USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=28 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: A 61 TYR OH : rot 40:sc= -0.235 USER MOD Set 1.2: D 307 TYR OH : rot 108:sc= 0.674! USER MOD Set 2.1: B 107 TYR OH : rot 95:sc= 0.0842! USER MOD Set 2.2: C 261 TYR OH : rot 75:sc= 1.62 USER MOD Set 3.1: A 68 LYS NZ :NH3+ 176:sc= 2 (180deg=0.875) USER MOD Set 3.2: C 230 ASN : amide:sc= -2.75! C(o=-0.75!,f=-10!) USER MOD Set 4.1: A 22 ASN :FLIP amide:sc= -0.768 F(o=-1.8,f=-0.77) USER MOD Set 4.2: A 45 ASN :FLIP amide:sc= 0.00131 X(o=-1.1,f=-0.77) USER MOD Single : A 16 SER OG : rot -150:sc= 1.58 USER MOD Single : A 17 HIS :FLIP no HD1:sc= -0.181 F(o=-0.84,f=-0.18) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -2.06! C(o=-2.1!,f=-3.6!) USER MOD Single : A 27 LYS NZ :NH3+ -172:sc= -1.66! (180deg=-2.01!) USER MOD Single : A 30 ASN : amide:sc= -0.0529 X(o=-0.053,f=0.086) USER MOD Single : A 31 THR OG1 : rot 60:sc= -1.28! USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= -2.13! C(o=-2.1!,f=-3.9!) USER MOD Single : A 43 LYS NZ :NH3+ 178:sc= 1.26 (180deg=1.21) USER MOD Single : A 44 ASN : amide:sc= -0.256 K(o=-0.26,f=-4.9!) USER MOD Single : A 46 ASN : amide:sc= -1.04! C(o=-1!,f=-12!) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 LYS NZ :NH3+ -176:sc= 1.26 (180deg=1.2) USER MOD Single : A 56 LYS NZ :NH3+ -171:sc= 1.21 (180deg=1.1) USER MOD Single : A 59 GLN : amide:sc= -3.62! C(o=-3.6!,f=-11!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -1.99! C(o=-2!,f=-5.3!) USER MOD Single : B 108 THR OG1 : rot 6:sc= 1.17 USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 111 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : B 121 TYR OH : rot 180:sc= 0 USER MOD Single : B 123 SER OG : rot 105:sc= 1.21 USER MOD Single : B 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 125 LYS NZ :NH3+ -164:sc= 0.82 (180deg=0.645) USER MOD Single : C 216 SER OG : rot -75:sc= 0.844 USER MOD Single : C 217 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : C 222 ASN : amide:sc= -0.82 K(o=-0.82,f=-3.7!) USER MOD Single : C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 225 HIS : no HE2:sc= -1.64 K(o=-1.6,f=-2.4) USER MOD Single : C 227 LYS NZ :NH3+ -171:sc= -1.72! (180deg=-2.03!) USER MOD Single : C 231 THR OG1 : rot -60:sc= -1.86! USER MOD Single : C 233 ASN : amide:sc= -0.167 K(o=-0.17,f=-2.6!) USER MOD Single : C 237 GLN : amide:sc= -4.31! C(o=-4.3!,f=-7.5!) USER MOD Single : C 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 244 ASN : amide:sc= -0.214 X(o=-0.21,f=-0.21) USER MOD Single : C 245 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : C 246 ASN : amide:sc= -1.57! C(o=-1.6!,f=-14!) USER MOD Single : C 248 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 254 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 256 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 259 GLN :FLIP amide:sc= -2.56 F(o=-3.3,f=-2.6) USER MOD Single : C 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 267 ASN : amide:sc= 0.291 X(o=0.29,f=-0.09) USER MOD Single : C 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 308 THR OG1 : rot 12:sc= 1.15 USER MOD Single : D 309 SER OG : rot -58:sc= -1.61! USER MOD Single : D 311 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 321 TYR OH : rot 180:sc= 0 USER MOD Single : D 323 SER OG : rot 65:sc= 1.26 USER MOD Single : D 324 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 139 N CYS A 9 -9.008 -8.972 14.129 1.00 55.41 N ATOM 140 CA CYS A 9 -8.213 -8.288 13.120 1.00 61.44 C ATOM 141 C CYS A 9 -9.048 -8.105 11.846 1.00 71.01 C ATOM 142 O CYS A 9 -9.953 -8.904 11.581 1.00 13.42 O ATOM 143 CB CYS A 9 -6.860 -9.031 12.832 1.00 35.10 C ATOM 144 SG CYS A 9 -5.664 -9.030 14.234 1.00 12.10 S ATOM 0 HA CYS A 9 -7.940 -7.305 13.503 1.00 61.44 H new ATOM 0 HB2 CYS A 9 -7.079 -10.064 12.561 1.00 35.10 H new ATOM 0 HB3 CYS A 9 -6.385 -8.568 11.967 1.00 35.10 H new ATOM 149 N PRO A 10 -8.769 -7.008 11.067 1.00 53.34 N ATOM 150 CA PRO A 10 -9.477 -6.641 9.809 1.00 10.02 C ATOM 151 C PRO A 10 -9.662 -7.820 8.873 1.00 55.24 C ATOM 152 O PRO A 10 -10.675 -7.941 8.172 1.00 12.45 O ATOM 153 CB PRO A 10 -8.501 -5.625 9.172 1.00 43.33 C ATOM 154 CG PRO A 10 -7.260 -5.748 9.971 1.00 75.14 C ATOM 155 CD PRO A 10 -7.733 -6.038 11.344 1.00 50.12 C ATOM 0 HA PRO A 10 -10.483 -6.266 9.998 1.00 10.02 H new ATOM 0 HB2 PRO A 10 -8.321 -5.854 8.122 1.00 43.33 H new ATOM 0 HB3 PRO A 10 -8.901 -4.612 9.214 1.00 43.33 H new ATOM 0 HG2 PRO A 10 -6.622 -6.547 9.593 1.00 75.14 H new ATOM 0 HG3 PRO A 10 -6.674 -4.830 9.938 1.00 75.14 H new ATOM 0 HD2 PRO A 10 -6.944 -6.444 11.977 1.00 50.12 H new ATOM 0 HD3 PRO A 10 -8.119 -5.151 11.845 1.00 50.12 H new ATOM 163 N CYS A 11 -8.686 -8.680 8.871 1.00 4.14 N ATOM 164 CA CYS A 11 -8.705 -9.851 8.077 1.00 45.13 C ATOM 165 C CYS A 11 -9.149 -11.025 8.901 1.00 4.13 C ATOM 166 O CYS A 11 -8.582 -11.303 9.957 1.00 60.41 O ATOM 167 CB CYS A 11 -7.326 -10.116 7.532 1.00 74.43 C ATOM 168 SG CYS A 11 -6.682 -8.790 6.462 1.00 23.55 S ATOM 0 H CYS A 11 -7.843 -8.576 9.436 1.00 4.14 H new ATOM 0 HA CYS A 11 -9.403 -9.707 7.252 1.00 45.13 H new ATOM 0 HB2 CYS A 11 -6.639 -10.261 8.366 1.00 74.43 H new ATOM 0 HB3 CYS A 11 -7.343 -11.048 6.967 1.00 74.43 H new ATOM 173 N ARG A 12 -10.149 -11.725 8.419 1.00 65.13 N ATOM 174 CA ARG A 12 -10.619 -12.909 9.099 1.00 64.52 C ATOM 175 C ARG A 12 -9.628 -13.999 8.794 1.00 73.52 C ATOM 176 O ARG A 12 -9.301 -14.840 9.622 1.00 54.40 O ATOM 177 CB ARG A 12 -11.959 -13.338 8.530 1.00 1.30 C ATOM 178 CG ARG A 12 -13.023 -12.273 8.497 1.00 62.40 C ATOM 179 CD ARG A 12 -14.268 -12.821 7.838 1.00 1.11 C ATOM 180 NE ARG A 12 -13.983 -13.315 6.477 1.00 72.24 N ATOM 181 CZ ARG A 12 -14.430 -14.481 5.976 1.00 4.23 C ATOM 182 NH1 ARG A 12 -15.152 -15.300 6.736 1.00 32.31 N ATOM 183 NH2 ARG A 12 -14.122 -14.836 4.730 1.00 20.11 N ATOM 0 H ARG A 12 -10.651 -11.496 7.561 1.00 65.13 H new ATOM 0 HA ARG A 12 -10.722 -12.718 10.167 1.00 64.52 H new ATOM 0 HB2 ARG A 12 -11.803 -13.702 7.514 1.00 1.30 H new ATOM 0 HB3 ARG A 12 -12.330 -14.179 9.116 1.00 1.30 H new ATOM 0 HG2 ARG A 12 -13.251 -11.941 9.510 1.00 62.40 H new ATOM 0 HG3 ARG A 12 -12.663 -11.402 7.950 1.00 62.40 H new ATOM 0 HD2 ARG A 12 -14.675 -13.631 8.443 1.00 1.11 H new ATOM 0 HD3 ARG A 12 -15.030 -12.043 7.792 1.00 1.11 H new ATOM 0 HE ARG A 12 -13.406 -12.730 5.873 1.00 72.24 H new ATOM 0 HH11 ARG A 12 -15.367 -15.044 7.700 1.00 32.31 H new ATOM 0 HH12 ARG A 12 -15.490 -16.184 6.355 1.00 32.31 H new ATOM 0 HH21 ARG A 12 -13.546 -14.223 4.153 1.00 20.11 H new ATOM 0 HH22 ARG A 12 -14.462 -15.721 4.353 1.00 20.11 H new ATOM 197 N PHE A 13 -9.180 -13.981 7.578 1.00 64.44 N ATOM 198 CA PHE A 13 -8.207 -14.890 7.084 1.00 60.40 C ATOM 199 C PHE A 13 -7.234 -14.097 6.261 1.00 32.22 C ATOM 200 O PHE A 13 -7.641 -13.130 5.604 1.00 32.12 O ATOM 201 CB PHE A 13 -8.873 -15.963 6.199 1.00 3.13 C ATOM 202 CG PHE A 13 -9.914 -16.803 6.891 1.00 73.32 C ATOM 203 CD1 PHE A 13 -11.246 -16.404 6.921 1.00 74.15 C ATOM 204 CD2 PHE A 13 -9.564 -17.990 7.505 1.00 43.15 C ATOM 205 CE1 PHE A 13 -12.198 -17.174 7.554 1.00 32.42 C ATOM 206 CE2 PHE A 13 -10.513 -18.762 8.139 1.00 45.54 C ATOM 207 CZ PHE A 13 -11.831 -18.352 8.165 1.00 73.22 C ATOM 0 H PHE A 13 -9.496 -13.307 6.881 1.00 64.44 H new ATOM 0 HA PHE A 13 -7.707 -15.394 7.911 1.00 60.40 H new ATOM 0 HB2 PHE A 13 -9.335 -15.471 5.343 1.00 3.13 H new ATOM 0 HB3 PHE A 13 -8.098 -16.622 5.807 1.00 3.13 H new ATOM 0 HD1 PHE A 13 -11.538 -15.481 6.443 1.00 74.15 H new ATOM 0 HD2 PHE A 13 -8.535 -18.317 7.488 1.00 43.15 H new ATOM 0 HE1 PHE A 13 -13.229 -16.854 7.571 1.00 32.42 H new ATOM 0 HE2 PHE A 13 -10.226 -19.688 8.616 1.00 45.54 H new ATOM 0 HZ PHE A 13 -12.574 -18.955 8.665 1.00 73.22 H new ATOM 217 N PHE A 14 -5.987 -14.440 6.321 1.00 60.13 N ATOM 218 CA PHE A 14 -5.020 -13.836 5.465 1.00 33.21 C ATOM 219 C PHE A 14 -4.603 -14.897 4.473 1.00 51.42 C ATOM 220 O PHE A 14 -4.354 -16.044 4.843 1.00 73.13 O ATOM 221 CB PHE A 14 -3.813 -13.232 6.237 1.00 52.33 C ATOM 222 CG PHE A 14 -2.955 -14.218 6.989 1.00 41.33 C ATOM 223 CD1 PHE A 14 -1.979 -14.922 6.324 1.00 21.32 C ATOM 224 CD2 PHE A 14 -3.124 -14.432 8.344 1.00 20.12 C ATOM 225 CE1 PHE A 14 -1.178 -15.828 6.982 1.00 20.42 C ATOM 226 CE2 PHE A 14 -2.328 -15.339 9.019 1.00 2.02 C ATOM 227 CZ PHE A 14 -1.351 -16.039 8.336 1.00 61.32 C ATOM 0 H PHE A 14 -5.613 -15.142 6.960 1.00 60.13 H new ATOM 0 HA PHE A 14 -5.455 -12.978 4.952 1.00 33.21 H new ATOM 0 HB2 PHE A 14 -3.182 -12.698 5.527 1.00 52.33 H new ATOM 0 HB3 PHE A 14 -4.191 -12.494 6.945 1.00 52.33 H new ATOM 0 HD1 PHE A 14 -1.838 -14.761 5.265 1.00 21.32 H new ATOM 0 HD2 PHE A 14 -3.885 -13.885 8.881 1.00 20.12 H new ATOM 0 HE1 PHE A 14 -0.417 -16.372 6.442 1.00 20.42 H new ATOM 0 HE2 PHE A 14 -2.469 -15.500 10.078 1.00 2.02 H new ATOM 0 HZ PHE A 14 -0.726 -16.748 8.859 1.00 61.32 H new ATOM 237 N GLU A 15 -4.561 -14.564 3.252 1.00 32.32 N ATOM 238 CA GLU A 15 -4.308 -15.538 2.270 1.00 51.44 C ATOM 239 C GLU A 15 -2.832 -15.627 1.954 1.00 34.12 C ATOM 240 O GLU A 15 -2.204 -14.650 1.549 1.00 4.03 O ATOM 241 CB GLU A 15 -5.107 -15.271 1.011 1.00 50.31 C ATOM 242 CG GLU A 15 -6.628 -15.036 1.208 1.00 60.21 C ATOM 243 CD GLU A 15 -7.358 -16.037 2.098 1.00 1.31 C ATOM 244 OE1 GLU A 15 -7.852 -17.051 1.601 1.00 63.12 O ATOM 245 OE2 GLU A 15 -7.497 -15.771 3.296 1.00 75.43 O ATOM 0 H GLU A 15 -4.699 -13.617 2.900 1.00 32.32 H new ATOM 0 HA GLU A 15 -4.627 -16.498 2.675 1.00 51.44 H new ATOM 0 HB2 GLU A 15 -4.686 -14.396 0.516 1.00 50.31 H new ATOM 0 HB3 GLU A 15 -4.975 -16.115 0.334 1.00 50.31 H new ATOM 0 HG2 GLU A 15 -6.769 -14.040 1.627 1.00 60.21 H new ATOM 0 HG3 GLU A 15 -7.104 -15.039 0.228 1.00 60.21 H new ATOM 252 N SER A 16 -2.290 -16.801 2.140 1.00 73.21 N ATOM 253 CA SER A 16 -0.904 -17.051 1.906 1.00 21.22 C ATOM 254 C SER A 16 -0.659 -17.686 0.531 1.00 45.55 C ATOM 255 O SER A 16 0.467 -17.947 0.153 1.00 0.10 O ATOM 256 CB SER A 16 -0.399 -17.943 3.003 1.00 42.01 C ATOM 257 OG SER A 16 -1.256 -19.079 3.156 1.00 3.04 O ATOM 0 H SER A 16 -2.810 -17.617 2.462 1.00 73.21 H new ATOM 0 HA SER A 16 -0.364 -16.104 1.908 1.00 21.22 H new ATOM 0 HB2 SER A 16 0.615 -18.272 2.775 1.00 42.01 H new ATOM 0 HB3 SER A 16 -0.351 -17.387 3.939 1.00 42.01 H new ATOM 0 HG SER A 16 -1.240 -19.377 4.089 1.00 3.04 H new ATOM 263 N HIS A 17 -1.713 -17.967 -0.194 1.00 5.25 N ATOM 264 CA HIS A 17 -1.582 -18.505 -1.544 1.00 23.12 C ATOM 265 C HIS A 17 -2.560 -17.863 -2.487 1.00 21.12 C ATOM 266 O HIS A 17 -3.625 -18.397 -2.763 1.00 34.24 O ATOM 267 CB HIS A 17 -1.620 -20.058 -1.640 1.00 73.45 C ATOM 268 CG HIS A 17 -0.335 -20.768 -1.251 1.00 30.51 C ATOM 269 ND1 HIS A 17 0.258 -20.972 -0.047 1.00 2.21 N flip ATOM 270 CD2 HIS A 17 0.476 -21.398 -2.172 1.00 1.43 C flip ATOM 271 CE1 HIS A 17 1.394 -21.708 -0.267 1.00 11.14 C flip ATOM 272 NE2 HIS A 17 1.500 -21.948 -1.553 1.00 63.01 N flip ATOM 0 H HIS A 17 -2.675 -17.836 0.119 1.00 5.25 H new ATOM 0 HA HIS A 17 -0.572 -18.239 -1.855 1.00 23.12 H new ATOM 0 HB2 HIS A 17 -2.425 -20.425 -1.003 1.00 73.45 H new ATOM 0 HB3 HIS A 17 -1.873 -20.335 -2.663 1.00 73.45 H new ATOM 0 HD2 HIS A 17 0.299 -21.435 -3.237 1.00 1.43 H new ATOM 0 HE1 HIS A 17 2.088 -22.036 0.493 1.00 11.14 H new ATOM 0 HE2 HIS A 17 2.252 -22.474 -1.999 1.00 63.01 H new ATOM 281 N VAL A 18 -2.206 -16.694 -2.921 1.00 32.24 N ATOM 282 CA VAL A 18 -2.993 -15.890 -3.827 1.00 72.30 C ATOM 283 C VAL A 18 -2.082 -15.347 -4.910 1.00 12.32 C ATOM 284 O VAL A 18 -0.902 -15.071 -4.655 1.00 75.35 O ATOM 285 CB VAL A 18 -3.752 -14.757 -3.059 1.00 54.11 C ATOM 286 CG1 VAL A 18 -4.248 -13.653 -3.991 1.00 61.21 C ATOM 287 CG2 VAL A 18 -4.958 -15.354 -2.380 1.00 13.21 C ATOM 0 H VAL A 18 -1.329 -16.249 -2.649 1.00 32.24 H new ATOM 0 HA VAL A 18 -3.763 -16.502 -4.297 1.00 72.30 H new ATOM 0 HB VAL A 18 -3.051 -14.322 -2.347 1.00 54.11 H new ATOM 0 HG11 VAL A 18 -4.768 -12.892 -3.409 1.00 61.21 H new ATOM 0 HG12 VAL A 18 -3.399 -13.201 -4.504 1.00 61.21 H new ATOM 0 HG13 VAL A 18 -4.932 -14.077 -4.726 1.00 61.21 H new ATOM 0 HG21 VAL A 18 -5.496 -14.574 -1.841 1.00 13.21 H new ATOM 0 HG22 VAL A 18 -5.615 -15.797 -3.129 1.00 13.21 H new ATOM 0 HG23 VAL A 18 -4.637 -16.124 -1.679 1.00 13.21 H new ATOM 297 N ALA A 19 -2.614 -15.213 -6.096 1.00 55.42 N ATOM 298 CA ALA A 19 -1.824 -14.845 -7.246 1.00 41.55 C ATOM 299 C ALA A 19 -1.669 -13.342 -7.383 1.00 42.22 C ATOM 300 O ALA A 19 -2.642 -12.588 -7.318 1.00 23.25 O ATOM 301 CB ALA A 19 -2.416 -15.442 -8.512 1.00 73.55 C ATOM 0 H ALA A 19 -3.604 -15.355 -6.294 1.00 55.42 H new ATOM 0 HA ALA A 19 -0.825 -15.255 -7.095 1.00 41.55 H new ATOM 0 HB1 ALA A 19 -1.807 -15.154 -9.369 1.00 73.55 H new ATOM 0 HB2 ALA A 19 -2.434 -16.529 -8.428 1.00 73.55 H new ATOM 0 HB3 ALA A 19 -3.432 -15.072 -8.648 1.00 73.55 H new ATOM 307 N ARG A 20 -0.436 -12.932 -7.603 1.00 53.02 N ATOM 308 CA ARG A 20 -0.063 -11.536 -7.809 1.00 44.23 C ATOM 309 C ARG A 20 -0.624 -11.045 -9.162 1.00 33.05 C ATOM 310 O ARG A 20 -0.761 -9.851 -9.406 1.00 62.05 O ATOM 311 CB ARG A 20 1.497 -11.435 -7.675 1.00 22.22 C ATOM 312 CG ARG A 20 2.196 -10.061 -7.861 1.00 74.14 C ATOM 313 CD ARG A 20 2.337 -9.647 -9.298 1.00 42.24 C ATOM 314 NE ARG A 20 3.080 -10.632 -10.104 1.00 72.21 N ATOM 315 CZ ARG A 20 3.038 -10.714 -11.449 1.00 33.05 C ATOM 316 NH1 ARG A 20 2.320 -9.844 -12.158 1.00 31.02 N ATOM 317 NH2 ARG A 20 3.743 -11.642 -12.077 1.00 22.40 N ATOM 0 H ARG A 20 0.358 -13.571 -7.646 1.00 53.02 H new ATOM 0 HA ARG A 20 -0.496 -10.873 -7.060 1.00 44.23 H new ATOM 0 HB2 ARG A 20 1.764 -11.805 -6.685 1.00 22.22 H new ATOM 0 HB3 ARG A 20 1.932 -12.123 -8.400 1.00 22.22 H new ATOM 0 HG2 ARG A 20 1.629 -9.299 -7.326 1.00 74.14 H new ATOM 0 HG3 ARG A 20 3.185 -10.101 -7.405 1.00 74.14 H new ATOM 0 HD2 ARG A 20 1.346 -9.504 -9.729 1.00 42.24 H new ATOM 0 HD3 ARG A 20 2.847 -8.685 -9.346 1.00 42.24 H new ATOM 0 HE ARG A 20 3.669 -11.301 -9.608 1.00 72.21 H new ATOM 0 HH11 ARG A 20 1.796 -9.108 -11.683 1.00 31.02 H new ATOM 0 HH12 ARG A 20 2.294 -9.914 -13.175 1.00 31.02 H new ATOM 0 HH21 ARG A 20 4.317 -12.294 -11.543 1.00 22.40 H new ATOM 0 HH22 ARG A 20 3.712 -11.705 -13.095 1.00 22.40 H new ATOM 331 N ALA A 21 -0.934 -11.993 -10.023 1.00 71.43 N ATOM 332 CA ALA A 21 -1.564 -11.723 -11.311 1.00 13.10 C ATOM 333 C ALA A 21 -3.114 -11.583 -11.209 1.00 42.44 C ATOM 334 O ALA A 21 -3.766 -11.196 -12.169 1.00 14.34 O ATOM 335 CB ALA A 21 -1.192 -12.805 -12.315 1.00 74.13 C ATOM 0 H ALA A 21 -0.757 -12.983 -9.852 1.00 71.43 H new ATOM 0 HA ALA A 21 -1.185 -10.761 -11.655 1.00 13.10 H new ATOM 0 HB1 ALA A 21 -1.668 -12.592 -13.272 1.00 74.13 H new ATOM 0 HB2 ALA A 21 -0.110 -12.825 -12.444 1.00 74.13 H new ATOM 0 HB3 ALA A 21 -1.531 -13.774 -11.948 1.00 74.13 H new ATOM 341 N ASN A 22 -3.691 -11.930 -10.057 1.00 25.25 N ATOM 342 CA ASN A 22 -5.174 -11.956 -9.902 1.00 63.12 C ATOM 343 C ASN A 22 -5.657 -10.830 -8.961 1.00 51.21 C ATOM 344 O ASN A 22 -6.761 -10.852 -8.441 1.00 51.42 O ATOM 345 CB ASN A 22 -5.597 -13.349 -9.366 1.00 32.45 C ATOM 346 CG ASN A 22 -7.112 -13.555 -9.221 1.00 62.55 C ATOM 347 OD1 ASN A 22 -7.492 -14.372 -8.265 1.00 62.34 O flip ATOM 348 ND2 ASN A 22 -7.929 -12.983 -9.964 1.00 54.35 N flip ATOM 0 H ASN A 22 -3.175 -12.196 -9.219 1.00 25.25 H new ATOM 0 HA ASN A 22 -5.640 -11.783 -10.872 1.00 63.12 H new ATOM 0 HB2 ASN A 22 -5.204 -14.114 -10.035 1.00 32.45 H new ATOM 0 HB3 ASN A 22 -5.129 -13.505 -8.394 1.00 32.45 H new ATOM 0 HD21 ASN A 22 -7.599 -12.355 -10.697 1.00 54.35 H new ATOM 0 HD22 ASN A 22 -8.929 -13.142 -9.841 1.00 54.35 H new ATOM 355 N VAL A 23 -4.857 -9.831 -8.814 1.00 71.33 N ATOM 356 CA VAL A 23 -5.146 -8.728 -7.908 1.00 64.31 C ATOM 357 C VAL A 23 -5.053 -7.378 -8.650 1.00 41.13 C ATOM 358 O VAL A 23 -4.400 -7.291 -9.662 1.00 23.43 O ATOM 359 CB VAL A 23 -4.174 -8.796 -6.679 1.00 74.24 C ATOM 360 CG1 VAL A 23 -2.764 -9.012 -7.149 1.00 70.34 C ATOM 361 CG2 VAL A 23 -4.239 -7.542 -5.829 1.00 20.12 C ATOM 0 H VAL A 23 -3.973 -9.738 -9.314 1.00 71.33 H new ATOM 0 HA VAL A 23 -6.167 -8.814 -7.537 1.00 64.31 H new ATOM 0 HB VAL A 23 -4.493 -9.635 -6.060 1.00 74.24 H new ATOM 0 HG11 VAL A 23 -2.097 -9.058 -6.288 1.00 70.34 H new ATOM 0 HG12 VAL A 23 -2.705 -9.948 -7.704 1.00 70.34 H new ATOM 0 HG13 VAL A 23 -2.466 -8.187 -7.796 1.00 70.34 H new ATOM 0 HG21 VAL A 23 -3.549 -7.635 -4.990 1.00 20.12 H new ATOM 0 HG22 VAL A 23 -3.961 -6.678 -6.433 1.00 20.12 H new ATOM 0 HG23 VAL A 23 -5.253 -7.410 -5.452 1.00 20.12 H new ATOM 371 N LYS A 24 -5.775 -6.356 -8.172 1.00 75.42 N ATOM 372 CA LYS A 24 -5.713 -5.020 -8.774 1.00 11.30 C ATOM 373 C LYS A 24 -4.914 -4.027 -7.927 1.00 71.14 C ATOM 374 O LYS A 24 -4.338 -3.078 -8.449 1.00 73.14 O ATOM 375 CB LYS A 24 -7.121 -4.475 -9.034 1.00 43.21 C ATOM 376 CG LYS A 24 -7.894 -5.335 -10.004 1.00 21.21 C ATOM 377 CD LYS A 24 -9.235 -4.734 -10.406 1.00 1.34 C ATOM 378 CE LYS A 24 -10.217 -4.644 -9.254 1.00 24.41 C ATOM 379 NZ LYS A 24 -11.508 -4.054 -9.684 1.00 43.33 N ATOM 0 H LYS A 24 -6.406 -6.429 -7.374 1.00 75.42 H new ATOM 0 HA LYS A 24 -5.188 -5.132 -9.723 1.00 11.30 H new ATOM 0 HB2 LYS A 24 -7.665 -4.414 -8.091 1.00 43.21 H new ATOM 0 HB3 LYS A 24 -7.050 -3.461 -9.427 1.00 43.21 H new ATOM 0 HG2 LYS A 24 -7.292 -5.493 -10.899 1.00 21.21 H new ATOM 0 HG3 LYS A 24 -8.062 -6.314 -9.556 1.00 21.21 H new ATOM 0 HD2 LYS A 24 -9.071 -3.737 -10.815 1.00 1.34 H new ATOM 0 HD3 LYS A 24 -9.672 -5.337 -11.202 1.00 1.34 H new ATOM 0 HE2 LYS A 24 -10.389 -5.639 -8.843 1.00 24.41 H new ATOM 0 HE3 LYS A 24 -9.788 -4.039 -8.455 1.00 24.41 H new ATOM 0 HZ1 LYS A 24 -12.156 -4.007 -8.872 1.00 43.33 H new ATOM 0 HZ2 LYS A 24 -11.346 -3.095 -10.053 1.00 43.33 H new ATOM 0 HZ3 LYS A 24 -11.929 -4.645 -10.429 1.00 43.33 H new ATOM 393 N HIS A 25 -4.904 -4.246 -6.621 1.00 24.03 N ATOM 394 CA HIS A 25 -4.216 -3.346 -5.658 1.00 72.43 C ATOM 395 C HIS A 25 -4.303 -3.884 -4.238 1.00 42.55 C ATOM 396 O HIS A 25 -5.113 -4.787 -3.963 1.00 35.22 O ATOM 397 CB HIS A 25 -4.764 -1.889 -5.712 1.00 54.04 C ATOM 398 CG HIS A 25 -6.260 -1.755 -5.612 1.00 30.44 C ATOM 399 ND1 HIS A 25 -7.062 -2.619 -4.894 1.00 11.22 N ATOM 400 CD2 HIS A 25 -7.103 -0.883 -6.208 1.00 64.42 C ATOM 401 CE1 HIS A 25 -8.319 -2.292 -5.071 1.00 33.14 C ATOM 402 NE2 HIS A 25 -8.377 -1.246 -5.855 1.00 51.12 N ATOM 0 H HIS A 25 -5.365 -5.044 -6.183 1.00 24.03 H new ATOM 0 HA HIS A 25 -3.169 -3.318 -5.960 1.00 72.43 H new ATOM 0 HB2 HIS A 25 -4.311 -1.319 -4.901 1.00 54.04 H new ATOM 0 HB3 HIS A 25 -4.437 -1.431 -6.646 1.00 54.04 H new ATOM 0 HD2 HIS A 25 -6.825 -0.055 -6.843 1.00 64.42 H new ATOM 0 HE1 HIS A 25 -9.168 -2.802 -4.640 1.00 33.14 H new ATOM 0 HE2 HIS A 25 -9.232 -0.777 -6.155 1.00 51.12 H new ATOM 411 N LEU A 26 -3.539 -3.281 -3.337 1.00 74.31 N ATOM 412 CA LEU A 26 -3.456 -3.720 -1.946 1.00 71.42 C ATOM 413 C LEU A 26 -3.998 -2.644 -0.989 1.00 45.20 C ATOM 414 O LEU A 26 -3.956 -1.462 -1.284 1.00 14.32 O ATOM 415 CB LEU A 26 -1.974 -3.999 -1.557 1.00 70.44 C ATOM 416 CG LEU A 26 -1.227 -5.120 -2.292 1.00 13.33 C ATOM 417 CD1 LEU A 26 0.208 -5.223 -1.772 1.00 53.21 C ATOM 418 CD2 LEU A 26 -1.939 -6.455 -2.136 1.00 53.13 C ATOM 0 H LEU A 26 -2.957 -2.471 -3.549 1.00 74.31 H new ATOM 0 HA LEU A 26 -4.055 -4.626 -1.857 1.00 71.42 H new ATOM 0 HB2 LEU A 26 -1.413 -3.076 -1.701 1.00 70.44 H new ATOM 0 HB3 LEU A 26 -1.947 -4.225 -0.491 1.00 70.44 H new ATOM 0 HG LEU A 26 -1.208 -4.873 -3.353 1.00 13.33 H new ATOM 0 HD11 LEU A 26 0.730 -6.021 -2.300 1.00 53.21 H new ATOM 0 HD12 LEU A 26 0.725 -4.278 -1.941 1.00 53.21 H new ATOM 0 HD13 LEU A 26 0.193 -5.443 -0.705 1.00 53.21 H new ATOM 0 HD21 LEU A 26 -1.384 -7.228 -2.668 1.00 53.13 H new ATOM 0 HD22 LEU A 26 -1.999 -6.714 -1.079 1.00 53.13 H new ATOM 0 HD23 LEU A 26 -2.945 -6.381 -2.549 1.00 53.13 H new ATOM 430 N LYS A 27 -4.525 -3.089 0.133 1.00 21.34 N ATOM 431 CA LYS A 27 -4.968 -2.234 1.232 1.00 3.25 C ATOM 432 C LYS A 27 -4.038 -2.544 2.361 1.00 33.24 C ATOM 433 O LYS A 27 -4.018 -3.670 2.806 1.00 72.12 O ATOM 434 CB LYS A 27 -6.381 -2.677 1.732 1.00 62.40 C ATOM 435 CG LYS A 27 -6.982 -1.813 2.872 1.00 23.24 C ATOM 436 CD LYS A 27 -7.655 -0.556 2.344 1.00 13.25 C ATOM 437 CE LYS A 27 -9.100 -0.827 1.869 1.00 61.30 C ATOM 438 NZ LYS A 27 -9.216 -1.856 0.802 1.00 74.24 N ATOM 0 H LYS A 27 -4.664 -4.082 0.318 1.00 21.34 H new ATOM 0 HA LYS A 27 -4.988 -1.190 0.919 1.00 3.25 H new ATOM 0 HB2 LYS A 27 -7.069 -2.662 0.886 1.00 62.40 H new ATOM 0 HB3 LYS A 27 -6.320 -3.710 2.075 1.00 62.40 H new ATOM 0 HG2 LYS A 27 -7.707 -2.405 3.430 1.00 23.24 H new ATOM 0 HG3 LYS A 27 -6.192 -1.535 3.570 1.00 23.24 H new ATOM 0 HD2 LYS A 27 -7.667 0.204 3.125 1.00 13.25 H new ATOM 0 HD3 LYS A 27 -7.071 -0.153 1.516 1.00 13.25 H new ATOM 0 HE2 LYS A 27 -9.697 -1.141 2.725 1.00 61.30 H new ATOM 0 HE3 LYS A 27 -9.530 0.106 1.505 1.00 61.30 H new ATOM 0 HZ1 LYS A 27 -10.193 -1.880 0.448 1.00 74.24 H new ATOM 0 HZ2 LYS A 27 -8.570 -1.621 0.021 1.00 74.24 H new ATOM 0 HZ3 LYS A 27 -8.966 -2.788 1.190 1.00 74.24 H new ATOM 452 N ILE A 28 -3.286 -1.612 2.829 1.00 1.24 N ATOM 453 CA ILE A 28 -2.444 -1.935 3.942 1.00 22.15 C ATOM 454 C ILE A 28 -2.959 -1.280 5.186 1.00 71.31 C ATOM 455 O ILE A 28 -3.229 -0.048 5.214 1.00 2.21 O ATOM 456 CB ILE A 28 -0.942 -1.626 3.751 1.00 11.02 C ATOM 457 CG1 ILE A 28 -0.426 -2.249 2.458 1.00 13.51 C ATOM 458 CG2 ILE A 28 -0.157 -2.216 4.930 1.00 52.15 C ATOM 459 CD1 ILE A 28 1.059 -2.066 2.264 1.00 53.11 C ATOM 0 H ILE A 28 -3.230 -0.655 2.481 1.00 1.24 H new ATOM 0 HA ILE A 28 -2.495 -3.020 4.030 1.00 22.15 H new ATOM 0 HB ILE A 28 -0.809 -0.545 3.703 1.00 11.02 H new ATOM 0 HG12 ILE A 28 -0.658 -3.314 2.457 1.00 13.51 H new ATOM 0 HG13 ILE A 28 -0.954 -1.807 1.613 1.00 13.51 H new ATOM 0 HG21 ILE A 28 0.904 -2.003 4.804 1.00 52.15 H new ATOM 0 HG22 ILE A 28 -0.508 -1.770 5.861 1.00 52.15 H new ATOM 0 HG23 ILE A 28 -0.309 -3.295 4.965 1.00 52.15 H new ATOM 0 HD11 ILE A 28 1.364 -2.531 1.327 1.00 53.11 H new ATOM 0 HD12 ILE A 28 1.294 -1.002 2.234 1.00 53.11 H new ATOM 0 HD13 ILE A 28 1.594 -2.532 3.091 1.00 53.11 H new ATOM 471 N LEU A 29 -3.135 -2.096 6.182 1.00 34.31 N ATOM 472 CA LEU A 29 -3.618 -1.710 7.455 1.00 2.13 C ATOM 473 C LEU A 29 -2.961 -2.548 8.563 1.00 74.14 C ATOM 474 O LEU A 29 -3.285 -3.707 8.791 1.00 5.23 O ATOM 475 CB LEU A 29 -5.169 -1.668 7.445 1.00 63.43 C ATOM 476 CG LEU A 29 -5.893 -2.720 6.556 1.00 64.52 C ATOM 477 CD1 LEU A 29 -5.819 -4.113 7.094 1.00 51.44 C ATOM 478 CD2 LEU A 29 -7.311 -2.318 6.273 1.00 34.55 C ATOM 0 H LEU A 29 -2.933 -3.094 6.116 1.00 34.31 H new ATOM 0 HA LEU A 29 -3.320 -0.689 7.694 1.00 2.13 H new ATOM 0 HB2 LEU A 29 -5.519 -1.791 8.470 1.00 63.43 H new ATOM 0 HB3 LEU A 29 -5.480 -0.676 7.119 1.00 63.43 H new ATOM 0 HG LEU A 29 -5.347 -2.736 5.613 1.00 64.52 H new ATOM 0 HD11 LEU A 29 -6.345 -4.791 6.422 1.00 51.44 H new ATOM 0 HD12 LEU A 29 -4.775 -4.418 7.173 1.00 51.44 H new ATOM 0 HD13 LEU A 29 -6.282 -4.147 8.080 1.00 51.44 H new ATOM 0 HD21 LEU A 29 -7.786 -3.075 5.650 1.00 34.55 H new ATOM 0 HD22 LEU A 29 -7.857 -2.225 7.212 1.00 34.55 H new ATOM 0 HD23 LEU A 29 -7.321 -1.361 5.752 1.00 34.55 H new ATOM 490 N ASN A 30 -1.997 -1.940 9.212 1.00 11.53 N ATOM 491 CA ASN A 30 -1.147 -2.619 10.176 1.00 34.13 C ATOM 492 C ASN A 30 -1.782 -2.711 11.534 1.00 3.51 C ATOM 493 O ASN A 30 -2.176 -1.715 12.130 1.00 13.24 O ATOM 494 CB ASN A 30 0.222 -1.922 10.276 1.00 43.14 C ATOM 495 CG ASN A 30 1.178 -2.581 11.259 1.00 55.25 C ATOM 496 OD1 ASN A 30 1.917 -3.490 10.901 1.00 52.43 O ATOM 497 ND2 ASN A 30 1.188 -2.115 12.491 1.00 41.43 N ATOM 0 H ASN A 30 -1.774 -0.952 9.089 1.00 11.53 H new ATOM 0 HA ASN A 30 -1.007 -3.637 9.813 1.00 34.13 H new ATOM 0 HB2 ASN A 30 0.684 -1.907 9.289 1.00 43.14 H new ATOM 0 HB3 ASN A 30 0.070 -0.884 10.572 1.00 43.14 H new ATOM 0 HD21 ASN A 30 1.825 -2.512 13.181 1.00 41.43 H new ATOM 0 HD22 ASN A 30 0.559 -1.357 12.755 1.00 41.43 H new ATOM 504 N THR A 31 -1.874 -3.911 11.993 1.00 53.03 N ATOM 505 CA THR A 31 -2.403 -4.236 13.272 1.00 64.33 C ATOM 506 C THR A 31 -1.244 -4.614 14.179 1.00 73.23 C ATOM 507 O THR A 31 -0.306 -5.213 13.709 1.00 23.13 O ATOM 508 CB THR A 31 -3.288 -5.466 13.105 1.00 63.24 C ATOM 509 OG1 THR A 31 -2.500 -6.517 12.495 1.00 54.33 O ATOM 510 CG2 THR A 31 -4.461 -5.152 12.203 1.00 14.32 C ATOM 0 H THR A 31 -1.569 -4.728 11.464 1.00 53.03 H new ATOM 0 HA THR A 31 -2.964 -3.399 13.689 1.00 64.33 H new ATOM 0 HB THR A 31 -3.663 -5.776 14.080 1.00 63.24 H new ATOM 0 HG1 THR A 31 -1.737 -6.731 13.072 1.00 54.33 H new ATOM 0 HG21 THR A 31 -5.084 -6.040 12.093 1.00 14.32 H new ATOM 0 HG22 THR A 31 -5.051 -4.347 12.641 1.00 14.32 H new ATOM 0 HG23 THR A 31 -4.095 -4.843 11.224 1.00 14.32 H new ATOM 518 N PRO A 32 -1.250 -4.248 15.453 1.00 14.31 N ATOM 519 CA PRO A 32 -0.200 -4.674 16.384 1.00 22.11 C ATOM 520 C PRO A 32 -0.401 -6.124 16.887 1.00 55.41 C ATOM 521 O PRO A 32 0.564 -6.801 17.239 1.00 51.34 O ATOM 522 CB PRO A 32 -0.334 -3.675 17.553 1.00 53.24 C ATOM 523 CG PRO A 32 -1.258 -2.618 17.043 1.00 71.32 C ATOM 524 CD PRO A 32 -2.177 -3.325 16.094 1.00 62.14 C ATOM 0 HA PRO A 32 0.783 -4.675 15.912 1.00 22.11 H new ATOM 0 HB2 PRO A 32 -0.737 -4.158 18.443 1.00 53.24 H new ATOM 0 HB3 PRO A 32 0.634 -3.256 17.829 1.00 53.24 H new ATOM 0 HG2 PRO A 32 -1.814 -2.154 17.858 1.00 71.32 H new ATOM 0 HG3 PRO A 32 -0.708 -1.823 16.540 1.00 71.32 H new ATOM 0 HD2 PRO A 32 -2.985 -3.843 16.610 1.00 62.14 H new ATOM 0 HD3 PRO A 32 -2.640 -2.642 15.381 1.00 62.14 H new ATOM 532 N ASN A 33 -1.651 -6.593 16.903 1.00 25.22 N ATOM 533 CA ASN A 33 -1.964 -7.942 17.421 1.00 73.45 C ATOM 534 C ASN A 33 -1.844 -9.024 16.353 1.00 62.34 C ATOM 535 O ASN A 33 -1.803 -10.207 16.658 1.00 42.14 O ATOM 536 CB ASN A 33 -3.340 -7.994 18.078 1.00 50.31 C ATOM 537 CG ASN A 33 -3.455 -7.112 19.308 1.00 22.15 C ATOM 538 OD1 ASN A 33 -3.830 -5.938 19.222 1.00 34.11 O ATOM 539 ND2 ASN A 33 -3.151 -7.662 20.459 1.00 31.11 N ATOM 0 H ASN A 33 -2.461 -6.071 16.569 1.00 25.22 H new ATOM 0 HA ASN A 33 -1.213 -8.149 18.183 1.00 73.45 H new ATOM 0 HB2 ASN A 33 -4.093 -7.691 17.351 1.00 50.31 H new ATOM 0 HB3 ASN A 33 -3.563 -9.024 18.357 1.00 50.31 H new ATOM 0 HD21 ASN A 33 -3.221 -7.118 21.319 1.00 31.11 H new ATOM 0 HD22 ASN A 33 -2.845 -8.634 20.495 1.00 31.11 H new ATOM 546 N CYS A 34 -1.771 -8.611 15.129 1.00 12.02 N ATOM 547 CA CYS A 34 -1.563 -9.501 14.002 1.00 52.43 C ATOM 548 C CYS A 34 -0.328 -8.981 13.274 1.00 43.54 C ATOM 549 O CYS A 34 -0.016 -7.813 13.426 1.00 75.25 O ATOM 550 CB CYS A 34 -2.830 -9.566 13.068 1.00 13.44 C ATOM 551 SG CYS A 34 -4.286 -10.464 13.768 1.00 24.12 S ATOM 0 H CYS A 34 -1.854 -7.629 14.866 1.00 12.02 H new ATOM 0 HA CYS A 34 -1.408 -10.528 14.332 1.00 52.43 H new ATOM 0 HB2 CYS A 34 -3.135 -8.548 12.826 1.00 13.44 H new ATOM 0 HB3 CYS A 34 -2.545 -10.045 12.131 1.00 13.44 H new ATOM 556 N ALA A 35 0.391 -9.841 12.530 1.00 52.43 N ATOM 557 CA ALA A 35 1.677 -9.458 11.882 1.00 62.41 C ATOM 558 C ALA A 35 1.571 -8.130 11.136 1.00 43.32 C ATOM 559 O ALA A 35 2.227 -7.155 11.487 1.00 72.34 O ATOM 560 CB ALA A 35 2.159 -10.556 10.946 1.00 31.04 C ATOM 0 H ALA A 35 0.111 -10.807 12.358 1.00 52.43 H new ATOM 0 HA ALA A 35 2.410 -9.328 12.678 1.00 62.41 H new ATOM 0 HB1 ALA A 35 3.099 -10.254 10.485 1.00 31.04 H new ATOM 0 HB2 ALA A 35 2.311 -11.475 11.511 1.00 31.04 H new ATOM 0 HB3 ALA A 35 1.412 -10.727 10.170 1.00 31.04 H new ATOM 566 N CYS A 36 0.752 -8.124 10.137 1.00 33.35 N ATOM 567 CA CYS A 36 0.416 -6.962 9.357 1.00 23.02 C ATOM 568 C CYS A 36 -0.705 -7.425 8.474 1.00 71.22 C ATOM 569 O CYS A 36 -0.749 -8.603 8.137 1.00 51.30 O ATOM 570 CB CYS A 36 1.624 -6.440 8.528 1.00 64.41 C ATOM 571 SG CYS A 36 1.292 -4.897 7.592 1.00 41.05 S ATOM 0 H CYS A 36 0.272 -8.966 9.821 1.00 33.35 H new ATOM 0 HA CYS A 36 0.131 -6.117 9.984 1.00 23.02 H new ATOM 0 HB2 CYS A 36 2.464 -6.268 9.201 1.00 64.41 H new ATOM 0 HB3 CYS A 36 1.931 -7.217 7.827 1.00 64.41 H new ATOM 576 N GLN A 37 -1.635 -6.581 8.156 1.00 25.52 N ATOM 577 CA GLN A 37 -2.791 -7.018 7.409 1.00 71.44 C ATOM 578 C GLN A 37 -2.890 -6.238 6.111 1.00 13.31 C ATOM 579 O GLN A 37 -2.882 -4.995 6.109 1.00 62.23 O ATOM 580 CB GLN A 37 -4.052 -6.831 8.267 1.00 13.14 C ATOM 581 CG GLN A 37 -4.009 -7.555 9.615 1.00 2.44 C ATOM 582 CD GLN A 37 -4.097 -9.065 9.529 1.00 0.03 C ATOM 583 OE1 GLN A 37 -5.173 -9.633 9.596 1.00 45.14 O ATOM 584 NE2 GLN A 37 -2.986 -9.715 9.350 1.00 55.02 N ATOM 0 H GLN A 37 -1.625 -5.590 8.396 1.00 25.52 H new ATOM 0 HA GLN A 37 -2.695 -8.075 7.161 1.00 71.44 H new ATOM 0 HB2 GLN A 37 -4.202 -5.766 8.444 1.00 13.14 H new ATOM 0 HB3 GLN A 37 -4.916 -7.185 7.705 1.00 13.14 H new ATOM 0 HG2 GLN A 37 -3.084 -7.288 10.126 1.00 2.44 H new ATOM 0 HG3 GLN A 37 -4.830 -7.192 10.233 1.00 2.44 H new ATOM 0 HE21 GLN A 37 -2.102 -9.209 9.298 1.00 55.02 H new ATOM 0 HE22 GLN A 37 -2.998 -10.731 9.261 1.00 55.02 H new ATOM 593 N ILE A 38 -2.924 -6.951 5.019 1.00 12.42 N ATOM 594 CA ILE A 38 -3.041 -6.354 3.716 1.00 10.23 C ATOM 595 C ILE A 38 -4.222 -6.971 2.996 1.00 53.33 C ATOM 596 O ILE A 38 -4.310 -8.159 2.899 1.00 32.02 O ATOM 597 CB ILE A 38 -1.751 -6.564 2.874 1.00 32.40 C ATOM 598 CG1 ILE A 38 -0.539 -5.944 3.583 1.00 51.03 C ATOM 599 CG2 ILE A 38 -1.920 -5.969 1.484 1.00 30.33 C ATOM 600 CD1 ILE A 38 0.764 -6.078 2.824 1.00 52.42 C ATOM 0 H ILE A 38 -2.871 -7.970 5.008 1.00 12.42 H new ATOM 0 HA ILE A 38 -3.188 -5.281 3.840 1.00 10.23 H new ATOM 0 HB ILE A 38 -1.577 -7.635 2.771 1.00 32.40 H new ATOM 0 HG12 ILE A 38 -0.737 -4.886 3.757 1.00 51.03 H new ATOM 0 HG13 ILE A 38 -0.426 -6.413 4.561 1.00 51.03 H new ATOM 0 HG21 ILE A 38 -1.008 -6.125 0.908 1.00 30.33 H new ATOM 0 HG22 ILE A 38 -2.755 -6.455 0.979 1.00 30.33 H new ATOM 0 HG23 ILE A 38 -2.118 -4.900 1.567 1.00 30.33 H new ATOM 0 HD11 ILE A 38 1.567 -5.613 3.396 1.00 52.42 H new ATOM 0 HD12 ILE A 38 0.990 -7.134 2.672 1.00 52.42 H new ATOM 0 HD13 ILE A 38 0.674 -5.584 1.857 1.00 52.42 H new ATOM 612 N VAL A 39 -5.112 -6.168 2.486 1.00 54.03 N ATOM 613 CA VAL A 39 -6.279 -6.702 1.808 1.00 41.34 C ATOM 614 C VAL A 39 -6.173 -6.437 0.314 1.00 15.11 C ATOM 615 O VAL A 39 -6.004 -5.299 -0.116 1.00 24.13 O ATOM 616 CB VAL A 39 -7.605 -6.095 2.361 1.00 74.20 C ATOM 617 CG1 VAL A 39 -8.816 -6.717 1.685 1.00 1.43 C ATOM 618 CG2 VAL A 39 -7.696 -6.259 3.871 1.00 0.31 C ATOM 0 H VAL A 39 -5.062 -5.150 2.521 1.00 54.03 H new ATOM 0 HA VAL A 39 -6.306 -7.776 1.993 1.00 41.34 H new ATOM 0 HB VAL A 39 -7.598 -5.029 2.134 1.00 74.20 H new ATOM 0 HG11 VAL A 39 -9.726 -6.275 2.090 1.00 1.43 H new ATOM 0 HG12 VAL A 39 -8.769 -6.531 0.612 1.00 1.43 H new ATOM 0 HG13 VAL A 39 -8.822 -7.792 1.867 1.00 1.43 H new ATOM 0 HG21 VAL A 39 -8.631 -5.827 4.228 1.00 0.31 H new ATOM 0 HG22 VAL A 39 -7.666 -7.319 4.124 1.00 0.31 H new ATOM 0 HG23 VAL A 39 -6.856 -5.749 4.344 1.00 0.31 H new ATOM 628 N ALA A 40 -6.304 -7.464 -0.470 1.00 1.12 N ATOM 629 CA ALA A 40 -6.167 -7.341 -1.888 1.00 22.31 C ATOM 630 C ALA A 40 -7.497 -7.512 -2.550 1.00 74.42 C ATOM 631 O ALA A 40 -8.324 -8.341 -2.138 1.00 44.42 O ATOM 632 CB ALA A 40 -5.190 -8.365 -2.425 1.00 70.11 C ATOM 0 H ALA A 40 -6.508 -8.409 -0.145 1.00 1.12 H new ATOM 0 HA ALA A 40 -5.781 -6.346 -2.109 1.00 22.31 H new ATOM 0 HB1 ALA A 40 -5.102 -8.252 -3.506 1.00 70.11 H new ATOM 0 HB2 ALA A 40 -4.214 -8.214 -1.964 1.00 70.11 H new ATOM 0 HB3 ALA A 40 -5.549 -9.368 -2.193 1.00 70.11 H new ATOM 638 N ARG A 41 -7.721 -6.730 -3.549 1.00 4.31 N ATOM 639 CA ARG A 41 -8.932 -6.818 -4.273 1.00 0.54 C ATOM 640 C ARG A 41 -8.591 -7.503 -5.581 1.00 15.55 C ATOM 641 O ARG A 41 -7.730 -7.037 -6.342 1.00 11.42 O ATOM 642 CB ARG A 41 -9.525 -5.422 -4.480 1.00 44.42 C ATOM 643 CG ARG A 41 -11.034 -5.358 -4.765 1.00 71.23 C ATOM 644 CD ARG A 41 -11.450 -6.075 -6.026 1.00 72.31 C ATOM 645 NE ARG A 41 -12.874 -5.914 -6.288 1.00 31.41 N ATOM 646 CZ ARG A 41 -13.530 -6.399 -7.343 1.00 12.13 C ATOM 647 NH1 ARG A 41 -12.898 -7.148 -8.245 1.00 40.03 N ATOM 648 NH2 ARG A 41 -14.822 -6.145 -7.485 1.00 24.43 N ATOM 0 H ARG A 41 -7.072 -6.017 -3.882 1.00 4.31 H new ATOM 0 HA ARG A 41 -9.692 -7.390 -3.741 1.00 0.54 H new ATOM 0 HB2 ARG A 41 -9.320 -4.828 -3.590 1.00 44.42 H new ATOM 0 HB3 ARG A 41 -9.000 -4.947 -5.309 1.00 44.42 H new ATOM 0 HG2 ARG A 41 -11.572 -5.788 -3.920 1.00 71.23 H new ATOM 0 HG3 ARG A 41 -11.336 -4.313 -4.837 1.00 71.23 H new ATOM 0 HD2 ARG A 41 -10.878 -5.690 -6.870 1.00 72.31 H new ATOM 0 HD3 ARG A 41 -11.213 -7.135 -5.938 1.00 72.31 H new ATOM 0 HE ARG A 41 -13.416 -5.384 -5.605 1.00 31.41 H new ATOM 0 HH11 ARG A 41 -11.906 -7.354 -8.131 1.00 40.03 H new ATOM 0 HH12 ARG A 41 -13.406 -7.515 -9.049 1.00 40.03 H new ATOM 0 HH21 ARG A 41 -15.310 -5.581 -6.789 1.00 24.43 H new ATOM 0 HH22 ARG A 41 -15.329 -6.513 -8.290 1.00 24.43 H new ATOM 662 N LEU A 42 -9.259 -8.578 -5.805 1.00 62.30 N ATOM 663 CA LEU A 42 -9.025 -9.499 -6.881 1.00 3.03 C ATOM 664 C LEU A 42 -9.582 -9.015 -8.211 1.00 50.40 C ATOM 665 O LEU A 42 -10.351 -8.043 -8.269 1.00 64.21 O ATOM 666 CB LEU A 42 -9.658 -10.821 -6.479 1.00 5.30 C ATOM 667 CG LEU A 42 -9.096 -11.433 -5.207 1.00 74.20 C ATOM 668 CD1 LEU A 42 -9.881 -12.643 -4.850 1.00 43.33 C ATOM 669 CD2 LEU A 42 -7.626 -11.789 -5.382 1.00 64.00 C ATOM 0 H LEU A 42 -10.035 -8.864 -5.208 1.00 62.30 H new ATOM 0 HA LEU A 42 -7.951 -9.601 -7.039 1.00 3.03 H new ATOM 0 HB2 LEU A 42 -10.730 -10.671 -6.351 1.00 5.30 H new ATOM 0 HB3 LEU A 42 -9.531 -11.532 -7.295 1.00 5.30 H new ATOM 0 HG LEU A 42 -9.172 -10.703 -4.401 1.00 74.20 H new ATOM 0 HD11 LEU A 42 -9.478 -13.082 -3.937 1.00 43.33 H new ATOM 0 HD12 LEU A 42 -10.923 -12.366 -4.690 1.00 43.33 H new ATOM 0 HD13 LEU A 42 -9.819 -13.369 -5.660 1.00 43.33 H new ATOM 0 HD21 LEU A 42 -7.245 -12.226 -4.459 1.00 64.00 H new ATOM 0 HD22 LEU A 42 -7.520 -12.508 -6.194 1.00 64.00 H new ATOM 0 HD23 LEU A 42 -7.059 -10.888 -5.618 1.00 64.00 H new ATOM 681 N LYS A 43 -9.178 -9.683 -9.267 1.00 1.24 N ATOM 682 CA LYS A 43 -9.616 -9.369 -10.602 1.00 35.14 C ATOM 683 C LYS A 43 -10.821 -10.220 -11.012 1.00 74.30 C ATOM 684 O LYS A 43 -11.969 -9.814 -10.814 1.00 1.30 O ATOM 685 CB LYS A 43 -8.457 -9.536 -11.590 1.00 21.40 C ATOM 686 CG LYS A 43 -7.311 -8.554 -11.368 1.00 41.50 C ATOM 687 CD LYS A 43 -6.059 -8.946 -12.145 1.00 55.01 C ATOM 688 CE LYS A 43 -6.286 -9.042 -13.643 1.00 62.44 C ATOM 689 NZ LYS A 43 -6.621 -7.747 -14.250 1.00 63.14 N ATOM 0 H LYS A 43 -8.529 -10.468 -9.220 1.00 1.24 H new ATOM 0 HA LYS A 43 -9.939 -8.328 -10.619 1.00 35.14 H new ATOM 0 HB2 LYS A 43 -8.071 -10.553 -11.514 1.00 21.40 H new ATOM 0 HB3 LYS A 43 -8.836 -9.414 -12.604 1.00 21.40 H new ATOM 0 HG2 LYS A 43 -7.627 -7.555 -11.670 1.00 41.50 H new ATOM 0 HG3 LYS A 43 -7.077 -8.506 -10.305 1.00 41.50 H new ATOM 0 HD2 LYS A 43 -5.275 -8.214 -11.950 1.00 55.01 H new ATOM 0 HD3 LYS A 43 -5.698 -9.906 -11.777 1.00 55.01 H new ATOM 0 HE2 LYS A 43 -5.389 -9.440 -14.117 1.00 62.44 H new ATOM 0 HE3 LYS A 43 -7.091 -9.750 -13.840 1.00 62.44 H new ATOM 0 HZ1 LYS A 43 -6.732 -7.864 -15.277 1.00 63.14 H new ATOM 0 HZ2 LYS A 43 -7.510 -7.393 -13.843 1.00 63.14 H new ATOM 0 HZ3 LYS A 43 -5.858 -7.067 -14.059 1.00 63.14 H new ATOM 703 N ASN A 44 -10.563 -11.410 -11.538 1.00 40.51 N ATOM 704 CA ASN A 44 -11.638 -12.286 -12.013 1.00 30.44 C ATOM 705 C ASN A 44 -11.408 -13.695 -11.518 1.00 5.10 C ATOM 706 O ASN A 44 -10.612 -14.429 -12.104 1.00 14.43 O ATOM 707 CB ASN A 44 -11.731 -12.320 -13.567 1.00 0.53 C ATOM 708 CG ASN A 44 -12.085 -10.997 -14.257 1.00 5.22 C ATOM 709 OD1 ASN A 44 -11.760 -9.905 -13.791 1.00 62.12 O ATOM 710 ND2 ASN A 44 -12.745 -11.092 -15.381 1.00 32.31 N ATOM 0 H ASN A 44 -9.625 -11.794 -11.648 1.00 40.51 H new ATOM 0 HA ASN A 44 -12.572 -11.883 -11.621 1.00 30.44 H new ATOM 0 HB2 ASN A 44 -10.774 -12.665 -13.959 1.00 0.53 H new ATOM 0 HB3 ASN A 44 -12.477 -13.063 -13.849 1.00 0.53 H new ATOM 0 HD21 ASN A 44 -13.003 -10.249 -15.894 1.00 32.31 H new ATOM 0 HD22 ASN A 44 -13.002 -12.009 -15.745 1.00 32.31 H new ATOM 717 N ASN A 45 -12.098 -14.067 -10.452 1.00 71.34 N ATOM 718 CA ASN A 45 -11.954 -15.393 -9.788 1.00 61.23 C ATOM 719 C ASN A 45 -12.728 -15.354 -8.494 1.00 60.54 C ATOM 720 O ASN A 45 -13.403 -16.300 -8.113 1.00 14.44 O ATOM 721 CB ASN A 45 -10.471 -15.672 -9.438 1.00 43.44 C ATOM 722 CG ASN A 45 -10.223 -17.006 -8.723 1.00 74.13 C ATOM 723 OD1 ASN A 45 -10.966 -18.036 -9.064 1.00 13.04 O flip ATOM 724 ND2 ASN A 45 -9.327 -17.103 -7.882 1.00 75.31 N flip ATOM 0 H ASN A 45 -12.787 -13.464 -10.003 1.00 71.34 H new ATOM 0 HA ASN A 45 -12.320 -16.168 -10.461 1.00 61.23 H new ATOM 0 HB2 ASN A 45 -9.885 -15.653 -10.357 1.00 43.44 H new ATOM 0 HB3 ASN A 45 -10.102 -14.863 -8.808 1.00 43.44 H new ATOM 0 HD21 ASN A 45 -8.767 -16.287 -7.637 1.00 75.31 H new ATOM 0 HD22 ASN A 45 -9.146 -18.000 -7.431 1.00 75.31 H new ATOM 731 N ASN A 46 -12.620 -14.234 -7.851 1.00 31.51 N ATOM 732 CA ASN A 46 -13.210 -13.952 -6.566 1.00 4.02 C ATOM 733 C ASN A 46 -13.130 -12.416 -6.478 1.00 33.12 C ATOM 734 O ASN A 46 -12.947 -11.782 -7.528 1.00 13.50 O ATOM 735 CB ASN A 46 -12.380 -14.724 -5.463 1.00 72.41 C ATOM 736 CG ASN A 46 -12.906 -14.667 -4.010 1.00 10.24 C ATOM 737 OD1 ASN A 46 -13.506 -13.703 -3.575 1.00 21.04 O ATOM 738 ND2 ASN A 46 -12.663 -15.714 -3.262 1.00 41.01 N ATOM 0 H ASN A 46 -12.091 -13.445 -8.222 1.00 31.51 H new ATOM 0 HA ASN A 46 -14.240 -14.279 -6.423 1.00 4.02 H new ATOM 0 HB2 ASN A 46 -12.319 -15.771 -5.759 1.00 72.41 H new ATOM 0 HB3 ASN A 46 -11.363 -14.331 -5.469 1.00 72.41 H new ATOM 0 HD21 ASN A 46 -12.979 -15.732 -2.292 1.00 41.01 H new ATOM 0 HD22 ASN A 46 -12.158 -16.511 -3.649 1.00 41.01 H new ATOM 745 N ARG A 47 -13.223 -11.810 -5.332 1.00 33.10 N ATOM 746 CA ARG A 47 -13.281 -10.367 -5.304 1.00 43.33 C ATOM 747 C ARG A 47 -12.368 -9.728 -4.287 1.00 62.40 C ATOM 748 O ARG A 47 -11.600 -8.855 -4.620 1.00 22.31 O ATOM 749 CB ARG A 47 -14.713 -9.812 -5.229 1.00 74.32 C ATOM 750 CG ARG A 47 -15.432 -9.972 -3.902 1.00 63.42 C ATOM 751 CD ARG A 47 -15.602 -11.416 -3.509 1.00 44.02 C ATOM 752 NE ARG A 47 -16.547 -12.147 -4.345 1.00 61.51 N ATOM 753 CZ ARG A 47 -16.922 -13.422 -4.133 1.00 22.23 C ATOM 754 NH1 ARG A 47 -16.435 -14.104 -3.098 1.00 71.31 N ATOM 755 NH2 ARG A 47 -17.790 -14.004 -4.950 1.00 62.14 N ATOM 0 H ARG A 47 -13.260 -12.271 -4.423 1.00 33.10 H new ATOM 0 HA ARG A 47 -12.886 -10.071 -6.276 1.00 43.33 H new ATOM 0 HB2 ARG A 47 -14.681 -8.750 -5.474 1.00 74.32 H new ATOM 0 HB3 ARG A 47 -15.309 -10.299 -6.001 1.00 74.32 H new ATOM 0 HG2 ARG A 47 -14.874 -9.450 -3.125 1.00 63.42 H new ATOM 0 HG3 ARG A 47 -16.411 -9.498 -3.964 1.00 63.42 H new ATOM 0 HD2 ARG A 47 -14.632 -11.912 -3.555 1.00 44.02 H new ATOM 0 HD3 ARG A 47 -15.936 -11.464 -2.473 1.00 44.02 H new ATOM 0 HE ARG A 47 -16.951 -11.659 -5.144 1.00 61.51 H new ATOM 0 HH11 ARG A 47 -15.774 -13.660 -2.461 1.00 71.31 H new ATOM 0 HH12 ARG A 47 -16.723 -15.070 -2.943 1.00 71.31 H new ATOM 0 HH21 ARG A 47 -18.174 -13.485 -5.740 1.00 62.14 H new ATOM 0 HH22 ARG A 47 -18.074 -14.970 -4.788 1.00 62.14 H new ATOM 769 N GLN A 48 -12.459 -10.128 -3.068 1.00 31.42 N ATOM 770 CA GLN A 48 -11.630 -9.562 -2.047 1.00 33.54 C ATOM 771 C GLN A 48 -11.115 -10.628 -1.115 1.00 12.54 C ATOM 772 O GLN A 48 -11.888 -11.434 -0.596 1.00 51.21 O ATOM 773 CB GLN A 48 -12.406 -8.477 -1.294 1.00 31.41 C ATOM 774 CG GLN A 48 -11.698 -7.914 -0.079 1.00 22.10 C ATOM 775 CD GLN A 48 -12.503 -6.838 0.600 1.00 34.32 C ATOM 776 OE1 GLN A 48 -12.359 -5.648 0.298 1.00 15.03 O ATOM 777 NE2 GLN A 48 -13.371 -7.235 1.491 1.00 75.24 N ATOM 0 H GLN A 48 -13.103 -10.851 -2.745 1.00 31.42 H new ATOM 0 HA GLN A 48 -10.759 -9.100 -2.512 1.00 33.54 H new ATOM 0 HB2 GLN A 48 -12.620 -7.660 -1.983 1.00 31.41 H new ATOM 0 HB3 GLN A 48 -13.365 -8.889 -0.979 1.00 31.41 H new ATOM 0 HG2 GLN A 48 -11.500 -8.719 0.629 1.00 22.10 H new ATOM 0 HG3 GLN A 48 -10.732 -7.508 -0.379 1.00 22.10 H new ATOM 0 HE21 GLN A 48 -13.458 -8.227 1.711 1.00 75.24 H new ATOM 0 HE22 GLN A 48 -13.962 -6.553 1.967 1.00 75.24 H new ATOM 786 N VAL A 49 -9.833 -10.609 -0.890 1.00 72.21 N ATOM 787 CA VAL A 49 -9.164 -11.526 0.004 1.00 32.01 C ATOM 788 C VAL A 49 -8.038 -10.791 0.686 1.00 60.23 C ATOM 789 O VAL A 49 -7.577 -9.776 0.190 1.00 34.53 O ATOM 790 CB VAL A 49 -8.645 -12.866 -0.669 1.00 25.23 C ATOM 791 CG1 VAL A 49 -9.789 -13.717 -1.196 1.00 23.35 C ATOM 792 CG2 VAL A 49 -7.610 -12.627 -1.771 1.00 24.54 C ATOM 0 H VAL A 49 -9.202 -9.940 -1.332 1.00 72.21 H new ATOM 0 HA VAL A 49 -9.909 -11.865 0.724 1.00 32.01 H new ATOM 0 HB VAL A 49 -8.144 -13.414 0.129 1.00 25.23 H new ATOM 0 HG11 VAL A 49 -9.389 -14.624 -1.648 1.00 23.35 H new ATOM 0 HG12 VAL A 49 -10.453 -13.984 -0.374 1.00 23.35 H new ATOM 0 HG13 VAL A 49 -10.347 -13.154 -1.944 1.00 23.35 H new ATOM 0 HG21 VAL A 49 -7.297 -13.583 -2.189 1.00 24.54 H new ATOM 0 HG22 VAL A 49 -8.051 -12.014 -2.557 1.00 24.54 H new ATOM 0 HG23 VAL A 49 -6.745 -12.113 -1.352 1.00 24.54 H new ATOM 802 N CYS A 50 -7.610 -11.265 1.797 1.00 33.41 N ATOM 803 CA CYS A 50 -6.559 -10.595 2.524 1.00 75.44 C ATOM 804 C CYS A 50 -5.304 -11.334 2.251 1.00 54.23 C ATOM 805 O CYS A 50 -5.352 -12.463 1.944 1.00 3.02 O ATOM 806 CB CYS A 50 -6.871 -10.586 4.006 1.00 34.12 C ATOM 807 SG CYS A 50 -5.606 -9.794 5.072 1.00 61.35 S ATOM 0 H CYS A 50 -7.962 -12.115 2.236 1.00 33.41 H new ATOM 0 HA CYS A 50 -6.464 -9.556 2.209 1.00 75.44 H new ATOM 0 HB2 CYS A 50 -7.821 -10.073 4.157 1.00 34.12 H new ATOM 0 HB3 CYS A 50 -7.008 -11.615 4.337 1.00 34.12 H new ATOM 812 N ILE A 51 -4.202 -10.695 2.309 1.00 61.11 N ATOM 813 CA ILE A 51 -2.979 -11.305 1.897 1.00 11.34 C ATOM 814 C ILE A 51 -1.998 -11.364 3.031 1.00 23.32 C ATOM 815 O ILE A 51 -1.953 -10.463 3.878 1.00 31.15 O ATOM 816 CB ILE A 51 -2.336 -10.495 0.729 1.00 0.42 C ATOM 817 CG1 ILE A 51 -3.307 -10.282 -0.413 1.00 24.24 C ATOM 818 CG2 ILE A 51 -1.117 -11.181 0.205 1.00 22.04 C ATOM 819 CD1 ILE A 51 -3.840 -11.559 -1.045 1.00 74.53 C ATOM 0 H ILE A 51 -4.110 -9.735 2.641 1.00 61.11 H new ATOM 0 HA ILE A 51 -3.212 -12.317 1.567 1.00 11.34 H new ATOM 0 HB ILE A 51 -2.061 -9.524 1.142 1.00 0.42 H new ATOM 0 HG12 ILE A 51 -4.150 -9.694 -0.050 1.00 24.24 H new ATOM 0 HG13 ILE A 51 -2.814 -9.690 -1.184 1.00 24.24 H new ATOM 0 HG21 ILE A 51 -0.690 -10.594 -0.608 1.00 22.04 H new ATOM 0 HG22 ILE A 51 -0.383 -11.280 1.005 1.00 22.04 H new ATOM 0 HG23 ILE A 51 -1.387 -12.170 -0.165 1.00 22.04 H new ATOM 0 HD11 ILE A 51 -4.527 -11.306 -1.853 1.00 74.53 H new ATOM 0 HD12 ILE A 51 -3.010 -12.142 -1.444 1.00 74.53 H new ATOM 0 HD13 ILE A 51 -4.366 -12.146 -0.292 1.00 74.53 H new ATOM 831 N ASP A 52 -1.242 -12.440 3.058 1.00 24.21 N ATOM 832 CA ASP A 52 -0.132 -12.573 3.954 1.00 12.54 C ATOM 833 C ASP A 52 0.940 -11.596 3.502 1.00 54.20 C ATOM 834 O ASP A 52 1.435 -11.682 2.376 1.00 74.23 O ATOM 835 CB ASP A 52 0.417 -14.008 3.928 1.00 24.43 C ATOM 836 CG ASP A 52 1.614 -14.191 4.825 1.00 32.40 C ATOM 837 OD1 ASP A 52 1.478 -13.994 6.049 1.00 5.12 O ATOM 838 OD2 ASP A 52 2.685 -14.557 4.329 1.00 34.34 O ATOM 0 H ASP A 52 -1.387 -13.248 2.452 1.00 24.21 H new ATOM 0 HA ASP A 52 -0.445 -12.358 4.976 1.00 12.54 H new ATOM 0 HB2 ASP A 52 -0.369 -14.699 4.233 1.00 24.43 H new ATOM 0 HB3 ASP A 52 0.691 -14.269 2.906 1.00 24.43 H new ATOM 843 N PRO A 53 1.311 -10.647 4.344 1.00 14.21 N ATOM 844 CA PRO A 53 2.284 -9.617 3.983 1.00 3.34 C ATOM 845 C PRO A 53 3.708 -10.147 3.992 1.00 24.13 C ATOM 846 O PRO A 53 4.659 -9.405 3.784 1.00 64.14 O ATOM 847 CB PRO A 53 2.103 -8.574 5.082 1.00 71.43 C ATOM 848 CG PRO A 53 1.647 -9.353 6.261 1.00 41.30 C ATOM 849 CD PRO A 53 0.821 -10.488 5.724 1.00 51.02 C ATOM 0 HA PRO A 53 2.125 -9.234 2.975 1.00 3.34 H new ATOM 0 HB2 PRO A 53 3.036 -8.050 5.289 1.00 71.43 H new ATOM 0 HB3 PRO A 53 1.370 -7.820 4.797 1.00 71.43 H new ATOM 0 HG2 PRO A 53 2.497 -9.727 6.832 1.00 41.30 H new ATOM 0 HG3 PRO A 53 1.059 -8.730 6.935 1.00 41.30 H new ATOM 0 HD2 PRO A 53 0.962 -11.398 6.307 1.00 51.02 H new ATOM 0 HD3 PRO A 53 -0.244 -10.256 5.748 1.00 51.02 H new ATOM 857 N LYS A 54 3.826 -11.427 4.222 1.00 11.05 N ATOM 858 CA LYS A 54 5.073 -12.100 4.355 1.00 53.35 C ATOM 859 C LYS A 54 5.274 -13.069 3.150 1.00 51.12 C ATOM 860 O LYS A 54 6.154 -13.935 3.152 1.00 54.01 O ATOM 861 CB LYS A 54 5.012 -12.838 5.699 1.00 32.54 C ATOM 862 CG LYS A 54 4.661 -11.893 6.861 1.00 10.24 C ATOM 863 CD LYS A 54 4.390 -12.620 8.170 1.00 12.02 C ATOM 864 CE LYS A 54 5.606 -13.330 8.692 1.00 1.21 C ATOM 865 NZ LYS A 54 5.347 -14.004 9.991 1.00 50.41 N ATOM 0 H LYS A 54 3.021 -12.045 4.324 1.00 11.05 H new ATOM 0 HA LYS A 54 5.924 -11.419 4.345 1.00 53.35 H new ATOM 0 HB2 LYS A 54 4.269 -13.634 5.642 1.00 32.54 H new ATOM 0 HB3 LYS A 54 5.973 -13.313 5.896 1.00 32.54 H new ATOM 0 HG2 LYS A 54 5.480 -11.189 7.008 1.00 10.24 H new ATOM 0 HG3 LYS A 54 3.782 -11.307 6.591 1.00 10.24 H new ATOM 0 HD2 LYS A 54 4.043 -11.904 8.915 1.00 12.02 H new ATOM 0 HD3 LYS A 54 3.587 -13.342 8.022 1.00 12.02 H new ATOM 0 HE2 LYS A 54 5.936 -14.068 7.961 1.00 1.21 H new ATOM 0 HE3 LYS A 54 6.419 -12.614 8.812 1.00 1.21 H new ATOM 0 HZ1 LYS A 54 6.230 -14.423 10.347 1.00 50.41 H new ATOM 0 HZ2 LYS A 54 4.992 -13.309 10.678 1.00 50.41 H new ATOM 0 HZ3 LYS A 54 4.637 -14.752 9.858 1.00 50.41 H new ATOM 879 N LEU A 55 4.457 -12.860 2.104 1.00 22.02 N ATOM 880 CA LEU A 55 4.474 -13.661 0.851 1.00 32.14 C ATOM 881 C LEU A 55 5.708 -13.529 -0.023 1.00 61.34 C ATOM 882 O LEU A 55 5.850 -14.280 -0.994 1.00 35.11 O ATOM 883 CB LEU A 55 3.247 -13.375 0.000 1.00 44.11 C ATOM 884 CG LEU A 55 1.989 -14.059 0.434 1.00 74.32 C ATOM 885 CD1 LEU A 55 0.839 -13.678 -0.442 1.00 23.13 C ATOM 886 CD2 LEU A 55 2.202 -15.501 0.325 1.00 33.31 C ATOM 0 H LEU A 55 3.753 -12.122 2.097 1.00 22.02 H new ATOM 0 HA LEU A 55 4.481 -14.687 1.220 1.00 32.14 H new ATOM 0 HB2 LEU A 55 3.072 -12.299 -0.004 1.00 44.11 H new ATOM 0 HB3 LEU A 55 3.463 -13.667 -1.028 1.00 44.11 H new ATOM 0 HG LEU A 55 1.755 -13.764 1.457 1.00 74.32 H new ATOM 0 HD11 LEU A 55 -0.062 -14.190 -0.103 1.00 23.13 H new ATOM 0 HD12 LEU A 55 0.685 -12.600 -0.391 1.00 23.13 H new ATOM 0 HD13 LEU A 55 1.055 -13.966 -1.471 1.00 23.13 H new ATOM 0 HD21 LEU A 55 1.299 -16.027 0.636 1.00 33.31 H new ATOM 0 HD22 LEU A 55 2.434 -15.757 -0.709 1.00 33.31 H new ATOM 0 HD23 LEU A 55 3.032 -15.796 0.967 1.00 33.31 H new ATOM 898 N LYS A 56 6.558 -12.609 0.292 1.00 22.24 N ATOM 899 CA LYS A 56 7.758 -12.289 -0.474 1.00 22.13 C ATOM 900 C LYS A 56 7.452 -11.461 -1.731 1.00 74.33 C ATOM 901 O LYS A 56 8.167 -10.522 -2.008 1.00 34.40 O ATOM 902 CB LYS A 56 8.657 -13.476 -0.785 1.00 73.44 C ATOM 903 CG LYS A 56 10.020 -13.032 -1.275 1.00 22.51 C ATOM 904 CD LYS A 56 10.873 -14.196 -1.620 1.00 55.14 C ATOM 905 CE LYS A 56 12.286 -13.775 -2.015 1.00 65.12 C ATOM 906 NZ LYS A 56 12.317 -12.810 -3.146 1.00 35.22 N ATOM 0 H LYS A 56 6.448 -12.025 1.121 1.00 22.24 H new ATOM 0 HA LYS A 56 8.342 -11.664 0.201 1.00 22.13 H new ATOM 0 HB2 LYS A 56 8.773 -14.089 0.109 1.00 73.44 H new ATOM 0 HB3 LYS A 56 8.184 -14.102 -1.542 1.00 73.44 H new ATOM 0 HG2 LYS A 56 9.904 -12.391 -2.149 1.00 22.51 H new ATOM 0 HG3 LYS A 56 10.509 -12.435 -0.505 1.00 22.51 H new ATOM 0 HD2 LYS A 56 10.922 -14.874 -0.768 1.00 55.14 H new ATOM 0 HD3 LYS A 56 10.417 -14.749 -2.441 1.00 55.14 H new ATOM 0 HE2 LYS A 56 12.779 -13.328 -1.152 1.00 65.12 H new ATOM 0 HE3 LYS A 56 12.859 -14.661 -2.287 1.00 65.12 H new ATOM 0 HZ1 LYS A 56 13.298 -12.681 -3.465 1.00 35.22 H new ATOM 0 HZ2 LYS A 56 11.743 -13.177 -3.931 1.00 35.22 H new ATOM 0 HZ3 LYS A 56 11.932 -11.896 -2.833 1.00 35.22 H new ATOM 920 N TRP A 57 6.375 -11.782 -2.498 1.00 24.31 N ATOM 921 CA TRP A 57 6.009 -10.869 -3.609 1.00 44.43 C ATOM 922 C TRP A 57 5.546 -9.559 -3.034 1.00 22.55 C ATOM 923 O TRP A 57 5.705 -8.504 -3.635 1.00 22.13 O ATOM 924 CB TRP A 57 4.984 -11.421 -4.658 1.00 34.43 C ATOM 925 CG TRP A 57 3.626 -11.859 -4.173 1.00 1.33 C ATOM 926 CD1 TRP A 57 3.266 -13.086 -3.682 1.00 71.43 C ATOM 927 CD2 TRP A 57 2.422 -11.072 -4.197 1.00 33.41 C ATOM 928 NE1 TRP A 57 1.926 -13.104 -3.419 1.00 33.43 N ATOM 929 CE2 TRP A 57 1.383 -11.881 -3.716 1.00 5.33 C ATOM 930 CE3 TRP A 57 2.128 -9.757 -4.583 1.00 54.10 C ATOM 931 CZ2 TRP A 57 0.062 -11.424 -3.611 1.00 54.53 C ATOM 932 CZ3 TRP A 57 0.827 -9.308 -4.478 1.00 74.44 C ATOM 933 CH2 TRP A 57 -0.189 -10.140 -3.997 1.00 72.51 C ATOM 0 H TRP A 57 5.784 -12.605 -2.381 1.00 24.31 H new ATOM 0 HA TRP A 57 6.919 -10.746 -4.196 1.00 44.43 H new ATOM 0 HB2 TRP A 57 4.834 -10.649 -5.413 1.00 34.43 H new ATOM 0 HB3 TRP A 57 5.447 -12.271 -5.159 1.00 34.43 H new ATOM 0 HD1 TRP A 57 3.941 -13.915 -3.526 1.00 71.43 H new ATOM 0 HE1 TRP A 57 1.408 -13.905 -3.057 1.00 33.43 H new ATOM 0 HE3 TRP A 57 2.905 -9.107 -4.956 1.00 54.10 H new ATOM 0 HZ2 TRP A 57 -0.725 -12.063 -3.239 1.00 54.53 H new ATOM 0 HZ3 TRP A 57 0.589 -8.296 -4.772 1.00 74.44 H new ATOM 0 HH2 TRP A 57 -1.196 -9.757 -3.930 1.00 72.51 H new ATOM 944 N ILE A 58 4.987 -9.643 -1.839 1.00 64.35 N ATOM 945 CA ILE A 58 4.621 -8.479 -1.091 1.00 11.03 C ATOM 946 C ILE A 58 5.902 -7.732 -0.675 1.00 25.23 C ATOM 947 O ILE A 58 5.969 -6.520 -0.762 1.00 32.21 O ATOM 948 CB ILE A 58 3.745 -8.842 0.159 1.00 74.10 C ATOM 949 CG1 ILE A 58 2.383 -9.477 -0.274 1.00 53.14 C ATOM 950 CG2 ILE A 58 3.514 -7.612 1.030 1.00 23.12 C ATOM 951 CD1 ILE A 58 1.560 -8.573 -1.164 1.00 44.41 C ATOM 0 H ILE A 58 4.779 -10.525 -1.371 1.00 64.35 H new ATOM 0 HA ILE A 58 4.009 -7.832 -1.720 1.00 11.03 H new ATOM 0 HB ILE A 58 4.288 -9.582 0.747 1.00 74.10 H new ATOM 0 HG12 ILE A 58 2.576 -10.413 -0.798 1.00 53.14 H new ATOM 0 HG13 ILE A 58 1.805 -9.723 0.617 1.00 53.14 H new ATOM 0 HG21 ILE A 58 2.904 -7.885 1.891 1.00 23.12 H new ATOM 0 HG22 ILE A 58 4.473 -7.224 1.373 1.00 23.12 H new ATOM 0 HG23 ILE A 58 2.999 -6.847 0.449 1.00 23.12 H new ATOM 0 HD11 ILE A 58 0.628 -9.073 -1.428 1.00 44.41 H new ATOM 0 HD12 ILE A 58 1.337 -7.646 -0.635 1.00 44.41 H new ATOM 0 HD13 ILE A 58 2.121 -8.347 -2.071 1.00 44.41 H new ATOM 963 N GLN A 59 6.927 -8.495 -0.279 1.00 22.14 N ATOM 964 CA GLN A 59 8.247 -7.939 0.106 1.00 11.42 C ATOM 965 C GLN A 59 8.871 -7.189 -1.019 1.00 4.42 C ATOM 966 O GLN A 59 9.239 -6.046 -0.854 1.00 42.43 O ATOM 967 CB GLN A 59 9.209 -9.054 0.530 1.00 30.42 C ATOM 968 CG GLN A 59 9.045 -9.581 1.940 1.00 50.44 C ATOM 969 CD GLN A 59 7.620 -9.674 2.396 1.00 73.40 C ATOM 970 OE1 GLN A 59 6.948 -10.668 2.178 1.00 53.04 O ATOM 971 NE2 GLN A 59 7.176 -8.650 3.065 1.00 13.32 N ATOM 0 H GLN A 59 6.875 -9.512 -0.214 1.00 22.14 H new ATOM 0 HA GLN A 59 8.070 -7.262 0.941 1.00 11.42 H new ATOM 0 HB2 GLN A 59 9.093 -9.888 -0.163 1.00 30.42 H new ATOM 0 HB3 GLN A 59 10.229 -8.687 0.419 1.00 30.42 H new ATOM 0 HG2 GLN A 59 9.501 -10.569 2.002 1.00 50.44 H new ATOM 0 HG3 GLN A 59 9.593 -8.934 2.625 1.00 50.44 H new ATOM 0 HE21 GLN A 59 7.779 -7.842 3.220 1.00 13.32 H new ATOM 0 HE22 GLN A 59 6.225 -8.655 3.434 1.00 13.32 H new ATOM 980 N GLU A 60 8.951 -7.833 -2.178 1.00 1.31 N ATOM 981 CA GLU A 60 9.552 -7.220 -3.350 1.00 1.12 C ATOM 982 C GLU A 60 8.800 -5.946 -3.668 1.00 40.11 C ATOM 983 O GLU A 60 9.390 -4.915 -3.946 1.00 43.43 O ATOM 984 CB GLU A 60 9.462 -8.154 -4.571 1.00 33.24 C ATOM 985 CG GLU A 60 10.003 -9.575 -4.377 1.00 41.13 C ATOM 986 CD GLU A 60 11.440 -9.634 -3.934 1.00 13.14 C ATOM 987 OE1 GLU A 60 12.319 -9.096 -4.637 1.00 13.32 O ATOM 988 OE2 GLU A 60 11.718 -10.228 -2.872 1.00 63.11 O ATOM 0 H GLU A 60 8.606 -8.781 -2.328 1.00 1.31 H new ATOM 0 HA GLU A 60 10.602 -7.018 -3.137 1.00 1.12 H new ATOM 0 HB2 GLU A 60 8.417 -8.223 -4.873 1.00 33.24 H new ATOM 0 HB3 GLU A 60 10.002 -7.691 -5.397 1.00 33.24 H new ATOM 0 HG2 GLU A 60 9.386 -10.089 -3.640 1.00 41.13 H new ATOM 0 HG3 GLU A 60 9.901 -10.121 -5.315 1.00 41.13 H new ATOM 995 N TYR A 61 7.489 -6.029 -3.576 1.00 0.24 N ATOM 996 CA TYR A 61 6.632 -4.924 -3.884 1.00 74.32 C ATOM 997 C TYR A 61 6.888 -3.756 -2.920 1.00 11.22 C ATOM 998 O TYR A 61 7.091 -2.616 -3.355 1.00 11.51 O ATOM 999 CB TYR A 61 5.175 -5.372 -3.841 1.00 4.23 C ATOM 1000 CG TYR A 61 4.250 -4.379 -4.444 1.00 22.22 C ATOM 1001 CD1 TYR A 61 4.098 -4.332 -5.815 1.00 25.33 C ATOM 1002 CD2 TYR A 61 3.548 -3.480 -3.668 1.00 4.32 C ATOM 1003 CE1 TYR A 61 3.276 -3.425 -6.407 1.00 53.21 C ATOM 1004 CE2 TYR A 61 2.721 -2.552 -4.245 1.00 54.53 C ATOM 1005 CZ TYR A 61 2.586 -2.527 -5.624 1.00 42.53 C ATOM 1006 OH TYR A 61 1.777 -1.597 -6.212 1.00 32.22 O ATOM 0 H TYR A 61 6.995 -6.872 -3.284 1.00 0.24 H new ATOM 0 HA TYR A 61 6.852 -4.571 -4.892 1.00 74.32 H new ATOM 0 HB2 TYR A 61 5.076 -6.321 -4.368 1.00 4.23 H new ATOM 0 HB3 TYR A 61 4.885 -5.550 -2.806 1.00 4.23 H new ATOM 0 HD1 TYR A 61 4.644 -5.031 -6.431 1.00 25.33 H new ATOM 0 HD2 TYR A 61 3.651 -3.508 -2.593 1.00 4.32 H new ATOM 0 HE1 TYR A 61 3.165 -3.409 -7.481 1.00 53.21 H new ATOM 0 HE2 TYR A 61 2.180 -1.847 -3.631 1.00 54.53 H new ATOM 0 HH TYR A 61 1.296 -2.008 -6.960 1.00 32.22 H new ATOM 1016 N LEU A 62 6.893 -4.054 -1.620 1.00 13.33 N ATOM 1017 CA LEU A 62 7.169 -3.052 -0.583 1.00 54.24 C ATOM 1018 C LEU A 62 8.562 -2.452 -0.788 1.00 61.11 C ATOM 1019 O LEU A 62 8.732 -1.231 -0.788 1.00 30.12 O ATOM 1020 CB LEU A 62 7.085 -3.680 0.826 1.00 52.02 C ATOM 1021 CG LEU A 62 5.733 -4.289 1.242 1.00 42.14 C ATOM 1022 CD1 LEU A 62 5.839 -4.922 2.616 1.00 54.20 C ATOM 1023 CD2 LEU A 62 4.639 -3.244 1.243 1.00 1.01 C ATOM 0 H LEU A 62 6.708 -4.988 -1.256 1.00 13.33 H new ATOM 0 HA LEU A 62 6.417 -2.267 -0.664 1.00 54.24 H new ATOM 0 HB2 LEU A 62 7.843 -4.460 0.895 1.00 52.02 H new ATOM 0 HB3 LEU A 62 7.350 -2.914 1.555 1.00 52.02 H new ATOM 0 HG LEU A 62 5.475 -5.056 0.512 1.00 42.14 H new ATOM 0 HD11 LEU A 62 4.875 -5.348 2.896 1.00 54.20 H new ATOM 0 HD12 LEU A 62 6.592 -5.710 2.597 1.00 54.20 H new ATOM 0 HD13 LEU A 62 6.126 -4.164 3.345 1.00 54.20 H new ATOM 0 HD21 LEU A 62 3.697 -3.704 1.541 1.00 1.01 H new ATOM 0 HD22 LEU A 62 4.894 -2.451 1.946 1.00 1.01 H new ATOM 0 HD23 LEU A 62 4.537 -2.823 0.243 1.00 1.01 H new ATOM 1035 N GLU A 63 9.546 -3.330 -0.989 1.00 41.32 N ATOM 1036 CA GLU A 63 10.934 -2.932 -1.192 1.00 21.11 C ATOM 1037 C GLU A 63 11.120 -2.041 -2.415 1.00 75.11 C ATOM 1038 O GLU A 63 11.942 -1.125 -2.401 1.00 3.14 O ATOM 1039 CB GLU A 63 11.869 -4.151 -1.281 1.00 20.53 C ATOM 1040 CG GLU A 63 11.982 -4.962 -0.001 1.00 33.14 C ATOM 1041 CD GLU A 63 13.095 -5.978 -0.059 1.00 54.22 C ATOM 1042 OE1 GLU A 63 12.959 -7.017 -0.744 1.00 42.23 O ATOM 1043 OE2 GLU A 63 14.156 -5.723 0.562 1.00 23.23 O ATOM 0 H GLU A 63 9.399 -4.339 -1.015 1.00 41.32 H new ATOM 0 HA GLU A 63 11.205 -2.346 -0.314 1.00 21.11 H new ATOM 0 HB2 GLU A 63 11.516 -4.805 -2.079 1.00 20.53 H new ATOM 0 HB3 GLU A 63 12.864 -3.808 -1.566 1.00 20.53 H new ATOM 0 HG2 GLU A 63 12.153 -4.288 0.839 1.00 33.14 H new ATOM 0 HG3 GLU A 63 11.037 -5.473 0.187 1.00 33.14 H new ATOM 1050 N LYS A 64 10.377 -2.292 -3.472 1.00 4.24 N ATOM 1051 CA LYS A 64 10.537 -1.487 -4.666 1.00 71.24 C ATOM 1052 C LYS A 64 9.742 -0.196 -4.584 1.00 62.32 C ATOM 1053 O LYS A 64 10.247 0.856 -4.959 1.00 0.14 O ATOM 1054 CB LYS A 64 10.209 -2.259 -5.955 1.00 73.20 C ATOM 1055 CG LYS A 64 10.983 -3.562 -6.115 1.00 21.00 C ATOM 1056 CD LYS A 64 12.474 -3.372 -5.924 1.00 43.40 C ATOM 1057 CE LYS A 64 13.207 -4.689 -6.047 1.00 13.12 C ATOM 1058 NZ LYS A 64 14.644 -4.556 -5.710 1.00 74.13 N ATOM 0 H LYS A 64 9.673 -3.028 -3.531 1.00 4.24 H new ATOM 0 HA LYS A 64 11.595 -1.228 -4.716 1.00 71.24 H new ATOM 0 HB2 LYS A 64 9.142 -2.479 -5.972 1.00 73.20 H new ATOM 0 HB3 LYS A 64 10.416 -1.618 -6.812 1.00 73.20 H new ATOM 0 HG2 LYS A 64 10.616 -4.291 -5.392 1.00 21.00 H new ATOM 0 HG3 LYS A 64 10.796 -3.974 -7.107 1.00 21.00 H new ATOM 0 HD2 LYS A 64 12.853 -2.670 -6.667 1.00 43.40 H new ATOM 0 HD3 LYS A 64 12.666 -2.935 -4.944 1.00 43.40 H new ATOM 0 HE2 LYS A 64 12.746 -5.424 -5.387 1.00 13.12 H new ATOM 0 HE3 LYS A 64 13.106 -5.067 -7.064 1.00 13.12 H new ATOM 0 HZ1 LYS A 64 15.110 -5.481 -5.807 1.00 74.13 H new ATOM 0 HZ2 LYS A 64 15.090 -3.874 -6.356 1.00 74.13 H new ATOM 0 HZ3 LYS A 64 14.741 -4.220 -4.731 1.00 74.13 H new ATOM 1072 N CYS A 65 8.511 -0.272 -4.054 1.00 13.23 N ATOM 1073 CA CYS A 65 7.615 0.903 -3.928 1.00 44.54 C ATOM 1074 C CYS A 65 8.266 1.988 -3.075 1.00 34.14 C ATOM 1075 O CYS A 65 8.005 3.171 -3.251 1.00 35.12 O ATOM 1076 CB CYS A 65 6.263 0.481 -3.314 1.00 73.04 C ATOM 1077 SG CYS A 65 5.049 1.835 -3.070 1.00 11.35 S ATOM 0 H CYS A 65 8.105 -1.139 -3.702 1.00 13.23 H new ATOM 0 HA CYS A 65 7.438 1.308 -4.924 1.00 44.54 H new ATOM 0 HB2 CYS A 65 5.813 -0.276 -3.956 1.00 73.04 H new ATOM 0 HB3 CYS A 65 6.453 0.009 -2.350 1.00 73.04 H new ATOM 1082 N LEU A 66 9.148 1.538 -2.190 1.00 43.32 N ATOM 1083 CA LEU A 66 9.909 2.337 -1.278 1.00 65.02 C ATOM 1084 C LEU A 66 10.674 3.468 -2.049 1.00 3.01 C ATOM 1085 O LEU A 66 10.880 4.554 -1.523 1.00 4.51 O ATOM 1086 CB LEU A 66 10.883 1.345 -0.582 1.00 73.21 C ATOM 1087 CG LEU A 66 11.529 1.700 0.766 1.00 24.45 C ATOM 1088 CD1 LEU A 66 12.423 2.900 0.691 1.00 3.20 C ATOM 1089 CD2 LEU A 66 10.476 1.871 1.839 1.00 10.43 C ATOM 0 H LEU A 66 9.352 0.543 -2.096 1.00 43.32 H new ATOM 0 HA LEU A 66 9.283 2.847 -0.546 1.00 65.02 H new ATOM 0 HB2 LEU A 66 10.343 0.409 -0.443 1.00 73.21 H new ATOM 0 HB3 LEU A 66 11.693 1.144 -1.283 1.00 73.21 H new ATOM 0 HG LEU A 66 12.169 0.859 1.035 1.00 24.45 H new ATOM 0 HD11 LEU A 66 12.848 3.099 1.675 1.00 3.20 H new ATOM 0 HD12 LEU A 66 13.227 2.711 -0.021 1.00 3.20 H new ATOM 0 HD13 LEU A 66 11.845 3.764 0.364 1.00 3.20 H new ATOM 0 HD21 LEU A 66 10.957 2.122 2.784 1.00 10.43 H new ATOM 0 HD22 LEU A 66 9.794 2.672 1.555 1.00 10.43 H new ATOM 0 HD23 LEU A 66 9.917 0.942 1.952 1.00 10.43 H new ATOM 1101 N ASN A 67 11.069 3.206 -3.300 1.00 44.34 N ATOM 1102 CA ASN A 67 11.795 4.220 -4.068 1.00 72.31 C ATOM 1103 C ASN A 67 11.402 4.221 -5.544 1.00 74.51 C ATOM 1104 O ASN A 67 11.008 5.251 -6.087 1.00 24.45 O ATOM 1105 CB ASN A 67 13.296 4.022 -3.961 1.00 54.14 C ATOM 1106 CG ASN A 67 14.032 5.214 -4.538 1.00 23.24 C ATOM 1107 OD1 ASN A 67 13.570 6.349 -4.452 1.00 73.24 O ATOM 1108 ND2 ASN A 67 15.130 4.979 -5.137 1.00 1.21 N ATOM 0 H ASN A 67 10.904 2.327 -3.790 1.00 44.34 H new ATOM 0 HA ASN A 67 11.519 5.181 -3.634 1.00 72.31 H new ATOM 0 HB2 ASN A 67 13.577 3.885 -2.917 1.00 54.14 H new ATOM 0 HB3 ASN A 67 13.588 3.116 -4.492 1.00 54.14 H new ATOM 0 HD21 ASN A 67 15.653 5.744 -5.563 1.00 1.21 H new ATOM 0 HD22 ASN A 67 15.487 4.025 -5.191 1.00 1.21 H new ATOM 1115 N LYS A 68 11.499 3.050 -6.185 1.00 15.34 N ATOM 1116 CA LYS A 68 11.254 2.898 -7.640 1.00 63.34 C ATOM 1117 C LYS A 68 12.192 3.779 -8.469 1.00 65.24 C ATOM 1118 O LYS A 68 13.291 4.154 -8.012 1.00 2.24 O ATOM 1119 CB LYS A 68 9.784 3.170 -8.030 1.00 25.10 C ATOM 1120 CG LYS A 68 8.762 2.182 -7.460 1.00 73.21 C ATOM 1121 CD LYS A 68 8.980 0.746 -7.967 1.00 22.40 C ATOM 1122 CE LYS A 68 8.820 0.624 -9.486 1.00 12.20 C ATOM 1123 NZ LYS A 68 7.457 0.979 -9.943 1.00 61.14 N ATOM 0 H LYS A 68 11.748 2.178 -5.719 1.00 15.34 H new ATOM 0 HA LYS A 68 11.466 1.854 -7.869 1.00 63.34 H new ATOM 0 HB2 LYS A 68 9.518 4.174 -7.700 1.00 25.10 H new ATOM 0 HB3 LYS A 68 9.706 3.161 -9.117 1.00 25.10 H new ATOM 0 HG2 LYS A 68 8.821 2.192 -6.372 1.00 73.21 H new ATOM 0 HG3 LYS A 68 7.757 2.509 -7.728 1.00 73.21 H new ATOM 0 HD2 LYS A 68 9.978 0.413 -7.683 1.00 22.40 H new ATOM 0 HD3 LYS A 68 8.270 0.080 -7.476 1.00 22.40 H new ATOM 0 HE2 LYS A 68 9.545 1.273 -9.978 1.00 12.20 H new ATOM 0 HE3 LYS A 68 9.048 -0.397 -9.791 1.00 12.20 H new ATOM 0 HZ1 LYS A 68 7.420 0.946 -10.982 1.00 61.14 H new ATOM 0 HZ2 LYS A 68 6.772 0.302 -9.550 1.00 61.14 H new ATOM 0 HZ3 LYS A 68 7.221 1.938 -9.619 1.00 61.14 H new ATOM 1207 N ILE B 106 0.128 3.581 14.541 1.00 42.03 N ATOM 1208 CA ILE B 106 -0.495 3.358 13.268 1.00 53.15 C ATOM 1209 C ILE B 106 -1.156 4.623 12.725 1.00 74.03 C ATOM 1210 O ILE B 106 -0.727 5.731 13.033 1.00 73.31 O ATOM 1211 CB ILE B 106 -1.449 2.123 13.277 1.00 30.25 C ATOM 1212 CG1 ILE B 106 -2.715 2.303 14.142 1.00 14.01 C ATOM 1213 CG2 ILE B 106 -0.668 0.870 13.701 1.00 51.42 C ATOM 1214 CD1 ILE B 106 -3.675 1.135 14.076 1.00 63.45 C ATOM 0 HA ILE B 106 0.301 3.107 12.567 1.00 53.15 H new ATOM 0 HB ILE B 106 -1.817 2.010 12.257 1.00 30.25 H new ATOM 0 HG12 ILE B 106 -2.416 2.456 15.179 1.00 14.01 H new ATOM 0 HG13 ILE B 106 -3.235 3.206 13.823 1.00 14.01 H new ATOM 0 HG21 ILE B 106 -1.337 0.009 13.706 1.00 51.42 H new ATOM 0 HG22 ILE B 106 0.146 0.693 12.998 1.00 51.42 H new ATOM 0 HG23 ILE B 106 -0.258 1.017 14.700 1.00 51.42 H new ATOM 0 HD11 ILE B 106 -4.538 1.337 14.710 1.00 63.45 H new ATOM 0 HD12 ILE B 106 -4.006 0.993 13.047 1.00 63.45 H new ATOM 0 HD13 ILE B 106 -3.173 0.232 14.423 1.00 63.45 H new ATOM 1226 N TYR B 107 -2.155 4.469 11.909 1.00 21.03 N ATOM 1227 CA TYR B 107 -2.861 5.598 11.321 1.00 61.43 C ATOM 1228 C TYR B 107 -3.762 6.326 12.382 1.00 23.00 C ATOM 1229 O TYR B 107 -4.608 7.120 12.030 1.00 60.24 O ATOM 1230 CB TYR B 107 -3.758 5.090 10.208 1.00 73.20 C ATOM 1231 CG TYR B 107 -3.112 4.244 9.142 1.00 4.33 C ATOM 1232 CD1 TYR B 107 -2.423 4.815 8.092 1.00 34.21 C ATOM 1233 CD2 TYR B 107 -3.252 2.871 9.156 1.00 43.24 C ATOM 1234 CE1 TYR B 107 -1.897 4.057 7.089 1.00 72.45 C ATOM 1235 CE2 TYR B 107 -2.717 2.100 8.162 1.00 62.33 C ATOM 1236 CZ TYR B 107 -2.044 2.699 7.125 1.00 41.11 C ATOM 1237 OH TYR B 107 -1.532 1.937 6.115 1.00 75.32 O ATOM 0 H TYR B 107 -2.515 3.558 11.623 1.00 21.03 H new ATOM 0 HA TYR B 107 -2.120 6.303 10.944 1.00 61.43 H new ATOM 0 HB2 TYR B 107 -4.563 4.510 10.660 1.00 73.20 H new ATOM 0 HB3 TYR B 107 -4.219 5.951 9.724 1.00 73.20 H new ATOM 0 HD1 TYR B 107 -2.298 5.887 8.064 1.00 34.21 H new ATOM 0 HD2 TYR B 107 -3.792 2.399 9.964 1.00 43.24 H new ATOM 0 HE1 TYR B 107 -1.368 4.526 6.272 1.00 72.45 H new ATOM 0 HE2 TYR B 107 -2.823 1.026 8.192 1.00 62.33 H new ATOM 0 HH TYR B 107 -0.639 1.619 6.365 1.00 75.32 H new ATOM 1247 N THR B 108 -3.553 6.026 13.668 1.00 73.23 N ATOM 1248 CA THR B 108 -4.331 6.554 14.817 1.00 75.34 C ATOM 1249 C THR B 108 -5.807 6.107 14.802 1.00 14.03 C ATOM 1250 O THR B 108 -6.623 6.536 15.620 1.00 42.42 O ATOM 1251 CB THR B 108 -4.174 8.100 15.063 1.00 43.42 C ATOM 1252 OG1 THR B 108 -4.614 8.872 13.939 1.00 11.34 O ATOM 1253 CG2 THR B 108 -2.722 8.441 15.368 1.00 32.52 C ATOM 0 H THR B 108 -2.813 5.387 13.959 1.00 73.23 H new ATOM 0 HA THR B 108 -3.869 6.087 15.687 1.00 75.34 H new ATOM 0 HB THR B 108 -4.804 8.353 15.916 1.00 43.42 H new ATOM 0 HG1 THR B 108 -5.012 8.277 13.269 1.00 11.34 H new ATOM 0 HG21 THR B 108 -2.628 9.514 15.536 1.00 32.52 H new ATOM 0 HG22 THR B 108 -2.402 7.904 16.261 1.00 32.52 H new ATOM 0 HG23 THR B 108 -2.095 8.149 14.525 1.00 32.52 H new ATOM 1261 N SER B 109 -6.129 5.231 13.879 1.00 20.11 N ATOM 1262 CA SER B 109 -7.414 4.623 13.832 1.00 72.33 C ATOM 1263 C SER B 109 -7.262 3.265 14.496 1.00 21.04 C ATOM 1264 O SER B 109 -6.779 2.315 13.889 1.00 55.34 O ATOM 1265 CB SER B 109 -7.907 4.488 12.371 1.00 55.24 C ATOM 1266 OG SER B 109 -9.232 3.967 12.306 1.00 32.32 O ATOM 0 H SER B 109 -5.495 4.926 13.141 1.00 20.11 H new ATOM 0 HA SER B 109 -8.161 5.226 14.348 1.00 72.33 H new ATOM 0 HB2 SER B 109 -7.876 5.463 11.885 1.00 55.24 H new ATOM 0 HB3 SER B 109 -7.232 3.835 11.818 1.00 55.24 H new ATOM 0 HG SER B 109 -9.510 3.897 11.369 1.00 32.32 H new ATOM 1272 N ASP B 110 -7.638 3.184 15.754 1.00 74.14 N ATOM 1273 CA ASP B 110 -7.401 1.975 16.553 1.00 20.51 C ATOM 1274 C ASP B 110 -8.457 0.924 16.304 1.00 41.14 C ATOM 1275 O ASP B 110 -8.570 -0.034 17.057 1.00 12.51 O ATOM 1276 CB ASP B 110 -7.339 2.292 18.050 1.00 53.24 C ATOM 1277 CG ASP B 110 -6.286 3.308 18.423 1.00 50.33 C ATOM 1278 OD1 ASP B 110 -5.097 2.926 18.610 1.00 41.23 O ATOM 1279 OD2 ASP B 110 -6.633 4.510 18.548 1.00 4.43 O ATOM 0 H ASP B 110 -8.110 3.935 16.257 1.00 74.14 H new ATOM 0 HA ASP B 110 -6.435 1.581 16.237 1.00 20.51 H new ATOM 0 HB2 ASP B 110 -8.313 2.659 18.373 1.00 53.24 H new ATOM 0 HB3 ASP B 110 -7.148 1.369 18.598 1.00 53.24 H new ATOM 1284 N ASN B 111 -9.200 1.070 15.218 1.00 64.31 N ATOM 1285 CA ASN B 111 -10.230 0.091 14.850 1.00 12.30 C ATOM 1286 C ASN B 111 -9.586 -1.109 14.186 1.00 61.33 C ATOM 1287 O ASN B 111 -10.265 -2.037 13.768 1.00 53.24 O ATOM 1288 CB ASN B 111 -11.284 0.688 13.905 1.00 72.13 C ATOM 1289 CG ASN B 111 -12.065 1.850 14.490 1.00 22.24 C ATOM 1290 OD1 ASN B 111 -12.260 1.955 15.709 1.00 23.42 O ATOM 1291 ND2 ASN B 111 -12.532 2.718 13.630 1.00 72.14 N ATOM 0 H ASN B 111 -9.115 1.854 14.571 1.00 64.31 H new ATOM 0 HA ASN B 111 -10.734 -0.210 15.768 1.00 12.30 H new ATOM 0 HB2 ASN B 111 -10.789 1.021 12.993 1.00 72.13 H new ATOM 0 HB3 ASN B 111 -11.984 -0.097 13.619 1.00 72.13 H new ATOM 0 HD21 ASN B 111 -13.078 3.516 13.956 1.00 72.14 H new ATOM 0 HD22 ASN B 111 -12.350 2.597 12.634 1.00 72.14 H new ATOM 1417 N TYR B 121 -4.936 -19.088 3.855 1.00 75.43 N ATOM 1418 CA TYR B 121 -5.385 -19.712 2.608 1.00 62.14 C ATOM 1419 C TYR B 121 -4.796 -21.123 2.455 1.00 44.22 C ATOM 1420 O TYR B 121 -5.408 -21.977 1.825 1.00 1.23 O ATOM 1421 CB TYR B 121 -4.942 -18.813 1.406 1.00 74.24 C ATOM 1422 CG TYR B 121 -5.571 -19.080 0.038 1.00 2.12 C ATOM 1423 CD1 TYR B 121 -5.378 -20.246 -0.669 1.00 24.21 C ATOM 1424 CD2 TYR B 121 -6.337 -18.100 -0.538 1.00 14.22 C ATOM 1425 CE1 TYR B 121 -5.954 -20.416 -1.925 1.00 53.24 C ATOM 1426 CE2 TYR B 121 -6.917 -18.234 -1.763 1.00 20.12 C ATOM 1427 CZ TYR B 121 -6.727 -19.395 -2.465 1.00 34.53 C ATOM 1428 OH TYR B 121 -7.312 -19.546 -3.707 1.00 23.44 O ATOM 0 HA TYR B 121 -6.471 -19.804 2.626 1.00 62.14 H new ATOM 0 HB2 TYR B 121 -5.148 -17.776 1.671 1.00 74.24 H new ATOM 0 HB3 TYR B 121 -3.861 -18.906 1.300 1.00 74.24 H new ATOM 0 HD1 TYR B 121 -4.775 -21.035 -0.245 1.00 24.21 H new ATOM 0 HD2 TYR B 121 -6.488 -17.179 0.005 1.00 14.22 H new ATOM 0 HE1 TYR B 121 -5.802 -21.333 -2.475 1.00 53.24 H new ATOM 0 HE2 TYR B 121 -7.518 -17.437 -2.175 1.00 20.12 H new ATOM 0 HH TYR B 121 -7.818 -18.737 -3.931 1.00 23.44 H new ATOM 1438 N ASP B 122 -3.635 -21.383 3.065 1.00 71.02 N ATOM 1439 CA ASP B 122 -2.937 -22.670 2.845 1.00 53.32 C ATOM 1440 C ASP B 122 -1.788 -22.916 3.827 1.00 52.30 C ATOM 1441 O ASP B 122 -1.751 -23.942 4.507 1.00 5.53 O ATOM 1442 CB ASP B 122 -2.413 -22.752 1.406 1.00 5.14 C ATOM 1443 CG ASP B 122 -1.557 -23.969 1.163 1.00 55.12 C ATOM 1444 OD1 ASP B 122 -2.097 -25.044 0.902 1.00 24.03 O ATOM 1445 OD2 ASP B 122 -0.317 -23.843 1.223 1.00 5.34 O ATOM 0 H ASP B 122 -3.162 -20.742 3.701 1.00 71.02 H new ATOM 0 HA ASP B 122 -3.677 -23.451 3.022 1.00 53.32 H new ATOM 0 HB2 ASP B 122 -3.258 -22.764 0.717 1.00 5.14 H new ATOM 0 HB3 ASP B 122 -1.834 -21.856 1.184 1.00 5.14 H new ATOM 1450 N SER B 123 -0.854 -21.989 3.890 1.00 62.20 N ATOM 1451 CA SER B 123 0.329 -22.127 4.742 1.00 22.21 C ATOM 1452 C SER B 123 0.706 -20.757 5.315 1.00 33.24 C ATOM 1453 O SER B 123 -0.131 -19.859 5.360 1.00 32.14 O ATOM 1454 CB SER B 123 1.493 -22.679 3.897 1.00 43.55 C ATOM 1455 OG SER B 123 1.180 -23.957 3.339 1.00 61.33 O ATOM 0 H SER B 123 -0.885 -21.119 3.358 1.00 62.20 H new ATOM 0 HA SER B 123 0.119 -22.812 5.564 1.00 22.21 H new ATOM 0 HB2 SER B 123 1.725 -21.978 3.095 1.00 43.55 H new ATOM 0 HB3 SER B 123 2.386 -22.761 4.517 1.00 43.55 H new ATOM 0 HG SER B 123 0.978 -23.857 2.385 1.00 61.33 H new ATOM 1461 N MET B 124 1.931 -20.609 5.770 1.00 1.04 N ATOM 1462 CA MET B 124 2.421 -19.323 6.234 1.00 43.52 C ATOM 1463 C MET B 124 3.856 -19.140 5.763 1.00 10.50 C ATOM 1464 O MET B 124 4.609 -20.113 5.679 1.00 1.42 O ATOM 1465 CB MET B 124 2.344 -19.201 7.770 1.00 32.44 C ATOM 1466 CG MET B 124 3.205 -20.195 8.532 1.00 52.14 C ATOM 1467 SD MET B 124 3.147 -19.938 10.316 1.00 44.14 S ATOM 1468 CE MET B 124 4.249 -21.237 10.875 1.00 41.53 C ATOM 0 H MET B 124 2.612 -21.366 5.830 1.00 1.04 H new ATOM 0 HA MET B 124 1.787 -18.541 5.816 1.00 43.52 H new ATOM 0 HB2 MET B 124 2.640 -18.192 8.056 1.00 32.44 H new ATOM 0 HB3 MET B 124 1.307 -19.328 8.079 1.00 32.44 H new ATOM 0 HG2 MET B 124 2.873 -21.208 8.304 1.00 52.14 H new ATOM 0 HG3 MET B 124 4.237 -20.113 8.190 1.00 52.14 H new ATOM 0 HE1 MET B 124 4.320 -21.211 11.962 1.00 41.53 H new ATOM 0 HE2 MET B 124 3.860 -22.205 10.560 1.00 41.53 H new ATOM 0 HE3 MET B 124 5.238 -21.086 10.443 1.00 41.53 H new ATOM 1478 N LYS B 125 4.223 -17.927 5.428 1.00 74.45 N ATOM 1479 CA LYS B 125 5.579 -17.631 4.995 1.00 12.44 C ATOM 1480 C LYS B 125 6.156 -16.540 5.873 1.00 52.24 C ATOM 1481 O LYS B 125 5.407 -15.812 6.517 1.00 5.33 O ATOM 1482 CB LYS B 125 5.609 -17.201 3.516 1.00 2.35 C ATOM 1483 CG LYS B 125 5.099 -18.259 2.538 1.00 70.12 C ATOM 1484 CD LYS B 125 5.178 -17.788 1.084 1.00 10.22 C ATOM 1485 CE LYS B 125 6.612 -17.525 0.642 1.00 34.32 C ATOM 1486 NZ LYS B 125 6.693 -17.093 -0.774 1.00 43.45 N ATOM 0 H LYS B 125 3.601 -17.119 5.445 1.00 74.45 H new ATOM 0 HA LYS B 125 6.183 -18.534 5.089 1.00 12.44 H new ATOM 0 HB2 LYS B 125 5.009 -16.299 3.401 1.00 2.35 H new ATOM 0 HB3 LYS B 125 6.633 -16.939 3.247 1.00 2.35 H new ATOM 0 HG2 LYS B 125 5.684 -19.171 2.655 1.00 70.12 H new ATOM 0 HG3 LYS B 125 4.066 -18.509 2.782 1.00 70.12 H new ATOM 0 HD2 LYS B 125 4.732 -18.541 0.435 1.00 10.22 H new ATOM 0 HD3 LYS B 125 4.590 -16.878 0.966 1.00 10.22 H new ATOM 0 HE2 LYS B 125 7.052 -16.758 1.279 1.00 34.32 H new ATOM 0 HE3 LYS B 125 7.204 -18.430 0.778 1.00 34.32 H new ATOM 0 HZ1 LYS B 125 7.673 -17.186 -1.110 1.00 43.45 H new ATOM 0 HZ2 LYS B 125 6.069 -17.689 -1.355 1.00 43.45 H new ATOM 0 HZ3 LYS B 125 6.394 -16.100 -0.852 1.00 43.45 H new ATOM 1500 N GLU B 126 7.468 -16.432 5.922 