HA GLN A 37 -2.728 -7.296 7.668 1.00 54.51 H new ATOM 0 HB2 GLN A 37 -4.383 -6.155 9.305 1.00 43.51 H new ATOM 0 HB3 GLN A 37 -4.739 -5.039 8.001 1.00 43.51 H new ATOM 0 HG2 GLN A 37 -6.419 -6.568 7.704 1.00 1.34 H new ATOM 0 HG3 GLN A 37 -5.210 -7.220 6.616 1.00 1.34 H new ATOM 0 HE21 GLN A 37 -3.538 -8.176 9.017 1.00 31.23 H new ATOM 0 HE22 GLN A 37 -4.404 -9.587 9.634 1.00 31.23 H new ATOM 593 N ILE A 38 -2.955 -6.642 5.325 1.00 74.21 N ATOM 594 CA ILE A 38 -2.989 -6.330 3.932 1.00 5.51 C ATOM 595 C ILE A 38 -4.165 -7.055 3.298 1.00 34.42 C ATOM 596 O ILE A 38 -4.356 -8.242 3.519 1.00 5.41 O ATOM 597 CB ILE A 38 -1.672 -6.732 3.225 1.00 33.42 C ATOM 598 CG1 ILE A 38 -0.491 -5.954 3.835 1.00 14.42 C ATOM 599 CG2 ILE A 38 -1.770 -6.498 1.725 1.00 63.45 C ATOM 600 CD1 ILE A 38 0.834 -6.195 3.156 1.00 71.34 C ATOM 0 H ILE A 38 -2.927 -7.642 5.524 1.00 74.21 H new ATOM 0 HA ILE A 38 -3.103 -5.252 3.817 1.00 5.51 H new ATOM 0 HB ILE A 38 -1.500 -7.797 3.379 1.00 33.42 H new ATOM 0 HG12 ILE A 38 -0.716 -4.888 3.797 1.00 14.42 H new ATOM 0 HG13 ILE A 38 -0.400 -6.223 4.887 1.00 14.42 H new ATOM 0 HG21 ILE A 38 -0.833 -6.788 1.250 1.00 63.45 H new ATOM 0 HG22 ILE A 38 -2.584 -7.096 1.316 1.00 63.45 H new ATOM 0 HG23 ILE A 38 -1.963 -5.443 1.533 1.00 63.45 H new ATOM 0 HD11 ILE A 38 1.608 -5.608 3.650 1.00 71.34 H new ATOM 0 HD12 ILE A 38 1.087 -7.254 3.217 1.00 71.34 H new ATOM 0 HD13 ILE A 38 0.766 -5.898 2.109 1.00 71.34 H new ATOM 612 N VAL A 39 -4.964 -6.342 2.555 1.00 64.32 N ATOM 613 CA VAL A 39 -6.114 -6.931 1.892 1.00 25.22 C ATOM 614 C VAL A 39 -6.008 -6.696 0.385 1.00 11.35 C ATOM 615 O VAL A 39 -5.724 -5.586 -0.052 1.00 35.12 O ATOM 616 CB VAL A 39 -7.443 -6.328 2.430 1.00 52.10 C ATOM 617 CG1 VAL A 39 -8.640 -7.029 1.827 1.00 24.41 C ATOM 618 CG2 VAL A 39 -7.500 -6.385 3.948 1.00 41.12 C ATOM 0 H VAL A 39 -4.846 -5.343 2.387 1.00 64.32 H new ATOM 0 HA VAL A 39 -6.122 -8.001 2.099 1.00 25.22 H new ATOM 0 HB VAL A 39 -7.473 -5.280 2.131 1.00 52.10 H new ATOM 0 HG11 VAL A 39 -9.556 -6.588 2.220 1.00 24.41 H new ATOM 0 HG12 VAL A 39 -8.619 -6.917 0.743 1.00 24.41 H new ATOM 0 HG13 VAL A 39 -8.608 -8.088 2.083 1.00 24.41 H new ATOM 0 HG21 VAL A 39 -8.441 -5.956 4.293 1.00 41.12 H new ATOM 0 HG22 VAL A 39 -7.432 -7.422 4.276 1.00 41.12 H new ATOM 0 HG23 VAL A 39 -6.668 -5.817 4.365 1.00 41.12 H new ATOM 628 N ALA A 40 -6.237 -7.718 -0.398 1.00 35.44 N ATOM 629 CA ALA A 40 -6.116 -7.617 -1.830 1.00 51.23 C ATOM 630 C ALA A 40 -7.344 -8.189 -2.514 1.00 72.11 C ATOM 631 O ALA A 40 -7.886 -9.209 -2.101 1.00 33.32 O ATOM 632 CB ALA A 40 -4.859 -8.335 -2.307 1.00 13.14 C ATOM 0 H ALA A 40 -6.512 -8.641 -0.063 1.00 35.44 H new ATOM 0 HA ALA A 40 -6.037 -6.563 -2.095 1.00 51.23 H new ATOM 0 HB1 ALA A 40 -4.781 -8.250 -3.391 1.00 13.14 H new ATOM 0 HB2 ALA A 40 -3.983 -7.882 -1.843 1.00 13.14 H new ATOM 0 HB3 ALA A 40 -4.913 -9.387 -2.028 1.00 13.14 H new ATOM 638 N ARG A 41 -7.795 -7.539 -3.544 1.00 34.15 N ATOM 639 CA ARG A 41 -8.923 -8.048 -4.277 1.00 32.52 C ATOM 640 C ARG A 41 -8.508 -8.820 -5.493 1.00 15.12 C ATOM 641 O ARG A 41 -7.720 -8.331 -6.324 1.00 43.33 O ATOM 642 CB ARG A 41 -9.954 -6.976 -4.648 1.00 23.04 C ATOM 643 CG ARG A 41 -10.750 -6.442 -3.474 1.00 32.30 C ATOM 644 CD ARG A 41 -11.847 -5.500 -3.938 1.00 23.33 C ATOM 645 NE ARG A 41 -12.708 -5.074 -2.832 1.00 55.04 N ATOM 646 CZ ARG A 41 -13.886 -4.450 -2.956 1.00 10.21 C ATOM 647 NH1 ARG A 41 -14.374 -4.148 -4.160 1.00 41.05 N ATOM 648 NH2 ARG A 41 -14.570 -4.136 -1.868 1.00 31.32 N ATOM 0 H ARG A 41 -7.407 -6.664 -3.896 1.00 34.15 H new ATOM 0 HA ARG A 41 -9.417 -8.732 -3.586 1.00 32.52 H new ATOM 0 HB2 ARG A 41 -9.439 -6.145 -5.131 1.00 23.04 H new ATOM 0 HB3 ARG A 41 -10.645 -7.392 -5.381 1.00 23.04 H new ATOM 0 HG2 ARG A 41 -11.190 -7.272 -2.921 1.00 32.30 H new ATOM 0 HG3 ARG A 41 -10.084 -5.919 -2.787 1.00 32.30 H new ATOM 0 HD2 ARG A 41 -11.399 -4.624 -4.407 1.00 23.33 H new ATOM 0 HD3 ARG A 41 -12.452 -5.994 -4.699 1.00 23.33 H new ATOM 0 HE ARG A 41 -12.382 -5.270 -1.886 1.00 55.04 H new ATOM 0 HH11 ARG A 41 -13.849 -4.393 -4.999 1.00 41.05 H new ATOM 0 HH12 ARG A 41 -15.273 -3.672 -4.241 1.00 41.05 H new ATOM 0 HH21 ARG A 41 -14.199 -4.369 -0.947 1.00 31.32 H new ATOM 0 HH22 ARG A 41 -15.469 -3.660 -1.950 1.00 31.32 H new ATOM 662 N LEU A 42 -9.008 -10.037 -5.557 1.00 31.42 N ATOM 663 CA LEU A 42 -8.849 -10.929 -6.692 1.00 33.12 C ATOM 664 C LEU A 42 -9.541 -10.318 -7.904 1.00 40.30 C ATOM 665 O LEU A 42 -10.450 -9.483 -7.763 1.00 44.33 O ATOM 666 CB LEU A 42 -9.512 -12.286 -6.386 1.00 2.15 C ATOM 667 CG LEU A 42 -8.986 -13.067 -5.173 1.00 21.53 C ATOM 668 CD1 LEU A 42 -9.827 -14.321 -4.942 1.00 33.33 C ATOM 669 CD2 LEU A 42 -7.524 -13.441 -5.365 1.00 12.41 C ATOM 0 H LEU A 42 -9.553 -10.447 -4.799 1.00 31.42 H new ATOM 0 HA LEU A 42 -7.787 -11.073 -6.889 1.00 33.12 H new ATOM 0 HB2 LEU A 42 -10.579 -12.116 -6.241 1.00 2.15 H new ATOM 0 HB3 LEU A 42 -9.407 -12.919 -7.267 1.00 2.15 H new ATOM 0 HG LEU A 42 -9.064 -12.426 -4.295 1.00 21.53 H new ATOM 0 HD11 LEU A 42 -9.442 -14.864 -4.079 1.00 33.33 H new ATOM 0 HD12 LEU A 42 -10.863 -14.036 -4.758 1.00 33.33 H new ATOM 0 HD13 LEU A 42 -9.778 -14.960 -5.824 1.00 33.33 H new ATOM 0 HD21 LEU A 42 -7.172 -13.994 -4.494 1.00 12.41 H new ATOM 0 HD22 LEU A 42 -7.421 -14.062 -6.255 1.00 12.41 H new ATOM 0 HD23 LEU A 42 -6.929 -12.535 -5.484 1.00 12.41 H new ATOM 681 N LYS A 43 -9.140 -10.726 -9.069 1.00 55.44 N ATOM 682 CA LYS A 43 -9.720 -10.210 -10.282 1.00 74.01 C ATOM 683 C LYS A 43 -11.037 -10.888 -10.643 1.00 11.24 C ATOM 684 O LYS A 43 -11.088 -11.743 -11.531 1.00 13.31 O ATOM 685 CB LYS A 43 -8.735 -10.303 -11.412 1.00 22.22 C ATOM 686 CG LYS A 43 -7.521 -9.427 -11.221 1.00 72.55 C ATOM 687 CD LYS A 43 -6.454 -9.627 -12.287 1.00 50.15 C ATOM 688 CE LYS A 43 -6.873 -9.218 -13.726 1.00 75.41 C ATOM 689 NZ LYS A 43 -7.995 -10.000 -14.312 1.00 0.41 N ATOM 0 H LYS A 43 -8.407 -11.421 -9.211 1.00 55.44 H new ATOM 0 HA LYS A 43 -9.956 -9.161 -10.104 1.00 74.01 H new ATOM 0 HB2 LYS A 43 -8.413 -11.339 -11.520 1.00 22.22 H new ATOM 0 HB3 LYS A 43 -9.232 -10.025 -12.341 1.00 22.22 H new ATOM 0 HG2 LYS A 43 -7.833 -8.383 -11.222 1.00 72.55 H new ATOM 0 HG3 LYS A 43 -7.087 -9.629 -10.242 1.00 72.55 H new ATOM 0 HD2 LYS A 43 -5.570 -9.054 -12.006 1.00 50.15 H new ATOM 0 HD3 LYS A 43 -6.163 -10.677 -12.295 1.00 50.15 H new ATOM 0 HE2 LYS A 43 -7.152 -8.164 -13.719 1.00 75.41 H new ATOM 0 HE3 LYS A 43 -6.006 -9.314 -14.379 1.00 75.41 H new ATOM 0 HZ1 LYS A 43 -7.849 -10.102 -15.337 1.00 0.41 H new ATOM 0 HZ2 LYS A 43 -8.029 -10.942 -13.872 1.00 0.41 H new ATOM 0 HZ3 LYS A 43 -8.892 -9.504 -14.138 1.00 0.41 H new ATOM 703 N ASN A 44 -12.079 -10.549 -9.878 1.00 52.22 N ATOM 704 CA ASN A 44 -13.471 -11.029 -10.086 1.00 51.13 C ATOM 705 C ASN A 44 -13.607 -12.551 -9.978 1.00 4.21 C ATOM 706 O ASN A 44 -14.663 -13.114 -10.303 1.00 32.23 O ATOM 707 CB ASN A 44 -14.049 -10.541 -11.434 1.00 20.21 C ATOM 708 CG ASN A 44 -14.147 -9.028 -11.531 1.00 62.35 C ATOM 709 OD1 ASN A 44 -13.226 -8.353 -11.997 1.00 42.41 O ATOM 710 ND2 ASN A 44 -15.256 -8.479 -11.089 1.00 61.14 N ATOM 0 H ASN A 44 -11.989 -9.922 -9.079 1.00 52.22 H new ATOM 0 HA ASN A 44 -14.052 -10.593 -9.273 1.00 51.13 H new ATOM 0 HB2 ASN A 44 -13.422 -10.911 -12.246 1.00 20.21 H new ATOM 0 HB3 ASN A 44 -15.040 -10.973 -11.574 1.00 20.21 H new ATOM 0 HD21 ASN A 44 -15.374 -7.466 -11.126 1.00 61.14 H new ATOM 0 HD22 ASN A 44 -15.999 -9.065 -10.709 1.00 61.14 H new ATOM 717 N ASN A 45 -12.573 -13.203 -9.479 1.00 22.14 N ATOM 718 CA ASN A 45 -12.545 -14.655 -9.392 1.00 22.24 C ATOM 719 C ASN A 45 -13.529 -15.182 -8.381 1.00 30.04 C ATOM 720 O ASN A 45 -14.457 -15.908 -8.737 1.00 0.21 O ATOM 721 CB ASN A 45 -11.144 -15.186 -9.083 1.00 61.45 C ATOM 722 CG ASN A 45 -10.127 -14.819 -10.134 1.00 23.51 C ATOM 723 OD1 ASN A 45 -9.479 -13.777 -10.038 1.00 41.25 O ATOM 724 ND2 ASN A 45 -9.979 -15.647 -11.145 1.00 65.34 N ATOM 0 H ASN A 45 -11.733 -12.746 -9.124 1.00 22.14 H new ATOM 0 HA ASN A 45 -12.839 -15.019 -10.376 1.00 22.24 H new ATOM 0 HB2 ASN A 45 -10.818 -14.795 -8.119 1.00 61.45 H new ATOM 0 HB3 ASN A 45 -11.186 -16.271 -8.990 1.00 61.45 H new ATOM 0 HD21 ASN A 45 -9.309 -15.435 -11.884 1.00 65.34 H new ATOM 0 HD22 ASN A 45 -10.534 -16.501 -11.190 1.00 65.34 H new ATOM 731 N ASN A 46 -13.358 -14.809 -7.126 1.00 52.12 N ATOM 732 CA ASN A 46 -14.220 -15.332 -6.069 1.00 40.30 C ATOM 733 C ASN A 46 -14.561 -14.293 -5.041 1.00 35.41 C ATOM 734 O ASN A 46 -15.712 -13.869 -4.930 1.00 12.12 O ATOM 735 CB ASN A 46 -13.601 -16.555 -5.366 1.00 23.31 C ATOM 736 CG ASN A 46 -13.484 -17.770 -6.249 1.00 53.32 C ATOM 737 OD1 ASN A 46 -12.472 -17.969 -6.916 1.00 61.41 O ATOM 738 ND2 ASN A 46 -14.510 -18.584 -6.263 1.00 34.30 N ATOM 0 H ASN A 46 -12.642 -14.155 -6.811 1.00 52.12 H new ATOM 0 HA ASN A 46 -15.138 -15.640 -6.570 1.00 40.30 H new ATOM 0 HB2 ASN A 46 -12.610 -16.288 -4.998 1.00 23.31 H new ATOM 0 HB3 ASN A 46 -14.207 -16.807 -4.496 1.00 23.31 H new ATOM 0 HD21 ASN A 46 -14.488 -19.422 -6.844 1.00 34.30 H new ATOM 0 HD22 ASN A 46 -15.331 -18.380 -5.693 1.00 34.30 H new ATOM 745 N ARG A 47 -13.573 -13.861 -4.290 1.00 35.50 N ATOM 746 CA ARG A 47 -13.824 -12.950 -3.204 1.00 2.03 C ATOM 747 C ARG A 47 -12.675 -11.981 -3.040 1.00 11.01 C ATOM 748 O ARG A 47 -11.785 -11.903 -3.887 1.00 44.40 O ATOM 749 CB ARG A 47 -14.052 -13.724 -1.864 1.00 42.33 C ATOM 750 CG ARG A 47 -12.839 -14.482 -1.242 1.00 61.12 C ATOM 751 CD ARG A 47 -12.380 -15.717 -2.028 1.00 2.33 C ATOM 752 NE ARG A 47 -11.249 -16.399 -1.353 1.00 43.02 N ATOM 753 CZ ARG A 47 -10.667 -17.559 -1.734 1.00 33.02 C ATOM 754 NH1 ARG A 47 -11.195 -18.288 -2.718 1.00 0.15 N ATOM 755 NH2 ARG A 47 -9.589 -18.012 -1.084 1.00 31.13 N ATOM 0 H ARG A 47 -12.596 -14.125 -4.412 1.00 35.50 H new ATOM 0 HA ARG A 47 -14.728 -12.392 -3.446 1.00 2.03 H new ATOM 0 HB2 ARG A 47 -14.416 -13.011 -1.124 1.00 42.33 H new ATOM 0 HB3 ARG A 47 -14.850 -14.448 -2.028 1.00 42.33 H new ATOM 0 HG2 ARG A 47 -12.001 -13.790 -1.158 1.00 61.12 H new ATOM 0 HG3 ARG A 47 -13.101 -14.790 -0.230 1.00 61.12 H new ATOM 0 HD2 ARG A 47 -13.213 -16.411 -2.136 1.00 2.33 H new ATOM 0 HD3 ARG A 47 -12.080 -15.420 -3.033 1.00 2.33 H new ATOM 0 HE ARG A 47 -10.873 -15.949 -0.519 1.00 43.02 H new ATOM 0 HH11 ARG A 47 -12.043 -17.972 -3.188 1.00 0.15 H new ATOM 0 HH12 ARG A 47 -10.751 -19.162 -3.000 1.00 0.15 H new ATOM 0 HH21 ARG A 47 -9.206 -17.483 -0.301 1.00 31.13 H new ATOM 0 HH22 ARG A 47 -9.150 -18.887 -1.372 1.00 31.13 H new ATOM 769 N GLN A 48 -12.701 -11.262 -1.956 1.00 34.04 N ATOM 770 CA GLN A 48 -11.641 -10.379 -1.587 1.00 71.01 C ATOM 771 C GLN A 48 -10.788 -11.142 -0.604 1.00 44.53 C ATOM 772 O GLN A 48 -11.313 -11.734 0.339 1.00 61.03 O ATOM 773 CB GLN A 48 -12.238 -9.128 -0.925 1.00 72.44 C ATOM 774 CG GLN A 48 -11.220 -8.177 -0.325 1.00 63.34 C ATOM 775 CD GLN A 48 -11.863 -6.957 0.304 1.00 74.30 C ATOM 776 OE1 GLN A 48 -12.054 -5.930 -0.351 1.00 34.44 O ATOM 777 NE2 GLN A 48 -12.207 -7.056 1.563 1.00 32.34 N ATOM 0 H GLN A 48 -13.476 -11.275 -1.293 1.00 34.04 H new ATOM 0 HA GLN A 48 -11.052 -10.056 -2.446 1.00 71.01 H new ATOM 0 HB2 GLN A 48 -12.826 -8.587 -1.667 1.00 72.44 H new ATOM 0 HB3 GLN A 48 -12.926 -9.443 -0.141 1.00 72.44 H new ATOM 0 HG2 GLN A 48 -10.635 -8.704 0.429 1.00 63.34 H new ATOM 0 HG3 GLN A 48 -10.525 -7.857 -1.101 1.00 63.34 H new ATOM 0 HE21 GLN A 48 -12.033 -7.922 2.073 1.00 32.34 H new ATOM 0 HE22 GLN A 48 -12.649 -6.267 2.034 1.00 32.34 H new ATOM 786 N VAL A 49 -9.507 -11.148 -0.810 1.00 41.25 N ATOM 787 CA VAL A 49 -8.648 -11.936 0.022 1.00 62.05 C ATOM 788 C VAL A 49 -7.753 -11.099 0.882 1.00 23.13 C ATOM 789 O VAL A 49 -7.413 -9.969 0.560 1.00 33.21 O ATOM 790 CB VAL A 49 -7.838 -13.008 -0.756 1.00 62.32 C ATOM 791 CG1 VAL A 49 -8.759 -14.074 -1.312 1.00 10.41 C ATOM 792 CG2 VAL A 49 -7.031 -12.395 -1.881 1.00 1.34 C ATOM 0 H VAL A 49 -9.034 -10.619 -1.543 1.00 41.25 H new ATOM 0 HA VAL A 49 -9.324 -12.480 0.682 1.00 62.05 H new ATOM 0 HB VAL A 49 -7.145 -13.463 -0.049 1.00 62.32 H new ATOM 0 HG11 VAL A 49 -8.172 -14.816 -1.854 1.00 10.41 H new ATOM 0 HG12 VAL A 49 -9.290 -14.559 -0.493 1.00 10.41 H new ATOM 0 HG13 VAL A 49 -9.479 -13.615 -1.990 1.00 10.41 H new ATOM 0 HG21 VAL A 49 -6.479 -13.178 -2.401 1.00 1.34 H new ATOM 0 HG22 VAL A 49 -7.702 -11.898 -2.581 1.00 1.34 H new ATOM 0 HG23 VAL A 49 -6.330 -11.667 -1.472 1.00 1.34 H new ATOM 802 N CYS A 50 -7.394 -11.650 1.970 1.00 75.01 N ATOM 803 CA CYS A 50 -6.580 -10.997 2.931 1.00 54.44 C ATOM 804 C CYS A 50 -5.224 -11.603 2.861 1.00 75.24 C ATOM 805 O CYS A 50 -5.099 -12.794 2.884 1.00 12.22 O ATOM 806 CB CYS A 50 -7.225 -11.211 4.265 1.00 54.32 C ATOM 807 SG CYS A 50 -8.964 -10.659 4.243 1.00 24.33 S ATOM 0 H CYS A 50 -7.662 -12.598 2.233 1.00 75.01 H new ATOM 0 HA CYS A 50 -6.482 -9.926 2.755 1.00 54.44 H new ATOM 0 HB2 CYS A 50 -7.178 -12.267 4.531 1.00 54.32 H new ATOM 0 HB3 CYS A 50 -6.675 -10.664 5.031 1.00 54.32 H new ATOM 812 N ILE A 51 -4.223 -10.807 2.766 1.00 50.43 N ATOM 813 CA ILE A 51 -2.912 -11.325 2.511 1.00 12.35 C ATOM 814 C ILE A 51 -2.044 -11.202 3.760 1.00 23.15 C ATOM 815 O ILE A 51 -2.233 -10.290 4.575 1.00 32.11 O ATOM 816 CB ILE A 51 -2.240 -10.554 1.340 1.00 52.24 C ATOM 817 CG1 ILE A 51 -3.201 -10.382 0.151 1.00 43.00 C ATOM 818 CG2 ILE A 51 -1.032 -11.316 0.869 1.00 52.13 C ATOM 819 CD1 ILE A 51 -3.668 -11.675 -0.476 1.00 24.42 C ATOM 0 H ILE A 51 -4.277 -9.793 2.860 1.00 50.43 H new ATOM 0 HA ILE A 51 -3.008 -12.376 2.238 1.00 12.35 H new ATOM 0 HB ILE A 51 -1.959 -9.567 1.709 1.00 52.24 H new ATOM 0 HG12 ILE A 51 -4.073 -9.820 0.485 1.00 43.00 H new ATOM 0 HG13 ILE A 51 -2.708 -9.781 -0.613 1.00 43.00 H new ATOM 0 HG21 ILE A 51 -0.559 -10.777 0.048 1.00 52.13 H new ATOM 0 HG22 ILE A 51 -0.324 -11.419 