USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=34 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 87:sc= 2 USER MOD Set 1.2: C 230 ASN : amide:sc= 0.935 K(o=2.7,f=-1.3) USER MOD Set 1.3: D 307 TYR OH : rot 68:sc= -0.248! USER MOD Set 2.1: C 222 ASN : amide:sc= -0.493 X(o=-0.19,f=-0.49) USER MOD Set 2.2: C 246 ASN : amide:sc= 0.144 X(o=-0.19,f=-0.49) USER MOD Set 2.3: D 321 TYR OH : rot 30:sc= 0.157 USER MOD Set 3.1: A 30 ASN : amide:sc= 0.218 K(o=1.9,f=-4.6!) USER MOD Set 3.2: B 107 TYR OH : rot 62:sc= -0.515! USER MOD Set 3.3: C 261 TYR OH : rot -115:sc= 2.22 USER MOD Single : A 16 SER OG : rot 139:sc= -0.501! USER MOD Single : A 17 HIS : no HE2:sc= -0.462 K(o=-0.46,f=-2.4) USER MOD Single : A 22 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.92) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HE2:sc= -1.83 K(o=-1.8,f=-4!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 108:sc= 1.09 USER MOD Single : A 33 ASN :FLIP amide:sc= -0.292 F(o=-0.95,f=-0.29) USER MOD Single : A 37 GLN : amide:sc= -0.223 X(o=-0.22,f=-0.51) USER MOD Single : A 43 LYS NZ :NH3+ 178:sc= 1.06 (180deg=1.06) USER MOD Single : A 44 ASN : amide:sc= 0.0218 K(o=0.022,f=-2.7!) USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=-0.0017) USER MOD Single : A 46 ASN : amide:sc= 0.225 X(o=0.23,f=0) USER MOD Single : A 48 GLN : amide:sc= 1.18 K(o=1.2,f=-7.4!) USER MOD Single : A 54 LYS NZ :NH3+ -163:sc= 1.25 (180deg=0.925) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= -6.42! C(o=-6.4!,f=-7.7!) USER MOD Single : A 64 LYS NZ :NH3+ 156:sc= 1.3 (180deg=1.1) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=-0.0046) USER MOD Single : A 68 LYS NZ :NH3+ 142:sc= -1.06 (180deg=-3.28!) USER MOD Single : B 108 THR OG1 : rot 180:sc= 0 USER MOD Single : B 109 SER OG : rot 33:sc= 0.0608 USER MOD Single : B 111 ASN : amide:sc= -0.099 K(o=-0.099,f=-2!) USER MOD Single : B 121 TYR OH : rot 180:sc= 0.238 USER MOD Single : B 123 SER OG : rot 180:sc= 0 USER MOD Single : B 124 MET CE :methyl -143:sc= 0 (180deg=-0.878) USER MOD Single : B 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 216 SER OG : rot 156:sc= -2.89! USER MOD Single : C 217 HIS : no HD1:sc= -1.87 X(o=-1.9,f=-2.1!) USER MOD Single : C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 225 HIS : no HE2:sc= -1.5 K(o=-1.5,f=-3.5!) USER MOD Single : C 227 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00522) USER MOD Single : C 231 THR OG1 : rot 6:sc= 0.872 USER MOD