1.00 23.21 N ATOM 1501 CA GLU B 126 8.108 -15.426 6.723 1.00 14.10 C ATOM 1502 C GLU B 126 9.486 -15.111 6.191 1.00 50.31 C ATOM 1503 O GLU B 126 10.412 -15.910 6.331 1.00 1.22 O ATOM 1504 CB GLU B 126 8.179 -15.824 8.199 1.00 11.01 C ATOM 1505 CG GLU B 126 8.806 -14.744 9.068 1.00 42.14 C ATOM 1506 CD GLU B 126 8.746 -15.063 10.525 1.00 33.43 C ATOM 1507 OE1 GLU B 126 7.686 -14.820 11.141 1.00 1.22 O ATOM 1508 OE2 GLU B 126 9.758 -15.521 11.084 1.00 43.01 O ATOM 0 H GLU B 126 8.110 -17.037 5.410 1.00 23.21 H new ATOM 0 HA GLU B 126 7.495 -14.527 6.658 1.00 14.10 H new ATOM 0 HB2 GLU B 126 7.174 -16.039 8.562 1.00 11.01 H new ATOM 0 HB3 GLU B 126 8.756 -16.743 8.296 1.00 11.01 H new ATOM 0 HG2 GLU B 126 9.847 -14.607 8.774 1.00 42.14 H new ATOM 0 HG3 GLU B 126 8.296 -13.798 8.887 1.00 42.14 H new ATOM 1515 N PRO B 127 9.611 -13.974 5.509 1.00 73.33 N ATOM 1516 CA PRO B 127 10.876 -13.458 5.003 1.00 63.53 C ATOM 1517 C PRO B 127 11.881 -13.208 6.081 1.00 34.22 C ATOM 1518 O PRO B 127 11.839 -12.206 6.792 1.00 10.21 O ATOM 1519 CB PRO B 127 10.485 -12.151 4.337 1.00 53.33 C ATOM 1520 CG PRO B 127 9.117 -12.425 3.937 1.00 25.14 C ATOM 1521 CD PRO B 127 8.517 -13.117 5.102 1.00 12.24 C ATOM 0 HA PRO B 127 11.357 -14.173 4.335 1.00 63.53 H new ATOM 0 HB2 PRO B 127 10.550 -11.306 5.023 1.00 53.33 H new ATOM 0 HB3 PRO B 127 11.123 -11.919 3.484 1.00 53.33 H new ATOM 0 HG2 PRO B 127 8.581 -11.505 3.703 1.00 25.14 H new ATOM 0 HG3 PRO B 127 9.083 -13.050 3.044 1.00 25.14 H new ATOM 0 HD2 PRO B 127 8.224 -12.422 5.888 1.00 12.24 H new ATOM 0 HD3 PRO B 127 7.627 -13.685 4.831 1.00 12.24 H new ATOM 1846 N CYS C 209 -2.300 9.705 -13.780 1.00 12.30 N ATOM 1847 CA CYS C 209 -2.158 8.620 -12.858 1.00 45.11 C ATOM 1848 C CYS C 209 -3.233 8.664 -11.783 1.00 32.11 C ATOM 1849 O CYS C 209 -3.774 9.730 -11.468 1.00 13.13 O ATOM 1850 CB CYS C 209 -0.727 8.572 -12.242 1.00 24.32 C ATOM 1851 SG CYS C 209 0.595 8.025 -13.400 1.00 74.32 S ATOM 0 HA CYS C 209 -2.295 7.695 -13.418 1.00 45.11 H new ATOM 0 HB2 CYS C 209 -0.475 9.564 -11.868 1.00 24.32 H new ATOM 0 HB3 CYS C 209 -0.739 7.901 -11.383 1.00 24.32 H new ATOM 1856 N PRO C 210 -3.586 7.465 -11.230 1.00 31.34 N ATOM 1857 CA PRO C 210 -4.589 7.286 -10.144 1.00 73.21 C ATOM 1858 C PRO C 210 -4.236 8.121 -8.917 1.00 44.40 C ATOM 1859 O PRO C 210 -5.077 8.394 -8.044 1.00 3.01 O ATOM 1860 CB PRO C 210 -4.458 5.781 -9.846 1.00 24.32 C ATOM 1861 CG PRO C 210 -3.136 5.429 -10.373 1.00 41.21 C ATOM 1862 CD PRO C 210 -3.032 6.179 -11.628 1.00 63.31 C ATOM 0 HA PRO C 210 -5.596 7.601 -10.417 1.00 73.21 H new ATOM 0 HB2 PRO C 210 -4.529 5.578 -8.777 1.00 24.32 H new ATOM 0 HB3 PRO C 210 -5.247 5.208 -10.332 1.00 24.32 H new ATOM 0 HG2 PRO C 210 -2.344 5.707 -9.677 1.00 41.21 H new ATOM 0 HG3 PRO C 210 -3.049 4.356 -10.543 1.00 41.21 H new ATOM 0 HD2 PRO C 210 -2.002 6.263 -11.974 1.00 63.31 H new ATOM 0 HD3 PRO C 210 -3.602 5.716 -12.434 1.00 63.31 H new ATOM 1870 N CYS C 211 -2.996 8.505 -8.864 1.00 14.23 N ATOM 1871 CA CYS C 211 -2.496 9.402 -7.897 1.00 31.12 C ATOM 1872 C CYS C 211 -2.471 10.764 -8.545 1.00 62.51 C ATOM 1873 O CYS C 211 -1.609 11.044 -9.380 1.00 72.25 O ATOM 1874 CB CYS C 211 -1.097 8.994 -7.506 1.00 22.21 C ATOM 1875 SG CYS C 211 -0.334 9.981 -6.216 1.00 31.10 S ATOM 0 H CYS C 211 -2.288 8.183 -9.523 1.00 14.23 H new ATOM 0 HA CYS C 211 -3.114 9.406 -6.999 1.00 31.12 H new ATOM 0 HB2 CYS C 211 -1.119 7.955 -7.178 1.00 22.21 H new ATOM 0 HB3 CYS C 211 -0.464 9.035 -8.393 1.00 22.21 H new ATOM 1880 N ARG C 212 -3.434 11.589 -8.207 1.00 73.35 N ATOM 1881 CA ARG C 212 -3.551 12.894 -8.832 1.00 44.31 C ATOM 1882 C ARG C 212 -2.521 13.792 -8.228 1.00 30.24 C ATOM 1883 O ARG C 212 -1.766 14.441 -8.916 1.00 62.44 O ATOM 1884 CB ARG C 212 -4.920 13.487 -8.559 1.00 41.42 C ATOM 1885 CG ARG C 212 -6.072 12.580 -8.895 1.00 22.13 C ATOM 1886 CD ARG C 212 -7.383 13.226 -8.520 1.00 71.20 C ATOM 1887 NE ARG C 212 -7.406 13.615 -7.105 1.00 13.21 N ATOM 1888 CZ ARG C 212 -8.399 14.268 -6.509 1.00 3.31 C ATOM 1889 NH1 ARG C 212 -9.516 14.532 -7.169 1.00 23.11 N ATOM 1890 NH2 ARG C 212 -8.270 14.654 -5.249 1.00 24.35 N ATOM 0 H ARG C 212 -4.147 11.385 -7.506 1.00 73.35 H new ATOM 0 HA ARG C 212 -3.410 12.795 -9.908 1.00 44.31 H new ATOM 0 HB2 ARG C 212 -4.982 13.756 -7.504 1.00 41.42 H new ATOM 0 HB3 ARG C 212 -5.022 14.410 -9.130 1.00 41.42 H new ATOM 0 HG2 ARG C 212 -6.064 12.353 -9.961 1.00 22.13 H new ATOM 0 HG3 ARG C 212 -5.963 11.633 -8.366 1.00 22.13 H new ATOM 0 HD2 ARG C 212 -7.548 14.105 -9.143 1.00 71.20 H new ATOM 0 HD3 ARG C 212 -8.201 12.535 -8.722 1.00 71.20 H new ATOM 0 HE ARG C 212 -6.598 13.365 -6.535 1.00 13.21 H new ATOM 0 HH11 ARG C 212 -9.618 14.234 -8.139 1.00 23.11 H new ATOM 0 HH12 ARG C 212 -10.275 15.033 -6.707 1.00 23.11 H new ATOM 0 HH21 ARG C 212 -7.411 14.450 -4.739 1.00 24.35 H new ATOM 0 HH22 ARG C 212 -9.030 15.155 -4.789 1.00 24.35 H new ATOM 1904 N PHE C 213 -2.513 13.821 -6.931 1.00 41.33 N ATOM 1905 CA PHE C 213 -1.573 14.581 -6.177 1.00 31.20 C ATOM 1906 C PHE C 213 -1.094 13.713 -5.059 1.00 70.24 C ATOM 1907 O PHE C 213 -1.915 13.117 -4.364 1.00 73.31 O ATOM 1908 CB PHE C 213 -2.232 15.843 -5.600 1.00 31.52 C ATOM 1909 CG PHE C 213 -2.712 16.836 -6.624 1.00 3.42 C ATOM 1910 CD1 PHE C 213 -3.947 16.689 -7.247 1.00 2.42 C ATOM 1911 CD2 PHE C 213 -1.931 17.925 -6.951 1.00 61.13 C ATOM 1912 CE1 PHE C 213 -4.381 17.615 -8.176 1.00 53.04 C ATOM 1913 CE2 PHE C 213 -2.359 18.852 -7.879 1.00 2.34 C ATOM 1914 CZ PHE C 213 -3.585 18.697 -8.493 1.00 45.44 C ATOM 0 H PHE C 213 -3.178 13.303 -6.356 1.00 41.33 H new ATOM 0 HA PHE C 213 -0.748 14.896 -6.816 1.00 31.20 H new ATOM 0 HB2 PHE C 213 -3.079 15.542 -4.983 1.00 31.52 H new ATOM 0 HB3 PHE C 213 -1.518 16.339 -4.942 1.00 31.52 H new ATOM 0 HD1 PHE C 213 -4.572 15.843 -7.002 1.00 2.42 H new ATOM 0 HD2 PHE C 213 -0.971 18.054 -6.474 1.00 61.13 H new ATOM 0 HE1 PHE C 213 -5.342 17.492 -8.654 1.00 53.04 H new ATOM 0 HE2 PHE C 213 -1.735 19.698 -8.125 1.00 2.34 H new ATOM 0 HZ PHE C 213 -3.921 19.421 -9.220 1.00 45.44 H new ATOM 1924 N PHE C 214 0.187 13.617 -4.888 1.00 10.14 N ATOM 1925 CA PHE C 214 0.716 12.805 -3.832 1.00 51.33 C ATOM 1926 C PHE C 214 1.199 13.693 -2.702 1.00 41.21 C ATOM 1927 O PHE C 214 1.801 14.759 -2.926 1.00 24.34 O ATOM 1928 CB PHE C 214 1.803 11.828 -4.320 1.00 52.32 C ATOM 1929 CG PHE C 214 3.055 12.475 -4.820 1.00 11.32 C ATOM 1930 CD1 PHE C 214 4.052 12.815 -3.941 1.00 33.00 C ATOM 1931 CD2 PHE C 214 3.231 12.741 -6.163 1.00 62.23 C ATOM 1932 CE1 PHE C 214 5.211 13.415 -4.376 1.00 0.34 C ATOM 1933 CE2 PHE C 214 4.388 13.342 -6.616 1.00 41.34 C ATOM 1934 CZ PHE C 214 5.383 13.683 -5.719 1.00 31.05 C ATOM 0 H PHE C 214 0.886 14.088 -5.463 1.00 10.14 H new ATOM 0 HA PHE C 214 -0.086 12.171 -3.455 1.00 51.33 H new ATOM 0 HB2 PHE C 214 2.061 11.156 -3.501 1.00 52.32 H new ATOM 0 HB3 PHE C 214 1.386 11.213 -5.118 1.00 52.32 H new ATOM 0 HD1 PHE C 214 3.925 12.608 -2.889 1.00 33.00 H new ATOM 0 HD2 PHE C 214 2.455 12.476 -6.866 1.00 62.23 H new ATOM 0 HE1 PHE C 214 5.984 13.676 -3.669 1.00 0.34 H new ATOM 0 HE2 PHE C 214 4.516 13.545 -7.669 1.00 41.34 H new ATOM 0 HZ PHE C 214 6.289 14.156 -6.067 1.00 31.05 H new ATOM 1944 N GLU C 215 0.925 13.290 -1.518 1.00 31.41 N ATOM 1945 CA GLU C 215 1.208 14.098 -0.398 1.00 73.41 C ATOM 1946 C GLU C 215 2.545 13.701 0.202 1.00 61.33 C ATOM 1947 O GLU C 215 2.676 12.622 0.782 1.00 44.34 O ATOM 1948 CB GLU C 215 0.109 13.922 0.659 1.00 71.13 C ATOM 1949 CG GLU C 215 -1.325 13.689 0.120 1.00 14.40 C ATOM 1950 CD GLU C 215 -1.919 14.764 -0.785 1.00 11.22 C ATOM 1951 OE1 GLU C 215 -1.279 15.208 -1.738 1.00 72.12 O ATOM 1952 OE2 GLU C 215 -3.057 15.169 -0.546 1.00 32.41 O ATOM 0 H GLU C 215 0.498 12.390 -1.300 1.00 31.41 H new ATOM 0 HA GLU C 215 1.248 15.140 -0.716 1.00 73.41 H new ATOM 0 HB2 GLU C 215 0.377 13.079 1.296 1.00 71.13 H new ATOM 0 HB3 GLU C 215 0.097 14.809 1.293 1.00 71.13 H new ATOM 0 HG2 GLU C 215 -1.330 12.747 -0.428 1.00 14.40 H new ATOM 0 HG3 GLU C 215 -1.990 13.563 0.975 1.00 14.40 H new ATOM 1959 N SER C 216 3.539 14.555 0.040 1.00 4.30 N ATOM 1960 CA SER C 216 4.839 14.331 0.653 1.00 42.55 C ATOM 1961 C SER C 216 4.854 14.915 2.063 1.00 73.03 C ATOM 1962 O SER C 216 5.750 14.671 2.847 1.00 10.11 O ATOM 1963 CB SER C 216 5.918 14.969 -0.181 1.00 4.44 C ATOM 1964 OG SER C 216 5.846 14.508 -1.498 1.00 61.20 O ATOM 0 H SER C 216 3.473 15.411 -0.511 1.00 4.30 H new ATOM 0 HA SER C 216 5.026 13.259 0.711 1.00 42.55 H new ATOM 0 HB2 SER C 216 5.810 16.053 -0.161 1.00 4.44 H new ATOM 0 HB3 SER C 216 6.897 14.739 0.240 1.00 4.44 H new ATOM 0 HG SER C 216 6.196 13.594 -1.544 1.00 61.20 H new ATOM 1970 N HIS C 217 3.865 15.719 2.340 1.00 32.33 N ATOM 1971 CA HIS C 217 3.636 16.293 3.646 1.00 1.45 C ATOM 1972 C HIS C 217 2.184 16.162 3.951 1.00 61.24 C ATOM 1973 O HIS C 217 1.378 16.953 3.502 1.00 1.41 O ATOM 1974 CB HIS C 217 4.097 17.767 3.768 1.00 32.14 C ATOM 1975 CG HIS C 217 5.582 17.970 3.942 1.00 42.30 C ATOM 1976 ND1 HIS C 217 6.121 18.578 5.052 1.00 52.44 N ATOM 1977 CD2 HIS C 217 6.633 17.676 3.137 1.00 74.54 C ATOM 1978 CE1 HIS C 217 7.428 18.651 4.925 1.00 40.10 C ATOM 1979 NE2 HIS C 217 7.765 18.109 3.771 1.00 24.41 N ATOM 0 H HIS C 217 3.174 16.004 1.646 1.00 32.33 H new ATOM 0 HA HIS C 217 4.242 15.749 4.370 1.00 1.45 H new ATOM 0 HB2 HIS C 217 3.776 18.305 2.876 1.00 32.14 H new ATOM 0 HB3 HIS C 217 3.584 18.221 4.616 1.00 32.14 H new ATOM 0 HD2 HIS C 217 6.585 17.190 2.174 1.00 74.54 H new ATOM 0 HE1 HIS C 217 8.109 19.082 5.644 1.00 40.10 H new ATOM 0 HE2 HIS C 217 8.715 18.026 3.410 1.00 24.41 H new ATOM 1988 N VAL C 218 1.863 15.122 4.638 1.00 22.11 N ATOM 1989 CA VAL C 218 0.507 14.801 4.980 1.00 53.31 C ATOM 1990 C VAL C 218 0.503 14.351 6.436 1.00 43.43 C ATOM 1991 O VAL C 218 1.571 14.039 6.992 1.00 24.42 O ATOM 1992 CB VAL C 218 0.003 13.637 4.076 1.00 33.11 C ATOM 1993 CG1 VAL C 218 0.692 12.320 4.414 1.00 24.45 C ATOM 1994 CG2 VAL C 218 -1.520 13.523 4.059 1.00 14.34 C ATOM 0 H VAL C 218 2.546 14.451 4.989 1.00 22.11 H new ATOM 0 HA VAL C 218 -0.144 15.663 4.836 1.00 53.31 H new ATOM 0 HB VAL C 218 0.289 13.884 3.054 1.00 33.11 H new ATOM 0 HG11 VAL C 218 0.313 11.533 3.762 1.00 24.45 H new ATOM 0 HG12 VAL C 218 1.767 12.424 4.270 1.00 24.45 H new ATOM 0 HG13 VAL C 218 0.489 12.059 5.453 1.00 24.45 H new ATOM 0 HG21 VAL C 218 -1.816 12.696 3.414 1.00 14.34 H new ATOM 0 HG22 VAL C 218 -1.883 13.341 5.071 1.00 14.34 H new ATOM 0 HG23 VAL C 218 -1.950 14.450 3.680 1.00 14.34 H new ATOM 2004 N ALA C 219 -0.647 14.303 7.044 1.00 3.54 N ATOM 2005 CA ALA C 219 -0.729 13.873 8.408 1.00 42.52 C ATOM 2006 C ALA C 219 -1.073 12.390 8.485 1.00 64.01 C ATOM 2007 O ALA C 219 -2.140 11.964 8.048 1.00 62.40 O ATOM 2008 CB ALA C 219 -1.732 14.710 9.184 1.00 4.21 C ATOM 0 H ALA C 219 -1.538 14.556 6.617 1.00 3.54 H new ATOM 0 HA ALA C 219 0.248 14.017 8.869 1.00 42.52 H new ATOM 0 HB1 ALA C 219 -1.775 14.362 10.216 1.00 4.21 H new ATOM 0 HB2 ALA C 219 -1.425 15.756 9.166 1.00 4.21 H new ATOM 0 HB3 ALA C 219 -2.717 14.613 8.728 1.00 4.21 H new ATOM 2014 N ARG C 220 -0.158 11.621 9.039 1.00 70.05 N ATOM 2015 CA ARG C 220 -0.328 10.179 9.244 1.00 13.10 C ATOM 2016 C ARG C 220 -1.400 9.914 10.326 1.00 3.14 C ATOM 2017 O ARG C 220 -1.933 8.818 10.455 1.00 42.14 O ATOM 2018 CB ARG C 220 1.074 9.535 9.513 1.00 13.22 C ATOM 2019 CG ARG C 220 1.143 8.036 9.878 1.00 44.21 C ATOM 2020 CD ARG C 220 0.854 7.781 11.330 1.00 41.42 C ATOM 2021 NE ARG C 220 1.804 8.470 12.214 1.00 34.30 N ATOM 2022 CZ ARG C 220 1.807 8.367 13.541 1.00 52.11 C ATOM 2023 NH1 ARG C 220 0.925 7.588 14.149 1.00 55.11 N ATOM 2024 NH2 ARG C 220 2.692 9.034 14.255 1.00 31.21 N ATOM 0 H ARG C 220 0.740 11.975 9.367 1.00 70.05 H new ATOM 0 HA ARG C 220 -0.716 9.690 8.351 1.00 13.10 H new ATOM 0 HB2 ARG C 220 1.684 9.687 8.623 1.00 13.22 H new ATOM 0 HB3 ARG C 220 1.545 10.094 10.321 1.00 13.22 H new ATOM 0 HG2 ARG C 220 0.429 7.484 9.267 1.00 44.21 H new ATOM 0 HG3 ARG C 220 2.134 7.652 9.636 1.00 44.21 H new ATOM 0 HD2 ARG C 220 -0.159 8.111 11.560 1.00 41.42 H new ATOM 0 HD3 ARG C 220 0.892 6.709 11.524 1.00 41.42 H new ATOM 0 HE ARG C 220 2.509 9.067 11.782 1.00 34.30 H new ATOM 0 HH11 ARG C 220 0.242 7.066 13.600 1.00 55.11 H new ATOM 0 HH12 ARG C 220 0.929 7.510 15.166 1.00 55.11 H new ATOM 0 HH21 ARG C 220 3.377 9.631 13.791 1.00 31.21 H new ATOM 0 HH22 ARG C 220 2.692 8.953 15.272 1.00 31.21 H new ATOM 2038 N ALA C 221 -1.696 10.941 11.077 1.00 2.12 N ATOM 2039 CA ALA C 221 -2.748 10.928 12.076 1.00 53.14 C ATOM 2040 C ALA C 221 -4.129 11.178 11.437 1.00 35.21 C ATOM 2041 O ALA C 221 -5.155 11.086 12.095 1.00 52.42 O ATOM 2042 CB ALA C 221 -2.465 11.969 13.142 1.00 73.44 C ATOM 0 H ALA C 221 -1.205 11.833 11.015 1.00 2.12 H new ATOM 0 HA ALA C 221 -2.767 9.940 12.537 1.00 53.14 H new ATOM 0 HB1 ALA C 221 -3.260 11.952 13.887 1.00 73.44 H new ATOM 0 HB2 ALA C 221 -1.512 11.748 13.623 1.00 73.44 H new ATOM 0 HB3 ALA C 221 -2.419 12.957 12.683 1.00 73.44 H new ATOM 2048 N ASN C 222 -4.136 11.546 10.163 1.00 15.53 N ATOM 2049 CA ASN C 222 -5.381 11.909 9.468 1.00 12.35 C ATOM 2050 C ASN C 222 -5.842 10.793 8.498 1.00 24.14 C ATOM 2051 O ASN C 222 -6.852 10.913 7.828 1.00 52.44 O ATOM 2052 CB ASN C 222 -5.154 13.234 8.705 1.00 3.33 C ATOM 2053 CG ASN C 222 -6.391 13.792 8.009 1.00 22.53 C ATOM 2054 OD1 ASN C 222 -7.529 13.602 8.456 1.00 72.44 O ATOM 2055 ND2 ASN C 222 -6.174 14.490 6.923 1.00 61.30 N ATOM 0 H ASN C 222 -3.299 11.604 9.583 1.00 15.53 H new ATOM 0 HA ASN C 222 -6.173 12.034 10.206 1.00 12.35 H new ATOM 0 HB2 ASN C 222 -4.781 13.981 9.406 1.00 3.33 H new ATOM 0 HB3 ASN C 222 -4.374 13.078 7.960 1.00 3.33 H new ATOM 0 HD21 ASN C 222 -6.958 14.899 6.414 1.00 61.30 H new ATOM 0 HD22 ASN C 222 -5.221 14.625 6.585 1.00 61.30 H new ATOM 2062 N VAL C 223 -5.130 9.707 8.473 1.00 55.22 N ATOM 2063 CA VAL C 223 -5.415 8.604 7.546 1.00 61.11 C ATOM 2064 C VAL C 223 -5.936 7.356 8.297 1.00 12.53 C ATOM 2065 O VAL C 223 -5.664 7.204 9.455 1.00 13.14 O ATOM 2066 CB VAL C 223 -4.135 8.276 6.704 1.00 55.54 C ATOM 2067 CG1 VAL C 223 -2.944 8.128 7.608 1.00 25.11 C ATOM 2068 CG2 VAL C 223 -4.304 7.012 5.891 1.00 42.33 C ATOM 0 H VAL C 223 -4.332 9.541 9.086 1.00 55.22 H new ATOM 0 HA VAL C 223 -6.207 8.916 6.865 1.00 61.11 H new ATOM 0 HB VAL C 223 -3.979 9.106 6.015 1.00 55.54 H new ATOM 0 HG11 VAL C 223 -2.061 7.900 7.012 1.00 25.11 H new ATOM 0 HG12 VAL C 223 -2.784 9.058 8.154 1.00 25.11 H new ATOM 0 HG13 VAL C 223 -3.123 7.318 8.316 1.00 25.11 H new ATOM 0 HG21 VAL C 223 -3.394 6.821 5.322 1.00 42.33 H new ATOM 0 HG22 VAL C 223 -4.497 6.173 6.559 1.00 42.33 H new ATOM 0 HG23 VAL C 223 -5.143 7.130 5.205 1.00 42.33 H new ATOM 2078 N LYS C 224 -6.748 6.504 7.632 1.00 75.34 N ATOM 2079 CA LYS C 224 -7.213 5.254 8.261 1.00 0.23 C ATOM 2080 C LYS C 224 -6.459 4.032 7.740 1.00 31.42 C ATOM 2081 O LYS C 224 -6.304 3.051 8.452 1.00 20.00 O ATOM 2082 CB LYS C 224 -8.708 5.032 8.047 1.00 25.55 C ATOM 2083 CG LYS C 224 -9.574 6.136 8.593 1.00 42.00 C ATOM 2084 CD LYS C 224 -11.056 5.795 8.524 1.00 32.02 C ATOM 2085 CE LYS C 224 -11.539 5.548 7.104 1.00 13.42 C ATOM 2086 NZ LYS C 224 -12.975 5.201 7.077 1.00 23.33 N ATOM 0 H LYS C 224 -7.087 6.656 6.682 1.00 75.34 H new ATOM 0 HA LYS C 224 -7.013 5.369 9.326 1.00 0.23 H new ATOM 0 HB2 LYS C 224 -8.900 4.927 6.979 1.00 25.55 H new ATOM 0 HB3 LYS C 224 -8.996 4.092 8.517 1.00 25.55 H new ATOM 0 HG2 LYS C 224 -9.297 6.334 9.628 1.00 42.00 H new ATOM 0 HG3 LYS C 224 -9.388 7.052 8.032 1.00 42.00 H new ATOM 0 HD2 LYS C 224 -11.248 4.908 9.128 1.00 32.02 H new ATOM 0 HD3 LYS C 224 -11.632 6.610 8.962 1.00 32.02 H new ATOM 0 HE2 LYS C 224 -11.367 6.438 6.499 1.00 13.42 H new ATOM 0 HE3 LYS C 224 -10.959 4.741 6.656 1.00 13.42 H new ATOM 0 HZ1 LYS C 224 -13.274 5.038 6.094 1.00 23.33 H new ATOM 0 HZ2 LYS C 224 -13.134 4.338 7.635 1.00 23.33 H new ATOM 0 HZ3 LYS C 224 -13.529 5.982 7.483 1.00 23.33 H new ATOM 2100 N HIS C 225 -6.011 4.099 6.489 1.00 23.24 N ATOM 2101 CA HIS C 225 -5.301 2.979 5.819 1.00 5.11 C ATOM 2102 C HIS C 225 -4.846 3.376 4.428 1.00 42.02 C ATOM 2103 O HIS C 225 -5.315 4.395 3.897 1.00 72.34 O ATOM 2104 CB HIS C 225 -6.156 1.686 5.758 1.00 70.35 C ATOM 2105 CG HIS C 225 -7.535 1.847 5.169 1.00 11.21 C ATOM 2106 ND1 HIS C 225 -7.914 2.907 4.365 1.00 64.20 N ATOM 2107 CD2 HIS C 225 -8.637 1.091 5.316 1.00 75.31 C ATOM 2108 CE1 HIS C 225 -9.185 2.787 4.059 1.00 14.03 C ATOM 2109 NE2 HIS C 225 -9.645 1.697 4.620 1.00 74.40 N ATOM 0 H HIS C 225 -6.123 4.924 5.900 1.00 23.24 H new ATOM 0 HA HIS C 225 -4.424 2.760 6.428 1.00 5.11 H new ATOM 0 HB2 HIS C 225 -5.615 0.941 5.174 1.00 70.35 H new ATOM 0 HB3 HIS C 225 -6.255 1.289 6.768 1.00 70.35 H new ATOM 0 HD1 HIS C 225 -7.302 3.663 4.058 1.00 64.20 H new ATOM 0 HD2 HIS C 225 -8.712 0.173 5.880 1.00 75.31 H new ATOM 0 HE1 HIS C 225 -9.755 3.471 3.448 1.00 14.03 H new ATOM 2118 N LEU C 226 -4.014 2.541 3.811 1.00 22.31 N ATOM 2119 CA LEU C 226 -3.418 2.863 2.509 1.00 75.51 C ATOM 2120 C LEU C 226 -3.889 1.891 1.427 1.00 43.32 C ATOM 2121 O LEU C 226 -4.245 0.748 1.720 1.00 44.34 O ATOM 2122 CB LEU C 226 -1.877 2.734 2.588 1.00 62.14 C ATOM 2123 CG LEU C 226 -1.123 3.614 3.589 1.00 4.05 C ATOM 2124 CD1 LEU C 226 0.368 3.285 3.551 1.00 72.25 C ATOM 2125 CD2 LEU C 226 -1.348 5.092 3.307 1.00 43.34 C ATOM 0 H LEU C 226 -3.735 1.635 4.188 1.00 22.31 H