1.691 1.00 52.13 H new ATOM 0 HG23 ILE A 51 -1.336 -12.305 0.526 1.00 52.13 H new ATOM 0 HD11 ILE A 51 -4.341 -11.455 -1.305 1.00 24.42 H new ATOM 0 HD12 ILE A 51 -2.807 -12.232 -0.845 1.00 24.42 H new ATOM 0 HD13 ILE A 51 -4.194 -12.272 0.269 1.00 24.42 H new ATOM 831 N ASP A 52 -1.120 -12.127 3.911 1.00 55.12 N ATOM 832 CA ASP A 52 -0.191 -12.100 5.020 1.00 74.31 C ATOM 833 C ASP A 52 0.979 -11.210 4.662 1.00 25.22 C ATOM 834 O ASP A 52 1.612 -11.399 3.620 1.00 15.51 O ATOM 835 CB ASP A 52 0.317 -13.503 5.351 1.00 70.33 C ATOM 836 CG ASP A 52 1.182 -13.544 6.601 1.00 3.53 C ATOM 837 OD1 ASP A 52 0.656 -13.339 7.713 1.00 61.13 O ATOM 838 OD2 ASP A 52 2.374 -13.838 6.496 1.00 72.42 O ATOM 0 H ASP A 52 -0.992 -12.913 3.274 1.00 55.12 H new ATOM 0 HA ASP A 52 -0.708 -11.711 5.897 1.00 74.31 H new ATOM 0 HB2 ASP A 52 -0.535 -14.170 5.484 1.00 70.33 H new ATOM 0 HB3 ASP A 52 0.891 -13.884 4.506 1.00 70.33 H new ATOM 843 N PRO A 53 1.291 -10.237 5.512 1.00 3.31 N ATOM 844 CA PRO A 53 2.382 -9.276 5.266 1.00 64.13 C ATOM 845 C PRO A 53 3.781 -9.892 5.476 1.00 1.11 C ATOM 846 O PRO A 53 4.802 -9.193 5.426 1.00 11.40 O ATOM 847 CB PRO A 53 2.127 -8.186 6.308 1.00 33.23 C ATOM 848 CG PRO A 53 1.402 -8.878 7.423 1.00 72.51 C ATOM 849 CD PRO A 53 0.595 -9.980 6.787 1.00 2.14 C ATOM 0 HA PRO A 53 2.382 -8.922 4.235 1.00 64.13 H new ATOM 0 HB2 PRO A 53 3.062 -7.747 6.657 1.00 33.23 H new ATOM 0 HB3 PRO A 53 1.530 -7.374 5.892 1.00 33.23 H new ATOM 0 HG2 PRO A 53 2.105 -9.282 8.151 1.00 72.51 H new ATOM 0 HG3 PRO A 53 0.755 -8.182 7.957 1.00 72.51 H new ATOM 0 HD2 PRO A 53 0.570 -10.870 7.415 1.00 2.14 H new ATOM 0 HD3 PRO A 53 -0.439 -9.675 6.624 1.00 2.14 H new ATOM 857 N LYS A 54 3.820 -11.182 5.739 1.00 1.33 N ATOM 858 CA LYS A 54 5.047 -11.877 5.928 1.00 63.52 C ATOM 859 C LYS A 54 5.278 -12.859 4.790 1.00 23.42 C ATOM 860 O LYS A 54 5.998 -13.820 4.940 1.00 22.31 O ATOM 861 CB LYS A 54 5.016 -12.613 7.246 1.00 62.05 C ATOM 862 CG LYS A 54 4.779 -11.721 8.456 1.00 11.11 C ATOM 863 CD LYS A 54 4.705 -12.539 9.730 1.00 22.21 C ATOM 864 CE LYS A 54 5.987 -13.308 9.965 1.00 0.23 C ATOM 865 NZ LYS A 54 7.138 -12.423 10.202 1.00 45.32 N ATOM 0 H LYS A 54 2.990 -11.768 5.825 1.00 1.33 H new ATOM 0 HA LYS A 54 5.864 -11.156 5.937 1.00 63.52 H new ATOM 0 HB2 LYS A 54 4.232 -13.370 7.208 1.00 62.05 H new ATOM 0 HB3 LYS A 54 5.961 -13.140 7.377 1.00 62.05 H new ATOM 0 HG2 LYS A 54 5.583 -10.990 8.536 1.00 11.11 H new ATOM 0 HG3 LYS A 54 3.852 -11.163 8.324 1.00 11.11 H new ATOM 0 HD2 LYS A 54 4.513 -11.880 10.577 1.00 22.21 H new ATOM 0 HD3 LYS A 54 3.867 -13.234 9.670 1.00 22.21 H new ATOM 0 HE2 LYS A 54 5.859 -13.969 10.822 1.00 0.23 H new ATOM 0 HE3 LYS A 54 6.191 -13.941 9.101 1.00 0.23 H new ATOM 0 HZ1 LYS A 54 7.824 -12.531 9.428 1.00 45.32 H new ATOM 0 HZ2 LYS A 54 6.814 -11.436 10.243 1.00 45.32 H new ATOM 0 HZ3 LYS A 54 7.591 -12.676 11.103 1.00 45.32 H new ATOM 879 N LEU A 55 4.637 -12.624 3.668 1.00 71.44 N ATOM 880 CA LEU A 55 4.903 -13.393 2.440 1.00 22.44 C ATOM 881 C LEU A 55 6.292 -13.094 1.870 1.00 33.54 C ATOM 882 O LEU A 55 7.191 -12.703 2.580 1.00 62.11 O ATOM 883 CB LEU A 55 3.847 -13.081 1.389 1.00 22.53 C ATOM 884 CG LEU A 55 2.519 -13.758 1.570 1.00 52.53 C ATOM 885 CD1 LEU A 55 1.577 -13.299 0.495 1.00 25.24 C ATOM 886 CD2 LEU A 55 2.710 -15.232 1.438 1.00 2.32 C ATOM 0 H LEU A 55 3.921 -11.905 3.565 1.00 71.44 H new ATOM 0 HA LEU A 55 4.865 -14.450 2.703 1.00 22.44 H new ATOM 0 HB2 LEU A 55 3.684 -12.003 1.375 1.00 22.53 H new ATOM 0 HB3 LEU A 55 4.243 -13.357 0.412 1.00 22.53 H new ATOM 0 HG LEU A 55 2.111 -13.513 2.551 1.00 52.53 H new ATOM 0 HD11 LEU A 55 0.612 -13.789 0.624 1.00 25.24 H new ATOM 0 HD12 LEU A 55 1.448 -12.219 0.562 1.00 25.24 H new ATOM 0 HD13 LEU A 55 1.987 -13.556 -0.482 1.00 25.24 H new ATOM 0 HD21 LEU A 55 1.752 -15.736 1.567 1.00 2.32 H new ATOM 0 HD22 LEU A 55 3.109 -15.460 0.450 1.00 2.32 H new ATOM 0 HD23 LEU A 55 3.408 -15.578 2.200 1.00 2.32 H new ATOM 898 N LYS A 56 6.478 -13.362 0.602 1.00 74.10 N ATOM 899 CA LYS A 56 7.693 -12.993 -0.043 1.00 61.45 C ATOM 900 C LYS A 56 7.415 -11.999 -1.161 1.00 13.42 C ATOM 901 O LYS A 56 8.119 -10.998 -1.284 1.00 10.14 O ATOM 902 CB LYS A 56 8.477 -14.215 -0.527 1.00 4.14 C ATOM 903 CG LYS A 56 9.812 -13.895 -1.201 1.00 2.44 C ATOM 904 CD LYS A 56 10.739 -13.095 -0.297 1.00 70.33 C ATOM 905 CE LYS A 56 12.121 -12.944 -0.918 1.00 2.15 C ATOM 906 NZ LYS A 56 12.100 -12.284 -2.250 1.00 44.01 N ATOM 0 H LYS A 56 5.799 -13.834 0.005 1.00 74.10 H new ATOM 0 HA LYS A 56 8.333 -12.499 0.688 1.00 61.45 H new ATOM 0 HB2 LYS A 56 8.664 -14.870 0.324 1.00 4.14 H new ATOM 0 HB3 LYS A 56 7.856 -14.773 -1.228 1.00 4.14 H new ATOM 0 HG2 LYS A 56 10.303 -14.825 -1.489 1.00 2.44 H new ATOM 0 HG3 LYS A 56 9.628 -13.334 -2.117 1.00 2.44 H new ATOM 0 HD2 LYS A 56 10.311 -12.110 -0.114 1.00 70.33 H new ATOM 0 HD3 LYS A 56 10.824 -13.591 0.670 1.00 70.33 H new ATOM 0 HE2 LYS A 56 12.753 -12.366 -0.244 1.00 2.15 H new ATOM 0 HE3 LYS A 56 12.577 -13.929 -1.016 1.00 2.15 H new ATOM 0 HZ1 LYS A 56 13.047 -12.333 -2.677 1.00 44.01 H new ATOM 0 HZ2 LYS A 56 11.417 -12.768 -2.867 1.00 44.01 H new ATOM 0 HZ3 LYS A 56 11.821 -11.288 -2.140 1.00 44.01 H new ATOM 920 N TRP A 57 6.355 -12.242 -1.956 1.00 60.24 N ATOM 921 CA TRP A 57 6.021 -11.304 -3.035 1.00 63.51 C ATOM 922 C TRP A 57 5.532 -9.969 -2.491 1.00 63.20 C ATOM 923 O TRP A 57 5.701 -8.928 -3.128 1.00 55.14 O ATOM 924 CB TRP A 57 5.049 -11.873 -4.094 1.00 41.40 C ATOM 925 CG TRP A 57 3.659 -12.260 -3.654 1.00 33.05 C ATOM 926 CD1 TRP A 57 3.231 -13.462 -3.141 1.00 23.10 C ATOM 927 CD2 TRP A 57 2.493 -11.439 -3.756 1.00 62.04 C ATOM 928 NE1 TRP A 57 1.873 -13.419 -2.956 1.00 11.10 N ATOM 929 CE2 TRP A 57 1.405 -12.197 -3.311 1.00 72.50 C ATOM 930 CE3 TRP A 57 2.267 -10.128 -4.184 1.00 30.21 C ATOM 931 CZ2 TRP A 57 0.112 -11.702 -3.288 1.00 14.15 C ATOM 932 CZ3 TRP A 57 0.982 -9.639 -4.160 1.00 64.23 C ATOM 933 CH2 TRP A 57 -0.077 -10.428 -3.713 1.00 70.21 C ATOM 0 H TRP A 57 5.738 -13.050 -1.875 1.00 60.24 H new ATOM 0 HA TRP A 57 6.959 -11.135 -3.564 1.00 63.51 H new ATOM 0 HB2 TRP A 57 4.952 -11.133 -4.888 1.00 41.40 H new ATOM 0 HB3 TRP A 57 5.516 -12.754 -4.534 1.00 41.40 H new ATOM 0 HD1 TRP A 57 3.865 -14.307 -2.919 1.00 23.10 H new ATOM 0 HE1 TRP A 57 1.302 -14.188 -2.605 1.00 11.10 H new ATOM 0 HE3 TRP A 57 3.085 -9.511 -4.527 1.00 30.21 H new ATOM 0 HZ2 TRP A 57 -0.714 -12.307 -2.945 1.00 14.15 H new ATOM 0 HZ3 TRP A 57 0.790 -8.629 -4.492 1.00 64.23 H new ATOM 0 HH2 TRP A 57 -1.074 -10.014 -3.705 1.00 70.21 H new ATOM 944 N ILE A 58 4.938 -10.009 -1.310 1.00 33.43 N ATOM 945 CA ILE A 58 4.511 -8.804 -0.615 1.00 42.31 C ATOM 946 C ILE A 58 5.723 -7.965 -0.223 1.00 41.40 C ATOM 947 O ILE A 58 5.711 -6.745 -0.366 1.00 11.11 O ATOM 948 CB ILE A 58 3.654 -9.151 0.654 1.00 2.24 C ATOM 949 CG1 ILE A 58 2.256 -9.652 0.264 1.00 55.54 C ATOM 950 CG2 ILE A 58 3.557 -7.975 1.628 1.00 71.00 C ATOM 951 CD1 ILE A 58 1.376 -8.591 -0.327 1.00 14.24 C ATOM 0 H ILE A 58 4.738 -10.873 -0.807 1.00 33.43 H new ATOM 0 HA ILE A 58 3.884 -8.227 -1.295 1.00 42.31 H new ATOM 0 HB ILE A 58 4.174 -9.957 1.171 1.00 2.24 H new ATOM 0 HG12 ILE A 58 2.359 -10.466 -0.453 1.00 55.54 H new ATOM 0 HG13 ILE A 58 1.769 -10.065 1.147 1.00 55.54 H new ATOM 0 HG21 ILE A 58 2.955 -8.264 2.489 1.00 71.00 H new ATOM 0 HG22 ILE A 58 4.556 -7.696 1.962 1.00 71.00 H new ATOM 0 HG23 ILE A 58 3.091 -7.126 1.128 1.00 71.00 H new ATOM 0 HD11 ILE A 58 0.406 -9.021 -0.577 1.00 14.24 H new ATOM 0 HD12 ILE A 58 1.241 -7.786 0.396 1.00 14.24 H new ATOM 0 HD13 ILE A 58 1.841 -8.194 -1.230 1.00 14.24 H new ATOM 963 N GLN A 59 6.781 -8.633 0.211 1.00 32.01 N ATOM 964 CA GLN A 59 7.965 -7.942 0.702 1.00 24.51 C ATOM 965 C GLN A 59 8.630 -7.253 -0.473 1.00 53.05 C ATOM 966 O GLN A 59 9.021 -6.101 -0.381 1.00 34.12 O ATOM 967 CB GLN A 59 8.959 -8.916 1.353 1.00 23.41 C ATOM 968 CG GLN A 59 8.324 -10.074 2.116 1.00 63.32 C ATOM 969 CD GLN A 59 7.247 -9.713 3.127 1.00 53.30 C ATOM 970 OE1 GLN A 59 6.081 -9.637 2.781 1.00 2.20 O ATOM 971 NE2 GLN A 59 7.606 -9.562 4.362 1.00 53.12 N ATOM 0 H GLN A 59 6.845 -9.651 0.234 1.00 32.01 H new ATOM 0 HA GLN A 59 7.664 -7.221 1.462 1.00 24.51 H new ATOM 0 HB2 GLN A 59 9.606 -9.324 0.576 1.00 23.41 H new ATOM 0 HB3 GLN A 59 9.597 -8.357 2.037 1.00 23.41 H new ATOM 0 HG2 GLN A 59 7.893 -10.764 1.391 1.00 63.32 H new ATOM 0 HG3 GLN A 59 9.115 -10.613 2.638 1.00 63.32 H new ATOM 0 HE21 GLN A 59 8.591 -9.632 4.619 1.00 53.12 H new ATOM 0 HE22 GLN A 59 6.904 -9.373 5.078 1.00 53.12 H new ATOM 980 N GLU A 60 8.714 -7.982 -1.592 1.00 24.25 N ATOM 981 CA GLU A 60 9.252 -7.456 -2.853 1.00 34.10 C ATOM 982 C GLU A 60 8.487 -6.224 -3.251 1.00 53.10 C ATOM 983 O GLU A 60 9.065 -5.204 -3.583 1.00 15.40 O ATOM 984 CB GLU A 60 9.081 -8.489 -3.971 1.00 4.34 C ATOM 985 CG GLU A 60 9.821 -9.785 -3.776 1.00 12.12 C ATOM 986 CD GLU A 60 11.294 -9.585 -3.764 1.00 52.10 C ATOM 987 OE1 GLU A 60 11.868 -9.357 -4.832 1.00 13.41 O ATOM 988 OE2 GLU A 60 11.910 -9.675 -2.694 1.00 34.12 O ATOM 0 H GLU A 60 8.411 -8.954 -1.649 1.00 24.25 H new ATOM 0 HA GLU A 60 10.308 -7.228 -2.708 1.00 34.10 H new ATOM 0 HB2 GLU A 60 8.019 -8.710 -4.078 1.00 4.34 H new ATOM 0 HB3 GLU A 60 9.409 -8.041 -4.909 1.00 4.34 H new ATOM 0 HG2 GLU A 60 9.509 -10.244 -2.838 1.00 12.12 H new ATOM 0 HG3 GLU A 60 9.555 -10.479 -4.574 1.00 12.12 H new ATOM 995 N TYR A 61 7.181 -6.341 -3.198 1.00 43.32 N ATOM 996 CA TYR A 61 6.286 -5.288 -3.579 1.00 45.34 C ATOM 997 C TYR A 61 6.551 -4.032 -2.735 1.00 54.20 C ATOM 998 O TYR A 61 6.700 -2.926 -3.269 1.00 13.40 O ATOM 999 CB TYR A 61 4.843 -5.774 -3.404 1.00 4.51 C ATOM 1000 CG TYR A 61 3.816 -4.840 -3.952 1.00 4.15 C ATOM 1001 CD1 TYR A 61 3.414 -4.941 -5.269 1.00 22.50 C ATOM 1002 CD2 TYR A 61 3.253 -3.852 -3.167 1.00 54.22 C ATOM 1003 CE1 TYR A 61 2.485 -4.086 -5.792 1.00 42.51 C ATOM 1004 CE2 TYR A 61 2.327 -2.992 -3.683 1.00 21.21 C ATOM 1005 CZ TYR A 61 1.946 -3.111 -4.994 1.00 51.33 C ATOM 1006 OH TYR A 61 1.032 -2.242 -5.507 1.00 75.32 O ATOM 0 H TYR A 61 6.708 -7.188 -2.883 1.00 43.32 H new ATOM 0 HA TYR A 61 6.449 -5.025 -4.624 1.00 45.34 H new ATOM 0 HB2 TYR A 61 4.735 -6.743 -3.892 1.00 4.51 H new ATOM 0 HB3 TYR A 61 4.649 -5.929 -2.343 1.00 4.51 H new ATOM 0 HD1 TYR A 61 3.841 -5.709 -5.897 1.00 22.50 H new ATOM 0 HD2 TYR A 61 3.549 -3.759 -2.133 1.00 54.22 H new ATOM 0 HE1 TYR A 61 2.179 -4.178 -6.824 1.00 42.51 H new ATOM 0 HE2 TYR A 61 1.897 -2.221 -3.061 1.00 21.21 H new ATOM 0 HH TYR A 61 0.216 -2.729 -5.748 1.00 75.32 H new ATOM 1016 N LEU A 62 6.637 -4.223 -1.429 1.00 40.23 N ATOM 1017 CA LEU A 62 6.902 -3.140 -0.491 1.00 13.53 C ATOM 1018 C LEU A 62 8.288 -2.529 -0.754 1.00 60.42 C ATOM 1019 O LEU A 62 8.429 -1.309 -0.909 1.00 34.12 O ATOM 1020 CB LEU A 62 6.817 -3.675 0.951 1.00 11.04 C ATOM 1021 CG LEU A 62 5.465 -4.274 1.378 1.00 11.45 C ATOM 1022 CD1 LEU A 62 5.559 -4.875 2.761 1.00 73.33 C ATOM 1023 CD2 LEU A 62 4.369 -3.234 1.343 1.00 74.42 C ATOM 0 H LEU A 62 6.525 -5.135 -0.986 1.00 40.23 H new ATOM 0 HA LEU A 62 6.154 -2.359 -0.628 1.00 13.53 H new ATOM 0 HB2 LEU A 62 7.585 -4.438 1.078 1.00 11.04 H new ATOM 0 HB3 LEU A 62 7.061 -2.860 1.633 1.00 11.04 H new ATOM 0 HG LEU A 62 5.216 -5.061 0.666 1.00 11.45 H new ATOM 0 HD11 LEU A 62 4.592 -5.293 3.043 1.00 73.33 H new ATOM 0 HD12 LEU A 62 6.310 -5.665 2.764 1.00 73.33 H new ATOM 0 HD13 LEU A 62 5.842 -4.102 3.475 1.00 73.33 H new ATOM 0 HD21 LEU A 62 3.427 -3.688 1.650 1.00 74.42 H new ATOM 0 HD22 LEU A 62 4.618 -2.420 2.024 1.00 74.42 H new ATOM 0 HD23 LEU A 62 4.271 -2.843 0.330 1.00 74.42 H new ATOM 1035 N GLU A 63 9.292 -3.393 -0.832 1.00 41.02 N ATOM 1036 CA GLU A 63 10.668 -2.986 -1.071 1.00 2.33 C ATOM 1037 C GLU A 63 10.866 -2.278 -2.411 1.00 32.22 C ATOM 1038 O GLU A 63 11.653 -1.335 -2.511 1.00 32.44 O ATOM 1039 CB GLU A 63 11.621 -4.174 -0.976 1.00 33.43 C ATOM 1040 CG GLU A 63 11.805 -4.759 0.412 1.00 34.43 C ATOM 1041 CD GLU A 63 12.954 -5.735 0.438 1.00 22.01 C ATOM 1042 OE1 GLU A 63 12.803 -6.874 -0.017 1.00 34.33 O ATOM 1043 OE2 GLU A 63 14.056 -5.344 0.887 1.00 34.11 O ATOM 0 H GLU A 63 9.172 -4.401 -0.731 1.00 41.02 H new ATOM 0 HA GLU A 63 10.900 -2.267 -0.285 1.00 2.33 H new ATOM 0 HB2 GLU A 63 11.258 -4.961 -1.637 1.00 33.43 H new ATOM 0 HB3 GLU A 63 12.596 -3.865 -1.353 1.00 33.43 H new ATOM 0 HG2 GLU A 63 11.988 -3.957 1.127 1.00 34.43 H new ATOM 0 HG3 GLU A 63 10.889 -5.261 0.723 1.00 34.43 H new ATOM 1050 N LYS A 64 10.180 -2.719 -3.429 1.00 45.43 N ATOM 1051 CA LYS A 64 10.351 -2.135 -4.739 1.00 33.44 C ATOM 1052 C LYS A 64 9.555 -0.854 -4.942 1.00 42.52 C ATOM 1053 O LYS A 64 10.052 0.062 -5.570 1.00 42.33 O ATOM 1054 CB LYS A 64 10.133 -3.155 -5.859 1.00 22.22 C ATOM 1055 CG LYS A 64 11.178 -4.280 -5.878 1.00 12.21 C ATOM 1056 CD LYS A 64 12.577 -3.741 -6.183 1.00 54.31 C ATOM 1057 CE LYS A 64 13.630 -4.846 -6.184 1.00 74.31 C ATOM 1058 NZ LYS A 64 13.826 -5.458 -4.839 1.00 55.44 N ATOM 0 H LYS A 64 9.499 -3.477 -3.382 1.00 45.43 H new ATOM 0 HA LYS A 64 11.396 -1.830 -4.795 1.00 33.44 H new ATOM 0 HB2 LYS A 64 9.141 -3.594 -5.751 1.00 22.22 H new ATOM 0 HB3 LYS A 64 10.151 -2.638 -6.818 1.00 22.22 H new ATOM 0 HG2 LYS A 64 11.185 -4.788 -4.914 1.00 12.21 H new ATOM 0 HG3 LYS A 64 10.902 -5.022 -6.627 1.00 12.21 H new ATOM 0 HD2 LYS A 64 12.571 -3.246 -7.154 1.00 54.31 H new ATOM 0 HD3 LYS A 64 12.844 -2.987 -5.443 1.00 54.31 H new ATOM 0 HE2 LYS A 64 13.336 -5.621 -6.892 1.00 74.31 H new ATOM 0 HE3 LYS A 64 14.578 -4.438 -6.534 1.00 74.31 H new ATOM 0 HZ1 LYS A 64 14.631 -6.116 -4.871 1.00 55.44 H new ATOM 0 HZ2 LYS A 64 14.018 -4.710 -4.142 1.00 55.44 H new ATOM 0 HZ3 LYS A 64 12.967 -5.975 -4.564 1.00 55.44 H new ATOM 1072 N CYS A 65 8.345 -0.771 -4.392 1.00 61.21 N ATOM 1073 CA CYS A 65 7.548 0.460 -4.505 