Single : C 233 ASN :FLIP amide:sc= -0.271 F(o=-0.83,f=-0.27) USER MOD Single : C 237 GLN : amide:sc= -0.73 X(o=-0.73,f=-1.1) USER MOD Single : C 243 LYS NZ :NH3+ -179:sc= 2.48 (180deg=2.28) USER MOD Single : C 244 ASN : amide:sc= 0.0416 K(o=0.042,f=-2.1) USER MOD Single : C 245 ASN :FLIP amide:sc=-0.00583 F(o=-0.88,f=-0.0058) USER MOD Single : C 248 GLN : amide:sc= 1.03 K(o=1,f=-7!) USER MOD Single : C 254 LYS NZ :NH3+ 171:sc= 1.23 (180deg=0.922) USER MOD Single : C 256 LYS NZ :NH3+ -148:sc= 1.08 (180deg=0.316) USER MOD Single : C 259 GLN : amide:sc= -4.87! C(o=-4.9!,f=-5.6!) USER MOD Single : C 264 LYS NZ :NH3+ 166:sc= 0.619 (180deg=0.414) USER MOD Single : C 267 ASN :FLIP amide:sc= 0 F(o=-0.62,f=0) USER MOD Single : C 268 LYS NZ :NH3+ 139:sc= -0.543 (180deg=-2.62!) USER MOD Single : D 308 THR OG1 : rot 65:sc= 0.00956 USER MOD Single : D 309 SER OG : rot 180:sc= 0.00387 USER MOD Single : D 311 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 323 SER OG : rot 180:sc= 0 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 -7.641 -7.823 15.498 1.00 1.34 N ATOM 140 CA CYS A 9 -7.032 -7.893 14.199 1.00 54.11 C ATOM 141 C CYS A 9 -8.091 -8.008 13.112 1.00 62.52 C ATOM 142 O CYS A 9 -9.080 -8.746 13.264 1.00 71.31 O ATOM 143 CB CYS A 9 -6.012 -9.038 14.107 1.00 43.44 C ATOM 144 SG CYS A 9 -4.590 -8.812 15.196 1.00 24.02 S ATOM 0 HA CYS A 9 -6.484 -6.964 14.042 1.00 54.11 H new ATOM 0 HB2 CYS A 9 -6.506 -9.977 14.355 1.00 43.44 H new ATOM 0 HB3 CYS A 9 -5.663 -9.124 13.078 1.00 43.44 H new ATOM 149 N PRO A 10 -7.914 -7.252 12.006 1.00 33.33 N ATOM 150 CA PRO A 10 -8.833 -7.270 10.857 1.00 43.21 C ATOM 151 C PRO A 10 -8.920 -8.659 10.272 1.00 70.12 C ATOM 152 O PRO A 10 -10.001 -9.166 9.943 1.00 75.44 O ATOM 153 CB PRO A 10 -8.150 -6.330 9.862 1.00 24.04 C ATOM 154 CG PRO A 10 -6.744 -6.225 10.314 1.00 32.42 C ATOM 155 CD PRO A 10 -6.800 -6.319 11.794 1.00 51.13 C ATOM 0 HA PRO A 10 -9.850 -6.976 11.115 1.00 43.21 H new ATOM 0 HB2 PRO A 10 -8.207 -6.725 8.848 1.00 24.04 H new ATOM 0 HB3 PRO A 10 -8.632 -5.353 9.852 1.00 24.04 H new ATOM 0 HG2 PRO A 10 -6.135 -7.024 9.892 1.00 32.42 H new ATOM 0 HG3 PRO A 10 -6.298 -5.282 9.996 1.00 32.42 H new ATOM 0 HD2 PRO A 10 -5.868 -6.697 12.213 1.00 51.13 H new ATOM 0 HD3 PRO A 10 -6.988 -5.350 12.256 1.00 51.13 H new ATOM 163 N CYS A 11 -7.782 -9.268 10.157 1.00 55.14 N ATOM 164 CA CYS A 11 -7.661 -10.589 9.681 1.00 13.25 C ATOM 165 C CYS A 11 -7.534 -11.503 10.871 1.00 21.21 C ATOM 166 