new ATOM 0 HA LEU C 226 -3.722 3.879 2.259 1.00 75.51 H new ATOM 0 HB2 LEU C 226 -1.642 1.695 2.817 1.00 62.14 H new ATOM 0 HB3 LEU C 226 -1.475 2.940 1.596 1.00 62.14 H new ATOM 0 HG LEU C 226 -1.511 3.405 4.586 1.00 4.05 H new ATOM 0 HD11 LEU C 226 0.898 3.915 4.266 1.00 72.25 H new ATOM 0 HD12 LEU C 226 0.516 2.237 3.811 1.00 72.25 H new ATOM 0 HD13 LEU C 226 0.756 3.468 2.549 1.00 72.25 H new ATOM 0 HD21 LEU C 226 -0.799 5.689 4.035 1.00 43.34 H new ATOM 0 HD22 LEU C 226 -0.995 5.329 2.303 1.00 43.34 H new ATOM 0 HD23 LEU C 226 -2.412 5.319 3.380 1.00 43.34 H new ATOM 2137 N LYS C 227 -3.926 2.375 0.204 1.00 11.42 N ATOM 2138 CA LYS C 227 -4.168 1.569 -0.978 1.00 0.32 C ATOM 2139 C LYS C 227 -2.909 1.659 -1.793 1.00 41.25 C ATOM 2140 O LYS C 227 -2.535 2.751 -2.192 1.00 24.31 O ATOM 2141 CB LYS C 227 -5.294 2.164 -1.867 1.00 3.54 C ATOM 2142 CG LYS C 227 -5.640 1.289 -3.083 1.00 33.24 C ATOM 2143 CD LYS C 227 -6.540 0.132 -2.696 1.00 3.24 C ATOM 2144 CE LYS C 227 -8.023 0.543 -2.643 1.00 21.43 C ATOM 2145 NZ LYS C 227 -8.329 1.666 -1.719 1.00 34.24 N ATOM 0 H LYS C 227 -3.785 3.364 -0.003 1.00 11.42 H new ATOM 0 HA LYS C 227 -4.450 0.561 -0.675 1.00 0.32 H new ATOM 0 HB2 LYS C 227 -6.190 2.302 -1.262 1.00 3.54 H new ATOM 0 HB3 LYS C 227 -4.989 3.151 -2.214 1.00 3.54 H new ATOM 0 HG2 LYS C 227 -6.133 1.897 -3.842 1.00 33.24 H new ATOM 0 HG3 LYS C 227 -4.723 0.905 -3.529 1.00 33.24 H new ATOM 0 HD2 LYS C 227 -6.415 -0.679 -3.413 1.00 3.24 H new ATOM 0 HD3 LYS C 227 -6.236 -0.253 -1.723 1.00 3.24 H new ATOM 0 HE2 LYS C 227 -8.344 0.820 -3.647 1.00 21.43 H new ATOM 0 HE3 LYS C 227 -8.615 -0.323 -2.347 1.00 21.43 H new ATOM 0 HZ1 LYS C 227 -9.360 1.773 -1.632 1.00 34.24 H new ATOM 0 HZ2 LYS C 227 -7.922 1.466 -0.783 1.00 34.24 H new ATOM 0 HZ3 LYS C 227 -7.920 2.546 -2.094 1.00 34.24 H new ATOM 2159 N ILE C 228 -2.249 0.580 -2.037 1.00 12.43 N ATOM 2160 CA ILE C 228 -1.087 0.665 -2.873 1.00 13.21 C ATOM 2161 C ILE C 228 -1.398 0.039 -4.195 1.00 52.41 C ATOM 2162 O ILE C 228 -2.027 -1.032 -4.261 1.00 63.22 O ATOM 2163 CB ILE C 228 0.187 0.009 -2.285 1.00 3.31 C ATOM 2164 CG1 ILE C 228 0.465 0.511 -0.877 1.00 45.42 C ATOM 2165 CG2 ILE C 228 1.384 0.348 -3.176 1.00 13.52 C ATOM 2166 CD1 ILE C 228 1.743 -0.040 -0.296 1.00 43.45 C ATOM 0 H ILE C 228 -2.479 -0.349 -1.685 1.00 12.43 H new ATOM 0 HA ILE C 228 -0.856 1.726 -2.966 1.00 13.21 H new ATOM 0 HB ILE C 228 0.029 -1.069 -2.245 1.00 3.31 H new ATOM 0 HG12 ILE C 228 0.518 1.600 -0.889 1.00 45.42 H new ATOM 0 HG13 ILE C 228 -0.369 0.240 -0.229 1.00 45.42 H new ATOM 0 HG21 ILE C 228 2.284 -0.111 -2.767 1.00 13.52 H new ATOM 0 HG22 ILE C 228 1.208 -0.032 -4.182 1.00 13.52 H new ATOM 0 HG23 ILE C 228 1.514 1.430 -3.215 1.00 13.52 H new ATOM 0 HD11 ILE C 228 1.885 0.355 0.710 1.00 43.45 H new ATOM 0 HD12 ILE C 228 1.684 -1.128 -0.254 1.00 43.45 H new ATOM 0 HD13 ILE C 228 2.584 0.254 -0.924 1.00 43.45 H new ATOM 2178 N LEU C 229 -1.015 0.714 -5.229 1.00 21.13 N ATOM 2179 CA LEU C 229 -1.184 0.255 -6.553 1.00 14.12 C ATOM 2180 C LEU C 229 -0.021 0.791 -7.381 1.00 15.41 C ATOM 2181 O LEU C 229 0.586 1.801 -7.012 1.00 30.24 O ATOM 2182 CB LEU C 229 -2.579 0.688 -7.065 1.00 55.22 C ATOM 2183 CG LEU C 229 -2.859 2.185 -7.124 1.00 55.11 C ATOM 2184 CD1 LEU C 229 -2.368 2.776 -8.415 1.00 15.01 C ATOM 2185 CD2 LEU C 229 -4.318 2.467 -6.916 1.00 64.24 C ATOM 0 H LEU C 229 -0.563 1.626 -5.165 1.00 21.13 H new ATOM 0 HA LEU C 229 -1.163 -0.832 -6.626 1.00 14.12 H new ATOM 0 HB2 LEU C 229 -2.715 0.278 -8.066 1.00 55.22 H new ATOM 0 HB3 LEU C 229 -3.333 0.227 -6.426 1.00 55.22 H new ATOM 0 HG LEU C 229 -2.309 2.662 -6.312 1.00 55.11 H new ATOM 0 HD11 LEU C 229 -2.581 3.845 -8.430 1.00 15.01 H new ATOM 0 HD12 LEU C 229 -1.293 2.619 -8.501 1.00 15.01 H new ATOM 0 HD13 LEU C 229 -2.874 2.294 -9.252 1.00 15.01 H new ATOM 0 HD21 LEU C 229 -4.491 3.542 -6.963 1.00 64.24 H new ATOM 0 HD22 LEU C 229 -4.899 1.972 -7.694 1.00 64.24 H new ATOM 0 HD23 LEU C 229 -4.625 2.092 -5.940 1.00 64.24 H new ATOM 2197 N ASN C 230 0.327 0.138 -8.441 1.00 5.11 N ATOM 2198 CA ASN C 230 1.448 0.601 -9.227 1.00 33.42 C ATOM 2199 C ASN C 230 1.004 0.855 -10.642 1.00 22.31 C ATOM 2200 O ASN C 230 0.506 -0.032 -11.319 1.00 54.50 O ATOM 2201 CB ASN C 230 2.639 -0.402 -9.147 1.00 5.21 C ATOM 2202 CG ASN C 230 3.975 0.059 -9.809 1.00 32.54 C ATOM 2203 OD1 ASN C 230 5.059 -0.285 -9.325 1.00 45.33 O ATOM 2204 ND2 ASN C 230 3.924 0.780 -10.912 1.00 13.55 N ATOM 0 H ASN C 230 -0.132 -0.704 -8.787 1.00 5.11 H new ATOM 0 HA ASN C 230 1.812 1.543 -8.818 1.00 33.42 H new ATOM 0 HB2 ASN C 230 2.834 -0.619 -8.097 1.00 5.21 H new ATOM 0 HB3 ASN C 230 2.331 -1.338 -9.614 1.00 5.21 H new ATOM 0 HD21 ASN C 230 4.787 1.061 -11.378 1.00 13.55 H new ATOM 0 HD22 ASN C 230 3.022 1.056 -11.299 1.00 13.55 H new ATOM 2211 N THR C 231 1.169 2.078 -11.063 1.00 62.43 N ATOM 2212 CA THR C 231 0.834 2.505 -12.392 1.00 40.13 C ATOM 2213 C THR C 231 2.174 2.631 -13.144 1.00 12.11 C ATOM 2214 O THR C 231 3.063 3.287 -12.648 1.00 42.42 O ATOM 2215 CB THR C 231 0.170 3.883 -12.256 1.00 43.41 C ATOM 2216 OG1 THR C 231 -0.709 3.794 -11.142 1.00 42.35 O ATOM 2217 CG2 THR C 231 -0.681 4.225 -13.458 1.00 72.12 C ATOM 0 H THR C 231 1.549 2.822 -10.478 1.00 62.43 H new ATOM 0 HA THR C 231 0.165 1.824 -12.918 1.00 40.13 H new ATOM 0 HB THR C 231 0.945 4.642 -12.152 1.00 43.41 H new ATOM 0 HG1 THR C 231 -1.378 3.098 -11.308 1.00 42.35 H new ATOM 0 HG21 THR C 231 -1.131 5.208 -13.318 1.00 72.12 H new ATOM 0 HG22 THR C 231 -0.059 4.235 -14.353 1.00 72.12 H new ATOM 0 HG23 THR C 231 -1.468 3.479 -13.571 1.00 72.12 H new ATOM 2225 N PRO C 232 2.326 2.016 -14.329 1.00 1.52 N ATOM 2226 CA PRO C 232 3.621 1.922 -15.047 1.00 74.40 C ATOM 2227 C PRO C 232 4.398 3.244 -15.234 1.00 73.25 C ATOM 2228 O PRO C 232 5.631 3.255 -15.158 1.00 3.22 O ATOM 2229 CB PRO C 232 3.247 1.322 -16.413 1.00 21.51 C ATOM 2230 CG PRO C 232 1.762 1.422 -16.488 1.00 43.41 C ATOM 2231 CD PRO C 232 1.271 1.341 -15.076 1.00 51.13 C ATOM 0 HA PRO C 232 4.313 1.325 -14.454 1.00 74.40 H new ATOM 0 HB2 PRO C 232 3.721 1.870 -17.227 1.00 21.51 H new ATOM 0 HB3 PRO C 232 3.577 0.286 -16.492 1.00 21.51 H new ATOM 0 HG2 PRO C 232 1.457 2.359 -16.954 1.00 43.41 H new ATOM 0 HG3 PRO C 232 1.347 0.616 -17.092 1.00 43.41 H new ATOM 0 HD2 PRO C 232 0.308 1.836 -14.953 1.00 51.13 H new ATOM 0 HD3 PRO C 232 1.142 0.309 -14.751 1.00 51.13 H new ATOM 2239 N ASN C 233 3.706 4.340 -15.461 1.00 43.25 N ATOM 2240 CA ASN C 233 4.404 5.592 -15.763 1.00 62.40 C ATOM 2241 C ASN C 233 4.637 6.449 -14.523 1.00 72.45 C ATOM 2242 O ASN C 233 5.252 7.511 -14.595 1.00 41.13 O ATOM 2243 CB ASN C 233 3.697 6.403 -16.861 1.00 75.04 C ATOM 2244 CG ASN C 233 3.585 5.674 -18.204 1.00 74.34 C ATOM 2245 OD1 ASN C 233 3.461 4.450 -18.264 1.00 12.33 O ATOM 2246 ND2 ASN C 233 3.640 6.414 -19.283 1.00 74.32 N ATOM 0 H ASN C 233 2.688 4.401 -15.446 1.00 43.25 H new ATOM 0 HA ASN C 233 5.382 5.299 -16.144 1.00 62.40 H new ATOM 0 HB2 ASN C 233 2.696 6.664 -16.517 1.00 75.04 H new ATOM 0 HB3 ASN C 233 4.237 7.338 -17.011 1.00 75.04 H new ATOM 0 HD21 ASN C 233 3.580 5.979 -20.204 1.00 74.32 H new ATOM 0 HD22 ASN C 233 3.743 7.426 -19.203 1.00 74.32 H new ATOM 2253 N CYS C 234 4.203 5.971 -13.395 1.00 15.20 N ATOM 2254 CA CYS C 234 4.370 6.675 -12.142 1.00 23.22 C ATOM 2255 C CYS C 234 5.082 5.760 -11.144 1.00 31.45 C ATOM 2256 O CYS C 234 4.900 4.554 -11.198 1.00 0.41 O ATOM 2257 CB CYS C 234 3.011 7.214 -11.616 1.00 13.10 C ATOM 2258 SG CYS C 234 2.339 8.655 -12.556 1.00 33.01 S ATOM 0 H CYS C 234 3.719 5.077 -13.309 1.00 15.20 H new ATOM 0 HA CYS C 234 4.996 7.555 -12.291 1.00 23.22 H new ATOM 0 HB2 CYS C 234 2.280 6.406 -11.643 1.00 13.10 H new ATOM 0 HB3 CYS C 234 3.129 7.502 -10.571 1.00 13.10 H new ATOM 2263 N ALA C 235 5.920 6.336 -10.269 1.00 52.14 N ATOM 2264 CA ALA C 235 6.786 5.557 -9.343 1.00 14.45 C ATOM 2265 C ALA C 235 6.018 4.462 -8.593 1.00 61.43 C ATOM 2266 O ALA C 235 6.161 3.263 -8.886 1.00 25.21 O ATOM 2267 CB ALA C 235 7.495 6.488 -8.362 1.00 41.41 C ATOM 0 H ALA C 235 6.023 7.346 -10.176 1.00 52.14 H new ATOM 0 HA ALA C 235 7.532 5.052 -9.957 1.00 14.45 H new ATOM 0 HB1 ALA C 235 8.124 5.901 -7.693 1.00 41.41 H new ATOM 0 HB2 ALA C 235 8.114 7.195 -8.914 1.00 41.41 H new ATOM 0 HB3 ALA C 235 6.754 7.034 -7.778 1.00 41.41 H new ATOM 2273 N CYS C 236 5.225 4.867 -7.655 1.00 55.34 N ATOM 2274 CA CYS C 236 4.369 3.981 -6.918 1.00 75.34 C ATOM 2275 C CYS C 236 3.218 4.834 -6.477 1.00 12.35 C ATOM 2276 O CYS C 236 3.396 6.032 -6.286 1.00 52.41 O ATOM 2277 CB CYS C 236 5.101 3.336 -5.726 1.00 43.12 C ATOM 2278 SG CYS C 236 4.133 2.042 -4.870 1.00 5.24 S ATOM 0 H CYS C 236 5.149 5.843 -7.370 1.00 55.34 H new ATOM 0 HA CYS C 236 4.036 3.140 -7.526 1.00 75.34 H new ATOM 0 HB2 CYS C 236 6.036 2.902 -6.079 1.00 43.12 H new ATOM 0 HB3 CYS C 236 5.362 4.114 -5.009 1.00 43.12 H new ATOM 2283 N GLN C 237 2.053 4.282 -6.366 1.00 34.24 N ATOM 2284 CA GLN C 237 0.882 5.093 -6.120 1.00 3.45 C ATOM 2285 C GLN C 237 0.173 4.600 -4.876 1.00 72.34 C ATOM 2286 O GLN C 237 -0.345 3.481 -4.848 1.00 31.52 O ATOM 2287 CB GLN C 237 -0.032 4.966 -7.334 1.00 4.05 C ATOM 2288 CG GLN C 237 0.672 5.255 -8.667 1.00 22.34 C ATOM 2289 CD GLN C 237 0.936 6.717 -8.929 1.00 11.13 C ATOM 2290 OE1 GLN C 237 0.131 7.378 -9.563 1.00 72.01 O ATOM 2291 NE2 GLN C 237 2.024 7.247 -8.416 1.00 52.13 N ATOM 0 H GLN C 237 1.877 3.280 -6.440 1.00 34.24 H new ATOM 0 HA GLN C 237 1.159 6.136 -5.964 1.00 3.45 H new ATOM 0 HB2 GLN C 237 -0.446 3.958 -7.363 1.00 4.05 H new ATOM 0 HB3 GLN C 237 -0.871 5.652 -7.220 1.00 4.05 H new ATOM 0 HG2 GLN C 237 1.620 4.718 -8.687 1.00 22.34 H new ATOM 0 HG3 GLN C 237 0.063 4.857 -9.479 1.00 22.34 H new ATOM 0 HE21 GLN C 237 2.676 6.665 -7.891 1.00 52.13 H new ATOM 0 HE22 GLN C 237 2.216 8.241 -8.543 1.00 52.13 H new ATOM 2300 N ILE C 238 0.173 5.403 -3.851 1.00 75.13 N ATOM 2301 CA ILE C 238 -0.468 5.032 -2.621 1.00 23.24 C ATOM 2302 C ILE C 238 -1.618 5.970 -2.355 1.00 32.45 C ATOM 2303 O ILE C 238 -1.422 7.146 -2.198 1.00 22.34 O ATOM 2304 CB ILE C 238 0.519 5.063 -1.421 1.00 1.23 C ATOM 2305 CG1 ILE C 238 1.707 4.130 -1.698 1.00 50.02 C ATOM 2306 CG2 ILE C 238 -0.196 4.648 -0.139 1.00 43.31 C ATOM 2307 CD1 ILE C 238 2.707 4.044 -0.570 1.00 54.53 C ATOM 0 H ILE C 238 0.612 6.324 -3.842 1.00 75.13 H new ATOM 0 HA ILE C 238 -0.830 4.009 -2.725 1.00 23.24 H new ATOM 0 HB ILE C 238 0.892 6.079 -1.294 1.00 1.23 H new ATOM 0 HG12 ILE C 238 1.327 3.130 -1.908 1.00 50.02 H new ATOM 0 HG13 ILE C 238 2.220 4.471 -2.597 1.00 50.02 H new ATOM 0 HG21 ILE C 238 0.506 4.674 0.694 1.00 43.31 H new ATOM 0 HG22 ILE C 238 -1.018 5.336 0.058 1.00 43.31 H new ATOM 0 HG23 ILE C 238 -0.588 3.637 -0.252 1.00 43.31 H new ATOM 0 HD11 ILE C 238 3.512 3.365 -0.849 1.00 54.53 H new ATOM 0 HD12 ILE C 238 3.119 5.034 -0.373 1.00 54.53 H new ATOM 0 HD13 ILE C 238 2.212 3.672 0.327 1.00 54.53 H new ATOM 2319 N VAL C 239 -2.801 5.456 -2.296 1.00 20.14 N ATOM 2320 CA VAL C 239 -3.954 6.286 -2.068 1.00 62.12 C ATOM 2321 C VAL C 239 -4.477 6.010 -0.675 1.00 1.11 C ATOM 2322 O VAL C 239 -4.725 4.875 -0.315 1.00 12.11 O ATOM 2323 CB VAL C 239 -5.067 6.021 -3.123 1.00 11.20 C ATOM 2324 CG1 VAL C 239 -6.252 6.949 -2.911 1.00 45.02 C ATOM 2325 CG2 VAL C 239 -4.519 6.171 -4.541 1.00 24.33 C ATOM 0 H VAL C 239 -3.003 4.462 -2.402 1.00 20.14 H new ATOM 0 HA VAL C 239 -3.662 7.332 -2.163 1.00 62.12 H new ATOM 0 HB VAL C 239 -5.411 4.995 -2.994 1.00 11.20 H new ATOM 0 HG11 VAL C 239 -7.015 6.742 -3.662 1.00 45.02 H new ATOM 0 HG12 VAL C 239 -6.668 6.787 -1.917 1.00 45.02 H new ATOM 0 HG13 VAL C 239 -5.924 7.984 -3.002 1.00 45.02 H new ATOM 0 HG21 VAL C 239 -5.315 5.981 -5.261 1.00 24.33 H new ATOM 0 HG22 VAL C 239 -4.139 7.183 -4.679 1.00 24.33 H new ATOM 0 HG23 VAL C 239 -3.711 5.456 -4.696 1.00 24.33 H new ATOM 2335 N ALA C 240 -4.633 7.033 0.096 1.00 22.22 N ATOM 2336 CA ALA C 240 -5.043 6.893 1.455 1.00 73.11 C ATOM 2337 C ALA C 240 -6.415 7.470 1.661 1.00 72.23 C ATOM 2338 O ALA C 240 -6.741 8.550 1.144 1.00 0.42 O ATOM 2339 CB ALA C 240 -4.049 7.576 2.368 1.00 35.21 C ATOM 0 H ALA C 240 -4.479 7.997 -0.200 1.00 22.22 H new ATOM 0 HA ALA C 240 -5.079 5.831 1.696 1.00 73.11 H new ATOM 0 HB1 ALA C 240 -4.370 7.464 3.404 1.00 35.21 H new ATOM 0 HB2 ALA C 240 -3.067 7.121 2.241 1.00 35.21 H new ATOM 0 HB3 ALA C 240 -3.993 8.635 2.118 1.00 35.21 H new ATOM 2345 N ARG C 241 -7.228 6.760 2.395 1.00 32.24 N ATOM 2346 CA ARG C 241 -8.533 7.255 2.719 1.00 71.34 C ATOM 2347 C ARG C 241 -8.413 7.824 4.126 1.00 61.11 C ATOM 2348 O ARG C 241 -7.974 7.130 5.069 1.00 23.52 O ATOM 2349 CB ARG C 241 -9.596 6.135 2.638 1.00 43.33 C ATOM 2350 CG ARG C 241 -11.056 6.603 2.383 1.00 23.44 C ATOM 2351 CD ARG C 241 -11.605 7.546 3.446 1.00 54.43 C ATOM 2352 NE ARG C 241 -12.981 7.978 3.147 1.00 23.30 N ATOM 2353 CZ ARG C 241 -13.659 8.940 3.808 1.00 12.40 C ATOM 2354 NH1 ARG C 241 -13.121 9.545 4.866 1.00 3.04 N ATOM 2355 NH2 ARG C 241 -14.884 9.277 3.407 1.00 0.34 N ATOM 0 H ARG C 241 -7.009 5.840 2.778 1.00 32.24 H new ATOM 0 HA ARG C 241 -8.864 8.016 2.013 1.00 71.34 H new ATOM 0 HB2 ARG C 241 -9.311 5.447 1.842 1.00 43.33 H new ATOM 0 HB3 ARG C 241 -9.573 5.571 3.570 1.00 43.33 H new ATOM 0 HG2 ARG C 241 -11.102 7.100 1.414 1.00 23.44 H new ATOM 0 HG3 ARG C 241 -11.701 5.727 2.323 1.00 23.44 H new ATOM 0 HD2 ARG C 241 -11.584 7.049 4.416 1.00 54.43 H new ATOM 0 HD3 ARG C 241 -10.959 8.421 3.522 1.00 54.43 H new ATOM 0 HE ARG C 241 -13.461 7.512 2.377 1.00 23.30 H new ATOM 0 HH11 ARG C 241 -12.188 9.283 5.184 1.00 3.04 H new ATOM 0 HH12 ARG C 241 -13.642 10.271 5.358 1.00 3.04 H new ATOM 0 HH21 ARG C 241 -15.305 8.809 2.604 1.00 0.34 H new ATOM 0 HH22 ARG C 241 -15.401 10.003 3.903 1.00 0.34 H new ATOM 2369 N LEU C 242 -8.775 9.051 4.243 1.00 72.43 N ATOM 2370 CA LEU C 242 -8.600 9.840 5.426 1.00 70.51 C ATOM 2371 C LEU C 242 -9.680 9.598 6.472 1.00 3.33 C ATOM 2372 O LEU C 242 -10.754 9.069 6.167 1.00 13.32 O ATOM 2373 CB LEU C 242 -8.544 11.297 4.996 1.00 72.50 C ATOM 2374 CG LEU C 242 -7.417 11.617 4.019 1.00 24.32 C ATOM 2375 CD1 LEU C 242 -7.511 13.031 3.587 1.00 30.05 C ATOM 2376 CD2 LEU C 242 -6.054 11.341 4.645 1.00 2.33 C ATOM 0 H LEU C 242 -9.224 9.564 3.484 1.00 72.43 H new ATOM 0 HA LEU C 242 -7.672 9.549 5.919 1.00 70.51 H new ATOM 0 HB2 LEU C 242 -9.495 11.566 4.537 1.00 72.50 H new ATOM 0 HB3 LEU C 242 -8.430 11.922 5.882 1.00 72.50 H new ATOM 0 HG LEU C 242 -7.522 10.970 3.148 1.00 24.32 H new ATOM 0 HD11 LEU C 242 -6.703 13.253 2.890 1.00 30.05 H new ATOM 0 HD12 LEU C 242 -8.470 13.199 3.097 1.00 30.05 H new ATOM 0 HD13 LEU C 242 -7.429 13.683 4.456 1.00 30.05 H new ATOM 0 HD21 LEU C 242 -5.269 11.578 3.927 1.00 2.33 H new ATOM 0 HD22 LEU C 242 -5.930 11.959 5.534 1.00 2.33 H new ATOM 0 HD23 LEU C 242 -5.987 10.289 4.922 1.00 2.33 H new ATOM 2388 N LYS C 243 -9.367 9.980 7.694 1.00 13.55 N ATOM 2389 CA LYS C 243 -10.252 9.842 8.838 1.00 5.53 C ATOM 2390 C LYS C 243 -11.371 10.869 8.788 1.00 21.23 C ATOM 2391 O LYS C 243 -12.447 10.599 8.237 1.00 4.11 O ATOM 2392 CB LYS C 243 -9.453 9.976 10.154 1.00 15.34 C ATOM 2393 CG LYS C 243 -8.460 8.849 10.409 1.00 10.25 C ATOM 2394 CD LYS C 243 -7.462 9.192 11.517 1.00 71.23 C ATOM 2395 CE LYS C 243 -8.119 9.540 12.841 1.00 23.15 C ATOM 2396 NZ LYS C 243 -8.857 8.410 13.422 1.00 21.35 N ATOM 0 H LYS C 243 -8.470 10.405 7.927 1.00 13.55 H new ATOM 0 HA LYS C 243 -10.703 8.850 8.802 1.00 5.53 H new ATOM 0 HB2 LYS C 243 -8.913 10.923 10.141 1.00 15.34 H new ATOM 0 HB3 LYS C 243 -10.155 10.020 10.987 1.00 15.34 H new ATOM 0 HG2 LYS C 243 -9.003 7.944 10.680 1.00 10.25 H new ATOM 0 HG3 LYS C 243 -7.917 8.631 9.489 1.00 10.25 H new ATOM 0 HD2 LYS C 243 -6.791 8.346 11.665 1.00 71.23 H new ATOM 0 HD3 LYS C 243 -6.848 10.032 11.194 1.00 71.23 H new ATOM 0 HE2 LYS C 243 -7.355 9.870 13.545 1.00 23.15 H new ATOM 0 HE3 LYS C 243 -8.801 10.377 12.694 1.00 23.15 H new ATOM 0 HZ1 LYS C 243 -9.285 8.702 14.324 1.00 21.35 H new ATOM 0 HZ2 LYS C 243 -9.605 8.109 12.765 1.00 21.35 H new ATOM 0 HZ3 LYS C 243 -8.204 7.618 13.589 1.00 21.35 H new ATOM 2410 N ASN C 244 -11.109 12.054 9.327 1.00 24.22 N ATOM 2411 CA ASN C 244 -12.090 13.135 9.364 1.00 22.13 C ATOM 2412 C ASN C 244 -11.361 14.465 9.334 1.00 64.23 C ATOM 2413 O ASN C 244 -10.783 14.884 10.345 1.00 50.22 O ATOM 2414 CB ASN C 244 -12.982 13.065 10.635 1.00 23.53 C ATOM 2415 CG ASN C 244 -13.775 11.766 10.776 1.00 3.14 C ATOM 2416 OD1 ASN C 244 -13.316 10.805 11.400 1.00 63.01 O ATOM 2417 ND2 ASN C 244 -14.945 11.715 10.190 1.00 23.12 N ATOM 0 H ASN C 244 -10.212 12.294 9.750 1.00 24.22 H new ATOM 0 HA ASN C 244 -12.740 13.032 8.495 1.00 22.13 H new ATOM 0 HB2 ASN C 244 -12.351 13.189 11.515 1.00 23.53 H new ATOM 0 HB3 ASN C 244 -13.679 13.903 10.622 1.00 23.53 H new ATOM 0 HD21 ASN C 244 -15.505 10.864 10.242 1.00 23.12 H new ATOM 0 HD22 ASN C 244 -15.297 12.526 9.682 1.00 23.12 H new ATOM 2424 N ASN C 245 -11.364 15.098 8.171 1.00 22.21 N ATOM 2425 CA ASN C 245 -10.665 16.383 7.912 1.00 64.30 C ATOM 2426 C ASN C 245 -10.766 16.658 6.437 1.00 42.02 C ATOM 2427 O ASN C 245 -11.147 17.744 5.994 1.00 34.10 O ATOM 2428 CB ASN C 245 -9.167 16.291 8.291 1.00 22.14 C ATOM 2429 CG ASN C 245 -8.383 17.553 7.973 1.00 52.43 C ATOM 2430 OD1 ASN C 245 -7.841 17.704 6.872 1.00 54.24 O ATOM 2431 ND2 ASN C 245 -8.291 18.442 8.925 1.00 11.05 N ATOM 0 H ASN C 245 -11.857 14.740 