1.00 15.14 C ATOM 1074 C CYS A 65 8.249 1.621 -3.811 1.00 1.34 C ATOM 1075 O CYS A 65 8.247 2.745 -4.322 1.00 51.12 O ATOM 1076 CB CYS A 65 6.105 0.277 -3.974 1.00 31.33 C ATOM 1077 SG CYS A 65 5.081 1.806 -3.936 1.00 71.34 S ATOM 0 H CYS A 65 7.896 -1.525 -3.871 1.00 61.21 H new ATOM 0 HA CYS A 65 7.463 0.694 -5.566 1.00 15.14 H new ATOM 0 HB2 CYS A 65 5.599 -0.464 -4.593 1.00 31.33 H new ATOM 0 HB3 CYS A 65 6.156 -0.132 -2.965 1.00 31.33 H new ATOM 1082 N LEU A 66 8.922 1.336 -2.676 1.00 12.31 N ATOM 1083 CA LEU A 66 9.642 2.384 -1.959 1.00 71.34 C ATOM 1084 C LEU A 66 10.878 2.828 -2.731 1.00 3.34 C ATOM 1085 O LEU A 66 11.443 3.884 -2.483 1.00 45.23 O ATOM 1086 CB LEU A 66 9.965 1.991 -0.475 1.00 52.44 C ATOM 1087 CG LEU A 66 10.935 0.827 -0.129 1.00 52.50 C ATOM 1088 CD1 LEU A 66 12.377 1.124 -0.506 1.00 73.30 C ATOM 1089 CD2 LEU A 66 10.855 0.563 1.343 1.00 2.41 C ATOM 0 H LEU A 66 8.976 0.410 -2.253 1.00 12.31 H new ATOM 0 HA LEU A 66 8.976 3.244 -1.893 1.00 71.34 H new ATOM 0 HB2 LEU A 66 10.359 2.884 0.009 1.00 52.44 H new ATOM 0 HB3 LEU A 66 9.013 1.762 0.005 1.00 52.44 H new ATOM 0 HG LEU A 66 10.628 -0.043 -0.709 1.00 52.50 H new ATOM 0 HD11 LEU A 66 13.005 0.274 -0.240 1.00 73.30 H new ATOM 0 HD12 LEU A 66 12.443 1.302 -1.579 1.00 73.30 H new ATOM 0 HD13 LEU A 66 12.718 2.009 0.030 1.00 73.30 H new ATOM 0 HD21 LEU A 66 11.530 -0.252 1.604 1.00 2.41 H new ATOM 0 HD22 LEU A 66 11.142 1.461 1.890 1.00 2.41 H new ATOM 0 HD23 LEU A 66 9.834 0.287 1.608 1.00 2.41 H new ATOM 1101 N ASN A 67 11.282 2.012 -3.662 1.00 55.11 N ATOM 1102 CA ASN A 67 12.422 2.295 -4.507 1.00 11.12 C ATOM 1103 C ASN A 67 11.961 3.071 -5.746 1.00 75.44 C ATOM 1104 O ASN A 67 12.755 3.708 -6.440 1.00 32.30 O ATOM 1105 CB ASN A 67 13.113 0.970 -4.881 1.00 63.05 C ATOM 1106 CG ASN A 67 14.316 1.122 -5.789 1.00 21.20 C ATOM 1107 OD1 ASN A 67 14.198 1.046 -7.012 1.00 5.15 O ATOM 1108 ND2 ASN A 67 15.462 1.338 -5.205 1.00 40.12 N ATOM 0 H ASN A 67 10.829 1.121 -3.863 1.00 55.11 H new ATOM 0 HA ASN A 67 13.146 2.916 -3.979 1.00 11.12 H new ATOM 0 HB2 ASN A 67 13.426 0.467 -3.966 1.00 63.05 H new ATOM 0 HB3 ASN A 67 12.386 0.321 -5.369 1.00 63.05 H new ATOM 0 HD21 ASN A 67 16.307 1.451 -5.765 1.00 40.12 H new ATOM 0 HD22 ASN A 67 15.514 1.394 -4.188 1.00 40.12 H new ATOM 1115 N LYS A 68 10.664 3.044 -5.978 1.00 3.32 N ATOM 1116 CA LYS A 68 10.061 3.722 -7.110 1.00 72.34 C ATOM 1117 C LYS A 68 9.468 5.053 -6.680 1.00 65.50 C ATOM 1118 O LYS A 68 10.168 6.072 -6.632 1.00 45.03 O ATOM 1119 CB LYS A 68 8.972 2.852 -7.730 1.00 22.10 C ATOM 1120 CG LYS A 68 9.465 1.492 -8.163 1.00 1.22 C ATOM 1121 CD LYS A 68 8.381 0.691 -8.831 1.00 53.21 C ATOM 1122 CE LYS A 68 8.901 -0.668 -9.260 1.00 52.42 C ATOM 1123 NZ LYS A 68 9.988 -0.550 -10.262 1.00 55.13 N ATOM 0 H LYS A 68 9.996 2.550 -5.386 1.00 3.32 H new ATOM 0 HA LYS A 68 10.839 3.904 -7.852 1.00 72.34 H new ATOM 0 HB2 LYS A 68 8.164 2.725 -7.009 1.00 22.10 H new ATOM 0 HB3 LYS A 68 8.551 3.369 -8.592 1.00 22.10 H new ATOM 0 HG2 LYS A 68 10.304 1.611 -8.849 1.00 1.22 H new ATOM 0 HG3 LYS A 68 9.837 0.947 -7.295 1.00 1.22 H new ATOM 0 HD2 LYS A 68 7.542 0.565 -8.147 1.00 53.21 H new ATOM 0 HD3 LYS A 68 8.005 1.232 -9.699 1.00 53.21 H new ATOM 0 HE2 LYS A 68 9.268 -1.209 -8.388 1.00 52.42 H new ATOM 0 HE3 LYS A 68 8.083 -1.255 -9.678 1.00 52.42 H new ATOM 0 HZ1 LYS A 68 10.132 -1.468 -10.728 1.00 55.13 H new ATOM 0 HZ2 LYS A 68 9.728 0.163 -10.974 1.00 55.13 H new ATOM 0 HZ3 LYS A 68 10.867 -0.261 -9.788 1.00 55.13 H new ATOM 1207 N ILE B 106 3.164 4.461 12.465 1.00 63.32 N ATOM 1208 CA ILE B 106 1.937 4.008 11.905 1.00 73.31 C ATOM 1209 C ILE B 106 0.921 5.112 12.033 1.00 5.52 C ATOM 1210 O ILE B 106 1.156 6.088 12.773 1.00 23.24 O ATOM 1211 CB ILE B 106 1.403 2.741 12.599 1.00 60.34 C ATOM 1212 CG1 ILE B 106 1.117 3.001 14.086 1.00 55.55 C ATOM 1213 CG2 ILE B 106 2.381 1.582 12.424 1.00 34.13 C ATOM 1214 CD1 ILE B 106 0.463 1.836 14.785 1.00 2.31 C ATOM 0 HA ILE B 106 2.116 3.751 10.861 1.00 73.31 H new ATOM 0 HB ILE B 106 0.460 2.467 12.125 1.00 60.34 H new ATOM 0 HG12 ILE B 106 2.053 3.239 14.592 1.00 55.55 H new ATOM 0 HG13 ILE B 106 0.474 3.876 14.177 1.00 55.55 H new ATOM 0 HG21 ILE B 106 1.987 0.695 12.921 1.00 34.13 H new ATOM 0 HG22 ILE B 106 2.513 1.374 11.362 1.00 34.13 H new ATOM 0 HG23 ILE B 106 3.342 1.847 12.864 1.00 34.13 H new ATOM 0 HD11 ILE B 106 0.290 2.090 15.831 1.00 2.31 H new ATOM 0 HD12 ILE B 106 -0.489 1.611 14.304 1.00 2.31 H new ATOM 0 HD13 ILE B 106 1.114 0.964 14.726 1.00 2.31 H new ATOM 1226 N TYR B 107 -0.187 4.970 11.347 1.00 35.23 N ATOM 1227 CA TYR B 107 -1.215 5.989 11.340 1.00 54.43 C ATOM 1228 C TYR B 107 -1.740 6.119 12.753 1.00 13.04 C ATOM 1229 O TYR B 107 -2.133 5.113 13.363 1.00 41.41 O ATOM 1230 CB TYR B 107 -2.381 5.576 10.446 1.00 22.04 C ATOM 1231 CG TYR B 107 -2.021 4.690 9.305 1.00 13.52 C ATOM 1232 CD1 TYR B 107 -1.366 5.178 8.213 1.00 61.12 C ATOM 1233 CD2 TYR B 107 -2.372 3.353 9.324 1.00 31.14 C ATOM 1234 CE1 TYR B 107 -1.058 4.381 7.167 1.00 10.51 C ATOM 1235 CE2 TYR B 107 -2.081 2.539 8.275 1.00 61.52 C ATOM 1236 CZ TYR B 107 -1.422 3.058 7.186 1.00 30.12 C ATOM 1237 OH TYR B 107 -1.139 2.257 6.107 1.00 43.32 O ATOM 0 H TYR B 107 -0.403 4.150 10.780 1.00 35.23 H new ATOM 0 HA TYR B 107 -0.794 6.923 10.969 1.00 54.43 H new ATOM 0 HB2 TYR B 107 -3.126 5.068 11.059 1.00 22.04 H new ATOM 0 HB3 TYR B 107 -2.853 6.476 10.052 1.00 22.04 H new ATOM 0 HD1 TYR B 107 -1.088 6.221 8.184 1.00 61.12 H new ATOM 0 HD2 TYR B 107 -2.885 2.949 10.185 1.00 31.14 H new ATOM 0 HE1 TYR B 107 -0.526 4.784 6.318 1.00 10.51 H new ATOM 0 HE2 TYR B 107 -2.364 1.497 8.297 1.00 61.52 H new ATOM 0 HH TYR B 107 -0.378 1.677 6.321 1.00 43.32 H new ATOM 1247 N THR B 108 -1.726 7.311 13.293 1.00 12.13 N ATOM 1248 CA THR B 108 -2.224 7.493 14.619 1.00 72.54 C ATOM 1249 C THR B 108 -3.747 7.610 14.583 1.00 30.05 C ATOM 1250 O THR B 108 -4.319 8.714 14.565 1.00 20.42 O ATOM 1251 CB THR B 108 -1.573 8.698 15.328 1.00 43.20 C ATOM 1252 OG1 THR B 108 -0.139 8.555 15.235 1.00 3.33 O ATOM 1253 CG2 THR B 108 -1.967 8.727 16.804 1.00 2.44 C ATOM 0 H THR B 108 -1.379 8.155 12.837 1.00 12.13 H new ATOM 0 HA THR B 108 -1.953 6.617 15.209 1.00 72.54 H new ATOM 0 HB THR B 108 -1.908 9.621 14.855 1.00 43.20 H new ATOM 0 HG1 THR B 108 0.295 9.313 15.679 1.00 3.33 H new ATOM 0 HG21 THR B 108 -1.499 9.584 17.289 1.00 2.44 H new ATOM 0 HG22 THR B 108 -3.051 8.809 16.890 1.00 2.44 H new ATOM 0 HG23 THR B 108 -1.633 7.809 17.288 1.00 2.44 H new ATOM 1261 N SER B 109 -4.369 6.470 14.467 1.00 33.13 N ATOM 1262 CA SER B 109 -5.777 6.337 14.409 1.00 33.51 C ATOM 1263 C SER B 109 -6.169 4.974 14.931 1.00 43.33 C ATOM 1264 O SER B 109 -5.486 3.978 14.677 1.00 23.33 O ATOM 1265 CB SER B 109 -6.278 6.561 12.963 1.00 3.43 C ATOM 1266 OG SER B 109 -5.557 5.777 12.013 1.00 63.44 O ATOM 0 H SER B 109 -3.878 5.578 14.409 1.00 33.13 H new ATOM 0 HA SER B 109 -6.247 7.095 15.036 1.00 33.51 H new ATOM 0 HB2 SER B 109 -7.338 6.313 12.906 1.00 3.43 H new ATOM 0 HB3 SER B 109 -6.183 7.616 12.707 1.00 3.43 H new ATOM 0 HG SER B 109 -4.985 6.362 11.473 1.00 63.44 H new ATOM 1272 N ASP B 110 -7.224 4.927 15.691 1.00 64.13 N ATOM 1273 CA ASP B 110 -7.699 3.672 16.216 1.00 51.25 C ATOM 1274 C ASP B 110 -8.678 3.123 15.222 1.00 63.43 C ATOM 1275 O ASP B 110 -9.824 3.580 15.163 1.00 70.44 O ATOM 1276 CB ASP B 110 -8.400 3.847 17.580 1.00 41.51 C ATOM 1277 CG ASP B 110 -7.549 4.507 18.640 1.00 13.41 C ATOM 1278 OD1 ASP B 110 -6.754 3.819 19.303 1.00 53.31 O ATOM 1279 OD2 ASP B 110 -7.682 5.737 18.840 1.00 55.31 O ATOM 0 H ASP B 110 -7.775 5.741 15.963 1.00 64.13 H new ATOM 0 HA ASP B 110 -6.855 3.001 16.372 1.00 51.25 H new ATOM 0 HB2 ASP B 110 -9.304 4.439 17.437 1.00 41.51 H new ATOM 0 HB3 ASP B 110 -8.714 2.868 17.941 1.00 41.51 H new ATOM 1284 N ASN B 111 -8.235 2.212 14.391 1.00 12.22 N ATOM 1285 CA ASN B 111 -9.114 1.663 13.373 1.00 32.41 C ATOM 1286 C ASN B 111 -9.735 0.363 13.809 1.00 32.15 C ATOM 1287 O ASN B 111 -10.926 0.311 14.106 1.00 0.12 O ATOM 1288 CB ASN B 111 -8.414 1.494 12.005 1.00 23.41 C ATOM 1289 CG ASN B 111 -7.953 2.808 11.405 1.00 25.22 C ATOM 1290 OD1 ASN B 111 -8.712 3.476 10.684 1.00 74.52 O ATOM 1291 ND2 ASN B 111 -6.722 3.172 11.667 1.00 2.24 N ATOM 0 H ASN B 111 -7.287 1.836 14.393 1.00 12.22 H new ATOM 0 HA ASN B 111 -9.910 2.397 13.243 1.00 32.41 H new ATOM 0 HB2 ASN B 111 -7.554 0.834 12.123 1.00 23.41 H new ATOM 0 HB3 ASN B 111 -9.098 1.005 11.312 1.00 23.41 H new ATOM 0 HD21 ASN B 111 -6.351 4.036 11.273 1.00 2.24 H new ATOM 0 HD22 ASN B 111 -6.135 2.591 12.265 1.00 2.24 H new ATOM 1417 N TYR B 121 -3.934 -20.326 2.042 1.00 73.00 N ATOM 1418 CA TYR B 121 -4.441 -20.369 0.716 1.00 51.40 C ATOM 1419 C TYR B 121 -3.621 -21.408 -0.032 1.00 61.31 C ATOM 1420 O TYR B 121 -4.163 -22.346 -0.613 1.00 43.32 O ATOM 1421 CB TYR B 121 -4.277 -18.969 0.093 1.00 61.50 C ATOM 1422 CG TYR B 121 -4.907 -18.751 -1.265 1.00 42.45 C ATOM 1423 CD1 TYR B 121 -4.481 -19.446 -2.369 1.00 2.35 C ATOM 1424 CD2 TYR B 121 -5.921 -17.825 -1.423 1.00 40.04 C ATOM 1425 CE1 TYR B 121 -5.051 -19.234 -3.613 1.00 41.22 C ATOM 1426 CE2 TYR B 121 -6.504 -17.594 -2.653 1.00 64.51 C ATOM 1427 CZ TYR B 121 -6.066 -18.302 -3.748 1.00 52.22 C ATOM 1428 OH TYR B 121 -6.644 -18.083 -4.986 1.00 23.14 O ATOM 0 HA TYR B 121 -5.497 -20.638 0.677 1.00 51.40 H new ATOM 0 HB2 TYR B 121 -4.697 -18.238 0.784 1.00 61.50 H new ATOM 0 HB3 TYR B 121 -3.211 -18.756 0.012 1.00 61.50 H new ATOM 0 HD1 TYR B 121 -3.687 -20.171 -2.266 1.00 2.35 H new ATOM 0 HD2 TYR B 121 -6.265 -17.269 -0.564 1.00 40.04 H new ATOM 0 HE1 TYR B 121 -4.706 -19.791 -4.471 1.00 41.22 H new ATOM 0 HE2 TYR B 121 -7.295 -16.866 -2.754 1.00 64.51 H new ATOM 0 HH TYR B 121 -7.341 -17.398 -4.905 1.00 23.14 H new ATOM 1438 N ASP B 122 -2.303 -21.230 0.007 1.00 44.12 N ATOM 1439 CA ASP B 122 -1.367 -22.135 -0.657 1.00 71.33 C ATOM 1440 C ASP B 122 -0.257 -22.590 0.329 1.00 64.13 C ATOM 1441 O ASP B 122 0.552 -23.465 0.009 1.00 61.11 O ATOM 1442 CB ASP B 122 -0.767 -21.406 -1.866 1.00 10.12 C ATOM 1443 CG ASP B 122 0.154 -22.239 -2.724 1.00 55.13 C ATOM 1444 OD1 ASP B 122 -0.334 -22.966 -3.604 1.00 52.40 O ATOM 1445 OD2 ASP B 122 1.376 -22.143 -2.554 1.00 53.52 O ATOM 0 H ASP B 122 -1.854 -20.457 0.498 1.00 44.12 H new ATOM 0 HA ASP B 122 -1.888 -23.031 -0.994 1.00 71.33 H new ATOM 0 HB2 ASP B 122 -1.582 -21.036 -2.488 1.00 10.12 H new ATOM 0 HB3 ASP B 122 -0.217 -20.535 -1.509 1.00 10.12 H new ATOM 1450 N SER B 123 -0.256 -21.973 1.534 1.00 13.13 N ATOM 1451 CA SER B 123 0.686 -22.272 2.639 1.00 72.11 C ATOM 1452 C SER B 123 2.102 -21.693 2.355 1.00 73.40 C ATOM 1453 O SER B 123 2.293 -20.975 1.369 1.00 64.05 O ATOM 1454 CB SER B 123 0.707 -23.797 2.960 1.00 41.14 C ATOM 1455 OG SER B 123 1.503 -24.104 4.106 1.00 50.54 O ATOM 0 H SER B 123 -0.923 -21.239 1.770 1.00 13.13 H new ATOM 0 HA SER B 123 0.328 -21.769 3.537 1.00 72.11 H new ATOM 0 HB2 SER B 123 -0.313 -24.144 3.126 1.00 41.14 H new ATOM 0 HB3 SER B 123 1.092 -24.341 2.098 1.00 41.14 H new ATOM 0 HG SER B 123 1.484 -25.070 4.268 1.00 50.54 H new ATOM 1461 N MET B 124 3.049 -21.972 3.264 1.00 50.40 N ATOM 1462 CA MET B 124 4.469 -21.542 3.190 1.00 55.31 C ATOM 1463 C MET B 124 4.655 -20.033 3.152 1.00 4.32 C ATOM 1464 O MET B 124 4.616 -19.410 2.088 1.00 10.23 O ATOM 1465 CB MET B 124 5.238 -22.204 2.037 1.00 3.40 C ATOM 1466 CG MET B 124 5.394 -23.704 2.168 1.00 12.05 C ATOM 1467 SD MET B 124 6.352 -24.414 0.819 1.00 64.53 S ATOM 1468 CE MET B 124 6.378 -26.132 1.305 1.00 45.04 C ATOM 0 H MET B 124 2.849 -22.520 4.101 1.00 50.40 H new ATOM 0 HA MET B 124 4.899 -21.893 4.128 1.00 55.31 H new ATOM 0 HB2 MET B 124 4.724 -21.985 1.101 1.00 3.40 H new ATOM 0 HB3 MET B 124 6.228 -21.753 1.970 1.00 3.40 H new ATOM 0 HG2 MET B 124 5.880 -23.935 3.116 1.00 12.05 H new ATOM 0 HG3 MET B 124 4.408 -24.168 2.194 1.00 12.05 H new ATOM 0 HE1 MET B 124 6.937 -26.710 0.569 1.00 45.04 H new ATOM 0 HE2 MET B 124 6.856 -26.227 2.280 1.00 45.04 H new ATOM 0 HE3 MET B 124 5.357 -26.509 1.363 1.00 45.04 H new ATOM 1478 N LYS B 125 4.859 -19.440 4.296 1.00 1.14 N ATOM 1479 CA LYS B 125 5.067 -18.018 4.354 1.00 73.54 C ATOM 1480 C LYS B 125 6.293 -17.705 5.209 1.00 61.10 C ATOM 1481 O LYS B 125 7.027 -18.639 5.582 1.00 23.24 O ATOM 1482 CB LYS B 125 3.806 -17.307 4.837 1.00 62.12 C ATOM 1483 CG LYS B 125 3.454 -17.512 6.280 1.00 61.44 C ATOM 1484 CD LYS B 125 2.081 -16.958 6.551 1.00 33.21 C ATOM 1485 CE LYS B 125 1.835 -16.799 8.020 1.00 62.23 C ATOM 1486 NZ LYS B 125 2.678 -15.729 8.584 1.00 11.13 N ATOM 0 H LYS B 125 4.886 -19.916 5.198 1.00 1.14 H new ATOM 0 HA LYS B 125 5.268 -17.637 3.353 1.00 73.54 H new ATOM 0 HB2 LYS B 125 3.924 -16.238 4.659 1.00 62.12 H new ATOM 0 HB3 LYS B 125 2.967 -17.641 4.227 1.00 62.12 H new ATOM 0 HG2 LYS B 125 3.483 -18.574 6.524 1.00 61.44 H new ATOM 0 HG3 LYS B 125 4.188 -17.019 6.917 1.00 61.44 H new ATOM 0 HD2 LYS B 125 1.972 -15.993 6.056 1.00 33.21 H new ATOM 0 HD3 LYS B 125 1.329 -17.622 6.124 1.00 33.21 H new ATOM 0 HE2 LYS B 125 0.784 -16.568 8.193 1.00 62.23 H new ATOM 0 HE3 LYS B 125 2.044 -17.739 8.531 1.00 62.23 H new ATOM 0 HZ1 LYS B 125 2.236 -15.358 9.449 1.00 11.13 H new ATOM 0 HZ2 LYS B 125 3.618 -16.111 8.812 1.00 11.13 H new ATOM 0 HZ3 LYS B 125 2.776 -14.961 7.889 1.00 11.13 H new ATOM 1500 N GLU B 126 6.511 -16.415 5.502 1.00 3.51 N ATOM 1501 CA GLU B 126 7.690 -15.897 6.228 1.00 72.11 C ATOM 1502 C GLU B 126 8.866 -15.798 5.263 1.00 23.11 C ATOM 1503 O GLU B 126 9.319 -16.808 4.715 1.00 11.42 O ATOM 1504 CB GLU B 126 8.011 -16.691 7.509 1.00 62.41 C ATOM 1505 CG GLU B 126 6.887 -16.635 8.535 1.00 34.24 C ATOM 1506 CD GLU B 126 7.133 -17.488 9.740 1.00 20.53 C ATOM 1507 OE1 GLU B 126 6.798 -18.680 9.696 1.00 12.23 O ATOM 1508 OE2 GLU B 126 7.632 -16.982 10.762 1.00 