O CYS A 11 -6.578 -11.393 11.640 1.00 4.31 O ATOM 167 CB CYS A 11 -6.428 -10.688 8.806 1.00 73.31 C ATOM 168 SG CYS A 11 -6.375 -9.410 7.516 1.00 53.44 S ATOM 0 H CYS A 11 -6.891 -8.837 10.402 1.00 55.14 H new ATOM 0 HA CYS A 11 -8.532 -10.873 9.091 1.00 13.25 H new ATOM 0 HB2 CYS A 11 -5.538 -10.605 9.430 1.00 73.31 H new ATOM 0 HB3 CYS A 11 -6.399 -11.672 8.338 1.00 73.31 H new ATOM 173 N ARG A 12 -8.498 -12.366 11.050 1.00 51.21 N ATOM 174 CA ARG A 12 -8.457 -13.323 12.129 1.00 50.52 C ATOM 175 C ARG A 12 -7.501 -14.416 11.708 1.00 72.44 C ATOM 176 O ARG A 12 -6.736 -14.950 12.501 1.00 41.35 O ATOM 177 CB ARG A 12 -9.859 -13.871 12.379 1.00 2.55 C ATOM 178 CG ARG A 12 -9.967 -14.856 13.527 1.00 41.54 C ATOM 179 CD ARG A 12 -11.410 -15.290 13.727 1.00 53.24 C ATOM 180 NE ARG A 12 -11.973 -15.954 12.538 1.00 64.31 N ATOM 181 CZ ARG A 12 -13.150 -15.645 11.962 1.00 5.40 C ATOM 182 NH1 ARG A 12 -13.867 -14.597 12.395 1.00 22.52 N ATOM 183 NH2 ARG A 12 -13.591 -16.363 10.938 1.00 63.42 N ATOM 0 H ARG A 12 -9.327 -12.428 10.460 1.00 51.21 H new ATOM 0 HA ARG A 12 -8.117 -12.871 13.061 1.00 50.52 H new ATOM 0 HB2 ARG A 12 -10.530 -13.035 12.573 1.00 2.55 H new ATOM 0 HB3 ARG A 12 -10.210 -14.357 11.469 1.00 2.55 H new ATOM 0 HG2 ARG A 12 -9.344 -15.728 13.325 1.00 41.54 H new ATOM 0 HG3 ARG A 12 -9.589 -14.399 14.442 1.00 41.54 H new ATOM 0 HD2 ARG A 12 -11.467 -15.968 14.578 1.00 53.24 H new ATOM 0 HD3 ARG A 12 -12.017 -14.419 13.973 1.00 53.24 H new ATOM 0 HE ARG A 12 -11.428 -16.707 12.118 1.00 64.31 H new ATOM 0 HH11 ARG A 12 -13.521 -14.027 13.167 1.00 22.52 H new ATOM 0 HH12 ARG A 12 -14.758 -14.371 11.952 1.00 22.52 H new ATOM 0 HH21 ARG A 12 -13.039 -17.147 10.589 1.00 63.42 H new ATOM 0 HH22 ARG A 12 -14.482 -16.132 10.499 1.00 63.42 H new ATOM 197 N PHE A 13 -7.565 -14.720 10.444 1.00 14.44 N ATOM 198 CA PHE A 13 -6.664 -15.613 9.778 1.00 22.34 C ATOM 199 C PHE A 13 -6.327 -14.953 8.458 1.00 72.22 C ATOM 200 O PHE A 13 -7.062 -14.058 8.032 1.00 73.00 O ATOM 201 CB PHE A 13 -7.284 -17.011 9.572 1.00 51.42 C ATOM 202 CG PHE A 13 -7.587 -17.746 10.852 1.00 1.25 C ATOM 203 CD1 PHE A 13 -6.610 -18.495 11.477 1.00 51.14 C ATOM 204 CD2 PHE A 13 -8.844 -17.681 11.426 1.00 23.43 C ATOM 205 CE1 PHE A 13 -6.877 -19.168 12.652 1.00 51.11 C ATOM 206 CE2 PHE A 13 -9.119 -18.352 12.599 1.00 1.21 C ATOM 207 CZ PHE A 13 -8.134 -19.096 13.214 1.00 23.23 C ATOM 0 H PHE A 13 -8.277 -14.335 9.824 1.00 14.44 H new ATOM 0 HA PHE A 13 -5.769 -15.783 10.377 1.00 22.34 H new ATOM 0 HB2 PHE A 13 -8.205 -16.907 8.999 1.00 51.42 H new ATOM 0 HB3 PHE A 13 -6.602 -17.614 8.972 1.00 51.42 H new ATOM 0 HD1 PHE A 13 -5.624 -18.555 11.041 1.00 51.14 H new ATOM 0 HD2 PHE A 13 -9.619 -17.098 10.950 1.00 23.43 H new ATOM 0 HE1 PHE A 13 -6.103 -19.750 13.130 1.00 51.11 H new ATOM 0 HE2 PHE A 13 -10.105 -18.295 13.036 1.00 1.21 H new ATOM 0 HZ PHE A 13 -8.347 -19.621 14.134 1.00 23.23 H new ATOM 217 N PHE A 14 -5.261 -15.346 7.826 1.00 75.33 N ATOM 218 CA PHE A 14 -4.860 -14.705 6.587 1.00 4.23 C ATOM 219 C PHE A 14 -4.526 -15.709 5.483 1.00 72.53 C ATOM 220 O PHE A 14 -4.127 -16.856 5.747 1.00 4.22 O ATOM 221 CB PHE A 14 -3.695 -13.720 6.815 1.00 25.34 C ATOM 222 CG PHE A 14 -2.485 -14.337 7.456 1.00 52.11 C ATOM 223 CD1 PHE A 14 -1.614 -15.112 6.715 1.00 2.43 C ATOM 224 CD2 PHE A 14 -2.227 -14.147 8.803 1.00 43.42 C ATOM 225 CE1 PHE A 14 -0.516 -15.685 7.293 1.00 70.23 C ATOM 226 CE2 PHE A 14 -1.124 -14.718 9.393 1.00 10.53 C ATOM 227 CZ PHE A 14 -0.268 -15.487 8.640 1.00 75.42 C ATOM 0 H PHE A 14 -4.650 -16.101 8.137 1.00 75.33 H new ATOM 0 HA PHE A 14 -5.723 -14.136 6.241 1.00 4.23 H new ATOM 0 HB2 PHE A 14 -3.405 -13.289 5.857 1.00 25.34 H new ATOM 0 HB3 PHE A 14 -4.045 -12.899 7.441 1.00 25.34 H new ATOM 0 HD1 PHE A 14 -1.804 -15.267 5.663 1.00 2.43 H new ATOM 0 HD2 PHE A 14 -2.899 -13.544 9.396 1.00 43.42 H new ATOM 0 HE1 PHE A 14 0.155 -16.290 6.701 1.00 70.23 H new ATOM 0 HE2 PHE A 14 -0.931 -14.563 10.444 1.00 10.53 H new ATOM 0 HZ PHE A 14 0.599 -15.937 9.101 1.00 75.42 H new ATOM 237 N GLU A 15 -4.733 -15.282 4.276 1.00 32.43 N ATOM 238 CA GLU A 15 -4.411 -16.026 3.096 1.00 74.04 C ATOM 239 C GLU A 15 -2.901 -15.981 2.817 1.00 13.24 C ATOM 240 O GLU A 15 -2.283 -14.915 2.826 1.00 14.50 O ATOM 241 CB GLU A 15 -5.131 -15.435 1.877 1.00 32.22 C ATOM 242 CG GLU A 15 -6.635 -15.696 1.740 1.00 62.54 C ATOM 243 CD GLU A 15 -7.514 -15.067 2.776 1.00 42.32 C ATOM 244 OE1 GLU A 15 -7.290 -13.911 3.152 1.00 63.44 O ATOM 245 OE2 GLU A 15 -8.494 -15.711 3.172 1.00 12.41 O ATOM 0 H GLU A 15 -5.147 -14.371 4.077 1.00 32.43 H new ATOM 0 HA GLU A 15 -4.729 -17.055 3.263 1.00 74.04 H new ATOM 0 HB2 GLU A 15 -4.978 -14.356 1.888 1.00 32.22 H new ATOM 0 HB3 GLU A 15 -4.642 -15.817 0.981 1.00 32.22 H new ATOM 0 HG2 GLU A 15 -6.956 -15.344 0.760 1.00 62.54 H new ATOM 0 HG3 GLU A 15 -6.799 -16.773 1.761 1.00 62.54 H new ATOM 252 N SER A 16 -2.315 -17.119 2.561 1.00 42.03 N ATOM 253 CA SER