7.353 1.00 22.21 H new ATOM 0 HA ASN C 245 -11.122 17.172 8.509 1.00 64.30 H new ATOM 0 HB2 ASN C 245 -9.082 16.079 9.357 1.00 22.14 H new ATOM 0 HB3 ASN C 245 -8.717 15.451 7.762 1.00 22.14 H new ATOM 0 HD21 ASN C 245 -7.757 19.298 8.774 1.00 11.05 H new ATOM 0 HD22 ASN C 245 -8.753 18.281 9.820 1.00 11.05 H new ATOM 2438 N ASN C 246 -10.429 15.646 5.699 1.00 15.30 N ATOM 2439 CA ASN C 246 -10.480 15.616 4.260 1.00 60.13 C ATOM 2440 C ASN C 246 -10.967 14.181 3.966 1.00 3.42 C ATOM 2441 O ASN C 246 -11.516 13.557 4.879 1.00 60.34 O ATOM 2442 CB ASN C 246 -9.058 15.951 3.689 1.00 64.12 C ATOM 2443 CG ASN C 246 -8.955 16.123 2.152 1.00 1.50 C ATOM 2444 OD1 ASN C 246 -9.694 15.530 1.383 1.00 14.05 O ATOM 2445 ND2 ASN C 246 -8.026 16.920 1.716 1.00 11.42 N ATOM 0 H ASN C 246 -10.093 14.770 6.100 1.00 15.30 H new ATOM 0 HA ASN C 246 -11.139 16.347 3.792 1.00 60.13 H new ATOM 0 HB2 ASN C 246 -8.709 16.870 4.160 1.00 64.12 H new ATOM 0 HB3 ASN C 246 -8.373 15.158 3.991 1.00 64.12 H new ATOM 0 HD21 ASN C 246 -7.903 17.060 0.713 1.00 11.42 H new ATOM 0 HD22 ASN C 246 -7.419 17.406 2.377 1.00 11.42 H new ATOM 2452 N ARG C 247 -10.777 13.638 2.801 1.00 41.31 N ATOM 2453 CA ARG C 247 -11.376 12.355 2.516 1.00 30.23 C ATOM 2454 C ARG C 247 -10.476 11.351 1.847 1.00 44.24 C ATOM 2455 O ARG C 247 -10.214 10.299 2.400 1.00 24.44 O ATOM 2456 CB ARG C 247 -12.777 12.430 1.883 1.00 1.11 C ATOM 2457 CG ARG C 247 -12.896 13.133 0.542 1.00 31.35 C ATOM 2458 CD ARG C 247 -12.553 14.600 0.638 1.00 22.03 C ATOM 2459 NE ARG C 247 -13.448 15.357 1.527 1.00 41.10 N ATOM 2460 CZ ARG C 247 -13.189 16.601 1.991 1.00 51.14 C ATOM 2461 NH1 ARG C 247 -12.098 17.248 1.603 1.00 53.53 N ATOM 2462 NH2 ARG C 247 -14.028 17.192 2.832 1.00 21.45 N ATOM 0 H ARG C 247 -10.227 14.045 2.045 1.00 41.31 H new ATOM 0 HA ARG C 247 -11.531 11.946 3.514 1.00 30.23 H new ATOM 0 HB2 ARG C 247 -13.149 11.412 1.765 1.00 1.11 H new ATOM 0 HB3 ARG C 247 -13.440 12.932 2.588 1.00 1.11 H new ATOM 0 HG2 ARG C 247 -12.234 12.653 -0.179 1.00 31.35 H new ATOM 0 HG3 ARG C 247 -13.912 13.023 0.164 1.00 31.35 H new ATOM 0 HD2 ARG C 247 -11.528 14.702 0.995 1.00 22.03 H new ATOM 0 HD3 ARG C 247 -12.589 15.039 -0.359 1.00 22.03 H new ATOM 0 HE ARG C 247 -14.322 14.915 1.812 1.00 41.10 H new ATOM 0 HH11 ARG C 247 -11.449 16.808 0.951 1.00 53.53 H new ATOM 0 HH12 ARG C 247 -11.908 18.186 1.956 1.00 53.53 H new ATOM 0 HH21 ARG C 247 -14.874 16.708 3.132 1.00 21.45 H new ATOM 0 HH22 ARG C 247 -13.827 18.130 3.178 1.00 21.45 H new ATOM 2476 N GLN C 248 -10.024 11.639 0.680 1.00 53.54 N ATOM 2477 CA GLN C 248 -9.133 10.730 0.006 1.00 65.24 C ATOM 2478 C GLN C 248 -8.015 11.507 -0.652 1.00 30.40 C ATOM 2479 O GLN C 248 -8.270 12.483 -1.352 1.00 4.03 O ATOM 2480 CB GLN C 248 -9.913 9.871 -0.997 1.00 50.34 C ATOM 2481 CG GLN C 248 -9.075 8.872 -1.768 1.00 33.34 C ATOM 2482 CD GLN C 248 -9.906 8.013 -2.697 1.00 34.14 C ATOM 2483 OE1 GLN C 248 -10.386 6.938 -2.313 1.00 4.05 O ATOM 2484 NE2 GLN C 248 -10.096 8.473 -3.910 1.00 41.14 N ATOM 0 H GLN C 248 -10.248 12.490 0.164 1.00 53.54 H new ATOM 0 HA GLN C 248 -8.682 10.050 0.728 1.00 65.24 H new ATOM 0 HB2 GLN C 248 -10.694 9.331 -0.461 1.00 50.34 H new ATOM 0 HB3 GLN C 248 -10.411 10.530 -1.708 1.00 50.34 H new ATOM 0 HG2 GLN C 248 -8.322 9.405 -2.348 1.00 33.34 H new ATOM 0 HG3 GLN C 248 -8.542 8.231 -1.066 1.00 33.34 H new ATOM 0 HE21 GLN C 248 -9.683 9.363 -4.188 1.00 41.14 H new ATOM 0 HE22 GLN C 248 -10.656 7.940 -4.575 1.00 41.14 H new ATOM 2493 N VAL C 249 -6.796 11.077 -0.425 1.00 33.42 N ATOM 2494 CA VAL C 249 -5.604 11.728 -0.953 1.00 24.14 C ATOM 2495 C VAL C 249 -4.557 10.673 -1.286 1.00 33.05 C ATOM 2496 O VAL C 249 -4.604 9.569 -0.760 1.00 34.43 O ATOM 2497 CB VAL C 249 -4.991 12.808 0.027 1.00 41.44 C ATOM 2498 CG1 VAL C 249 -5.934 13.982 0.252 1.00 22.31 C ATOM 2499 CG2 VAL C 249 -4.586 12.206 1.366 1.00 3.43 C ATOM 0 H VAL C 249 -6.594 10.252 0.140 1.00 33.42 H new ATOM 0 HA VAL C 249 -5.906 12.266 -1.852 1.00 24.14 H new ATOM 0 HB VAL C 249 -4.093 13.180 -0.467 1.00 41.44 H new ATOM 0 HG11 VAL C 249 -5.470 14.697 0.931 1.00 22.31 H new ATOM 0 HG12 VAL C 249 -6.142 14.469 -0.701 1.00 22.31 H new ATOM 0 HG13 VAL C 249 -6.866 13.622 0.687 1.00 22.31 H new ATOM 0 HG21 VAL C 249 -4.171 12.986 2.005 1.00 3.43 H new ATOM 0 HG22 VAL C 249 -5.461 11.770 1.848 1.00 3.43 H new ATOM 0 HG23 VAL C 249 -3.836 11.431 1.205 1.00 3.43 H new ATOM 2509 N CYS C 250 -3.644 10.993 -2.153 1.00 14.33 N ATOM 2510 CA CYS C 250 -2.600 10.053 -2.528 1.00 42.21 C ATOM 2511 C CYS C 250 -1.350 10.440 -1.832 1.00 21.11 C ATOM 2512 O CYS C 250 -1.046 11.566 -1.764 1.00 52.02 O ATOM 2513 CB CYS C 250 -2.367 10.058 -4.021 1.00 70.22 C ATOM 2514 SG CYS C 250 -0.959 9.047 -4.552 1.00 65.35 S ATOM 0 H CYS C 250 -3.590 11.897 -2.622 1.00 14.33 H new ATOM 0 HA CYS C 250 -2.908 9.048 -2.241 1.00 42.21 H new ATOM 0 HB2 CYS C 250 -3.267 9.699 -4.520 1.00 70.22 H new ATOM 0 HB3 CYS C 250 -2.208 11.085 -4.350 1.00 70.22 H new ATOM 2519 N ILE C 251 -0.634 9.495 -1.333 1.00 71.31 N ATOM 2520 CA ILE C 251 0.509 9.758 -0.503 1.00 61.03 C ATOM 2521 C ILE C 251 1.790 9.463 -1.272 1.00 12.00 C ATOM 2522 O ILE C 251 1.802 8.618 -2.173 1.00 3.45 O ATOM 2523 CB ILE C 251 0.458 8.858 0.767 1.00 24.43 C ATOM 2524 CG1 ILE C 251 -0.935 8.886 1.423 1.00 31.33 C ATOM 2525 CG2 ILE C 251 1.509 9.276 1.771 1.00 35.45 C ATOM 2526 CD1 ILE C 251 -1.418 10.258 1.840 1.00 10.52 C ATOM 0 H ILE C 251 -0.820 8.504 -1.486 1.00 71.31 H new ATOM 0 HA ILE C 251 0.495 10.808 -0.209 1.00 61.03 H new ATOM 0 HB ILE C 251 0.665 7.837 0.446 1.00 24.43 H new ATOM 0 HG12 ILE C 251 -1.657 8.459 0.726 1.00 31.33 H new ATOM 0 HG13 ILE C 251 -0.920 8.240 2.301 1.00 31.33 H new ATOM 0 HG21 ILE C 251 1.451 8.631 2.648 1.00 35.45 H new ATOM 0 HG22 ILE C 251 2.498 9.188 1.321 1.00 35.45 H new ATOM 0 HG23 ILE C 251 1.337 10.310 2.069 1.00 35.45 H new ATOM 0 HD11 ILE C 251 -2.407 10.174 2.291 1.00 10.52 H new ATOM 0 HD12 ILE C 251 -0.724 10.684 2.564 1.00 10.52 H new ATOM 0 HD13 ILE C 251 -1.472 10.906 0.965 1.00 10.52 H new ATOM 2538 N ASP C 252 2.845 10.179 -0.919 1.00 5.43 N ATOM 2539 CA ASP C 252 4.160 9.985 -1.503 1.00 44.13 C ATOM 2540 C ASP C 252 4.698 8.638 -1.010 1.00 21.32 C ATOM 2541 O ASP C 252 4.812 8.424 0.200 1.00 22.32 O ATOM 2542 CB ASP C 252 5.110 11.112 -1.029 1.00 4.30 C ATOM 2543 CG ASP C 252 6.452 11.152 -1.756 1.00 15.33 C ATOM 2544 OD1 ASP C 252 6.882 10.129 -2.301 1.00 13.25 O ATOM 2545 OD2 ASP C 252 7.093 12.238 -1.787 1.00 2.41 O ATOM 0 H ASP C 252 2.812 10.916 -0.214 1.00 5.43 H new ATOM 0 HA ASP C 252 4.098 10.004 -2.591 1.00 44.13 H new ATOM 0 HB2 ASP C 252 4.610 12.072 -1.161 1.00 4.30 H new ATOM 0 HB3 ASP C 252 5.292 10.992 0.039 1.00 4.30 H new ATOM 2550 N PRO C 253 5.013 7.710 -1.917 1.00 64.51 N ATOM 2551 CA PRO C 253 5.550 6.393 -1.544 1.00 22.31 C ATOM 2552 C PRO C 253 7.031 6.465 -1.143 1.00 54.04 C ATOM 2553 O PRO C 253 7.648 5.462 -0.777 1.00 44.24 O ATOM 2554 CB PRO C 253 5.399 5.587 -2.829 1.00 43.51 C ATOM 2555 CG PRO C 253 5.479 6.599 -3.921 1.00 50.23 C ATOM 2556 CD PRO C 253 4.861 7.854 -3.377 1.00 31.05 C ATOM 0 HA PRO C 253 5.035 5.967 -0.683 1.00 22.31 H new ATOM 0 HB2 PRO C 253 6.187 4.840 -2.923 1.00 43.51 H new ATOM 0 HB3 PRO C 253 4.449 5.053 -2.852 1.00 43.51 H new ATOM 0 HG2 PRO C 253 6.514 6.771 -4.216 1.00 50.23 H new ATOM 0 HG3 PRO C 253 4.947 6.256 -4.809 1.00 50.23 H new ATOM 0 HD2 PRO C 253 5.369 8.744 -3.747 1.00 31.05 H new ATOM 0 HD3 PRO C 253 3.813 7.942 -3.664 1.00 31.05 H new ATOM 2564 N LYS C 254 7.581 7.651 -1.237 1.00 43.42 N ATOM 2565 CA LYS C 254 8.961 7.913 -0.961 1.00 54.52 C ATOM 2566 C LYS C 254 9.063 8.984 0.148 1.00 73.14 C ATOM 2567 O LYS C 254 10.094 9.645 0.314 1.00 0.31 O ATOM 2568 CB LYS C 254 9.561 8.402 -2.278 1.00 13.42 C ATOM 2569 CG LYS C 254 9.408 7.374 -3.395 1.00 61.10 C ATOM 2570 CD LYS C 254 9.794 7.911 -4.754 1.00 24.24 C ATOM 2571 CE LYS C 254 11.225 8.368 -4.807 1.00 51.35 C ATOM 2572 NZ LYS C 254 11.612 8.759 -6.177 1.00 40.53 N ATOM 0 H LYS C 254 7.059 8.482 -1.517 1.00 43.42 H new ATOM 0 HA LYS C 254 9.496 7.033 -0.604 1.00 54.52 H new ATOM 0 HB2 LYS C 254 9.076 9.333 -2.573 1.00 13.42 H new ATOM 0 HB3 LYS C 254 10.618 8.625 -2.134 1.00 13.42 H new ATOM 0 HG2 LYS C 254 10.024 6.504 -3.167 1.00 61.10 H new ATOM 0 HG3 LYS C 254 8.373 7.032 -3.427 1.00 61.10 H new ATOM 0 HD2 LYS C 254 9.635 7.138 -5.505 1.00 24.24 H new ATOM 0 HD3 LYS C 254 9.140 8.744 -5.011 1.00 24.24 H new ATOM 0 HE2 LYS C 254 11.365 9.213 -4.132 1.00 51.35 H new ATOM 0 HE3 LYS C 254 11.878 7.569 -4.456 1.00 51.35 H new ATOM 0 HZ1 LYS C 254 12.604 9.070 -6.182 1.00 40.53 H new ATOM 0 HZ2 LYS C 254 11.501 7.945 -6.815 1.00 40.53 H new ATOM 0 HZ3 LYS C 254 11.004 9.538 -6.501 1.00 40.53 H new ATOM 2586 N LEU C 255 7.977 9.094 0.920 1.00 34.31 N ATOM 2587 CA LEU C 255 7.788 10.078 1.959 1.00 23.51 C ATOM 2588 C LEU C 255 8.771 9.919 3.162 1.00 54.13 C ATOM 2589 O LEU C 255 9.806 10.583 3.230 1.00 12.32 O ATOM 2590 CB LEU C 255 6.331 9.959 2.435 1.00 23.12 C ATOM 2591 CG LEU C 255 5.667 11.217 2.920 1.00 64.10 C ATOM 2592 CD1 LEU C 255 4.219 10.958 3.255 1.00 3.03 C ATOM 2593 CD2 LEU C 255 6.376 11.864 4.082 1.00 52.42 C ATOM 0 H LEU C 255 7.179 8.467 0.823 1.00 34.31 H new ATOM 0 HA LEU C 255 8.003 11.064 1.547 1.00 23.51 H new ATOM 0 HB2 LEU C 255 5.738 9.558 1.613 1.00 23.12 H new ATOM 0 HB3 LEU C 255 6.297 9.226 3.241 1.00 23.12 H new ATOM 0 HG LEU C 255 5.725 11.929 2.097 1.00 64.10 H new ATOM 0 HD11 LEU C 255 3.756 11.881 3.604 1.00 3.03 H new ATOM 0 HD12 LEU C 255 3.697 10.604 2.366 1.00 3.03 H new ATOM 0 HD13 LEU C 255 4.156 10.202 4.037 1.00 3.03 H new ATOM 0 HD21 LEU C 255 5.841 12.766 4.378 1.00 52.42 H new ATOM 0 HD22 LEU C 255 6.408 11.169 4.921 1.00 52.42 H new ATOM 0 HD23 LEU C 255 7.393 12.125 3.788 1.00 52.42 H new ATOM 2605 N LYS C 256 8.408 9.044 4.099 1.00 71.11 N ATOM 2606 CA LYS C 256 9.156 8.776 5.334 1.00 74.15 C ATOM 2607 C LYS C 256 8.403 7.786 6.178 1.00 35.33 C ATOM 2608 O LYS C 256 8.846 6.672 6.351 1.00 51.35 O ATOM 2609 CB LYS C 256 9.406 10.005 6.185 1.00 45.41 C ATOM 2610 CG LYS C 256 10.189 9.636 7.434 1.00 11.21 C ATOM 2611 CD LYS C 256 10.364 10.788 8.345 1.00 33.32 C ATOM 2612 CE LYS C 256 11.043 10.352 9.631 1.00 62.51 C ATOM 2613 NZ LYS C 256 11.254 11.470 10.562 1.00 43.31 N ATOM 0 H LYS C 256 7.560 8.483 4.020 1.00 71.11 H new ATOM 0 HA LYS C 256 10.124 8.393 5.011 1.00 74.15 H new ATOM 0 HB2 LYS C 256 9.958 10.748 5.609 1.00 45.41 H new ATOM 0 HB3 LYS C 256 8.456 10.460 6.465 1.00 45.41 H new ATOM 0 HG2 LYS C 256 9.672 8.834 7.961 1.00 11.21 H new ATOM 0 HG3 LYS C 256 11.167 9.250 7.147 1.00 11.21 H new ATOM 0 HD2 LYS C 256 10.960 11.559 7.856 1.00 33.32 H new ATOM 0 HD3 LYS C 256 9.394 11.231 8.571 1.00 33.32 H new ATOM 0 HE2 LYS C 256 10.437 9.588 10.117 1.00 62.51 H new ATOM 0 HE3 LYS C 256 12.003 9.894 9.394 1.00 62.51 H new ATOM 0 HZ1 LYS C 256 11.720 11.121 11.424 1.00 43.31 H new ATOM 0 HZ2 LYS C 256 11.855 12.189 10.111 1.00 43.31 H new ATOM 0 HZ3 LYS C 256 10.337 11.892 10.811 1.00 43.31 H new ATOM 2627 N TRP C 257 7.225 8.194 6.705 1.00 71.43 N ATOM 2628 CA TRP C 257 6.430 7.273 7.516 1.00 3.43 C ATOM 2629 C TRP C 257 5.963 6.126 6.674 1.00 62.15 C ATOM 2630 O TRP C 257 5.788 5.033 7.159 1.00 11.24 O ATOM 2631 CB TRP C 257 5.257 7.942 8.276 1.00 14.51 C ATOM 2632 CG TRP C 257 4.230 8.648 7.437 1.00 41.44 C ATOM 2633 CD1 TRP C 257 4.243 9.955 7.054 1.00 61.44 C ATOM 2634 CD2 TRP C 257 3.019 8.088 6.914 1.00 0.30 C ATOM 2635 NE1 TRP C 257 3.114 10.242 6.332 1.00 34.53 N ATOM 2636 CE2 TRP C 257 2.348 9.113 6.227 1.00 0.13 C ATOM 2637 CE3 TRP C 257 2.436 6.815 6.963 1.00 10.35 C ATOM 2638 CZ2 TRP C 257 1.126 8.912 5.597 1.00 25.42 C ATOM 2639 CZ3 TRP C 257 1.224 6.619 6.338 1.00 0.11 C ATOM 2640 CH2 TRP C 257 0.584 7.665 5.664 1.00 23.21 C ATOM 0 H TRP C 257 6.823 9.124 6.584 1.00 71.43 H new ATOM 0 HA TRP C 257 7.088 6.902 8.302 1.00 3.43 H new ATOM 0 HB2 TRP C 257 4.750 7.176 8.863 1.00 14.51 H new ATOM 0 HB3 TRP C 257 5.674 8.661 8.982 1.00 14.51 H new ATOM 0 HD1 TRP C 257 5.027 10.661 7.285 1.00 61.44 H new ATOM 0 HE1 TRP C 257 2.882 11.153 5.936 1.00 34.53 H new ATOM 0 HE3 TRP C 257 2.927 6.004 7.480 1.00 10.35 H new ATOM 0 HZ2 TRP C 257 0.626 9.714 5.074 1.00 25.42 H new ATOM 0 HZ3 TRP C 257 0.761 5.644 6.369 1.00 0.11 H new ATOM 0 HH2 TRP C 257 -0.365 7.478 5.184 1.00 23.21 H new ATOM 2651 N ILE C 258 5.786 6.397 5.387 1.00 34.25 N ATOM 2652 CA ILE C 258 5.472 5.371 4.425 1.00 31.43 C ATOM 2653 C ILE C 258 6.619 4.362 4.351 1.00 61.00 C ATOM 2654 O ILE C 258 6.385 3.162 4.316 1.00 22.43 O ATOM 2655 CB ILE C 258 5.194 5.981 3.014 1.00 43.43 C ATOM 2656 CG1 ILE C 258 3.868 6.761 3.002 1.00 50.23 C ATOM 2657 CG2 ILE C 258 5.186 4.902 1.942 1.00 73.32 C ATOM 2658 CD1 ILE C 258 2.648 5.902 3.188 1.00 42.21 C ATOM 0 H ILE C 258 5.858 7.334 4.991 1.00 34.25 H new ATOM 0 HA ILE C 258 4.565 4.862 4.751 1.00 31.43 H new ATOM 0 HB ILE C 258 6.003 6.677 2.790 1.00 43.43 H new ATOM 0 HG12 ILE C 258 3.894 7.512 3.791 1.00 50.23 H new ATOM 0 HG13 ILE C 258 3.782 7.295 2.056 1.00 50.23 H new ATOM 0 HG21 ILE C 258 4.990 5.356 0.970 1.00 73.32 H new ATOM 0 HG22 ILE C 258 6.155 4.403 1.921 1.00 73.32 H new ATOM 0 HG23 ILE C 258 4.407 4.173 2.165 1.00 73.32 H new ATOM 0 HD11 ILE C 258 1.756 6.528 3.167 1.00 42.21 H new ATOM 0 HD12 ILE C 258 2.595 5.167 2.385 1.00 42.21 H new ATOM 0 HD13 ILE C 258 2.708 5.387 4.147 1.00 42.21 H new ATOM 2670 N GLN C 259 7.851 4.865 4.401 1.00 54.41 N ATOM 2671 CA GLN C 259 9.027 4.019 4.261 1.00 21.33 C ATOM 2672 C GLN C 259 9.107 3.116 5.459 1.00 55.32 C ATOM 2673 O GLN C 259 9.207 1.909 5.325 1.00 22.23 O ATOM 2674 CB GLN C 259 10.334 4.840 4.175 1.00 62.34 C ATOM 2675 CG GLN C 259 10.280 6.101 3.309 1.00 13.30 C ATOM 2676 CD GLN C 259 9.547 5.927 2.012 1.00 61.44 C ATOM 2677 OE1 GLN C 259 10.222 5.506 1.003 1.00 25.32 O flip ATOM 2678 NE2 GLN C 259 8.352 6.175 1.948 1.00 73.10 N flip ATOM 0 H GLN C 259 8.057 5.855 4.538 1.00 54.41 H new ATOM 0 HA GLN C 259 8.927 3.454 3.334 1.00 21.33 H new ATOM 0 HB2 GLN C 259 10.625 5.129 5.185 1.00 62.34 H new ATOM 0 HB3 GLN C 259 11.122 4.192 3.790 1.00 62.34 H new ATOM 0 HG2 GLN C 259 9.803 6.899 3.878 1.00 13.30 H new ATOM 0 HG3 GLN C 259 11.299 6.426 3.097 1.00 13.30 H new ATOM 0 HE21 GLN C 259 7.855 6.507 2.774 1.00 73.10 H new ATOM 0 HE22 GLN C 259 7.852 6.050 1.068 1.00 73.10 H new ATOM 2687 N GLU C 260 9.005 3.734 6.630 1.00 52.00 N ATOM 2688 CA GLU C 260 9.024 3.044 7.916 1.00 63.34 C ATOM 2689 C GLU C 260 7.950 1.963 7.922 1.00 24.24 C ATOM 2690 O GLU C 260 8.176 0.834 8.339 1.00 11.24 O ATOM 2691 CB GLU C 260 8.679 4.051 9.027 1.00 73.21 C ATOM 2692 CG GLU C 260 9.597 5.268 9.143 1.00 52.55 C ATOM 2693 CD GLU C 260 10.977 4.922 9.609 1.00 23.04 C ATOM 2694 OE1 GLU C 260 11.837 4.578 8.781 1.00 12.33 O ATOM 2695 OE2 GLU C 260 11.225 5.017 10.825 1.00 70.03 O ATOM 0 H GLU C 260 8.905 4.746 6.715 1.00 52.00 H new ATOM 0 HA GLU C 260 10.009 2.607 8.078 1.00 63.34 H new ATOM 0 HB2 GLU C 260 7.661 4.404 8.865 1.00 73.21 H new ATOM 0 HB3 GLU C 260 8.686 3.524 9.981 1.00 73.21 H new ATOM 0 HG2 GLU C 260 9.661 5.761 8.173 1.00 52.55 H new ATOM 0 HG3 GLU C 260 9.155 5.984 9.836 1.00 52.55 H new ATOM 2702 N TYR C 261 6.793 2.335 7.433 1.00 42.03 N ATOM 2703 CA TYR C 261 5.640 1.491 7.406 1.00 11.41 C ATOM 2704 C TYR C 261 5.887 0.266 6.499 1.00 55.40 C ATOM 2705 O TYR C 261 5.685 -0.885 6.922 1.00 4.31 O ATOM 2706 CB TYR C 261 4.454 2.315 6.913 1.00 42.23 C ATOM 2707 CG TYR C 261 3.135 1.685 7.143 1.00 40.34 C ATOM 2708 CD1 TYR C 261 2.507 1.826 8.366 1.00 62.44 C ATOM 2709 CD2 TYR C 261 2.513 0.953 6.162 1.00 30.03 C ATOM 2710 CE1 TYR C 261 1.296 1.251 8.607 1.00 50.45 C ATOM 2711 CE2 TYR C 261 1.307 0.369 6.392 1.00 52.21 C ATOM 2712 CZ TYR C 261 0.697 0.518 7.613 1.00 44.10 C ATOM 2713 OH TYR C 261 -0.508 -0.093 7.844 1.00 21.34 O ATOM 0 H TYR C 261 6.630 3.259 7.034 1.00 42.03 H new ATOM 0 HA TYR C 261 5.427 1.113 8.406 1.00 11.41 H new ATOM 0 HB2 TYR C 261 4.471 3.286 7.408 1.00 42.23 H new ATOM 0 HB3 TYR C 261 4.574 2.499 5.845 1.00 42.23 H new ATOM 0 HD1 TYR C 261 2.985 2.402 9.144 1.00 62.44 H new ATOM 0 HD2 TYR C 261 2.987 0.840 5.198 1.00 30.03 H new ATOM 0 HE1 TYR C 261 0.814 1.370 9.566 1.00 50.45 H new ATOM 0 HE2 TYR C 261 0.830 -0.211 5.616 1.00 52.21 H new ATOM 0 HH TYR C 261 -1.222 0.578 7.835 1.00 21.34 H new ATOM 2723 N LEU C 262 6.345 0.526 5.270 1.00 41.15 N ATOM 2724 CA LEU C 262 6.662 -0.531 4.300 1.00 64.42 C ATOM 2725 C LEU C 262 7.746 -1.451 4.862 1.00 41.31 C ATOM 2726 O LEU C 262 7.613 -2.678 4.846 1.00 20.23 O ATOM 2727 CB LEU C 262 7.150 0.078 2.963 1.00 50.22 C ATOM 2728 CG LEU C 262 6.176 1.010 2.216 1.00 61.51 C ATOM 2729 CD1 LEU C 262 6.824 1.573 0.959 1.00 51.42 C ATOM 2730 CD2 LEU C 262 4.895 0.284 1.854 1.00 44.02 C ATOM 0 H LEU C 262 6.506 1.470 4.919 1.00 41.15 H new ATOM 0 HA LEU C 262 5.754 -1.105 4.116 1.00 64.42 H new ATOM 0 HB2 LEU C 262 8.066 0.635 3.160 1.00 50.22 H new ATOM 0 HB3 LEU C 262 7.413 -0.742 2.294 1.00 50.22 H new ATOM 0 HG LEU C 262 5.930 1.834 2.886 1.00 61.51 H new ATOM 0 HD11 LEU C 262 6.118 2.228 0.448 1.00 51.42 H new ATOM 0 HD12 LEU C 262 7.714 2.140 1.231 1.00 51.42 H new ATOM 0 HD13 LEU C 262 7.105 0.754 0.296 1.00 51.42 H new ATOM 0 HD21 LEU C 262 4.227 0.966 1.328 1.00 44.02 H new ATOM 0 HD22 LEU C 262 5.127 -0.565 1.211 1.00 44.02 H new ATOM 