11.41 O ATOM 0 H GLU B 126 5.857 -15.679 5.235 1.00 3.51 H new ATOM 0 HA GLU B 126 7.462 -14.896 6.594 1.00 72.11 H new ATOM 0 HB2 GLU B 126 8.206 -17.731 7.247 1.00 62.41 H new ATOM 0 HB3 GLU B 126 8.924 -16.298 7.955 1.00 62.41 H new ATOM 0 HG2 GLU B 126 6.748 -15.602 8.854 1.00 34.24 H new ATOM 0 HG3 GLU B 126 5.957 -16.950 8.061 1.00 34.24 H new ATOM 1515 N PRO B 127 9.355 -14.576 5.000 1.00 72.11 N ATOM 1516 CA PRO B 127 10.358 -14.349 3.987 1.00 22.22 C ATOM 1517 C PRO B 127 11.732 -14.844 4.364 1.00 40.53 C ATOM 1518 O PRO B 127 12.142 -14.826 5.529 1.00 50.53 O ATOM 1519 CB PRO B 127 10.364 -12.838 3.820 1.00 2.50 C ATOM 1520 CG PRO B 127 10.015 -12.347 5.161 1.00 14.22 C ATOM 1521 CD PRO B 127 8.989 -13.311 5.684 1.00 24.33 C ATOM 0 HA PRO B 127 10.120 -14.899 3.077 1.00 22.22 H new ATOM 0 HB2 PRO B 127 11.340 -12.473 3.499 1.00 2.50 H new ATOM 0 HB3 PRO B 127 9.641 -12.513 3.072 1.00 2.50 H new ATOM 0 HG2 PRO B 127 10.891 -12.316 5.809 1.00 14.22 H new ATOM 0 HG3 PRO B 127 9.616 -11.334 5.117 1.00 14.22 H new ATOM 0 HD2 PRO B 127 9.039 -13.407 6.769 1.00 24.33 H new ATOM 0 HD3 PRO B 127 7.975 -12.996 5.439 1.00 24.33 H new ATOM 1846 N CYS C 209 -3.962 6.541 -14.612 1.00 40.24 N ATOM 1847 CA CYS C 209 -3.363 6.440 -13.306 1.00 71.20 C ATOM 1848 C CYS C 209 -4.361 7.155 -12.458 1.00 74.03 C ATOM 1849 O CYS C 209 -4.827 8.236 -12.800 1.00 33.52 O ATOM 1850 CB CYS C 209 -1.940 7.076 -13.184 1.00 2.24 C ATOM 1851 SG CYS C 209 -0.601 6.184 -14.060 1.00 30.44 S ATOM 0 HA CYS C 209 -3.174 5.404 -13.024 1.00 71.20 H new ATOM 0 HB2 CYS C 209 -1.983 8.096 -13.565 1.00 2.24 H new ATOM 0 HB3 CYS C 209 -1.679 7.141 -12.128 1.00 2.24 H new ATOM 1856 N PRO C 210 -4.719 6.548 -11.359 1.00 10.02 N ATOM 1857 CA PRO C 210 -5.981 6.813 -10.714 1.00 1.41 C ATOM 1858 C PRO C 210 -6.113 8.133 -10.006 1.00 75.42 C ATOM 1859 O PRO C 210 -7.225 8.658 -9.867 1.00 4.54 O ATOM 1860 CB PRO C 210 -6.089 5.632 -9.786 1.00 34.33 C ATOM 1861 CG PRO C 210 -4.718 5.349 -9.365 1.00 32.34 C ATOM 1862 CD PRO C 210 -3.893 5.583 -10.588 1.00 54.30 C ATOM 0 HA PRO C 210 -6.790 6.915 -11.437 1.00 1.41 H new ATOM 0 HB2 PRO C 210 -6.725 5.860 -8.930 1.00 34.33 H new ATOM 0 HB3 PRO C 210 -6.531 4.773 -10.291 1.00 34.33 H new ATOM 0 HG2 PRO C 210 -4.411 6.003 -8.549 1.00 32.34 H new ATOM 0 HG3 PRO C 210 -4.616 4.324 -9.008 1.00 32.34 H new ATOM 0 HD2 PRO C 210 -2.913 5.993 -10.343 1.00 54.30 H new ATOM 0 HD3 PRO C 210 -3.722 4.661 -11.144 1.00 54.30 H new ATOM 1870 N CYS C 211 -5.046 8.676 -9.562 1.00 61.51 N ATOM 1871 CA CYS C 211 -5.153 9.889 -8.864 1.00 73.43 C ATOM 1872 C CYS C 211 -4.810 11.055 -9.766 1.00 31.54 C ATOM 1873 O CYS C 211 -3.987 10.928 -10.672 1.00 55.44 O ATOM 1874 CB CYS C 211 -4.296 9.870 -7.652 1.00 1.10 C ATOM 1875 SG CYS C 211 -4.899 10.965 -6.354 1.00 14.23 S ATOM 0 H CYS C 211 -4.102 8.304 -9.668 1.00 61.51 H new ATOM 0 HA CYS C 211 -6.186 10.014 -8.539 1.00 73.43 H new ATOM 0 HB2 CYS C 211 -4.242 8.852 -7.266 1.00 1.10 H new ATOM 0 HB3 CYS C 211 -3.282 10.161 -7.925 1.00 1.10 H new ATOM 1880 N ARG C 212 -5.442 12.176 -9.512 1.00 1.40 N ATOM 1881 CA ARG C 212 -5.219 13.390 -10.280 1.00 54.13 C ATOM 1882 C ARG C 212 -3.916 14.036 -9.832 1.00 53.42 C ATOM 1883 O ARG C 212 -3.140 14.551 -10.632 1.00 61.42 O ATOM 1884 CB ARG C 212 -6.354 14.373 -9.997 1.00 14.44 C ATOM 1885 CG ARG C 212 -7.747 13.863 -10.313 1.00 10.23 C ATOM 1886 CD ARG C 212 -8.789 14.876 -9.872 1.00 41.33 C ATOM 1887 NE ARG C 212 -10.159 14.435 -10.148 1.00 25.32 N ATOM 1888 CZ ARG C 212 -11.257 14.930 -9.556 1.00 3.01 C ATOM 1889 NH1 ARG C 212 -11.147 15.856 -8.595 1.00 41.52 N ATOM 1890 NH2 ARG C 212 -12.459 14.494 -9.919 1.00 62.55 N ATOM 0 H ARG C 212 -6.129 12.278 -8.765 1.00 1.40 H new ATOM 0 HA ARG C 212 -5.177 13.145 -11.341 1.00 54.13 H new ATOM 0 HB2 ARG C 212 -6.317 14.652 -8.944 1.00 14.44 H new ATOM 0 HB3 ARG C 212 -6.178 15.281 -10.573 1.00 14.44 H new ATOM 0 HG2 ARG C 212 -7.840 13.677 -11.383 1.00 10.23 H new ATOM 0 HG3 ARG C 212 -7.917 12.912 -9.808 1.00 10.23 H new ATOM 0 HD2 ARG C 212 -8.680 15.062 -8.803 1.00 41.33 H new ATOM 0 HD3 ARG C 212 -8.607 15.823 -10.380 1.00 41.33 H new ATOM 0 HE ARG C 212 -10.287 13.698 -10.841 1.00 25.32 H new ATOM 0 HH11 ARG C 212 -10.226 16.188 -8.310 1.00 41.52 H new ATOM 0 HH12 ARG C 212 -11.985 16.229 -8.148 1.00 41.52 H new ATOM 0 HH21 ARG C 212 -12.546 13.784 -10.646 1.00 62.55 H new ATOM 0 HH22 ARG C 212 -13.295 14.869 -9.470 1.00 62.55 H new ATOM 1904 N PHE C 213 -3.700 13.994 -8.545 1.00 13.03 N ATOM 1905 CA PHE C 213 -2.577 14.624 -7.921 1.00 65.41 C ATOM 1906 C PHE C 213 -1.992 13.688 -6.890 1.00 62.35 C ATOM 1907 O PHE C 213 -2.651 12.765 -6.462 1.00 11.34 O ATOM 1908 CB PHE C 213 -3.042 15.931 -7.237 1.00 41.24 C ATOM 1909 CG PHE C 213 -4.095 15.729 -6.160 1.00 63.42 C ATOM 1910 CD1 PHE C 213 -5.444 15.741 -6.476 1.00 51.35 C ATOM 1911 CD2 PHE C 213 -3.728 15.518 -4.836 1.00 42.11 C ATOM 1912 CE1 PHE C 213 -6.402 15.546 -5.502 1.00 13.42 C ATOM 1913 CE2 PHE C 213 -4.682 15.321 -3.859 1.00 0.43 C ATOM 1914 CZ PHE C 213 -6.018 15.334 -4.191 1.00 42.20 C ATOM 0 H PHE C 213 -4.315 13.510 -7.891 1.00 13.03 H new ATOM 0 HA PHE C 213 -1.819 14.857 -8.669 1.00 65.41 H new ATOM 0 HB2 PHE C 213 -2.176 16.425 -6.795 1.00 41.24 H new ATOM 0 HB3 PHE C 213 -3.440 16.604 -7.997 1.00 41.24 H new ATOM 0 HD1 PHE C 213 -5.750 15.905 -7.499 1.00 51.35 H new ATOM 0 HD2 PHE C 213 -2.682 15.508 -4.568 1.00 42.11 H new ATOM 0 HE1 PHE C 213 -7.450 15.559 -5.763 1.00 13.42 H new ATOM 0 HE2 PHE C 213 -4.381 15.157 -2.835 1.00 0.43 H new ATOM 0 HZ PHE C 213 -6.766 15.179 -3.427 1.00 42.20 H new ATOM 1924 N PHE C 214 -0.786 13.909 -6.509 1.00 12.50 N ATOM 1925 CA PHE C 214 -0.222 13.172 -5.435 1.00 25.41 C ATOM 1926 C PHE C 214 0.409 14.136 -4.470 1.00 11.14 C ATOM 1927 O PHE C 214 1.145 15.056 -4.866 1.00 1.33 O ATOM 1928 CB PHE C 214 0.757 12.057 -5.889 1.00 72.12 C ATOM 1929 CG PHE C 214 2.015 12.513 -6.576 1.00 0.32 C ATOM 1930 CD1 PHE C 214 2.047 12.699 -7.944 1.00 23.24 C ATOM 1931 CD2 PHE C 214 3.167 12.738 -5.842 1.00 74.51 C ATOM 1932 CE1 PHE C 214 3.207 13.104 -8.572 1.00 32.32 C ATOM 1933 CE2 PHE C 214 4.330 13.143 -6.463 1.00 10.44 C ATOM 1934 CZ PHE C 214 4.349 13.327 -7.831 1.00 21.54 C ATOM 0 H PHE C 214 -0.165 14.601 -6.929 1.00 12.50 H new ATOM 0 HA PHE C 214 -1.024 12.629 -4.935 1.00 25.41 H new ATOM 0 HB2 PHE C 214 1.038 11.472 -5.014 1.00 72.12 H new ATOM 0 HB3 PHE C 214 0.223 11.387 -6.563 1.00 72.12 H new ATOM 0 HD1 PHE C 214 1.155 12.526 -8.528 1.00 23.24 H new ATOM 0 HD2 PHE C 214 3.155 12.595 -4.772 1.00 74.51 H new ATOM 0 HE1 PHE C 214 3.221 13.246 -9.643 1.00 32.32 H new ATOM 0 HE2 PHE C 214 5.223 13.316 -5.881 1.00 10.44 H new ATOM 0 HZ PHE C 214 5.257 13.645 -8.321 1.00 21.54 H new ATOM 1944 N GLU C 215 0.097 13.961 -3.247 1.00 41.22 N ATOM 1945 CA GLU C 215 0.563 14.794 -2.209 1.00 12.25 C ATOM 1946 C GLU C 215 1.887 14.297 -1.735 1.00 34.00 C ATOM 1947 O GLU C 215 2.080 13.093 -1.545 1.00 22.03 O ATOM 1948 CB GLU C 215 -0.432 14.783 -1.071 1.00 51.33 C ATOM 1949 CG GLU C 215 -1.798 15.335 -1.419 1.00 51.23 C ATOM 1950 CD GLU C 215 -1.773 16.790 -1.845 1.00 33.20 C ATOM 1951 OE1 GLU C 215 -1.369 17.093 -2.983 1.00 45.34 O ATOM 1952 OE2 GLU C 215 -2.200 17.646 -1.053 1.00 70.53 O ATOM 0 H GLU C 215 -0.512 13.207 -2.927 1.00 41.22 H new ATOM 0 HA GLU C 215 0.674 15.815 -2.576 1.00 12.25 H new ATOM 0 HB2 GLU C 215 -0.548 13.758 -0.718 1.00 51.33 H new ATOM 0 HB3 GLU C 215 -0.022 15.361 -0.243 1.00 51.33 H new ATOM 0 HG2 GLU C 215 -2.229 14.737 -2.222 1.00 51.23 H new ATOM 0 HG3 GLU C 215 -2.455 15.229 -0.555 1.00 51.23 H new ATOM 1959 N SER C 216 2.794 15.198 -1.565 1.00 50.13 N ATOM 1960 CA SER C 216 4.084 14.859 -1.114 1.00 61.40 C ATOM 1961 C SER C 216 4.118 14.608 0.386 1.00 4.13 C ATOM 1962 O SER C 216 3.991 13.496 0.822 1.00 61.33 O ATOM 1963 CB SER C 216 5.087 15.913 -1.541 1.00 23.32 C ATOM 1964 OG SER C 216 4.620 17.219 -1.211 1.00 14.02 O ATOM 0 H SER C 216 2.652 16.193 -1.738 1.00 50.13 H new ATOM 0 HA SER C 216 4.368 13.917 -1.583 1.00 61.40 H new ATOM 0 HB2 SER C 216 6.044 15.730 -1.053 1.00 23.32 H new ATOM 0 HB3 SER C 216 5.259 15.844 -2.615 1.00 23.32 H new ATOM 0 HG SER C 216 3.860 17.450 -1.786 1.00 14.02 H new ATOM 1970 N HIS C 217 4.222 15.647 1.169 1.00 75.24 N ATOM 1971 CA HIS C 217 4.374 15.482 2.599 1.00 5.43 C ATOM 1972 C HIS C 217 3.032 15.500 3.295 1.00 54.21 C ATOM 1973 O HIS C 217 2.536 16.551 3.651 1.00 64.30 O ATOM 1974 CB HIS C 217 5.262 16.572 3.166 1.00 52.14 C ATOM 1975 CG HIS C 217 6.330 16.073 4.062 1.00 3.00 C ATOM 1976 ND1 HIS C 217 6.433 16.401 5.392 1.00 74.05 N ATOM 1977 CD2 HIS C 217 7.381 15.300 3.783 1.00 64.21 C ATOM 1978 CE1 HIS C 217 7.518 15.845 5.890 1.00 11.04 C ATOM 1979 NE2 HIS C 217 8.115 15.166 4.929 1.00 11.35 N ATOM 0 H HIS C 217 4.205 16.615 0.848 1.00 75.24 H new ATOM 0 HA HIS C 217 4.841 14.513 2.775 1.00 5.43 H new ATOM 0 HB2 HIS C 217 5.720 17.119 2.342 1.00 52.14 H new ATOM 0 HB3 HIS C 217 4.643 17.282 3.715 1.00 52.14 H new ATOM 0 HD2 HIS C 217 7.611 14.859 2.824 1.00 64.21 H new ATOM 0 HE1 HIS C 217 7.861 15.930 6.911 1.00 11.04 H new ATOM 0 HE2 HIS C 217 8.978 14.631 5.025 1.00 11.35 H new ATOM 1988 N VAL C 218 2.438 14.353 3.426 1.00 72.24 N ATOM 1989 CA VAL C 218 1.159 14.209 4.107 1.00 4.25 C ATOM 1990 C VAL C 218 1.383 13.823 5.561 1.00 74.41 C ATOM 1991 O VAL C 218 2.380 13.161 5.885 1.00 31.12 O ATOM 1992 CB VAL C 218 0.273 13.165 3.380 1.00 73.12 C ATOM 1993 CG1 VAL C 218 -1.004 12.824 4.159 1.00 4.20 C ATOM 1994 CG2 VAL C 218 -0.097 13.700 2.022 1.00 72.04 C ATOM 0 H VAL C 218 2.818 13.477 3.066 1.00 72.24 H new ATOM 0 HA VAL C 218 0.635 15.165 4.085 1.00 4.25 H new ATOM 0 HB VAL C 218 0.851 12.245 3.295 1.00 73.12 H new ATOM 0 HG11 VAL C 218 -1.585 12.089 3.602 1.00 4.20 H new ATOM 0 HG12 VAL C 218 -0.737 12.414 5.133 1.00 4.20 H new ATOM 0 HG13 VAL C 218 -1.599 13.727 4.296 1.00 4.20 H new ATOM 0 HG21 VAL C 218 -0.721 12.973 1.502 1.00 72.04 H new ATOM 0 HG22 VAL C 218 -0.647 14.634 2.136 1.00 72.04 H new ATOM 0 HG23 VAL C 218 0.809 13.881 1.443 1.00 72.04 H new ATOM 2004 N ALA C 219 0.486 14.264 6.425 1.00 75.30 N ATOM 2005 CA ALA C 219 0.582 13.998 7.833 1.00 51.04 C ATOM 2006 C ALA C 219 0.201 12.560 8.139 1.00 3.02 C ATOM 2007 O ALA C 219 -0.960 12.158 7.986 1.00 63.12 O ATOM 2008 CB ALA C 219 -0.294 14.961 8.615 1.00 4.44 C ATOM 0 H ALA C 219 -0.329 14.818 6.160 1.00 75.30 H new ATOM 0 HA ALA C 219 1.618 14.146 8.139 1.00 51.04 H new ATOM 0 HB1 ALA C 219 -0.210 14.746 9.680 1.00 4.44 H new ATOM 0 HB2 ALA C 219 0.030 15.984 8.425 1.00 4.44 H new ATOM 0 HB3 ALA C 219 -1.332 14.845 8.302 1.00 4.44 H new ATOM 2014 N ARG C 220 1.176 11.799 8.575 1.00 22.25 N ATOM 2015 CA ARG C 220 1.014 10.400 8.940 1.00 25.44 C ATOM 2016 C ARG C 220 0.081 10.252 10.167 1.00 52.13 C ATOM 2017 O ARG C 220 -0.475 9.183 10.434 1.00 2.41 O ATOM 2018 CB ARG C 220 2.437 9.786 9.114 1.00 64.10 C ATOM 2019 CG ARG C 220 2.581 8.338 9.619 1.00 65.32 C ATOM 2020 CD ARG C 220 2.346 8.219 11.097 1.00 22.33 C ATOM 2021 NE ARG C 220 3.212 9.111 11.876 1.00 75.15 N ATOM 2022 CZ ARG C 220 3.362 9.066 13.202 1.00 22.25 C ATOM 2023 NH1 ARG C 220 2.775 8.108 13.914 1.00 33.23 N ATOM 2024 NH2 ARG C 220 4.106 9.973 13.802 1.00 24.44 N ATOM 0 H ARG C 220 2.131 12.138 8.691 1.00 22.25 H new ATOM 0 HA ARG C 220 0.509 9.834 8.157 1.00 25.44 H new ATOM 0 HB2 ARG C 220 2.939 9.847 8.149 1.00 64.10 H new ATOM 0 HB3 ARG C 220 2.988 10.428 9.801 1.00 64.10 H new ATOM 0 HG2 ARG C 220 1.874 7.700 9.089 1.00 65.32 H new ATOM 0 HG3 ARG C 220 3.580 7.972 9.382 1.00 65.32 H new ATOM 0 HD2 ARG C 220 1.303 8.448 11.316 1.00 22.33 H new ATOM 0 HD3 ARG C 220 2.518 7.188 11.407 1.00 22.33 H new ATOM 0 HE ARG C 220 3.740 9.819 11.366 1.00 75.15 H new ATOM 0 HH11 ARG C 220 2.206 7.402 13.447 1.00 33.23 H new ATOM 0 HH12 ARG C 220 2.894 8.080 14.927 1.00 33.23 H new ATOM 0 HH21 ARG C 220 4.562 10.702 13.254 1.00 24.44 H new ATOM 0 HH22 ARG C 220 4.226 9.946 14.815 1.00 24.44 H new ATOM 2038 N ALA C 221 -0.087 11.319 10.893 1.00 5.51 N ATOM 2039 CA ALA C 221 -0.999 11.337 12.010 1.00 41.30 C ATOM 2040 C ALA C 221 -2.456 11.597 11.564 1.00 25.34 C ATOM 2041 O ALA C 221 -3.387 11.428 12.353 1.00 1.14 O ATOM 2042 CB ALA C 221 -0.565 12.380 13.008 1.00 5.40 C ATOM 0 H ALA C 221 0.400 12.200 10.732 1.00 5.51 H new ATOM 0 HA ALA C 221 -0.973 10.352 12.476 1.00 41.30 H new ATOM 0 HB1 ALA C 221 -1.258 12.389 13.849 1.00 5.40 H new ATOM 0 HB2 ALA C 221 0.438 12.146 13.366 1.00 5.40 H new ATOM 0 HB3 ALA C 221 -0.561 13.360 12.531 1.00 5.40 H new ATOM 2048 N ASN C 222 -2.655 11.993 10.308 1.00 62.34 N ATOM 2049 CA ASN C 222 -3.996 12.399 9.842 1.00 72.15 C ATOM 2050 C ASN C 222 -4.581 11.353 8.863 1.00 53.32 C ATOM 2051 O ASN C 222 -5.681 11.512 8.332 1.00 2.25 O ATOM 2052 CB ASN C 222 -3.899 13.795 9.171 1.00 11.53 C ATOM 2053 CG ASN C 222 -5.249 14.493 8.960 1.00 11.25 C ATOM 2054 OD1 ASN C 222 -5.820 14.360 7.796 1.00 5.35 O flip ATOM 2055 ND2 ASN C 222 -5.747 15.191 9.854 1.00 60.23 N flip ATOM 0 H ASN C 222 -1.924 12.044 9.599 1.00 62.34 H new ATOM 0 HA ASN C 222 -4.671 12.458 10.696 1.00 72.15 H new ATOM 0 HB2 ASN C 222 -3.265 14.436 9.784 1.00 11.53 H new ATOM 0 HB3 ASN C 222 -3.405 13.687 8.205 1.00 11.53 H new ATOM 0 HD21 ASN C 222 -5.277 15.277 10.755 1.00 60.23 H new ATOM 0 HD22 ASN C 222 -6.627 15.680 9.689 1.00 60.23 H new ATOM 2062 N VAL C 223 -3.847 10.283 8.666 1.00 60.13 N ATOM 2063 CA VAL C 223 -4.225 9.210 7.737 1.00 45.34 C ATOM 2064 C VAL C 223 -4.817 7.988 8.480 1.00 64.41 C ATOM 2065 O VAL C 223 -4.480 7.739 9.642 1.00 5.33 O ATOM 2066 CB VAL C 223 -2.984 8.785 6.865 1.00 10.32 C ATOM 2067 CG1 VAL C 223 -1.798 8.530 7.746 1.00 23.42 C ATOM 2068 CG2 VAL C 223 -3.261 7.529 6.075 1.00 21.44 C ATOM 0 H VAL C 223 -2.961 10.118 9.143 1.00 60.13 H new ATOM 