A 16 -0.934 -17.155 2.200 1.00 50.42 C ATOM 254 C SER A 16 -0.814 -17.771 0.810 1.00 40.50 C ATOM 255 O SER A 16 -1.759 -18.406 0.339 1.00 44.12 O ATOM 256 CB SER A 16 -0.129 -17.964 3.195 1.00 1.22 C ATOM 257 OG SER A 16 1.254 -17.835 2.932 1.00 42.13 O ATOM 0 H SER A 16 -2.775 -18.029 2.597 1.00 42.03 H new ATOM 0 HA SER A 16 -0.537 -16.140 2.202 1.00 50.42 H new ATOM 0 HB2 SER A 16 -0.346 -17.626 4.208 1.00 1.22 H new ATOM 0 HB3 SER A 16 -0.420 -19.013 3.140 1.00 1.22 H new ATOM 0 HG SER A 16 1.741 -17.747 3.778 1.00 42.13 H new ATOM 263 N HIS A 17 0.344 -17.571 0.156 1.00 34.45 N ATOM 264 CA HIS A 17 0.618 -18.091 -1.214 1.00 1.15 C ATOM 265 C HIS A 17 -0.368 -17.574 -2.238 1.00 3.34 C ATOM 266 O HIS A 17 -0.536 -18.179 -3.306 1.00 15.25 O ATOM 267 CB HIS A 17 0.659 -19.627 -1.279 1.00 12.31 C ATOM 268 CG HIS A 17 1.842 -20.274 -0.641 1.00 23.41 C ATOM 269 ND1 HIS A 17 2.085 -21.616 -0.731 1.00 22.13 N ATOM 270 CD2 HIS A 17 2.867 -19.760 0.054 1.00 30.03 C ATOM 271 CE1 HIS A 17 3.207 -21.905 -0.128 1.00 45.14 C ATOM 272 NE2 HIS A 17 3.713 -20.801 0.358 1.00 1.01 N ATOM 0 H HIS A 17 1.122 -17.045 0.554 1.00 34.45 H new ATOM 0 HA HIS A 17 1.611 -17.713 -1.459 1.00 1.15 H new ATOM 0 HB2 HIS A 17 -0.243 -20.016 -0.806 1.00 12.31 H new ATOM 0 HB3 HIS A 17 0.625 -19.928 -2.326 1.00 12.31 H new ATOM 0 HD1 HIS A 17 1.480 -22.291 -1.199 1.00 22.13 H new ATOM 0 HD2 HIS A 17 3.003 -18.723 0.324 1.00 30.03 H new ATOM 0 HE1 HIS A 17 3.643 -22.889 -0.045 1.00 45.14 H new ATOM 281 N VAL A 18 -0.998 -16.457 -1.932 1.00 74.40 N ATOM 282 CA VAL A 18 -1.908 -15.826 -2.851 1.00 32.21 C ATOM 283 C VAL A 18 -1.174 -15.477 -4.120 1.00 25.33 C ATOM 284 O VAL A 18 -0.040 -14.992 -4.074 1.00 44.03 O ATOM 285 CB VAL A 18 -2.559 -14.579 -2.233 1.00 44.01 C ATOM 286 CG1 VAL A 18 -3.441 -13.843 -3.244 1.00 3.04 C ATOM 287 CG2 VAL A 18 -3.378 -14.984 -1.034 1.00 2.35 C ATOM 0 H VAL A 18 -0.891 -15.968 -1.043 1.00 74.40 H new ATOM 0 HA VAL A 18 -2.712 -16.525 -3.081 1.00 32.21 H new ATOM 0 HB VAL A 18 -1.766 -13.896 -1.928 1.00 44.01 H new ATOM 0 HG11 VAL A 18 -3.884 -12.967 -2.770 1.00 3.04 H new ATOM 0 HG12 VAL A 18 -2.836 -13.529 -4.094 1.00 3.04 H new ATOM 0 HG13 VAL A 18 -4.233 -14.508 -3.589 1.00 3.04 H new ATOM 0 HG21 VAL A 18 -3.841 -14.100 -0.594 1.00 2.35 H new ATOM 0 HG22 VAL A 18 -4.154 -15.684 -1.343 1.00 2.35 H new ATOM 0 HG23 VAL A 18 -2.732 -15.461 -0.296 1.00 2.35 H new ATOM 297 N ALA A 19 -1.798 -15.758 -5.235 1.00 4.03 N ATOM 298 CA