0 HD23 LEU C 262 4.409 -0.071 2.763 1.00 44.02 H new ATOM 2742 N GLU C 263 8.803 -0.837 5.375 1.00 12.33 N ATOM 2743 CA GLU C 263 9.932 -1.539 5.962 1.00 11.22 C ATOM 2744 C GLU C 263 9.556 -2.417 7.160 1.00 73.31 C ATOM 2745 O GLU C 263 10.174 -3.456 7.381 1.00 62.13 O ATOM 2746 CB GLU C 263 11.031 -0.553 6.341 1.00 31.12 C ATOM 2747 CG GLU C 263 11.716 0.088 5.152 1.00 25.12 C ATOM 2748 CD GLU C 263 12.851 0.980 5.563 1.00 43.45 C ATOM 2749 OE1 GLU C 263 12.617 2.148 5.882 1.00 34.45 O ATOM 2750 OE2 GLU C 263 14.008 0.506 5.599 1.00 45.01 O ATOM 0 H GLU C 263 8.900 0.178 5.395 1.00 12.33 H new ATOM 0 HA GLU C 263 10.301 -2.220 5.195 1.00 11.22 H new ATOM 0 HB2 GLU C 263 10.603 0.230 6.967 1.00 31.12 H new ATOM 0 HB3 GLU C 263 11.778 -1.070 6.943 1.00 31.12 H new ATOM 0 HG2 GLU C 263 12.091 -0.691 4.488 1.00 25.12 H new ATOM 0 HG3 GLU C 263 10.988 0.668 4.585 1.00 25.12 H new ATOM 2757 N LYS C 264 8.562 -2.016 7.925 1.00 52.10 N ATOM 2758 CA LYS C 264 8.177 -2.811 9.086 1.00 50.23 C ATOM 2759 C LYS C 264 7.173 -3.907 8.750 1.00 54.21 C ATOM 2760 O LYS C 264 7.335 -5.043 9.200 1.00 3.31 O ATOM 2761 CB LYS C 264 7.704 -1.949 10.266 1.00 42.10 C ATOM 2762 CG LYS C 264 8.759 -0.973 10.787 1.00 23.13 C ATOM 2763 CD LYS C 264 10.058 -1.690 11.136 1.00 73.41 C ATOM 2764 CE LYS C 264 11.102 -0.726 11.649 1.00 61.11 C ATOM 2765 NZ LYS C 264 12.411 -1.385 11.877 1.00 74.00 N ATOM 0 H LYS C 264 8.015 -1.168 7.776 1.00 52.10 H new ATOM 0 HA LYS C 264 9.089 -3.313 9.408 1.00 50.23 H new ATOM 0 HB2 LYS C 264 6.822 -1.386 9.960 1.00 42.10 H new ATOM 0 HB3 LYS C 264 7.397 -2.604 11.081 1.00 42.10 H new ATOM 0 HG2 LYS C 264 8.954 -0.210 10.033 1.00 23.13 H new ATOM 0 HG3 LYS C 264 8.377 -0.459 11.669 1.00 23.13 H new ATOM 0 HD2 LYS C 264 9.863 -2.452 11.891 1.00 73.41 H new ATOM 0 HD3 LYS C 264 10.439 -2.205 10.254 1.00 73.41 H new ATOM 0 HE2 LYS C 264 11.226 0.087 10.933 1.00 61.11 H new ATOM 0 HE3 LYS C 264 10.755 -0.280 12.581 1.00 61.11 H new ATOM 0 HZ1 LYS C 264 13.095 -0.685 12.228 1.00 74.00 H new ATOM 0 HZ2 LYS C 264 12.300 -2.144 12.580 1.00 74.00 H new ATOM 0 HZ3 LYS C 264 12.757 -1.789 10.983 1.00 74.00 H new ATOM 2779 N CYS C 265 6.166 -3.584 7.928 1.00 21.45 N ATOM 2780 CA CYS C 265 5.117 -4.562 7.522 1.00 42.22 C ATOM 2781 C CYS C 265 5.741 -5.739 6.751 1.00 50.21 C ATOM 2782 O CYS C 265 5.158 -6.817 6.636 1.00 10.23 O ATOM 2783 CB CYS C 265 4.036 -3.855 6.671 1.00 12.44 C ATOM 2784 SG CYS C 265 2.657 -4.921 6.083 1.00 62.50 S ATOM 0 H CYS C 265 6.045 -2.655 7.524 1.00 21.45 H new ATOM 0 HA CYS C 265 4.645 -4.963 8.419 1.00 42.22 H new ATOM 0 HB2 CYS C 265 3.615 -3.039 7.258 1.00 12.44 H new ATOM 0 HB3 CYS C 265 4.519 -3.407 5.803 1.00 12.44 H new ATOM 2789 N LEU C 266 6.951 -5.501 6.261 1.00 31.04 N ATOM 2790 CA LEU C 266 7.759 -6.436 5.540 1.00 70.41 C ATOM 2791 C LEU C 266 8.001 -7.721 6.393 1.00 15.50 C ATOM 2792 O LEU C 266 8.101 -8.824 5.856 1.00 24.54 O ATOM 2793 CB LEU C 266 9.094 -5.702 5.270 1.00 61.45 C ATOM 2794 CG LEU C 266 10.056 -6.211 4.197 1.00 24.33 C ATOM 2795 CD1 LEU C 266 10.568 -7.602 4.445 1.00 2.32 C ATOM 2796 CD2 LEU C 266 9.492 -6.034 2.807 1.00 63.14 C ATOM 0 H LEU C 266 7.407 -4.595 6.370 1.00 31.04 H new ATOM 0 HA LEU C 266 7.280 -6.758 4.615 1.00 70.41 H new ATOM 0 HB2 LEU C 266 8.849 -4.670 5.019 1.00 61.45 H new ATOM 0 HB3 LEU C 266 9.644 -5.679 6.211 1.00 61.45 H new ATOM 0 HG LEU C 266 10.940 -5.577 4.268 1.00 24.33 H new ATOM 0 HD11 LEU C 266 11.244 -7.890 3.640 1.00 2.32 H new ATOM 0 HD12 LEU C 266 11.102 -7.629 5.395 1.00 2.32 H new ATOM 0 HD13 LEU C 266 9.729 -8.297 4.481 1.00 2.32 H new ATOM 0 HD21 LEU C 266 10.207 -6.408 2.074 1.00 63.14 H new ATOM 0 HD22 LEU C 266 8.558 -6.589 2.720 1.00 63.14 H new ATOM 0 HD23 LEU C 266 9.304 -4.976 2.623 1.00 63.14 H new ATOM 2808 N ASN C 267 8.076 -7.572 7.711 1.00 21.21 N ATOM 2809 CA ASN C 267 8.411 -8.714 8.559 1.00 74.31 C ATOM 2810 C ASN C 267 7.746 -8.657 9.937 1.00 22.43 C ATOM 2811 O ASN C 267 7.058 -9.603 10.335 1.00 1.23 O ATOM 2812 CB ASN C 267 9.944 -8.827 8.710 1.00 12.23 C ATOM 2813 CG ASN C 267 10.392 -9.956 9.641 1.00 54.00 C ATOM 2814 OD1 ASN C 267 10.522 -9.758 10.846 1.00 62.31 O ATOM 2815 ND2 ASN C 267 10.673 -11.114 9.098 1.00 33.22 N ATOM 0 H ASN C 267 7.914 -6.696 8.207 1.00 21.21 H new ATOM 0 HA ASN C 267 8.019 -9.602 8.062 1.00 74.31 H new ATOM 0 HB2 ASN C 267 10.386 -8.983 7.726 1.00 12.23 H new ATOM 0 HB3 ASN C 267 10.333 -7.881 9.088 1.00 12.23 H new ATOM 0 HD21 ASN C 267 11.010 -11.882 9.679 1.00 33.22 H new ATOM 0 HD22 ASN C 267 10.555 -11.248 8.094 1.00 33.22 H new ATOM 2822 N LYS C 268 7.938 -7.539 10.651 1.00 13.43 N ATOM 2823 CA LYS C 268 7.485 -7.401 12.052 1.00 32.32 C ATOM 2824 C LYS C 268 7.988 -8.535 12.936 1.00 12.34 C ATOM 2825 O LYS C 268 9.162 -8.537 13.343 1.00 21.12 O ATOM 2826 CB LYS C 268 5.963 -7.217 12.210 1.00 74.33 C ATOM 2827 CG LYS C 268 5.402 -5.894 11.685 1.00 54.21 C ATOM 2828 CD LYS C 268 6.090 -4.668 12.325 1.00 62.32 C ATOM 2829 CE LYS C 268 6.017 -4.650 13.864 1.00 31.52 C ATOM 2830 NZ LYS C 268 4.641 -4.585 14.388 1.00 2.12 N ATOM 0 H LYS C 268 8.406 -6.710 10.283 1.00 13.43 H new ATOM 0 HA LYS C 268 7.939 -6.471 12.394 1.00 32.32 H new ATOM 0 HB2 LYS C 268 5.460 -8.035 11.694 1.00 74.33 H new ATOM 0 HB3 LYS C 268 5.712 -7.304 13.267 1.00 74.33 H new ATOM 0 HG2 LYS C 268 5.527 -5.853 10.603 1.00 54.21 H new ATOM 0 HG3 LYS C 268 4.331 -5.852 11.884 1.00 54.21 H new ATOM 0 HD2 LYS C 268 7.136 -4.649 12.019 1.00 62.32 H new ATOM 0 HD3 LYS C 268 5.628 -3.760 11.938 1.00 62.32 H new ATOM 0 HE2 LYS C 268 6.503 -5.545 14.253 1.00 31.52 H new ATOM 0 HE3 LYS C 268 6.580 -3.794 14.236 1.00 31.52 H new ATOM 0 HZ1 LYS C 268 4.666 -4.576 15.428 1.00 2.12 H new ATOM 0 HZ2 LYS C 268 4.180 -3.718 14.045 1.00 2.12 H new ATOM 0 HZ3 LYS C 268 4.106 -5.415 14.061 1.00 2.12 H new ATOM 2914 N ILE D 306 3.737 -5.612 -12.058 1.00 65.42 N ATOM 2915 CA ILE D 306 2.601 -5.108 -11.329 1.00 21.32 C ATOM 2916 C ILE D 306 1.457 -6.134 -11.139 1.00 12.41 C ATOM 2917 O ILE D 306 1.643 -7.330 -11.328 1.00 14.41 O ATOM 2918 CB ILE D 306 2.112 -3.740 -11.868 1.00 64.00 C ATOM 2919 CG1 ILE D 306 1.480 -3.812 -13.266 1.00 10.43 C ATOM 2920 CG2 ILE D 306 3.275 -2.749 -11.863 1.00 52.32 C ATOM 2921 CD1 ILE D 306 0.925 -2.488 -13.754 1.00 11.13 C ATOM 0 HA ILE D 306 2.969 -4.929 -10.319 1.00 21.32 H new ATOM 0 HB ILE D 306 1.318 -3.404 -11.201 1.00 64.00 H new ATOM 0 HG12 ILE D 306 2.228 -4.166 -13.975 1.00 10.43 H new ATOM 0 HG13 ILE D 306 0.678 -4.550 -13.255 1.00 10.43 H new ATOM 0 HG21 ILE D 306 2.934 -1.786 -12.242 1.00 52.32 H new ATOM 0 HG22 ILE D 306 3.646 -2.628 -10.845 1.00 52.32 H new ATOM 0 HG23 ILE D 306 4.077 -3.125 -12.499 1.00 52.32 H new ATOM 0 HD11 ILE D 306 0.495 -2.618 -14.747 1.00 11.13 H new ATOM 0 HD12 ILE D 306 0.153 -2.142 -13.067 1.00 11.13 H new ATOM 0 HD13 ILE D 306 1.727 -1.752 -13.799 1.00 11.13 H new ATOM 2933 N TYR D 307 0.298 -5.665 -10.709 1.00 13.55 N ATOM 2934 CA TYR D 307 -0.841 -6.543 -10.461 1.00 14.00 C ATOM 2935 C TYR D 307 -1.569 -6.856 -11.776 1.00 34.43 C ATOM 2936 O TYR D 307 -2.485 -7.662 -11.809 1.00 71.10 O ATOM 2937 CB TYR D 307 -1.837 -5.842 -9.559 1.00 3.01 C ATOM 2938 CG TYR D 307 -1.315 -5.275 -8.278 1.00 43.14 C ATOM 2939 CD1 TYR D 307 -1.182 -6.056 -7.151 1.00 73.11 C ATOM 2940 CD2 TYR D 307 -1.018 -3.942 -8.184 1.00 41.44 C ATOM 2941 CE1 TYR D 307 -0.771 -5.524 -5.967 1.00 21.22 C ATOM 2942 CE2 TYR D 307 -0.592 -3.404 -7.013 1.00 75.33 C ATOM 2943 CZ TYR D 307 -0.475 -4.200 -5.901 1.00 24.40 C ATOM 2944 OH TYR D 307 -0.087 -3.656 -4.718 1.00 31.13 O ATOM 0 H TYR D 307 0.117 -4.679 -10.523 1.00 13.55 H new ATOM 0 HA TYR D 307 -0.468 -7.458 -10.002 1.00 14.00 H new ATOM 0 HB2 TYR D 307 -2.294 -5.031 -10.126 1.00 3.01 H new ATOM 0 HB3 TYR D 307 -2.630 -6.549 -9.317 1.00 3.01 H new ATOM 0 HD1 TYR D 307 -1.408 -7.111 -7.208 1.00 73.11 H new ATOM 0 HD2 TYR D 307 -1.124 -3.310 -9.053 1.00 41.44 H new ATOM 0 HE1 TYR D 307 -0.681 -6.148 -5.090 1.00 21.22 H new ATOM 0 HE2 TYR D 307 -0.346 -2.354 -6.956 1.00 75.33 H new ATOM 0 HH TYR D 307 0.870 -3.447 -4.752 1.00 31.13 H new ATOM 2954 N THR D 308 -1.129 -6.211 -12.844 1.00 40.43 N ATOM 2955 CA THR D 308 -1.777 -6.244 -14.155 1.00 63.41 C ATOM 2956 C THR D 308 -3.233 -5.748 -14.089 1.00 74.20 C ATOM 2957 O THR D 308 -4.189 -6.521 -13.973 1.00 2.12 O ATOM 2958 CB THR D 308 -1.625 -7.600 -14.941 1.00 4.43 C ATOM 2959 OG1 THR D 308 -2.086 -8.725 -14.165 1.00 23.12 O ATOM 2960 CG2 THR D 308 -0.175 -7.826 -15.343 1.00 64.54 C ATOM 0 H THR D 308 -0.289 -5.633 -12.828 1.00 40.43 H new ATOM 0 HA THR D 308 -1.217 -5.532 -14.761 1.00 63.41 H new ATOM 0 HB THR D 308 -2.245 -7.522 -15.834 1.00 4.43 H new ATOM 0 HG1 THR D 308 -2.576 -8.402 -13.380 1.00 23.12 H new ATOM 0 HG21 THR D 308 -0.090 -8.768 -15.885 1.00 64.54 H new ATOM 0 HG22 THR D 308 0.157 -7.008 -15.983 1.00 64.54 H new ATOM 0 HG23 THR D 308 0.449 -7.864 -14.450 1.00 64.54 H new ATOM 2968 N SER D 309 -3.383 -4.443 -14.083 1.00 64.50 N ATOM 2969 CA SER D 309 -4.677 -3.821 -13.993 1.00 23.35 C ATOM 2970 C SER D 309 -4.797 -2.727 -15.040 1.00 50.40 C ATOM 2971 O SER D 309 -3.928 -1.850 -15.137 1.00 3.45 O ATOM 2972 CB SER D 309 -4.872 -3.249 -12.592 1.00 1.25 C ATOM 2973 OG SER D 309 -4.730 -4.266 -11.617 1.00 60.13 O ATOM 0 H SER D 309 -2.606 -3.784 -14.141 1.00 64.50 H new ATOM 0 HA SER D 309 -5.453 -4.563 -14.179 1.00 23.35 H new ATOM 0 HB2 SER D 309 -4.143 -2.459 -12.411 1.00 1.25 H new ATOM 0 HB3 SER D 309 -5.860 -2.796 -12.512 1.00 1.25 H new ATOM 0 HG SER D 309 -5.381 -4.978 -11.790 1.00 60.13 H new ATOM 2979 N ASP D 310 -5.867 -2.781 -15.808 1.00 53.15 N ATOM 2980 CA ASP D 310 -6.118 -1.848 -16.919 1.00 1.11 C ATOM 2981 C ASP D 310 -6.242 -0.451 -16.392 1.00 41.13 C ATOM 2982 O ASP D 310 -5.656 0.493 -16.923 1.00 52.44 O ATOM 2983 CB ASP D 310 -7.434 -2.197 -17.616 1.00 73.52 C ATOM 2984 CG ASP D 310 -7.549 -3.644 -17.953 1.00 41.52 C ATOM 2985 OD1 ASP D 310 -6.954 -4.094 -18.948 1.00 73.15 O ATOM 2986 OD2 ASP D 310 -8.211 -4.378 -17.184 1.00 23.25 O ATOM 0 H ASP D 310 -6.603 -3.477 -15.687 1.00 53.15 H new ATOM 0 HA ASP D 310 -5.286 -1.924 -17.619 1.00 1.11 H new ATOM 0 HB2 ASP D 310 -8.266 -1.912 -16.972 1.00 73.52 H new ATOM 0 HB3 ASP D 310 -7.522 -1.609 -18.529 1.00 73.52 H new ATOM 2991 N ASN D 311 -6.996 -0.332 -15.316 1.00 33.00 N ATOM 2992 CA ASN D 311 -7.285 0.957 -14.689 1.00 63.03 C ATOM 2993 C ASN D 311 -6.052 1.642 -14.157 1.00 62.24 C ATOM 2994 O ASN D 311 -6.024 2.860 -14.019 1.00 65.12 O ATOM 2995 CB ASN D 311 -8.344 0.826 -13.586 1.00 35.33 C ATOM 2996 CG ASN D 311 -9.701 0.443 -14.127 1.00 42.03 C ATOM 2997 OD1 ASN D 311 -10.498 1.310 -14.486 1.00 42.35 O ATOM 2998 ND2 ASN D 311 -9.990 -0.839 -14.189 1.00 63.22 N ATOM 0 H ASN D 311 -7.430 -1.126 -14.845 1.00 33.00 H new ATOM 0 HA ASN D 311 -7.686 1.589 -15.481 1.00 63.03 H new ATOM 0 HB2 ASN D 311 -8.020 0.077 -12.864 1.00 35.33 H new ATOM 0 HB3 ASN D 311 -8.424 1.772 -13.050 1.00 35.33 H new ATOM 0 HD21 ASN D 311 -10.898 -1.141 -14.543 1.00 63.22 H new ATOM 0 HD22 ASN D 311 -9.306 -1.531 -13.883 1.00 63.22 H new ATOM 3124 N TYR D 321 1.183 17.691 -2.532 1.00 32.35 N ATOM 3125 CA TYR D 321 0.572 18.419 -1.419 1.00 15.40 C ATOM 3126 C TYR D 321 1.461 19.602 -0.993 1.00 63.32 C ATOM 3127 O TYR D 321 0.959 20.633 -0.547 1.00 24.52 O ATOM 3128 CB TYR D 321 0.445 17.437 -0.219 1.00 51.02 C ATOM 3129 CG TYR D 321 -0.447 17.839 0.965 1.00 13.35 C ATOM 3130 CD1 TYR D 321 -0.220 18.966 1.723 1.00 1.45 C ATOM 3131 CD2 TYR D 321 -1.497 17.022 1.323 1.00 40.45 C ATOM 3132 CE1 TYR D 321 -1.031 19.265 2.810 1.00 44.44 C ATOM 3133 CE2 TYR D 321 -2.317 17.291 2.381 1.00 14.02 C ATOM 3134 CZ TYR D 321 -2.084 18.418 3.133 1.00 42.32 C ATOM 3135 OH TYR D 321 -2.893 18.699 4.211 1.00 62.24 O ATOM 0 HA TYR D 321 -0.401 18.803 -1.725 1.00 15.40 H new ATOM 0 HB2 TYR D 321 0.075 16.487 -0.605 1.00 51.02 H new ATOM 0 HB3 TYR D 321 1.448 17.255 0.168 1.00 51.02 H new ATOM 0 HD1 TYR D 321 0.598 19.625 1.469 1.00 1.45 H new ATOM 0 HD2 TYR D 321 -1.679 16.130 0.742 1.00 40.45 H new ATOM 0 HE1 TYR D 321 -0.844 20.150 3.400 1.00 44.44 H new ATOM 0 HE2 TYR D 321 -3.135 16.629 2.623 1.00 14.02 H new ATOM 0 HH TYR D 321 -3.580 18.005 4.294 1.00 62.24 H new ATOM 3145 N ASP D 322 2.765 19.473 -1.163 1.00 21.34 N ATOM 3146 CA ASP D 322 3.692 20.468 -0.597 1.00 53.44 C ATOM 3147 C ASP D 322 5.051 20.445 -1.271 1.00 44.31 C ATOM 3148 O ASP D 322 5.526 21.461 -1.786 1.00 71.02 O ATOM 3149 CB ASP D 322 3.868 20.200 0.904 1.00 41.14 C ATOM 3150 CG ASP D 322 4.872 21.116 1.559 1.00 15.43 C ATOM 3151 OD1 ASP D 322 4.498 22.243 1.933 1.00 63.34 O ATOM 3152 OD2 ASP D 322 6.031 20.711 1.731 1.00 1.41 O ATOM 0 H ASP D 322 3.210 18.711 -1.675 1.00 21.34 H new ATOM 0 HA ASP D 322 3.258 21.453 -0.767 1.00 53.44 H new ATOM 0 HB2 ASP D 322 2.905 20.313 1.402 1.00 41.14 H new ATOM 0 HB3 ASP D 322 4.182 19.166 1.047 1.00 41.14 H new ATOM 3157 N SER D 323 5.661 19.293 -1.256 1.00 12.43 N ATOM 3158 CA SER D 323 6.979 19.079 -1.802 1.00 21.24 C ATOM 3159 C SER D 323 7.008 17.693 -2.431 1.00 60.11 C ATOM 3160 O SER D 323 5.959 17.084 -2.584 1.00 10.32 O ATOM 3161 CB SER D 323 8.011 19.145 -0.658 1.00 32.34 C ATOM 3162 OG SER D 323 8.009 20.417 -0.018 1.00 23.40 O ATOM 0 H SER D 323 5.247 18.452 -0.854 1.00 12.43 H new ATOM 0 HA SER D 323 7.217 19.838 -2.548 1.00 21.24 H new ATOM 0 HB2 SER D 323 7.791 18.369 0.075 1.00 32.34 H new ATOM 0 HB3 SER D 323 9.006 18.938 -1.053 1.00 32.34 H new ATOM 0 HG SER D 323 7.145 20.561 0.421 1.00 23.40 H new ATOM 3168 N MET D 324 8.187 17.221 -2.797 1.00 72.51 N ATOM 3169 CA MET D 324 8.372 15.861 -3.301 1.00 3.21 C ATOM 3170 C MET D 324 9.593 15.258 -2.613 1.00 14.50 C ATOM 3171 O MET D 324 10.651 15.911 -2.521 1.00 32.21 O ATOM 3172 CB MET D 324 8.519 15.835 -4.841 1.00 4.34 C ATOM 3173 CG MET D 324 9.675 16.663 -5.397 1.00 61.41 C ATOM 3174 SD MET D 324 9.781 16.594 -7.202 1.00 22.31 S ATOM 3175 CE MET D 324 11.181 17.674 -7.494 1.00 31.14 C ATOM 0 H MET D 324 9.048 17.767 -2.755 1.00 72.51 H new ATOM 0 HA MET D 324 7.488 15.265 -3.071 1.00 3.21 H new ATOM 0 HB2 MET D 324 8.647 14.801 -5.160 1.00 4.34 H new ATOM 0 HB3 MET D 324 7.590 16.193 -5.285 1.00 4.34 H new ATOM 0 HG2 MET D 324 9.557 17.700 -5.084 1.00 61.41 H new ATOM 0 HG3 MET D 324 10.611 16.305 -4.969 1.00 61.41 H new ATOM 0 HE1 MET D 324 11.375 17.737 -8.565 1.00 31.14 H new ATOM 0 HE2 MET D 324 10.960 18.669 -7.106 1.00 31.14 H new ATOM 0 HE3 MET D 324 12.060 17.275 -6.989 1.00 31.14 H new ATOM 3185 N LYS D 325 9.464 14.052 -2.094 1.00 43.14 N ATOM 3186 CA LYS D 325 10.554 13.466 -1.332 1.00 52.44 C ATOM 3187 C LYS D 325 11.132 12.210 -1.975 1.00 41.53 C ATOM 3188 O LYS D 325 10.700 11.784 -3.059 1.00 1.14 O ATOM 3189 CB LYS D 325 10.126 13.201 0.116 1.00 63.50 C ATOM 3190 CG LYS D 325 9.703 14.464 0.864 1.00 52.11 C ATOM 3191 CD LYS D 325 9.346 14.186 2.315 1.00 15.04 C ATOM 3192 CE LYS D 325 10.547 13.661 3.083 1.00 41.44 C ATOM 3193 NZ LYS D 325 10.261 13.470 4.516 1.00 65.21 N ATOM 0 H LYS D 325 8.633 13.467 -2.182 1.00 43.14 H new ATOM 0 HA LYS D 325 11.359 14.201 -1.330 1.00 52.44 H new ATOM 0 HB2 LYS D 325 9.298 12.492 0.118 1.00 63.50 H new ATOM 0 HB3 LYS D 325 10.951 12.730 0.651 1.00 63.50 H new ATOM 0 HG2 LYS D 325 10.512 15.194 0.825 1.00 52.11 H new ATOM 0 HG3 LYS D 325 8.846 14.911 0.361 1.00 52.11 H new ATOM 0 HD2 LYS D 325 8.981 15.100 2.784 1.00 15.04 H new ATOM 0 HD3 LYS D 325 8.535 13.459 2.360 1.00 15.04 H new ATOM 0 HE2 LYS D 325 10.865 12.713 2.650 1.00 41.44 H new ATOM 0 HE3 LYS D 325 11.378 14.357 2.971 1.00 41.44 H new ATOM 0 HZ1 LYS D 325 11.111 13.111 4.995 1.00 65.21 H new ATOM 0 HZ2 LYS D 325 9.983 14.379 4.939 1.00 65.21 H new ATOM 0 HZ3 LYS D 325 9.486 12.785 4.627 1.00 65.21 H new ATOM 3207 N GLU D 326 12.127 11.646 -1.307 1.00 70.54 N ATOM 3208 CA GLU D 326 12.831 10.469 -1.732 1.00 23.21 C ATOM 3209 C GLU D 326 13.532 9.907 -0.503 1.00 13.23 C ATOM 3210 O GLU D 326 14.102 10.683 0.281 1.00 65.03 O ATOM 3211 CB GLU D 326 13.905 10.835 -2.769 1.00 22.32 C ATOM 3212 CG GLU D 326 14.626 9.631 -3.370 1.00 23.42 C ATOM 3213 CD GLU D 326 15.806 10.017 -4.219 1.00 1.13 C ATOM 3214 OE1 GLU D 326 15.620 10.645 -5.275 1.00 52.13 O ATOM 3215 OE2 GLU D 326 16.950 9.718 -3.825 1.00 50.21 O ATOM 0 H GLU D 326 12.471 12.018 -0.422 1.00 70.54 H new ATOM 0 HA GLU D 326 12.138 9.755 -2.176 1.00 23.21 H new ATOM 0 HB2 GLU D 326 13.439 11.405 -3.573 1.00 22.32 H new ATOM 0 HB3 GLU D 326 14.640 11.488 -2.300 1.00 22.32 H new ATOM 0 HG2 GLU D 326 14.963 8.977 -2.565 1.00 23.42 H new ATOM 0 HG3 GLU D 326 13.923 9.057 -3.974 1.00 23.42 H new ATOM 3222 N PRO D 327 13.487 8.591 -0.282 1.00 45.30 N ATOM 3223 CA PRO D 327 14.206 7.958 0.814 1.00 41.41 C ATOM 3224 C PRO D 327 15.706 7.925 0.514 1.00 21.12 C ATOM 3225 O PRO D 327 16.219 7.022 -0.155 1.00 13.14 O ATOM 3226 CB PRO D 327 13.638 6.549 0.827 1.00 22.25 C ATOM 3227 CG PRO D 327 13.327 6.327 -0.599 1.00 2.34 C ATOM 3228 CD PRO D 327 12.729 7.611 -1.060 1.00 21.32 C ATOM 0 HA PRO D 327 14.092 8.478 1.765 1.00 41.41 H new ATOM 0 HB2 PRO D 327 14.358 5.823 1.205 1.00 22.25 H new ATOM 0 HB3 PRO D 327 12.750 6.473 1.454 1.00 22.25 H new ATOM 0 HG2 PRO D 327 14.225 6.082 -1.167 1.00 2.34 H new ATOM 0 HG3 PRO D 327 12.632 5.497 -0.728 1.00 2.34 H new ATOM 0 HD2 PRO D 327 12.852 7.757 -2.133 1.00 21.32 H new ATOM 0 HD3 PRO D 327 11.660 7.662 -0.852 1.00 21.32 H new