0 HA VAL C 223 -5.004 9.596 7.080 1.00 45.34 H new ATOM 0 HB VAL C 223 -2.782 9.604 6.174 1.00 10.32 H new ATOM 0 HG11 VAL C 223 -0.946 8.237 7.133 1.00 23.42 H new ATOM 0 HG12 VAL C 223 -1.553 9.437 8.298 1.00 23.42 H new ATOM 0 HG13 VAL C 223 -2.032 7.730 8.448 1.00 23.42 H new ATOM 0 HG21 VAL C 223 -2.382 7.268 5.486 1.00 21.44 H new ATOM 0 HG22 VAL C 223 -3.495 6.713 6.759 1.00 21.44 H new ATOM 0 HG23 VAL C 223 -4.107 7.698 5.408 1.00 21.44 H new ATOM 2078 N LYS C 224 -5.734 7.259 7.811 1.00 51.20 N ATOM 2079 CA LYS C 224 -6.291 6.028 8.368 1.00 2.14 C ATOM 2080 C LYS C 224 -5.559 4.789 7.848 1.00 62.34 C ATOM 2081 O LYS C 224 -5.328 3.854 8.588 1.00 74.35 O ATOM 2082 CB LYS C 224 -7.780 5.872 8.036 1.00 25.52 C ATOM 2083 CG LYS C 224 -8.648 6.965 8.604 1.00 3.54 C ATOM 2084 CD LYS C 224 -10.135 6.748 8.327 1.00 12.32 C ATOM 2085 CE LYS C 224 -10.449 6.722 6.842 1.00 43.44 C ATOM 2086 NZ LYS C 224 -11.900 6.633 6.590 1.00 11.11 N ATOM 0 H LYS C 224 -6.097 7.507 6.891 1.00 51.20 H new ATOM 0 HA LYS C 224 -6.163 6.108 9.447 1.00 2.14 H new ATOM 0 HB2 LYS C 224 -7.901 5.851 6.953 1.00 25.52 H new ATOM 0 HB3 LYS C 224 -8.128 4.911 8.414 1.00 25.52 H new ATOM 0 HG2 LYS C 224 -8.489 7.026 9.681 1.00 3.54 H new ATOM 0 HG3 LYS C 224 -8.341 7.922 8.182 1.00 3.54 H new ATOM 0 HD2 LYS C 224 -10.453 5.809 8.779 1.00 12.32 H new ATOM 0 HD3 LYS C 224 -10.710 7.542 8.803 1.00 12.32 H new ATOM 0 HE2 LYS C 224 -10.053 7.622 6.371 1.00 43.44 H new ATOM 0 HE3 LYS C 224 -9.947 5.872 6.379 1.00 43.44 H new ATOM 0 HZ1 LYS C 224 -12.073 6.600 5.565 1.00 11.11 H new ATOM 0 HZ2 LYS C 224 -12.277 5.770 7.032 1.00 11.11 H new ATOM 0 HZ3 LYS C 224 -12.374 7.465 6.995 1.00 11.11 H new ATOM 2100 N HIS C 225 -5.210 4.797 6.545 1.00 21.04 N ATOM 2101 CA HIS C 225 -4.578 3.620 5.886 1.00 70.43 C ATOM 2102 C HIS C 225 -4.191 3.931 4.428 1.00 2.02 C ATOM 2103 O HIS C 225 -4.566 4.994 3.902 1.00 21.10 O ATOM 2104 CB HIS C 225 -5.527 2.393 5.906 1.00 13.31 C ATOM 2105 CG HIS C 225 -6.855 2.596 5.216 1.00 0.41 C ATOM 2106 ND1 HIS C 225 -7.132 3.672 4.400 1.00 73.12 N ATOM 2107 CD2 HIS C 225 -7.982 1.867 5.247 1.00 61.23 C ATOM 2108 CE1 HIS C 225 -8.358 3.594 3.977 1.00 2.31 C ATOM 2109 NE2 HIS C 225 -8.898 2.512 4.469 1.00 32.34 N ATOM 0 H HIS C 225 -5.351 5.596 5.927 1.00 21.04 H new ATOM 0 HA HIS C 225 -3.675 3.389 6.451 1.00 70.43 H new ATOM 0 HB2 HIS C 225 -5.017 1.552 5.437 1.00 13.31 H new ATOM 0 HB3 HIS C 225 -5.713 2.115 6.943 1.00 13.31 H new ATOM 0 HD2 HIS C 225 -8.135 0.944 5.786 1.00 61.23 H new ATOM 0 HE1 HIS C 225 -8.848 4.305 3.328 1.00 2.31 H new ATOM 0 HE2 HIS C 225 -9.854 2.199 4.299 1.00 32.34 H new ATOM 2118 N LEU C 226 -3.537 2.970 3.773 1.00 42.44 N ATOM 2119 CA LEU C 226 -3.057 3.109 2.380 1.00 15.11 C ATOM 2120 C LEU C 226 -3.726 2.114 1.411 1.00 12.14 C ATOM 2121 O LEU C 226 -4.123 1.010 1.801 1.00 42.02 O ATOM 2122 CB LEU C 226 -1.518 2.858 2.300 1.00 15.52 C ATOM 2123 CG LEU C 226 -0.536 4.018 2.588 1.00 42.44 C ATOM 2124 CD1 LEU C 226 -0.773 4.658 3.917 1.00 31.13 C ATOM 2125 CD2 LEU C 226 0.901 3.510 2.503 1.00 31.51 C ATOM 0 H LEU C 226 -3.320 2.064 4.189 1.00 42.44 H new ATOM 0 HA LEU C 226 -3.314 4.126 2.085 1.00 15.11 H new ATOM 0 HB2 LEU C 226 -1.283 2.052 2.995 1.00 15.52 H new ATOM 0 HB3 LEU C 226 -1.300 2.488 1.298 1.00 15.52 H new ATOM 0 HG LEU C 226 -0.709 4.783 1.831 1.00 42.44 H new ATOM 0 HD11 LEU C 226 -0.055 5.465 4.065 1.00 31.13 H new ATOM 0 HD12 LEU C 226 -1.785 5.062 3.951 1.00 31.13 H new ATOM 0 HD13 LEU C 226 -0.652 3.915 4.705 1.00 31.13 H new ATOM 0 HD21 LEU C 226 1.589 4.330 2.706 1.00 31.51 H new ATOM 0 HD22 LEU C 226 1.051 2.719 3.238 1.00 31.51 H new ATOM 0 HD23 LEU C 226 1.090 3.117 1.504 1.00 31.51 H new ATOM 2137 N LYS C 227 -3.864 2.542 0.160 1.00 20.23 N ATOM 2138 CA LYS C 227 -4.210 1.666 -0.951 1.00 75.34 C ATOM 2139 C LYS C 227 -2.981 1.701 -1.791 1.00 70.35 C ATOM 2140 O LYS C 227 -2.602 2.783 -2.259 1.00 72.40 O ATOM 2141 CB LYS C 227 -5.361 2.218 -1.862 1.00 11.34 C ATOM 2142 CG LYS C 227 -5.828 1.222 -2.951 1.00 75.33 C ATOM 2143 CD LYS C 227 -6.826 0.191 -2.406 1.00 34.44 C ATOM 2144 CE LYS C 227 -8.267 0.759 -2.264 1.00 24.45 C ATOM 2145 NZ LYS C 227 -8.395 1.944 -1.360 1.00 42.02 N ATOM 0 H LYS C 227 -3.737 3.517 -0.112 1.00 20.23 H new ATOM 0 HA LYS C 227 -4.536 0.697 -0.572 1.00 75.34 H new ATOM 0 HB2 LYS C 227 -6.213 2.482 -1.235 1.00 11.34 H new ATOM 0 HB3 LYS C 227 -5.022 3.136 -2.343 1.00 11.34 H new ATOM 0 HG2 LYS C 227 -6.289 1.773 -3.771 1.00 75.33 H new ATOM 0 HG3 LYS C 227 -4.962 0.704 -3.362 1.00 75.33 H new ATOM 0 HD2 LYS C 227 -6.846 -0.674 -3.069 1.00 34.44 H new ATOM 0 HD3 LYS C 227 -6.482 -0.161 -1.433 1.00 34.44 H new ATOM 0 HE2 LYS C 227 -8.631 1.035 -3.254 1.00 24.45 H new ATOM 0 HE3 LYS C 227 -8.918 -0.033 -1.894 1.00 24.45 H new ATOM 0 HZ1 LYS C 227 -9.401 2.136 -1.180 1.00 42.02 H new ATOM 0 HZ2 LYS C 227 -7.914 1.747 -0.459 1.00 42.02 H new ATOM 0 HZ3 LYS C 227 -7.959 2.774 -1.811 1.00 42.02 H new ATOM 2159 N ILE C 228 -2.344 0.612 -1.979 1.00 3.41 N ATOM 2160 CA ILE C 228 -1.174 0.641 -2.789 1.00 62.11 C ATOM 2161 C ILE C 228 -1.471 -0.040 -4.071 1.00 32.40 C ATOM 2162 O ILE C 228 -2.036 -1.150 -4.080 1.00 60.22 O ATOM 2163 CB ILE C 228 0.066 -0.013 -2.140 1.00 73.32 C ATOM 2164 CG1 ILE C 228 0.330 0.571 -0.762 1.00 71.24 C ATOM 2165 CG2 ILE C 228 1.295 0.225 -3.028 1.00 52.23 C ATOM 2166 CD1 ILE C 228 1.542 -0.028 -0.101 1.00 1.22 C ATOM 0 H ILE C 228 -2.599 -0.298 -1.596 1.00 3.41 H new ATOM 0 HA ILE C 228 -0.919 1.691 -2.933 1.00 62.11 H new ATOM 0 HB ILE C 228 -0.125 -1.081 -2.038 1.00 73.32 H new ATOM 0 HG12 ILE C 228 0.464 1.649 -0.848 1.00 71.24 H new ATOM 0 HG13 ILE C 228 -0.542 0.407 -0.129 1.00 71.24 H new ATOM 0 HG21 ILE C 228 2.170 -0.237 -2.570 1.00 52.23 H new ATOM 0 HG22 ILE C 228 1.125 -0.216 -4.010 1.00 52.23 H new ATOM 0 HG23 ILE C 228 1.464 1.296 -3.135 1.00 52.23 H new ATOM 0 HD11 ILE C 228 1.683 0.426 0.880 1.00 1.22 H new ATOM 0 HD12 ILE C 228 1.400 -1.103 0.013 1.00 1.22 H new ATOM 0 HD13 ILE C 228 2.422 0.158 -0.717 1.00 1.22 H new ATOM 2178 N LEU C 229 -1.141 0.625 -5.131 1.00 31.30 N ATOM 2179 CA LEU C 229 -1.305 0.119 -6.433 1.00 14.35 C ATOM 2180 C LEU C 229 -0.145 0.591 -7.302 1.00 60.14 C ATOM 2181 O LEU C 229 -0.010 1.765 -7.640 1.00 72.05 O ATOM 2182 CB LEU C 229 -2.735 0.451 -6.957 1.00 33.10 C ATOM 2183 CG LEU C 229 -3.196 1.921 -6.906 1.00 45.33 C ATOM 2184 CD1 LEU C 229 -2.762 2.685 -8.123 1.00 32.41 C ATOM 2185 CD2 LEU C 229 -4.684 2.014 -6.714 1.00 51.13 C ATOM 0 H LEU C 229 -0.739 1.562 -5.101 1.00 31.30 H new ATOM 0 HA LEU C 229 -1.256 -0.970 -6.457 1.00 14.35 H new ATOM 0 HB2 LEU C 229 -2.798 0.116 -7.992 1.00 33.10 H new ATOM 0 HB3 LEU C 229 -3.448 -0.143 -6.385 1.00 33.10 H new ATOM 0 HG LEU C 229 -2.713 2.382 -6.044 1.00 45.33 H new ATOM 0 HD11 LEU C 229 -3.107 3.716 -8.047 1.00 32.41 H new ATOM 0 HD12 LEU C 229 -1.674 2.670 -8.193 1.00 32.41 H new ATOM 0 HD13 LEU C 229 -3.189 2.224 -9.014 1.00 32.41 H new ATOM 0 HD21 LEU C 229 -4.982 3.062 -6.682 1.00 51.13 H new ATOM 0 HD22 LEU C 229 -5.189 1.519 -7.543 1.00 51.13 H new ATOM 0 HD23 LEU C 229 -4.961 1.529 -5.778 1.00 51.13 H new ATOM 2197 N ASN C 230 0.745 -0.308 -7.580 1.00 12.11 N ATOM 2198 CA ASN C 230 1.903 0.027 -8.355 1.00 62.35 C ATOM 2199 C ASN C 230 1.523 -0.054 -9.809 1.00 44.22 C ATOM 2200 O ASN C 230 1.322 -1.128 -10.351 1.00 2.54 O ATOM 2201 CB ASN C 230 3.092 -0.909 -8.013 1.00 51.42 C ATOM 2202 CG ASN C 230 4.469 -0.469 -8.584 1.00 11.32 C ATOM 2203 OD1 ASN C 230 5.501 -0.727 -7.975 1.00 44.03 O ATOM 2204 ND2 ASN C 230 4.505 0.169 -9.736 1.00 51.51 N ATOM 0 H ASN C 230 0.694 -1.282 -7.282 1.00 12.11 H new ATOM 0 HA ASN C 230 2.237 1.038 -8.122 1.00 62.35 H new ATOM 0 HB2 ASN C 230 3.174 -0.984 -6.929 1.00 51.42 H new ATOM 0 HB3 ASN C 230 2.865 -1.908 -8.385 1.00 51.42 H new ATOM 0 HD21 ASN C 230 5.400 0.455 -10.133 1.00 51.51 H new ATOM 0 HD22 ASN C 230 3.638 0.377 -10.231 1.00 51.51 H new ATOM 2211 N THR C 231 1.363 1.087 -10.405 1.00 64.23 N ATOM 2212 CA THR C 231 0.995 1.192 -11.784 1.00 52.10 C ATOM 2213 C THR C 231 2.250 1.041 -12.653 1.00 1.30 C ATOM 2214 O THR C 231 3.344 1.297 -12.178 1.00 65.32 O ATOM 2215 CB THR C 231 0.341 2.577 -12.018 1.00 30.52 C ATOM 2216 OG1 THR C 231 1.274 3.596 -11.639 1.00 71.42 O ATOM 2217 CG2 THR C 231 -0.908 2.739 -11.150 1.00 0.35 C ATOM 0 H THR C 231 1.486 1.986 -9.940 1.00 64.23 H new ATOM 0 HA THR C 231 0.286 0.408 -12.051 1.00 52.10 H new ATOM 0 HB THR C 231 0.066 2.659 -13.070 1.00 30.52 H new ATOM 0 HG1 THR C 231 2.186 3.291 -11.828 1.00 71.42 H new ATOM 0 HG21 THR C 231 -1.352 3.718 -11.330 1.00 0.35 H new ATOM 0 HG22 THR C 231 -1.630 1.962 -11.402 1.00 0.35 H new ATOM 0 HG23 THR C 231 -0.634 2.652 -10.099 1.00 0.35 H new ATOM 2225 N PRO C 232 2.135 0.591 -13.902 1.00 14.10 N ATOM 2226 CA PRO C 232 3.296 0.461 -14.792 1.00 33.44 C ATOM 2227 C PRO C 232 3.604 1.763 -15.555 1.00 71.02 C ATOM 2228 O PRO C 232 4.683 1.919 -16.119 1.00 1.44 O ATOM 2229 CB PRO C 232 2.832 -0.613 -15.768 1.00 41.02 C ATOM 2230 CG PRO C 232 1.373 -0.352 -15.914 1.00 10.23 C ATOM 2231 CD PRO C 232 0.893 0.098 -14.550 1.00 22.21 C ATOM 0 HA PRO C 232 4.212 0.227 -14.250 1.00 33.44 H new ATOM 0 HB2 PRO C 232 3.350 -0.536 -16.724 1.00 41.02 H new ATOM 0 HB3 PRO C 232 3.023 -1.614 -15.382 1.00 41.02 H new ATOM 0 HG2 PRO C 232 1.187 0.415 -16.666 1.00 10.23 H new ATOM 0 HG3 PRO C 232 0.846 -1.250 -16.237 1.00 10.23 H new ATOM 0 HD2 PRO C 232 0.140 0.882 -14.626 1.00 22.21 H new ATOM 0 HD3 PRO C 232 0.444 -0.722 -13.990 1.00 22.21 H new ATOM 2239 N ASN C 233 2.648 2.687 -15.562 1.00 63.53 N ATOM 2240 CA ASN C 233 2.790 3.933 -16.332 1.00 23.11 C ATOM 2241 C ASN C 233 3.219 5.067 -15.401 1.00 44.21 C ATOM 2242 O ASN C 233 3.767 6.075 -15.836 1.00 54.42 O ATOM 2243 CB ASN C 233 1.449 4.273 -17.000 1.00 50.34 C ATOM 2244 CG ASN C 233 1.525 5.256 -18.188 1.00 73.12 C ATOM 2245 OD1 ASN C 233 0.708 5.180 -19.085 1.00 54.32 O ATOM 2246 ND2 ASN C 233 2.471 6.156 -18.207 1.00 54.44 N ATOM 0 H ASN C 233 1.770 2.604 -15.049 1.00 63.53 H new ATOM 0 HA ASN C 233 3.551 3.804 -17.102 1.00 23.11 H new ATOM 0 HB2 ASN C 233 0.991 3.347 -17.347 1.00 50.34 H new ATOM 0 HB3 ASN C 233 0.784 4.694 -16.246 1.00 50.34 H new ATOM 0 HD21 ASN C 233 2.535 6.813 -18.985 1.00 54.44 H new ATOM 0 HD22 ASN C 233 3.146 6.202 -17.444 1.00 54.44 H new ATOM 2253 N CYS C 234 2.976 4.884 -14.137 1.00 53.32 N ATOM 2254 CA CYS C 234 3.348 5.847 -13.129 1.00 65.23 C ATOM 2255 C CYS C 234 4.186 5.090 -12.095 1.00 13.12 C ATOM 2256 O CYS C 234 3.948 3.903 -11.901 1.00 45.24 O ATOM 2257 CB CYS C 234 2.064 6.496 -12.516 1.00 20.04 C ATOM 2258 SG CYS C 234 1.026 7.378 -13.755 1.00 63.01 S ATOM 0 H CYS C 234 2.510 4.056 -13.767 1.00 53.32 H new ATOM 0 HA CYS C 234 3.934 6.671 -13.536 1.00 65.23 H new ATOM 0 HB2 CYS C 234 1.466 5.719 -12.039 1.00 20.04 H new ATOM 0 HB3 CYS C 234 2.358 7.197 -11.735 1.00 20.04 H new ATOM 2263 N ALA C 235 5.170 5.763 -11.467 1.00 64.23 N ATOM 2264 CA ALA C 235 6.166 5.110 -10.558 1.00 73.34 C ATOM 2265 C ALA C 235 5.539 4.077 -9.604 1.00 65.22 C ATOM 2266 O ALA C 235 5.831 2.887 -9.696 1.00 45.20 O ATOM 2267 CB ALA C 235 6.966 6.155 -9.784 1.00 1.20 C ATOM 0 H ALA C 235 5.307 6.769 -11.567 1.00 64.23 H new ATOM 0 HA ALA C 235 6.846 4.553 -11.203 1.00 73.34 H new ATOM 0 HB1 ALA C 235 7.682 5.655 -9.131 1.00 1.20 H new ATOM 0 HB2 ALA C 235 7.500 6.797 -10.485 1.00 1.20 H new ATOM 0 HB3 ALA C 235 6.288 6.760 -9.182 1.00 1.20 H new ATOM 2273 N CYS C 236 4.697 4.531 -8.728 1.00 43.20 N ATOM 2274 CA CYS C 236 3.956 3.682 -7.811 1.00 51.04 C ATOM 2275 C CYS C 236 2.932 4.582 -7.179 1.00 61.12 C ATOM 2276 O CYS C 236 3.244 5.716 -6.844 1.00 44.04 O ATOM 2277 CB CYS C 236 4.876 3.003 -6.740 1.00 44.43 C ATOM 2278 SG CYS C 236 4.016 1.791 -5.668 1.00 34.24 S ATOM 0 H CYS C 236 4.492 5.524 -8.618 1.00 43.20 H new ATOM 0 HA CYS C 236 3.493 2.847 -8.338 1.00 51.04 H new ATOM 0 HB2 CYS C 236 5.698 2.501 -7.250 1.00 44.43 H new ATOM 0 HB3 CYS C 236 5.316 3.778 -6.112 1.00 44.43 H new ATOM 2283 N GLN C 237 1.722 4.142 -7.049 1.00 62.34 N ATOM 2284 CA GLN C 237 0.713 5.040 -6.594 1.00 21.30 C ATOM 2285 C GLN C 237 0.121 4.557 -5.290 1.00 22.43 C ATOM 2286 O GLN C 237 -0.339 3.417 -5.176 1.00 5.51 O ATOM 2287 CB GLN C 237 -0.378 5.172 -7.653 1.00 42.34 C ATOM 2288 CG GLN C 237 -1.325 6.350 -7.461 1.00 63.25 C ATOM 2289 CD GLN C 237 -0.748 7.696 -7.925 1.00 10.14 C ATOM 2290 OE1 GLN C 237 0.565 7.851 -7.922 1.00 4.20 O flip ATOM 2291 NE2 GLN C 237 -1.497 8.580 -8.330 1.00 23.04 N flip ATOM 0 H GLN C 237 1.414 3.190 -7.246 1.00 62.34 H new ATOM 0 HA GLN C 237 1.164 6.017 -6.424 1.00 21.30 H new ATOM 0 HB2 GLN C 237 0.095 5.262 -8.631 1.00 42.34 H new ATOM 0 HB3 GLN C 237 -0.964 4.253 -7.666 1.00 42.34 H new ATOM 0 HG2 GLN C 237 -2.248 6.154 -8.007 1.00 63.25 H new ATOM 0 HG3 GLN C 237 -1.588 6.423 -6.406 1.00 63.25 H new ATOM 0 HE21 GLN C 237 -2.507 8.436 -8.322 1.00 23.04 H new ATOM 0 HE22 GLN C 237 -1.110 9.458 -8.674 1.00 23.04 H new ATOM 2300 N ILE C 238 0.155 5.410 -4.316 1.00 61.22 N ATOM 2301 CA ILE C 238 -0.421 5.130 -3.045 1.00 52.13 C ATOM 2302 C ILE C 238 -1.547 6.107 -2.804 1.00 62.21 C ATOM 2303 O ILE C 238 -1.367 7.306 -2.953 1.00 5.52 O ATOM 2304 CB ILE C 238 0.621 5.250 -1.909 1.00 71.41 C ATOM 2305 CG1 ILE C 238 1.735 4.207 -2.082 1.00 43.53 C ATOM 2306 CG2 ILE C 238 -0.043 5.124 -0.549 1.00 10.41 C ATOM 2307 CD1 ILE C 238 2.776 4.228 -0.984 1.00 45.25 C ATOM 0 H ILE C 238 0.589 6.330 -4.384 1.00 61.22 H new ATOM 0 HA ILE C 238 -0.792 4.105 -3.046 1.00 52.13 H new ATOM 0 HB ILE C 238 1.075 6.239 -1.966 1.00 71.41 H new ATOM 0 HG12 ILE C 238 1.286 3.215 -2.123 1.00 43.53 H new ATOM 0 HG13 ILE C 238 2.229 4.374 -3.039 1.00 43.53 H new ATOM 0 HG21 ILE C 238 0.711 5.212 0.233 1.00 10.41 H new ATOM 0 HG22 ILE C 238 -0.783 5.916 -0.431 1.00 10.41 H new ATOM 0 HG23 ILE C 238 -0.534 4.154 -0.472 1.00 10.41 H new ATOM 0 HD11 ILE C 238 3.527 3.462 -1.180 1.00 45.25 H new ATOM 0 HD12 ILE C 238 3.255 5.207 -0.955 1.00 45.25 H new ATOM 0 HD13 ILE C 238 2.297 4.030 -0.025 1.00 45.25 H new ATOM 2319 N VAL C 239 -2.699 5.609 -2.478 1.00 2.33 N ATOM 2320 CA VAL C 239 -3.822 6.463 -2.196 1.00 40.03 C ATOM 2321 C VAL C 239 -4.194 6.302 -0.726 1.00 13.20 C ATOM 2322 O VAL C 239 -4.421 5.181 -0.264 1.00 63.24 O ATOM 2323 CB VAL C 239 -5.039 6.111 -3.089 1.00 51.14 C ATOM 2324 CG1 VAL C 239 -6.164 7.093 -2.866 1.00 1.40 C ATOM 2325 CG2 VAL C 239 -4.648 6.067 -4.565 1.00 62.24 C ATOM 0 H VAL C 239 -2.892 4.611 -2.399 1.00 2.33 H new ATOM 0 HA VAL C 239 -3.545 7.495 -2.410 1.00 40.03 H new ATOM 0 HB VAL C 239 -5.386 5.117 -2.805 1.00 51.14 H new ATOM 0 HG11 VAL C 239 -7.009 6.829 -3.502 1.00 1.40 H new ATOM 0 HG12 VAL C 239 -6.473 7.062 -1.821 1.00 1.40 H new ATOM 0 HG13 VAL C 239 -5.824 8.098 -3.114 1.00 1.40 H new ATOM 0 HG21 VAL C 239 -5.523 5.818 -5.166 1.00 62.24 H new ATOM 0 HG22 VAL C 239 -4.265 7.041 -4.869 1.00 62.24 H new ATOM 0 HG23 VAL C 239 -3.877 5.311 -4.715 1.00 62.24 H new ATOM 2335 N ALA C 240 -4.275 7.385 -0.001 1.00 55.33 N ATOM 2336 CA ALA C 240 -4.543 7.316 1.413 1.00 5.40 C ATOM 2337 C ALA C 240 -5.777 8.111 1.790 1.00 71.15 C ATOM 2338 O ALA C 240 -5.971 9.246 1.357 1.00 74.14 O ATOM 2339 CB ALA C 240 -3.331 7.791 2.217 1.00 2.22 C ATOM 0 H ALA C 240 -4.159 8.330 -0.367 1.00 55.33 H new ATOM 0 HA ALA C 240 -4.737 6.272 1.658 1.00 5.40 H new ATOM 0 HB1 ALA C 240 -3.555 7.731 3.282 1.00 2.22 H new ATOM 0 HB2 ALA C 240 -2.473 7.158 1.990 1.00 2.22 H new ATOM 0 HB3 ALA C 240 -3.101 8.823 1.952 1.00 2.22 H new ATOM 2345 N ARG C 241 -6.615 7.517 2.583 1.00 23.11 N ATOM 2346 CA ARG C 241 -7.771 8.209 3.069 1.00 3.30 C ATOM 2347 C ARG C 241 -7.495 8.752 4.428 1.00 33.41 C ATOM 2348 O ARG C 241 -6.983 8.034 5.314 1.00 64.00 O ATOM 2349 CB ARG C 241 -9.037 7.348 3.067 1.00 75.20 C ATOM 2350 CG ARG C 241 -9.561 7.030 1.682 1.00 71.13 C ATOM 2351 CD ARG C 241 -10.883 6.288 1.736 1.00 25.05 C ATOM 2352 NE ARG C 241 -11.467 6.122 0.400 1.00 73.54 N ATOM 2353 CZ ARG C 241 -12.734 5.762 0.161 1.00 11.11 C ATOM 2354 NH1 ARG C 241 -13.541 5.452 1.166 1.00 52.32 N ATOM 2355 NH2 ARG C 241 -13.181 5.701 -1.086 1.00 3.04 N ATOM 0 H ARG C 241 -6.521 6.555 2.908 1.00 23.11 H new ATOM 0 HA ARG C 241 -7.971 9.030 2.380 1.00 3.30 H new ATOM 0 HB2 ARG C 241 -8.830 6.414 3.590 1.00 75.20 H new ATOM 0 HB3 ARG C 241 -9.816 7.863 3.630 1.00 75.20 H new ATOM 0 HG2 ARG C 241 -9.686 7.955 1.120 1.00 71.13 H new ATOM 0 HG3 ARG C 241 -8.828 6.428 1.146 1.00 71.13 H new ATOM 0 HD2 ARG C 241 -10.733 5.309 2.192 1.00 25.05 H new ATOM 0 HD3 ARG C 241 -11.580 6.832 2.373 1.00 25.05 H new ATOM 0 HE ARG C 241 -10.864 6.293 -0.405 1.00 73.54 H new ATOM 0 HH11 ARG C 241 -13.197 5.487 2.126 1.00 52.32 H new ATOM 0 HH12 ARG C 241 -14.506 5.178 0.980 1.00 52.32 H new ATOM 0 HH21 ARG C 241 -12.560 5.928 -1.862 1.00 3.04 H new ATOM 0 HH22 ARG C 241 -14.146 5.427 -1.269 1.00 3.04 H new ATOM 2369 N LEU C 242 -7.792 10.013 4.589 1.00 21.31 N ATOM 2370 CA LEU C 242 -7.569 10.709 5.823 1.00 34.03 C ATOM 2371 C LEU C 242 -8.633 10.298 6.838 1.00 61.03 C ATOM 2372 O LEU C 242 -9.623 9.663 6.477 1.00 4.52 O ATOM 2373 CB LEU C 242 -7.596 12.221 5.569 1.00 24.44 C ATOM 2374 CG LEU C 242 -6.613 12.745 4.505 1.00 13.42 C ATOM 2375 CD1 LEU C 242 -6.812 14.236 4.268 1.00 44.31 C ATOM 2376 CD2 LEU C 242 -5.166 12.437 4.880 1.00 44.03 C ATOM 0 H LEU C 242 -8.201 10.592 3.856 1.00 21.31 H new ATOM 0 HA LEU C 242 -6.591 10.449 6.229 1.00 34.03 H new ATOM 0 HB2 LEU C 242 -8.606 12.501 5.271 1.00 24.44 H new ATOM 0 HB3 LEU C 242 -7.388 12.731 6.510 1.00 24.44 H new ATOM 0 HG LEU C 242 -6.827 12.223 3.572 1.00 13.42 H new ATOM 0 HD11 LEU C 242 -6.106 14.582 3.513 1.00 44.31 H new ATOM 0 HD12 LEU C 242 -7.830 14.417 3.923 1.00 44.31 H new ATOM 0 HD13 LEU C 242 -6.642 14.778 5.198 1.00 44.31 H new ATOM 0 HD21 LEU C 242 -4.500 12.821 4.107 1.00 44.03 H new ATOM 0 HD22 LEU C 242 -4.928 12.911 5.832 1.00 44.03 H new ATOM 0 HD23 LEU C 242 -5.035 11.359 4.969 1.00 44.03 H new ATOM 2388 N LYS C 243 -8.430 10.671 8.082 1.00 44.03 N ATOM 2389 CA LYS C 243 -9.305 10.293 9.220 1.00 63.33 C ATOM 2390 C LYS C 243 -10.672 11.004 9.226 1.00 64.04 C ATOM 2391 O LYS C 243 -11.181 11.367 10.287 1.00 41.34 O ATOM 2392 CB LYS C 243 -8.547 10.549 10.519 1.00 14.13 C ATOM 2393 CG LYS C 243 -7.352 9.627 10.701 1.00 34.23 C ATOM 2394 CD LYS C 243 -6.413 10.018 11.853 1.00 25.43 C ATOM 2395 CE LYS C 243 -7.073 10.080 13.250 1.00 21.00 C ATOM 2396 NZ LYS C 243 -7.993 11.233 13.440 1.00 22.12 N ATOM 0 H LYS C 243 -7.643 11.257 8.359 1.00 44.03 H new ATOM 0 HA LYS C 243 -9.543 9.235 9.114 1.00 63.33 H new ATOM 0 HB2 LYS C 243 -8.206 11.584 10.536 1.00 14.13 H new ATOM 0 HB3 LYS C 243 -9.228 10.423 11.361 1.00 14.13 H new ATOM 0 HG2 LYS C 243 -7.714 8.613 10.873 1.00 34.23 H new ATOM 0 HG3 LYS C 243 -6.780 9.608 9.774 1.00 34.23 H new ATOM 0 HD2 LYS C 243 -5.591 9.303 11.889 1.00 25.43 H new ATOM 0 HD3 LYS C 243 -5.978 10.993 11.631 1.00 25.43 H new ATOM 0 HE2 LYS C 243 -7.627 9.156 13.419 1.00 21.00 H new ATOM 0 HE3 LYS C 243 -6.290 10.126 14.007 1.00 21.00 H new ATOM 0 HZ1 LYS C 243 -7.788 11.695 14.349 1.00 22.12 H new ATOM 0 HZ2 LYS C 243 -7.859 11.915 12.667 1.00 22.12 H new ATOM 0 HZ3 LYS C 243 -8.977 10.896 13.437 1.00 22.12 H new ATOM 2410 N ASN C 244 -11.276 11.133 8.044 1.00 43.31 N ATOM 2411 CA ASN C 244 -12.599 11.764 7.847 1.00 22.15 C ATOM 2412 C ASN C 244 -12.577 13.226 8.233 1.00 20.43 C ATOM 2413 O ASN C 244 -13.614 13.830 8.559 1.00 45.33 O ATOM 2414 CB ASN C 244 -13.731 11.003 8.585 1.00 3.13 C ATOM 2415 CG ASN C 244 -13.998 9.607 8.021 1.00 61.34 C ATOM 2416 OD1 ASN C 244 -13.100 8.926 7.525 1.00 25.01 O ATOM 2417 ND2 ASN C 244 -15.230 9.176 8.085 1.00 22.04 N ATOM 0 H ASN C 244 -10.859 10.798 7.175 1.00 43.31 H new ATOM 0 HA ASN C 244 -12.820 11.703 6.781 1.00 22.15 H new ATOM 0 HB2 ASN C 244 -13.471 10.916 9.640 1.00 3.13 H new ATOM 0 HB3 ASN C 244 -14.648 11.590 8.530 1.00 3.13 H new ATOM 0 HD21 ASN C 244 -15.467 8.254 7.719 1.00 22.04 H new ATOM 0 HD22 ASN C 244 -15.954 9.761 8.501 1.00 22.04 H new ATOM 2424 N ASN C 245 -11.406 13.809 8.147 1.00 44.40 N ATOM 2425 CA ASN C 245 -11.230 15.202 8.470 1.00 41.24 C ATOM 2426 C ASN C 245 -11.433 16.052 7.244 1.00 0.02 C ATOM 2427 O ASN C 245 -12.122 17.065 7.288 1.00 22.02 O ATOM 2428 CB ASN C 245 -9.826 15.495 9.033 1.00 63.13 C ATOM 2429 CG ASN C 245 -9.483 14.717 10.276 1.00 64.52 C ATOM 2430 OD1 ASN C 245 -8.897 13.643 10.204 1.00 50.22 O ATOM 2431 ND2 ASN C 245 -9.848 15.235 11.412 1.00 33.04 N ATOM 0 H ASN C 245 -10.553 13.333 7.853 1.00 44.40 H new ATOM 0 HA ASN C 245 -11.971 15.442 9.232 1.00 41.24 H new ATOM 0 HB2 ASN C 245 -9.086 15.274 8.264 1.00 63.13 H new ATOM 0 HB3 ASN C 245 -9.750 16.560 9.252 1.00 63.13 H new ATOM 0 HD21 ASN C 245 -9.648 14.745 12.284 1.00 33.04 H new ATOM 0 HD22 ASN C 245 -10.334 16.132 11.431 1.00 33.04 H new ATOM 2438 N ASN C 246 -10.859 15.636 6.134 1.00 35.10 N ATOM 2439 CA ASN C 246 -10.871 16.470 4.956 1.00 23.11 C ATOM 2440 C ASN C 246 -11.330 15.717 3.719 1.00 44.44 C ATOM 2441 O ASN C 246 -12.449 15.913 3.253 1.00 31.11 O ATOM 2442 CB ASN C 246 -9.485 17.088 4.704 1.00 24.32 C ATOM 2443 CG ASN C 246 -8.944 17.889 5.873 1.00 64.22 C ATOM 2444 OD1 ASN C 246 -8.249 17.348 6.733 1.00 42.14 O ATOM 2445 ND2 ASN C 246 -9.237 19.157 5.912 1.00 4.23 N ATOM 0 H ASN C 246 -10.386 14.739 6.025 1.00 35.10 H new ATOM 0 HA ASN C 246 -11.590 17.266 5.148 1.00 23.11 H new ATOM 0 HB2 ASN C 246 -8.781 16.291 4.467 1.00 24.32 H new ATOM 0 HB3 ASN C 246 -9.541 17.735 3.829 1.00 24.32 H new ATOM 0 HD21 ASN C 246 -8.887 19.738 6.674 1.00 4.23 H new ATOM 0 HD22 ASN C 246 -9.816 19.569 5.181 1.00 4.23 H new ATOM 2452 N ARG C 247 -10.472 14.831 3.196 1.00 21.03 N ATOM 2453 CA ARG C 247 -10.764 14.126 1.953 1.00 10.43 C ATOM 2454 C ARG C 247 -9.794 12.964 1.757 1.00 22.00 C ATOM 2455 O ARG C 247 -9.074 12.594 2.675 1.00 33.30 O ATOM 2456 CB ARG C 247 -10.691 15.088 0.722 1.00 0.43 C ATOM 2457 CG ARG C 247 -9.300 15.663 0.331 1.00 14.24 C ATOM 2458 CD ARG C 247 -8.724 16.636 1.349 1.00 41.54 C ATOM 2459 NE ARG C 247 -7.425 17.183 0.911 1.00 15.22 N ATOM 2460 CZ ARG C 247 -6.694 18.095 1.585 1.00 11.40 C ATOM 2461 NH1 ARG C 247 -7.145 18.614 2.725 1.00 1.54 N ATOM 2462 NH2 ARG C 247 -5.532 18.503 1.097 1.00 0.44 N ATOM 0 H ARG C 247 -9.575 14.590 3.617 1.00 21.03 H new ATOM 0 HA ARG C 247 -11.780 13.738 2.026 1.00 10.43 H new ATOM 0 HB2 ARG C 247 -11.088 14.556 -0.142 1.00 0.43 H new ATOM 0 HB3 ARG C 247 -11.359 15.928 0.914 1.00 0.43 H new ATOM 0 HG2 ARG C 247 -8.601 14.837 0.198 1.00 14.24 H new ATOM 0 HG3 ARG C 247 -9.384 16.168 -0.631 1.00 14.24 H new ATOM 0 HD2 ARG C 247 -9.427 17.453 1.509 1.00 41.54 H new ATOM 0 HD3 ARG C 247 -8.601 16.130 2.306 1.00 41.54 H new ATOM 0 HE ARG C 247 -7.049 16.844 0.026 1.00 15.22 H new ATOM 0 HH11 ARG C 247 -8.050 18.323 3.095 1.00 1.54 H new ATOM 0 HH12 ARG C 247 -6.586 19.303 3.228 1.00 1.54 H new ATOM 0 HH21 ARG C 247 -5.190 18.128 0.212 1.00 0.44 H new ATOM 0 HH22 ARG C 247 -4.979 19.192 1.606 1.00 0.44 H new ATOM 2476 N GLN C 248 -9.791 12.395 0.573 1.00 44.22 N ATOM 2477 CA GLN C 248 -8.849 11.356 0.221 1.00 4.45 C ATOM 2478 C GLN C 248 -7.711 11.994 -0.564 1.00 51.23 C ATOM 2479 O GLN C 248 -7.955 12.782 -1.484 1.00 3.04 O ATOM 2480 CB GLN C 248 -9.545 10.280 -0.640 1.00 43.43 C ATOM 2481 CG GLN C 248 -8.617 9.198 -1.179 1.00 23.41 C ATOM 2482 CD GLN C 248 -9.332 8.179 -2.058 1.00 43.24 C ATOM 2483 OE1 GLN C 248 -9.813 7.139 -1.581 1.00 54.11 O ATOM 2484 NE2 GLN C 248 -9.418 8.462 -3.334 1.00 55.21 N ATOM 0 H GLN C 248 -10.442 12.639 -0.174 1.00 44.22 H new ATOM 0 HA GLN C 248 -8.464 10.878 1.122 1.00 4.45 H new ATOM 0 HB2 GLN C 248 -10.326 9.807 -0.045 1.00 43.43 H new ATOM 0 HB3 GLN C 248 -10.037 10.769 -1.480 1.00 43.43 H new ATOM 0 HG2 GLN C 248 -7.818 9.667 -1.753 1.00 23.41 H new ATOM 0 HG3 GLN C 248 -8.147 8.681 -0.342 1.00 23.41 H new ATOM 0 HE21 GLN C 248 -9.012 9.326 -3.693 1.00 55.21 H new ATOM 0 HE22 GLN C 248 -9.891 7.819 -3.968 1.00 55.21 H new ATOM 2493 N VAL C 249 -6.491 11.686 -0.199 1.00 31.15 N ATOM 2494 CA VAL C 249 -5.334 12.231 -0.878 1.00 4.15 C ATOM 2495 C VAL C 249 -4.415 11.113 -1.305 1.00 73.40 C ATOM 2496 O VAL C 249 -4.430 10.035 -0.733 1.00 5.31 O ATOM 2497 CB VAL C 249 -4.545 13.288 -0.028 1.00 25.22 C ATOM 2498 CG1 VAL C 249 -5.393 14.514 0.259 1.00 13.44 C ATOM 2499 CG2 VAL C 249 -4.020 12.695 1.276 1.00 43.32 C ATOM 0 H VAL C 249 -6.269 11.055 0.571 1.00 31.15 H new ATOM 0 HA VAL C 249 -5.710 12.764 -1.752 1.00 4.15 H new ATOM 0 HB VAL C 249 -3.688 13.592 -0.628 1.00 25.22 H new ATOM 0 HG11 VAL C 249 -4.816 15.226 0.849 1.00 13.44 H new ATOM 0 HG12 VAL C 249 -5.690 14.979 -0.681 1.00 13.44 H new ATOM 0 HG13 VAL C 249 -6.283 14.219 0.815 1.00 13.44 H new ATOM 0 HG21 VAL C 249 -3.480 13.461 1.833 1.00 43.32 H new ATOM 0 HG22 VAL C 249 -4.856 12.333 1.874 1.00 43.32 H new ATOM 0 HG23 VAL C 249 -3.348 11.866 1.054 1.00 43.32 H new ATOM 2509 N CYS C 250 -3.650 11.346 -2.296 1.00 2.30 N ATOM 2510 CA CYS C 250 -2.754 10.345 -2.763 1.00 11.03 C ATOM 2511 C CYS C 250 -1.377 10.693 -2.324 1.00 3.13 C ATOM 2512 O CYS C 250 -1.076 11.852 -2.151 1.00 74.30 O ATOM 2513 CB CYS C 250 -2.889 10.208 -4.247 1.00 4.54 C ATOM 2514 SG CYS C 250 -4.610 9.844 -4.713 1.00 71.42 S ATOM 0 H CYS C 250 -3.619 12.226 -2.810 1.00 2.30 H new ATOM 0 HA CYS C 250 -2.992 9.369 -2.339 1.00 11.03 H new ATOM 0 HB2 CYS C 250 -2.564 11.128 -4.732 1.00 4.54 H new ATOM 0 HB3 CYS C 250 -2.236 9.412 -4.603 1.00 4.54 H new ATOM 2519 N ILE C 251 -0.558 9.715 -2.119 1.00 60.01 N ATOM 2520 CA ILE C 251 0.708 9.936 -1.489 1.00 0.41 C ATOM 2521 C ILE C 251 1.844 9.578 -2.428 1.00 5.54 C ATOM 2522 O ILE C 251 1.701 8.692 -3.286 1.00 40.15 O ATOM 2523 CB ILE C 251 0.838 9.041 -0.217 1.00 3.14 C ATOM 2524 CG1 ILE C 251 -0.436 9.071 0.642 1.00 4.02 C ATOM 2525 CG2 ILE C 251 2.005 9.492 0.619 1.00 63.34 C ATOM 2526 CD1 ILE C 251 -0.818 10.434 1.164 1.00 10.43 C ATOM 0 H ILE C 251 -0.742 8.746 -2.380 1.00 60.01 H new ATOM 0 HA ILE C 251 0.765 10.991 -1.222 1.00 0.41 H new ATOM 0 HB ILE C 251 0.995 8.018 -0.560 1.00 3.14 H new ATOM 0 HG12 ILE C 251 -1.264 8.679 0.052 1.00 4.02 H new ATOM 0 HG13 ILE C 251 -0.302 8.398 1.489 1.00 4.02 H new ATOM 0 HG21 ILE C 251 2.085 8.860 1.503 1.00 63.34 H new ATOM 0 HG22 ILE C 251 2.922 9.416 0.035 1.00 63.34 H new ATOM 0 HG23 ILE C 251 1.855 10.527 0.925 1.00 63.34 H new ATOM 0 HD11 ILE C 251 -1.728 10.354 1.758 1.00 10.43 H new ATOM 0 HD12 ILE C 251 -0.012 10.825 1.786 1.00 10.43 H new ATOM 0 HD13 ILE C 251 -0.990 11.110 0.326 1.00 10.43 H new ATOM 2538 N ASP C 252 2.949 10.275 -2.271 1.00 24.12 N ATOM 2539 CA ASP C 252 4.168 9.964 -2.984 1.00 14.55 C ATOM 2540 C ASP C 252 4.848 8.812 -2.257 1.00 64.32 C ATOM 2541 O ASP C 252 5.187 8.936 -1.072 1.00 33.35 O ATOM 2542 CB ASP C 252 5.100 11.180 -3.014 1.00 60.12 C ATOM 2543 CG ASP C 252 6.351 10.959 -3.850 1.00 3.34 C ATOM 2544 OD1 ASP C 252 6.232 10.686 -5.067 1.00 15.33 O ATOM 2545 OD2 ASP C 252 7.465 11.126 -3.319 1.00 50.44 O ATOM 0 H ASP C 252 3.027 11.075 -1.643 1.00 24.12 H new ATOM 0 HA ASP C 252 3.939 9.691 -4.014 1.00 14.55 H new ATOM 0 HB2 ASP C 252 4.555 12.037 -3.409 1.00 60.12 H new ATOM 0 HB3 ASP C 252 5.392 11.430 -1.994 1.00 60.12 H new ATOM 2550 N PRO C 253 5.068 7.685 -2.942 1.00 12.42 N ATOM 2551 CA PRO C 253 5.625 6.451 -2.329 1.00 71.53 C ATOM 2552 C PRO C 253 7.122 6.552 -2.033 1.00 21.42 C ATOM 2553 O PRO C 253 7.808 5.542 -1.904 1.00 75.31 O ATOM 2554 CB PRO C 253 5.387 5.410 -3.421 1.00 75.33 C ATOM 2555 CG PRO C 253 5.471 6.190 -4.679 1.00 3.55 C ATOM 2556 CD PRO C 253 4.810 7.501 -4.381 1.00 53.35 C ATOM 0 HA PRO C 253 5.163 6.230 -1.367 1.00 71.53 H new ATOM 0 HB2 PRO C 253 6.137 4.619 -3.390 1.00 75.33 H new ATOM 0 HB3 PRO C 253 4.414 4.931 -3.312 1.00 75.33 H new ATOM 0 HG2 PRO C 253 6.508 6.333 -4.984 1.00 3.55 H new ATOM 0 HG3 PRO C 253 4.967 5.673 -5.496 1.00 3.55 H new ATOM 0 HD2 PRO C 253 5.235 8.311 -4.974 1.00 53.35 H new ATOM 0 HD3 PRO C 253 3.742 7.473 -4.599 1.00 53.35 H new ATOM 2564 N LYS C 254 7.618 7.760 -1.951 1.00 50.12 N ATOM 2565 CA LYS C 254 8.985 7.997 -1.671 1.00 5.34 C ATOM 2566 C LYS C 254 9.138 8.665 -0.290 1.00 31.15 C ATOM 2567 O LYS C 254 10.248 8.932 0.150 1.00 62.32 O ATOM 2568 CB LYS C 254 9.554 8.874 -2.768 1.00 22.05 C ATOM 2569 CG LYS C 254 9.340 8.298 -4.175 1.00 53.41 C ATOM 2570 CD LYS C 254 9.799 9.262 -5.251 1.00 53.42 C ATOM 2571 CE LYS C 254 11.275 9.538 -5.147 1.00 42.45 C ATOM 2572 NZ LYS C 254 12.088 8.343 -5.421 1.00 52.53 N ATOM 0 H LYS C 254 7.066 8.608 -2.081 1.00 50.12 H new ATOM 0 HA LYS C 254 9.533 7.055 -1.642 1.00 5.34 H new ATOM 0 HB2 LYS C 254 9.093 9.860 -2.712 1.00 22.05 H new ATOM 0 HB3 LYS C 254 10.622 9.012 -2.597 1.00 22.05 H new ATOM 0 HG2 LYS C 254 9.885 7.359 -4.271 1.00 53.41 H new ATOM 0 HG3 LYS C 254 8.284 8.069 -4.318 1.00 53.41 H new ATOM 0 HD2 LYS C 254 9.573 8.848 -6.233 1.00 53.42 H new ATOM 0 HD3 LYS C 254 9.245 10.197 -5.164 1.00 53.42 H new ATOM 0 HE2 LYS C 254 11.545 10.327 -5.849 1.00 42.45 H new ATOM 0 HE3 LYS C 254 11.503 9.909 -4.148 1.00 42.45 H new ATOM 0 HZ1 LYS C 254 12.524 8.009 -4.538 1.00 52.53 H new ATOM 0 HZ2 LYS C 254 11.483 7.594 -5.813 1.00 52.53 H new ATOM 0 HZ3 LYS C 254 12.833 8.580 -6.107 1.00 52.53 H new ATOM 2586 N LEU C 255 8.007 8.964 0.369 1.00 11.04 N ATOM 2587 CA LEU C 255 8.024 9.541 1.737 1.00 43.44 C ATOM 2588 C LEU C 255 8.743 8.664 2.723 1.00 72.35 C ATOM 2589 O LEU C 255 8.567 7.466 2.723 1.00 32.24 O ATOM 2590 CB LEU C 255 6.631 9.781 2.265 1.00 61.33 C ATOM 2591 CG LEU C 255 5.865 10.925 1.678 1.00 21.54 C ATOM 2592 CD1 LEU C 255 4.489 10.939 2.275 1.00 22.33 C ATOM 2593 CD2 LEU C 255 6.566 12.217 2.008 1.00 52.25 C ATOM 0 H LEU C 255 7.073 8.820 -0.014 1.00 11.04 H new ATOM 0 HA LEU C 255 8.555 10.488 1.638 1.00 43.44 H new ATOM 0 HB2 LEU C 255 6.050 8.871 2.112 1.00 61.33 H new ATOM 0 HB3 LEU C 255 6.700 9.938 3.341 1.00 61.33 H new ATOM 0 HG LEU C 255 5.801 10.815 0.595 1.00 21.54 H new ATOM 0 HD11 LEU C 255 3.919 11.768 1.856 1.00 22.33 H new ATOM 0 HD12 LEU C 255 3.984 10.000 2.048 1.00 22.33 H new ATOM 0 HD13 LEU C 255 4.563 11.059 3.356 1.00 22.33 H new ATOM 0 HD21 LEU C 255 6.010 13.052 1.581 1.00 52.25 H new ATOM 0 HD22 LEU C 255 6.623 12.334 3.090 1.00 52.25 H new ATOM 0 HD23 LEU C 255 7.573 12.201 1.591 1.00 52.25 H new ATOM 2605 N LYS C 256 9.490 9.284 3.623 1.00 43.05 N ATOM 2606 CA LYS C 256 10.289 8.556 4.589 1.00 41.15 C ATOM 2607 C LYS C 256 9.401 7.724 5.528 1.00 61.45 C ATOM 2608 O LYS C 256 9.761 6.599 5.887 1.00 3.44 O ATOM 2609 CB LYS C 256 11.198 9.512 5.380 1.00 62.41 C ATOM 2610 CG LYS C 256 12.229 8.818 6.273 1.00 70.13 C ATOM 2611 CD LYS C 256 13.175 7.948 5.448 1.00 31.24 C ATOM 2612 CE LYS C 256 14.269 7.321 6.301 1.00 13.35 C ATOM 2613 NZ LYS C 256 13.734 6.454 7.374 1.00 35.40 N ATOM 0 H LYS C 256 9.558 10.299 3.702 1.00 43.05 H new ATOM 0 HA LYS C 256 10.929 7.863 4.043 1.00 41.15 H new ATOM 0 HB2 LYS C 256 11.723 10.159 4.677 1.00 62.41 H new ATOM 0 HB3 LYS C 256 10.574 10.156 6.000 1.00 62.41 H new ATOM 0 HG2 LYS C 256 12.802 9.566 6.820 1.00 70.13 H new ATOM 0 HG3 LYS C 256 11.718 8.203 7.014 1.00 70.13 H new ATOM 0 HD2 LYS C 256 12.605 7.161 4.955 1.00 31.24 H new ATOM 0 HD3 LYS C 256 13.630 8.552 4.663 1.00 31.24 H new ATOM 0 HE2 LYS C 256 14.930 6.735 5.663 1.00 13.35 H new ATOM 0 HE3 LYS C 256 14.874 8.111 6.746 1.00 13.35 H new ATOM 0 HZ1 LYS C 256 14.522 6.041 7.912 1.00 35.40 H new ATOM 0 HZ2 LYS C 256 13.138 7.019 8.012 1.00 35.40 H new ATOM 0 HZ3 LYS C 256 13.165 5.692 6.953 1.00 35.40 H new ATOM 2627 N TRP C 257 8.218 8.256 5.898 1.00 44.23 N ATOM 2628 CA TRP C 257 7.316 7.487 6.754 1.00 4.33 C ATOM 2629 C TRP C 257 6.684 6.341 5.980 1.00 50.54 C ATOM 2630 O TRP C 257 6.328 5.311 6.560 1.00 60.14 O ATOM 2631 CB TRP C 257 6.248 8.337 7.494 1.00 62.30 C ATOM 2632 CG TRP C 257 5.232 9.077 6.650 1.00 24.21 C ATOM 2633 CD1 TRP C 257 5.330 10.347 6.157 1.00 42.11 C ATOM 2634 CD2 TRP C 257 3.934 8.594 6.249 1.00 2.02 C ATOM 2635 NE1 TRP C 257 4.176 10.682 5.492 1.00 73.23 N ATOM 2636 CE2 TRP C 257 3.308 9.623 5.527 1.00 52.53 C ATOM 2637 CE3 TRP C 257 3.245 7.388 6.436 1.00 74.41 C ATOM 2638 CZ2 TRP C 257 2.018 9.486 4.991 1.00 71.35 C ATOM 2639 CZ3 TRP C 257 1.976 7.259 5.907 1.00 23.23 C ATOM 2640 CH2 TRP C 257 1.379 8.304 5.193 1.00 14.44 C ATOM 0 H TRP C 257 7.881 9.180 5.626 1.00 44.23 H new ATOM 0 HA TRP C 257 7.941 7.077 7.547 1.00 4.33 H new ATOM 0 HB2 TRP C 257 5.705 7.678 8.172 1.00 62.30 H new ATOM 0 HB3 TRP C 257 6.770 9.069 8.110 1.00 62.30 H new ATOM 0 HD1 TRP C 257 6.188 10.992 6.273 1.00 42.11 H new ATOM 0 HE1 TRP C 257 3.994 11.579 5.042 1.00 73.23 H new ATOM 0 HE3 TRP C 257 3.698 6.575 6.984 1.00 74.41 H new ATOM 0 HZ2 TRP C 257 1.551 10.289 4.439 1.00 71.35 H new ATOM 0 HZ3 TRP C 257 1.435 6.335 6.047 1.00 23.23 H new ATOM 0 HH2 TRP C 257 0.385 8.168 4.792 1.00 14.44 H new ATOM 2651 N ILE C 258 6.555 6.524 4.669 1.00 43.14 N ATOM 2652 CA ILE C 258 6.074 5.477 3.790 1.00 31.14 C ATOM 2653 C ILE C 258 7.121 4.376 3.708 1.00 42.34 C ATOM 2654 O ILE C 258 6.797 3.202 3.881 1.00 50.22 O ATOM 2655 CB ILE C 258 5.732 6.011 2.350 1.00 53.12 C ATOM 2656 CG1 ILE C 258 4.489 6.923 2.361 1.00 22.35 C ATOM 2657 CG2 ILE C 258 5.550 4.869 1.354 1.00 41.33 C ATOM 2658 CD1 ILE C 258 3.215 6.212 2.721 1.00 34.13 C ATOM 0 H ILE C 258 6.781 7.398 4.194 1.00 43.14 H new ATOM 0 HA ILE C 258 5.147 5.086 4.209 1.00 31.14 H new ATOM 0 HB ILE C 258 6.584 6.608 2.025 1.00 53.12 H new ATOM 0 HG12 ILE C 258 4.653 7.735 3.069 1.00 22.35 H new ATOM 0 HG13 ILE C 258 4.375 7.377 1.377 1.00 22.35 H new ATOM 0 HG21 ILE C 258 5.315 5.277 0.371 1.00 41.33 H new ATOM 0 HG22 ILE C 258 6.470 4.288 1.295 1.00 41.33 H new ATOM 0 HG23 ILE C 258 4.735 4.225 1.684 1.00 41.33 H new ATOM 0 HD11 ILE C 258 2.387 6.920 2.707 1.00 34.13 H new ATOM 0 HD12 ILE C 258 3.025 5.417 1.999 1.00 34.13 H new ATOM 0 HD13 ILE C 258 3.308 5.782 3.718 1.00 34.13 H new ATOM 2670 N GLN C 259 8.380 4.775 3.482 1.00 61.31 N ATOM 2671 CA GLN C 259 9.496 3.833 3.379 1.00 74.23 C ATOM 2672 C GLN C 259 9.557 2.964 4.619 1.00 43.41 C ATOM 2673 O GLN C 259 9.570 1.745 4.529 1.00 50.53 O ATOM 2674 CB GLN C 259 10.835 4.566 3.263 1.00 10.10 C ATOM 2675 CG GLN C 259 10.893 5.680 2.245 1.00 53.41 C ATOM 2676 CD GLN C 259 10.389 5.294 0.892 1.00 15.25 C ATOM 2677 OE1 GLN C 259 11.229 4.755 0.103 1.00 0.41 O flip ATOM 2678 NE2 GLN C 259 9.230 5.450 0.592 1.00 22.24 N flip ATOM 0 H GLN C 259 8.649 5.752 3.367 1.00 61.31 H new ATOM 0 HA GLN C 259 9.328 3.230 2.486 1.00 74.23 H new ATOM 0 HB2 GLN C 259 11.086 4.980 4.240 1.00 10.10 H new ATOM 0 HB3 GLN C 259 11.606 3.836 3.018 1.00 10.10 H new ATOM 0 HG2 GLN C 259 10.309 6.524 2.612 1.00 53.41 H new ATOM 0 HG3 GLN C 259 11.924 6.021 2.154 1.00 53.41 H new ATOM 0 HE21 GLN C 259 8.587 5.886 1.252 1.00 22.24 H new ATOM 0 HE22 GLN C 259 8.894 5.145 -0.322 1.00 22.24 H new ATOM 2687 N GLU C 260 9.550 3.611 5.784 1.00 24.30 N ATOM 2688 CA GLU C 260 9.586 2.905 7.062 1.00 42.32 C ATOM 2689 C GLU C 260 8.392 2.001 7.229 1.00 72.24 C ATOM 2690 O GLU C 260 8.521 0.900 7.736 1.00 75.05 O ATOM 2691 CB GLU C 260 9.654 3.878 8.236 1.00 4.10 C ATOM 2692 CG GLU C 260 10.980 4.575 8.410 1.00 51.02 C ATOM 2693 CD GLU C 260 12.086 3.598 8.709 1.00 13.52 C ATOM 2694 OE1 GLU C 260 11.991 2.880 9.722 1.00 41.30 O ATOM 2695 OE2 GLU C 260 13.056 3.517 7.921 1.00 73.03 O ATOM 0 H GLU C 260 9.520 4.627 5.868 1.00 24.30 H new ATOM 0 HA GLU C 260 10.490 2.296 7.056 1.00 42.32 H new ATOM 0 HB2 GLU C 260 8.878 4.633 8.108 1.00 4.10 H new ATOM 0 HB3 GLU C 260 9.423 3.335 9.152 1.00 4.10 H new ATOM 0 HG2 GLU C 260 11.221 5.131 7.504 1.00 51.02 H new ATOM 0 HG3 GLU C 260 10.906 5.301 9.220 1.00 51.02 H new ATOM 2702 N TYR C 261 7.245 2.449 6.781 1.00 73.12 N ATOM 2703 CA TYR C 261 6.037 1.680 6.933 1.00 24.34 C ATOM 2704 C TYR C 261 6.147 0.395 6.113 1.00 41.43 C ATOM 2705 O TYR C 261 5.886 -0.706 6.610 1.00 35.24 O ATOM 2706 CB TYR C 261 4.826 2.508 6.492 1.00 40.41 C ATOM 2707 CG TYR C 261 3.517 1.888 6.862 1.00 24.42 C ATOM 2708 CD1 TYR C 261 2.982 2.106 8.118 1.00 4.01 C ATOM 2709 CD2 TYR C 261 2.822 1.079 5.977 1.00 50.24 C ATOM 2710 CE1 TYR C 261 1.794 1.542 8.493 1.00 72.23 C ATOM 2711 CE2 TYR C 261 1.632 0.500 6.341 1.00 15.12 C ATOM 2712 CZ TYR C 261 1.118 0.733 7.602 1.00 20.32 C ATOM 2713 OH TYR C 261 -0.064 0.142 7.975 1.00 13.02 O ATOM 0 H TYR C 261 7.124 3.344 6.307 1.00 73.12 H new ATOM 0 HA TYR C 261 5.901 1.416 7.982 1.00 24.34 H new ATOM 0 HB2 TYR C 261 4.890 3.499 6.941 1.00 40.41 H new ATOM 0 HB3 TYR C 261 4.862 2.644 5.411 1.00 40.41 H new ATOM 0 HD1 TYR C 261 3.513 2.735 8.817 1.00 4.01 H new ATOM 0 HD2 TYR C 261 3.221 0.902 4.989 1.00 50.24 H new ATOM 0 HE1 TYR C 261 1.389 1.728 9.477 1.00 72.23 H new ATOM 0 HE2 TYR C 261 1.101 -0.134 5.646 1.00 15.12 H new ATOM 0 HH TYR C 261 -0.743 0.833 8.122 1.00 13.02 H new ATOM 2723 N LEU C 262 6.580 0.549 4.879 1.00 61.23 N ATOM 2724 CA LEU C 262 6.762 -0.557 3.959 1.00 11.44 C ATOM 2725 C LEU C 262 7.842 -1.517 4.485 1.00 4.20 C ATOM 2726 O LEU C 262 7.620 -2.729 4.585 1.00 40.13 O ATOM 2727 CB LEU C 262 7.156 -0.007 2.580 1.00 20.22 C ATOM 2728 CG LEU C 262 6.147 0.950 1.919 1.00 62.11 C ATOM 2729 CD1 LEU C 262 6.704 1.520 0.629 1.00 72.51 C ATOM 2730 CD2 LEU C 262 4.820 0.266 1.667 1.00 51.51 C ATOM 0 H LEU C 262 6.819 1.457 4.481 1.00 61.23 H new ATOM 0 HA LEU C 262 5.829 -1.113 3.871 1.00 11.44 H new ATOM 0 HB2 LEU C 262 8.109 0.513 2.678 1.00 20.22 H new ATOM 0 HB3 LEU C 262 7.320 -0.850 1.909 1.00 20.22 H new ATOM 0 HG LEU C 262 5.975 1.773 2.613 1.00 62.11 H new ATOM 0 HD11 LEU C 262 5.972 2.193 0.182 1.00 72.51 H new ATOM 0 HD12 LEU C 262 7.621 2.070 0.840 1.00 72.51 H new ATOM 0 HD13 LEU C 262 6.920 0.707 -0.064 1.00 72.51 H new ATOM 0 HD21 LEU C 262 4.131 0.970 1.200 1.00 51.51 H new ATOM 0 HD22 LEU C 262 4.970 -0.588 1.006 1.00 51.51 H new ATOM 0 HD23 LEU C 262 4.402 -0.077 2.613 1.00 51.51 H new ATOM 2742 N GLU C 263 8.990 -0.956 4.847 1.00 13.12 N ATOM 2743 CA GLU C 263 10.122 -1.726 5.353 1.00 53.02 C ATOM 2744 C GLU C 263 9.812 -2.445 6.659 1.00 20.21 C ATOM 2745 O GLU C 263 10.168 -3.617 6.840 1.00 71.22 O ATOM 2746 CB GLU C 263 11.343 -0.839 5.559 1.00 4.01 C ATOM 2747 CG GLU C 263 11.976 -0.298 4.294 1.00 33.14 C ATOM 2748 CD GLU C 263 13.247 0.450 4.596 1.00 53.41 C ATOM 2749 OE1 GLU C 263 14.281 -0.216 4.838 1.00 12.33 O ATOM 2750 OE2 GLU C 263 13.261 1.690 4.591 1.00 2.33 O ATOM 0 H GLU C 263 9.163 0.048 4.798 1.00 13.12 H new ATOM 0 HA GLU C 263 10.331 -2.477 4.592 1.00 53.02 H new ATOM 0 HB2 GLU C 263 11.057 0.002 6.190 1.00 4.01 H new ATOM 0 HB3 GLU C 263 12.095 -1.407 6.107 1.00 4.01 H new ATOM 0 HG2 GLU C 263 12.189 -1.120 3.611 1.00 33.14 H new ATOM 0 HG3 GLU C 263 11.273 0.364 3.787 1.00 33.14 H new ATOM 2757 N LYS C 264 9.158 -1.763 7.564 1.00 40.52 N ATOM 2758 CA LYS C 264 8.904 -2.326 8.863 1.00 63.01 C ATOM 2759 C LYS C 264 7.714 -3.295 8.882 1.00 42.02 C ATOM 2760 O LYS C 264 7.720 -4.244 9.658 1.00 23.11 O ATOM 2761 CB LYS C 264 8.807 -1.251 9.952 1.00 15.53 C ATOM 2762 CG LYS C 264 10.092 -0.407 10.140 1.00 70.40 C ATOM 2763 CD LYS C 264 11.302 -1.276 10.492 1.00 64.22 C ATOM 2764 CE LYS C 264 12.548 -0.442 10.847 1.00 61.31 C ATOM 2765 NZ LYS C 264 13.000 0.461 9.755 1.00 24.33 N ATOM 0 H LYS C 264 8.793 -0.821 7.425 1.00 40.52 H new ATOM 0 HA LYS C 264 9.777 -2.934 9.101 1.00 63.01 H new ATOM 0 HB2 LYS C 264 7.981 -0.582 9.712 1.00 15.53 H new ATOM 0 HB3 LYS C 264 8.562 -1.732 10.899 1.00 15.53 H new ATOM 0 HG2 LYS C 264 10.298 0.148 9.225 1.00 70.40 H new ATOM 0 HG3 LYS C 264 9.931 0.327 10.929 1.00 70.40 H new ATOM 0 HD2 LYS C 264 11.049 -1.921 11.334 1.00 64.22 H new ATOM 0 HD3 LYS C 264 11.534 -1.928 9.650 1.00 64.22 H new ATOM 0 HE2 LYS C 264 12.333 0.155 11.733 1.00 61.31 H new ATOM 0 HE3 LYS C 264 13.363 -1.117 11.108 1.00 61.31 H new ATOM 0 HZ1 LYS C 264 13.999 0.270 9.538 1.00 24.33 H new ATOM 0 HZ2 LYS C 264 12.423 0.294 8.906 1.00 24.33 H new ATOM 0 HZ3 LYS C 264 12.894 1.451 10.057 1.00 24.33 H new ATOM 2779 N CYS C 265 6.699 -3.083 8.036 1.00 74.20 N ATOM 2780 CA CYS C 265 5.599 -4.057 7.961 1.00 53.44 C ATOM 2781 C CYS C 265 6.066 -5.411 7.460 1.00 43.32 C ATOM 2782 O CYS C 265 5.561 -6.438 7.905 1.00 52.22 O ATOM 2783 CB CYS C 265 4.354 -3.560 7.189 1.00 2.54 C ATOM 2784 SG CYS C 265 3.303 -2.369 8.117 1.00 2.43 S ATOM 0 H CYS C 265 6.614 -2.279 7.415 1.00 74.20 H new ATOM 0 HA CYS C 265 5.267 -4.178 8.992 1.00 53.44 H new ATOM 0 HB2 CYS C 265 4.681 -3.090 6.262 1.00 2.54 H new ATOM 0 HB3 CYS C 265 3.746 -4.422 6.912 1.00 2.54 H new ATOM 2789 N LEU C 266 7.070 -5.426 6.572 1.00 14.43 N ATOM 2790 CA LEU C 266 7.599 -6.697 6.092 1.00 73.41 C ATOM 2791 C LEU C 266 8.504 -7.366 7.152 1.00 34.43 C ATOM 2792 O LEU C 266 8.919 -8.527 7.013 1.00 25.12 O ATOM 2793 CB LEU C 266 8.276 -6.566 4.678 1.00 23.50 C ATOM 2794 CG LEU C 266 9.579 -5.757 4.484 1.00 63.05 C ATOM 2795 CD1 LEU C 266 10.782 -6.455 5.095 1.00 13.43 C ATOM 2796 CD2 LEU C 266 9.812 -5.536 3.016 1.00 22.11 C ATOM 0 H LEU C 266 7.517 -4.595 6.185 1.00 14.43 H new ATOM 0 HA LEU C 266 6.756 -7.371 5.942 1.00 73.41 H new ATOM 0 HB2 LEU C 266 8.475 -7.578 4.326 1.00 23.50 H new ATOM 0 HB3 LEU C 266 7.532 -6.136 4.008 1.00 23.50 H new ATOM 0 HG LEU C 266 9.460 -4.803 4.997 1.00 63.05 H new ATOM 0 HD11 LEU C 266 11.674 -5.850 4.934 1.00 13.43 H new ATOM 0 HD12 LEU C 266 10.621 -6.587 6.165 1.00 13.43 H new ATOM 0 HD13 LEU C 266 10.915 -7.429 4.625 1.00 13.43 H new ATOM 0 HD21 LEU C 266 10.730 -4.966 2.875 1.00 22.11 H new ATOM 0 HD22 LEU C 266 9.902 -6.499 2.513 1.00 22.11 H new ATOM 0 HD23 LEU C 266 8.973 -4.983 2.594 1.00 22.11 H new ATOM 2808 N ASN C 267 8.789 -6.619 8.211 1.00 10.03 N ATOM 2809 CA ASN C 267 9.606 -7.093 9.333 1.00 40.02 C ATOM 2810 C ASN C 267 8.715 -7.626 10.455 1.00 4.33 C ATOM 2811 O ASN C 267 9.151 -8.434 11.294 1.00 4.11 O ATOM 2812 CB ASN C 267 10.497 -5.950 9.859 1.00 12.25 C ATOM 2813 CG ASN C 267 11.350 -6.340 11.062 1.00 42.30 C ATOM 2814 OD1 ASN C 267 10.945 -6.164 12.217 1.00 2.03 O ATOM 2815 ND2 ASN C 267 12.520 -6.859 10.806 1.00 13.45 N ATOM 0 H ASN C 267 8.460 -5.660 8.321 1.00 10.03 H new ATOM 0 HA ASN C 267 10.243 -7.905 8.981 1.00 40.02 H new ATOM 0 HB2 ASN C 267 11.151 -5.612 9.055 1.00 12.25 H new ATOM 0 HB3 ASN C 267 9.865 -5.105 10.132 1.00 12.25 H new ATOM 0 HD21 ASN C 267 13.134 -7.135 11.572 1.00 13.45 H new ATOM 0 HD22 ASN C 267 12.820 -6.989 9.840 1.00 13.45 H new ATOM 2822 N LYS C 268 7.465 -7.189 10.459 1.00 23.21 N ATOM 2823 CA LYS C 268 6.491 -7.603 11.475 1.00 55.34 C ATOM 2824 C LYS C 268 6.104 -9.067 11.319 1.00 3.13 C ATOM 2825 O LYS C 268 6.445 -9.711 10.319 1.00 23.13 O ATOM 2826 CB LYS C 268 5.239 -6.731 11.414 1.00 34.53 C ATOM 2827 CG LYS C 268 5.472 -5.276 11.780 1.00 52.03 C ATOM 2828 CD LYS C 268 4.184 -4.489 11.685 1.00 53.22 C ATOM 2829 CE LYS C 268 4.361 -3.046 12.130 1.00 41.41 C ATOM 2830 NZ LYS C 268 4.770 -2.954 13.546 1.00 10.23 N ATOM 0 H LYS C 268 7.092 -6.541 9.765 1.00 23.21 H new ATOM 0 HA LYS C 268 6.968 -7.477 12.447 1.00 55.34 H new ATOM 0 HB2 LYS C 268 4.826 -6.778 10.406 1.00 34.53 H new ATOM 0 HB3 LYS C 268 4.488 -7.147 12.086 1.00 34.53 H new ATOM 0 HG2 LYS C 268 5.871 -5.210 12.792 1.00 52.03 H new ATOM 0 HG3 LYS C 268 6.219 -4.843 11.114 1.00 52.03 H new ATOM 0 HD2 LYS C 268 3.822 -4.509 10.657 1.00 53.22 H new ATOM 0 HD3 LYS C 268 3.422 -4.967 12.300 1.00 53.22 H new ATOM 0 HE2 LYS C 268 5.110 -2.562 11.503 1.00 41.41 H new ATOM 0 HE3 LYS C 268 3.426 -2.504 11.986 1.00 41.41 H new ATOM 0 HZ1 LYS C 268 4.636 -1.979 13.883 1.00 10.23 H new ATOM 0 HZ2 LYS C 268 4.190 -3.601 14.118 1.00 10.23 H new ATOM 0 HZ3 LYS C 268 5.772 -3.217 13.636 1.00 10.23 H new ATOM 2914 N ILE D 306 4.547 -5.372 -9.749 1.00 74.51 N ATOM 2915 CA ILE D 306 3.193 -5.021 -9.925 1.00 51.04 C ATOM 2916 C ILE D 306 2.388 -6.299 -10.039 1.00 41.14 C ATOM 2917 O ILE D 306 2.942 -7.384 -9.954 1.00 3.13 O ATOM 2918 CB ILE D 306 2.981 -4.184 -11.208 1.00 75.54 C ATOM 2919 CG1 ILE D 306 3.320 -4.971 -12.478 1.00 51.43 C ATOM 2920 CG2 ILE D 306 3.787 -2.892 -11.161 1.00 1.25 C ATOM 2921 CD1 ILE D 306 2.973 -4.215 -13.742 1.00 53.23 C ATOM 0 HA ILE D 306 2.874 -4.419 -9.074 1.00 51.04 H new ATOM 0 HB ILE D 306 1.920 -3.937 -11.246 1.00 75.54 H new ATOM 0 HG12 ILE D 306 4.384 -5.207 -12.481 1.00 51.43 H new ATOM 0 HG13 ILE D 306 2.783 -5.919 -12.467 1.00 51.43 H new ATOM 0 HG21 ILE D 306 3.618 -2.324 -12.076 1.00 1.25 H new ATOM 0 HG22 ILE D 306 3.473 -2.298 -10.302 1.00 1.25 H new ATOM 0 HG23 ILE D 306 4.847 -3.128 -11.071 1.00 1.25 H new ATOM 0 HD11 ILE D 306 3.234 -4.819 -14.611 1.00 53.23 H new ATOM 0 HD12 ILE D 306 1.904 -4.002 -13.757 1.00 53.23 H new ATOM 0 HD13 ILE D 306 3.530 -3.279 -13.771 1.00 53.23 H new ATOM 2933 N TYR D 307 1.116 -6.182 -10.252 1.00 63.45 N ATOM 2934 CA TYR D 307 0.256 -7.335 -10.375 1.00 12.13 C ATOM 2935 C TYR D 307 0.246 -7.703 -11.848 1.00 74.23 C ATOM 2936 O TYR D 307 0.542 -6.844 -12.702 1.00 3.11 O ATOM 2937 CB TYR D 307 -1.165 -6.933 -9.987 1.00 24.11 C ATOM 2938 CG TYR D 307 -1.217 -5.866 -8.970 1.00 32.01 C ATOM 2939 CD1 TYR D 307 -1.014 -6.143 -7.653 1.00 0.14 C ATOM 2940 CD2 TYR D 307 -1.467 -4.568 -9.345 1.00 30.54 C ATOM 2941 CE1 TYR D 307 -1.066 -5.174 -6.726 1.00 52.24 C ATOM 2942 CE2 TYR D 307 -1.525 -3.579 -8.431 1.00 44.40 C ATOM 2943 CZ TYR D 307 -1.328 -3.877 -7.116 1.00 1.34 C ATOM 2944 OH TYR D 307 -1.400 -2.895 -6.196 1.00 43.23 O ATOM 0 H TYR D 307 0.636 -5.287 -10.347 1.00 63.45 H new ATOM 0 HA TYR D 307 0.598 -8.155 -9.744 1.00 12.13 H new ATOM 0 HB2 TYR D 307 -1.696 -6.600 -10.879 1.00 24.11 H new ATOM 0 HB3 TYR D 307 -1.692 -7.809 -9.610 1.00 24.11 H new ATOM 0 HD1 TYR D 307 -0.808 -7.159 -7.349 1.00 0.14 H new ATOM 0 HD2 TYR D 307 -1.619 -4.336 -10.389 1.00 30.54 H new ATOM 0 HE1 TYR D 307 -0.904 -5.408 -5.684 1.00 52.24 H new ATOM 0 HE2 TYR D 307 -1.725 -2.563 -8.737 1.00 44.40 H new ATOM 0 HH TYR D 307 -1.436 -3.289 -5.299 1.00 43.23 H new ATOM 2954 N THR D 308 -0.055 -8.921 -12.184 1.00 72.44 N ATOM 2955 CA THR D 308 -0.172 -9.239 -13.585 1.00 52.14 C ATOM 2956 C THR D 308 -1.590 -8.925 -14.046 1.00 23.43 C ATOM 2957 O THR D 308 -2.452 -9.801 -14.132 1.00 14.23 O ATOM 2958 CB THR D 308 0.209 -10.691 -13.914 1.00 73.15 C ATOM 2959 OG1 THR D 308 1.507 -10.967 -13.361 1.00 62.23 O ATOM 2960 CG2 THR D 308 0.270 -10.904 -15.423 1.00 23.54 C ATOM 0 H THR D 308 -0.220 -9.692 -11.537 1.00 72.44 H new ATOM 0 HA THR D 308 0.544 -8.622 -14.127 1.00 52.14 H new ATOM 0 HB THR D 308 -0.544 -11.356 -13.491 1.00 73.15 H new ATOM 0 HG1 THR D 308 1.759 -11.892 -13.564 1.00 62.23 H new ATOM 0 HG21 THR D 308 0.541 -11.938 -15.634 1.00 23.54 H new ATOM 0 HG22 THR D 308 -0.705 -10.688 -15.861 1.00 23.54 H new ATOM 0 HG23 THR D 308 1.017 -10.238 -15.855 1.00 23.54 H new ATOM 2968 N SER D 309 -1.835 -7.656 -14.245 1.00 0.14 N ATOM 2969 CA SER D 309 -3.116 -7.168 -14.623 1.00 2.35 C ATOM 2970 C SER D 309 -3.018 -5.734 -15.098 1.00 35.50 C ATOM 2971 O SER D 309 -2.212 -4.947 -14.571 1.00 73.23 O ATOM 2972 CB SER D 309 -4.078 -7.288 -13.431 1.00 15.41 C ATOM 2973 OG SER D 309 -3.535 -6.709 -12.246 1.00 40.50 O ATOM 0 H SER D 309 -1.129 -6.926 -14.144 1.00 0.14 H new ATOM 0 HA SER D 309 -3.501 -7.765 -15.449 1.00 2.35 H new ATOM 0 HB2 SER D 309 -5.021 -6.798 -13.675 1.00 15.41 H new ATOM 0 HB3 SER D 309 -4.303 -8.339 -13.251 1.00 15.41 H new ATOM 0 HG SER D 309 -3.804 -7.242 -11.469 1.00 40.50 H new ATOM 2979 N ASP D 310 -3.781 -5.412 -16.114 1.00 23.32 N ATOM 2980 CA ASP D 310 -3.862 -4.059 -16.618 1.00 40.42 C ATOM 2981 C ASP D 310 -4.964 -3.366 -15.871 1.00 43.43 C ATOM 2982 O ASP D 310 -6.153 -3.663 -16.066 1.00 74.10 O ATOM 2983 CB ASP D 310 -4.144 -4.028 -18.136 1.00 3.03 C ATOM 2984 CG ASP D 310 -3.046 -4.651 -18.973 1.00 43.54 C ATOM 2985 OD1 ASP D 310 -3.022 -5.899 -19.122 1.00 14.13 O ATOM 2986 OD2 ASP D 310 -2.192 -3.908 -19.499 1.00 14.45 O ATOM 0 H ASP D 310 -4.365 -6.080 -16.617 1.00 23.32 H new ATOM 0 HA ASP D 310 -2.907 -3.556 -16.466 1.00 40.42 H new ATOM 0 HB2 ASP D 310 -5.080 -4.551 -18.333 1.00 3.03 H new ATOM 0 HB3 ASP D 310 -4.285 -2.993 -18.449 1.00 3.03 H new ATOM 2991 N ASN D 311 -4.591 -2.489 -14.994 1.00 3.43 N ATOM 2992 CA ASN D 311 -5.546 -1.824 -14.145 1.00 12.32 C ATOM 2993 C ASN D 311 -5.486 -0.333 -14.359 1.00 32.53 C ATOM 2994 O ASN D 311 -6.340 0.252 -15.026 1.00 0.45 O ATOM 2995 CB ASN D 311 -5.265 -2.153 -12.661 1.00 12.23 C ATOM 2996 CG ASN D 311 -5.330 -3.634 -12.344 1.00 3.53 C ATOM 2997 OD1 ASN D 311 -6.102 -4.391 -12.943 1.00 34.33 O ATOM 2998 ND2 ASN D 311 -4.519 -4.064 -11.417 1.00 21.34 N ATOM 0 H ASN D 311 -3.622 -2.210 -14.841 1.00 3.43 H new ATOM 0 HA ASN D 311 -6.544 -2.179 -14.403 1.00 12.32 H new ATOM 0 HB2 ASN D 311 -4.277 -1.776 -12.395 1.00 12.23 H new ATOM 0 HB3 ASN D 311 -5.986 -1.625 -12.038 1.00 12.23 H new ATOM 0 HD21 ASN D 311 -4.509 -5.053 -11.167 1.00 21.34 H new ATOM 0 HD22 ASN D 311 -3.895 -3.411 -10.943 1.00 21.34 H new ATOM 3124 N TYR D 321 2.295 18.593 -1.444 1.00 52.15 N ATOM 3125 CA TYR D 321 1.689 19.024 -0.230 1.00 52.00 C ATOM 3126 C TYR D 321 2.654 19.930 0.561 1.00 33.51 C ATOM 3127 O TYR D 321 2.265 20.998 1.032 1.00 71.41 O ATOM 3128 CB TYR D 321 1.313 17.760 0.575 1.00 71.14 C ATOM 3129 CG TYR D 321 0.385 17.970 1.743 1.00 0.35 C ATOM 3130 CD1 TYR D 321 0.731 18.777 2.796 1.00 72.33 C ATOM 3131 CD2 TYR D 321 -0.828 17.318 1.785 1.00 13.24 C ATOM 3132 CE1 TYR D 321 -0.109 18.943 3.875 1.00 62.23 C ATOM 3133 CE2 TYR D 321 -1.687 17.467 2.846 1.00 33.00 C ATOM 3134 CZ TYR D 321 -1.320 18.287 3.897 1.00 63.15 C ATOM 3135 OH TYR D 321 -2.161 18.448 4.976 1.00 61.24 O ATOM 0 HA TYR D 321 0.795 19.614 -0.431 1.00 52.00 H new ATOM 0 HB2 TYR D 321 0.852 17.044 -0.106 1.00 71.14 H new ATOM 0 HB3 TYR D 321 2.231 17.303 0.944 1.00 71.14 H new ATOM 0 HD1 TYR D 321 1.680 19.292 2.779 1.00 72.33 H new ATOM 0 HD2 TYR D 321 -1.110 16.675 0.964 1.00 13.24 H new ATOM 0 HE1 TYR D 321 0.179 19.582 4.697 1.00 62.23 H new ATOM 0 HE2 TYR D 321 -2.636 16.951 2.859 1.00 33.00 H new ATOM 0 HH TYR D 321 -2.975 17.920 4.838 1.00 61.24 H new ATOM 3145 N ASP D 322 3.910 19.512 0.679 1.00 60.31 N ATOM 3146 CA ASP D 322 4.919 20.252 1.461 1.00 54.15 C ATOM 3147 C ASP D 322 6.294 19.798 0.937 1.00 62.52 C ATOM 3148 O ASP D 322 6.347 19.082 -0.061 1.00 23.54 O ATOM 3149 CB ASP D 322 4.743 19.952 2.980 1.00 54.34 C ATOM 3150 CG ASP D 322 5.536 20.867 3.918 1.00 2.24 C ATOM 3151 OD1 ASP D 322 6.727 20.628 4.130 1.00 40.40 O ATOM 3152 OD2 ASP D 322 4.949 21.814 4.488 1.00 21.40 O ATOM 0 H ASP D 322 4.264 18.660 0.244 1.00 60.31 H new ATOM 0 HA ASP D 322 4.814 21.331 1.347 1.00 54.15 H new ATOM 0 HB2 ASP D 322 3.685 20.030 3.230 1.00 54.34 H new ATOM 0 HB3 ASP D 322 5.039 18.920 3.168 1.00 54.34 H new ATOM 3157 N SER D 323 7.368 20.148 1.583 1.00 5.21 N ATOM 3158 CA SER D 323 8.681 19.879 1.032 1.00 42.14 C ATOM 3159 C SER D 323 9.451 18.805 1.863 1.00 51.34 C ATOM 3160 O SER D 323 8.972 18.374 2.917 1.00 61.44 O ATOM 3161 CB SER D 323 9.455 21.213 0.950 1.00 51.13 C ATOM 3162 OG SER D 323 10.683 21.080 0.251 1.00 74.43 O ATOM 0 H SER D 323 7.370 20.618 2.488 1.00 5.21 H new ATOM 0 HA SER D 323 8.578 19.458 0.032 1.00 42.14 H new ATOM 0 HB2 SER D 323 8.836 21.960 0.454 1.00 51.13 H new ATOM 0 HB3 SER D 323 9.651 21.580 1.958 1.00 51.13 H new ATOM 0 HG SER D 323 11.406 20.905 0.890 1.00 74.43 H new ATOM 3168 N MET D 324 10.627 18.374 1.342 1.00 31.43 N ATOM 3169 CA MET D 324 11.540 17.393 1.997 1.00 40.30 C ATOM 3170 C MET D 324 10.953 15.987 2.134 1.00 12.53 C ATOM 3171 O MET D 324 10.190 15.711 3.042 1.00 62.40 O ATOM 3172 CB MET D 324 12.099 17.884 3.360 1.00 21.11 C ATOM 3173 CG MET D 324 13.133 19.022 3.297 1.00 23.33 C ATOM 3174 SD MET D 324 12.513 20.568 2.588 1.00 11.43 S ATOM 3175 CE MET D 324 13.970 21.602 2.723 1.00 23.23 C ATOM 0 H MET D 324 10.976 18.701 0.441 1.00 31.43 H new ATOM 0 HA MET D 324 12.377 17.321 1.302 1.00 40.30 H new ATOM 0 HB2 MET D 324 11.262 18.215 3.975 1.00 21.11 H new ATOM 0 HB3 MET D 324 12.554 17.035 3.870 1.00 21.11 H new ATOM 0 HG2 MET D 324 13.497 19.221 4.305 1.00 23.33 H new ATOM 0 HG3 MET D 324 13.988 18.686 2.710 1.00 23.33 H new ATOM 0 HE1 MET D 324 13.751 22.593 2.326 1.00 23.23 H new ATOM 0 HE2 MET D 324 14.261 21.686 3.770 1.00 23.23 H new ATOM 0 HE3 MET D 324 14.786 21.156 2.155 1.00 23.23 H new ATOM 3185 N LYS D 325 11.329 15.109 1.224 1.00 32.42 N ATOM 3186 CA LYS D 325 10.907 13.725 1.236 1.00 1.43 C ATOM 3187 C LYS D 325 12.009 12.855 0.649 1.00 75.35 C ATOM 3188 O LYS D 325 13.168 13.260 0.670 1.00 64.05 O ATOM 3189 CB LYS D 325 9.582 13.565 0.483 1.00 31.53 C ATOM 3190 CG LYS D 325 9.581 13.974 -0.967 1.00 62.13 C ATOM 3191 CD LYS D 325 8.177 13.868 -1.517 1.00 1.20 C ATOM 3192 CE LYS D 325 8.099 14.298 -2.960 1.00 13.42 C ATOM 3193 NZ LYS D 325 8.802 13.370 -3.856 1.00 74.21 N ATOM 0 H LYS D 325 11.945 15.342 0.445 1.00 32.42 H new ATOM 0 HA LYS D 325 10.732 13.400 2.262 1.00 1.43 H new ATOM 0 HB2 LYS D 325 9.279 12.520 0.543 1.00 31.53 H new ATOM 0 HB3 LYS D 325 8.821 14.148 1.003 1.00 31.53 H new ATOM 0 HG2 LYS D 325 9.947 14.996 -1.068 1.00 62.13 H new ATOM 0 HG3 LYS D 325 10.256 13.336 -1.537 1.00 62.13 H new ATOM 0 HD2 LYS D 325 7.830 12.839 -1.427 1.00 1.20 H new ATOM 0 HD3 LYS D 325 7.506 14.485 -0.919 1.00 1.20 H new ATOM 0 HE2 LYS D 325 7.053 14.368 -3.260 1.00 13.42 H new ATOM 0 HE3 LYS D 325 8.528 15.295 -3.064 1.00 13.42 H new ATOM 0 HZ1 LYS D 325 8.542 13.575 -4.842 1.00 74.21 H new ATOM 0 HZ2 LYS D 325 9.829 13.484 -3.738 1.00 74.21 H new ATOM 0 HZ3 LYS D 325 8.533 12.393 -3.624 1.00 74.21 H new ATOM 3207 N GLU D 326 11.650 11.662 0.184 1.00 15.35 N ATOM 3208 CA GLU D 326 12.575 10.701 -0.447 1.00 73.11 C ATOM 3209 C GLU D 326 13.302 9.831 0.586 1.00 41.32 C ATOM 3210 O GLU D 326 13.546 10.272 1.721 1.00 34.02 O ATOM 3211 CB GLU D 326 13.543 11.354 -1.474 1.00 24.53 C ATOM 3212 CG GLU D 326 12.833 11.985 -2.660 1.00 62.02 C ATOM 3213 CD GLU D 326 13.781 12.562 -3.675 1.00 75.33 C ATOM 3214 OE1 GLU D 326 14.394 11.783 -4.437 1.00 72.42 O ATOM 3215 OE2 GLU D 326 13.915 13.801 -3.749 1.00 72.32 O ATOM 0 H GLU D 326 10.690 11.321 0.232 1.00 15.35 H new ATOM 0 HA GLU D 326 11.949 10.029 -1.034 1.00 73.11 H new ATOM 0 HB2 GLU D 326 14.136 12.116 -0.968 1.00 24.53 H new ATOM 0 HB3 GLU D 326 14.239 10.598 -1.837 1.00 24.53 H new ATOM 0 HG2 GLU D 326 12.206 11.235 -3.142 1.00 62.02 H new ATOM 0 HG3 GLU D 326 12.170 12.772 -2.302 1.00 62.02 H new ATOM 3222 N PRO D 327 13.629 8.564 0.206 1.00 65.44 N ATOM 3223 CA PRO D 327 14.292 7.567 1.088 1.00 62.23 C ATOM 3224 C PRO D 327 15.738 7.899 1.454 1.00 62.33 C ATOM 3225 O PRO D 327 16.597 7.023 1.455 1.00 3.15 O ATOM 3226 CB PRO D 327 14.284 6.305 0.240 1.00 11.33 C ATOM 3227 CG PRO D 327 14.231 6.783 -1.154 1.00 34.32 C ATOM 3228 CD PRO D 327 13.345 7.980 -1.123 1.00 5.22 C ATOM 0 HA PRO D 327 13.772 7.506 2.044 1.00 62.23 H new ATOM 0 HB2 PRO D 327 15.176 5.704 0.418 1.00 11.33 H new ATOM 0 HB3 PRO D 327 13.425 5.677 0.475 1.00 11.33 H new ATOM 0 HG2 PRO D 327 15.225 7.038 -1.521 1.00 34.32 H new ATOM 0 HG3 PRO D 327 13.833 6.016 -1.818 1.00 34.32 H new ATOM 0 HD2 PRO D 327 13.578 8.676 -1.929 1.00 5.22 H new ATOM 0 HD3 PRO D 327 12.295 7.709 -1.229 1.00 5.22 H new