ALA A 19 -1.179 -15.568 -6.504 1.00 63.15 C ATOM 299 C ALA A 19 -0.918 -14.107 -6.783 1.00 72.22 C ATOM 300 O ALA A 19 -1.833 -13.277 -6.798 1.00 30.24 O ATOM 301 CB ALA A 19 -1.990 -16.211 -7.616 1.00 41.24 C ATOM 0 H ALA A 19 -2.749 -16.124 -5.280 1.00 4.03 H new ATOM 0 HA ALA A 19 -0.211 -16.068 -6.472 1.00 63.15 H new ATOM 0 HB1 ALA A 19 -1.491 -16.048 -8.571 1.00 41.24 H new ATOM 0 HB2 ALA A 19 -2.078 -17.281 -7.430 1.00 41.24 H new ATOM 0 HB3 ALA A 19 -2.984 -15.765 -7.646 1.00 41.24 H new ATOM 307 N ARG A 20 0.332 -13.827 -7.015 1.00 22.12 N ATOM 308 CA ARG A 20 0.839 -12.512 -7.333 1.00 74.13 C ATOM 309 C ARG A 20 0.300 -12.089 -8.714 1.00 41.42 C ATOM 310 O ARG A 20 0.258 -10.915 -9.054 1.00 64.13 O ATOM 311 CB ARG A 20 2.403 -12.609 -7.239 1.00 74.11 C ATOM 312 CG ARG A 20 3.272 -11.372 -7.540 1.00 12.30 C ATOM 313 CD ARG A 20 3.301 -10.986 -9.001 1.00 12.43 C ATOM 314 NE ARG A 20 3.736 -12.096 -9.879 1.00 21.13 N ATOM 315 CZ ARG A 20 3.219 -12.361 -11.095 1.00 14.42 C ATOM 316 NH1 ARG A 20 2.221 -11.635 -11.575 1.00 41.14 N ATOM 317 NH2 ARG A 20 3.698 -13.359 -11.818 1.00 21.20 N ATOM 0 H ARG A 20 1.063 -14.538 -6.988 1.00 22.12 H new ATOM 0 HA ARG A 20 0.509 -11.733 -6.646 1.00 74.13 H new ATOM 0 HB2 ARG A 20 2.647 -12.938 -6.229 1.00 74.11 H new ATOM 0 HB3 ARG A 20 2.720 -13.401 -7.918 1.00 74.11 H new ATOM 0 HG2 ARG A 20 2.900 -10.528 -6.959 1.00 12.30 H new ATOM 0 HG3 ARG A 20 4.291 -11.565 -7.205 1.00 12.30 H new ATOM 0 HD2 ARG A 20 2.307 -10.656 -9.305 1.00 12.43 H new ATOM 0 HD3 ARG A 20 3.973 -10.138 -9.135 1.00 12.43 H new ATOM 0 HE ARG A 20 4.481 -12.704 -9.539 1.00 21.13 H new ATOM 0 HH11 ARG A 20 1.837 -10.868 -11.023 1.00 41.14 H new ATOM 0 HH12 ARG A 20 1.836 -11.843 -12.496 1.00 41.14 H new ATOM 0 HH21 ARG A 20 4.461 -13.931 -11.456 1.00 21.20 H new ATOM 0 HH22 ARG A 20 3.305 -13.557 -12.738 1.00 21.20 H new ATOM 331 N ALA A 21 -0.112 -13.072 -9.485 1.00 31.33 N ATOM 332 CA ALA A 21 -0.725 -12.855 -10.782 1.00 13.35 C ATOM 333 C ALA A 21 -2.236 -12.547 -10.680 1.00 30.31 C ATOM 334 O ALA A 21 -2.854 -12.158 -11.666 1.00 1.40 O ATOM 335 CB ALA A 21 -0.490 -14.056 -11.683 1.00 11.11 C ATOM 0 H ALA A 21 -0.031 -14.056 -9.228 1.00 31.33 H new ATOM 0 HA ALA A 21 -0.250 -11.976 -11.218 1.00 13.35 H new ATOM 0 HB1 ALA A 21 -0.955 -13.880 -12.653 1.00 11.11 H new ATOM 0 HB2 ALA A 21 0.581 -14.207 -11.816 1.00 11.11 H new ATOM 0 HB3 ALA A 21 -0.927 -14.944 -11.227 1.00 11.11 H new ATOM 341 N ASN A 22 -2.841 -12.736 -9.503 1.00 42.11 N ATOM 342 CA ASN A 22 -4.307 -12.557 -9.383 1.00 22.20 C ATOM 343 C ASN A 22 -4.658 -11.300 -8.567 1.00 65.13 C ATOM 344 O ASN A 22 -5.822 -11.007 -8.309 1.00 42.50 O ATOM 345 CB ASN A 22 -4.965 -13.824 -8.765 1.00 0.32 C ATOM 346 CG ASN A 22 -6.502 -13.815 -8.841 1.00 31.42 C ATOM 347 OD1 ASN A 22 -7.094 -13.211 -9.739 1.00 3.51 O ATOM 348 ND2 ASN A 22 -7.153 -14.520 -7.937 1.00 21.13 N ATOM 0 H ASN A 22 -2.365 -13.004 -8.641 1.00 42.11 H new ATOM 0 HA ASN A 22 -4.708 -12.416 -10.387 1.00 22.20 H new ATOM 0 HB2 ASN A 22 -4.589 -14.708 -9.280 1.00 0.32 H new ATOM 0 HB3 ASN A 22 -4.661 -13.910 -7.722 1.00 0.32 H new ATOM 0 HD21 ASN A 22 -8.171 -14.576 -7.970 1.00 21.13 H new ATOM 0 HD22 ASN A 22 -6.639 -15.010 -7.205 1.00 21.13 H new ATOM 355 N VAL A 23 -3.658 -10.556 -8.199 1.00 23.03 N ATOM 356 CA VAL A 23 -3.844 -9.352 -7.395 1.00 73.54 C ATOM 357 C VAL A 23 -3.914 -8.075 -8.271 1.00 74.20 C ATOM 358 O VAL A 23 -3.340 -8.029 -9.341 1.00 33.22 O ATOM 359 CB VAL A 23 -2.715 -9.228 -6.293 1.00 65.12 C ATOM 360 CG1 VAL A 23 -1.351 -9.428 -6.890 1.00 4.22 C ATOM 361 CG2 VAL A 23 -2.732 -7.880 -5.645 1.00 3.44 C ATOM 0 H VAL A 23 -2.686 -10.753 -8.439 1.00 23.03 H new ATOM 0 HA VAL A 23 -4.805 -9.445 -6.888 1.00 73.54 H new ATOM 0 HB VAL A 23 -2.920 -10.001 -5.553 1.00 65.12 H new ATOM 0 HG11 VAL A 23 -0.595 -9.337 -6.110 1.00 4.22 H new ATOM 0 HG12 VAL A 23 -1.292 -10.420 -7.339 1.00 4.22 H new ATOM 0 HG13 VAL A 23 -1.175 -8.672 -7.656 1.00 4.22 H new ATOM 0 HG21 VAL A 23 -1.945 -7.828 -4.893 1.00 3.44 H new ATOM 0 HG22 VAL A 23 -2.565 -7.111 -6.400 1.00 3.44 H new ATOM 0 HG23 VAL A 23 -3.699 -7.717 -5.169 1.00 3.44 H new ATOM 371 N LYS A 24 -4.697 -7.073 -7.833 1.00 43.04 N ATOM 372 CA LYS A 24 -4.697 -5.771 -8.497 1.00 13.02 C ATOM 373 C LYS A 24 -3.816 -4.771 -7.761 1.00 72.53 C ATOM 374 O LYS A 24 -3.228 -3.903 -8.377 1.00 25.00 O ATOM 375 CB LYS A 24 -6.092 -5.168 -8.624 1.00 21.13 C ATOM 376 CG LYS A 24 -7.062 -6.032 -9.374 1.00 33.22 C ATOM 377 CD LYS A 24 -8.311 -5.270 -9.773 1.00 32.51 C ATOM 378 CE LYS A 24 -9.098 -4.725 -8.595 1.00 53.45 C ATOM 379 NZ LYS A 24 -10.242 -3.904 -9.054 1.00 54.43 N ATOM 0 H LYS A 24 -5.327 -7.144 -7.034 1.00 43.04 H new ATOM 0 HA LYS A 24 -4.304 -5.960 -9.496 1.00 13.02 H new ATOM 0 HB2 LYS A 24 -6.487 -4.977 -7.626 1.00 21.13 H new ATOM 0 HB3 LYS A 24 -6.016 -4.204 -9.126 1.00 21.13 H new ATOM 0 HG2 LYS A 24 -6.579 -6.429 -10.267 1.00 33.22 H new ATOM 0 HG3 LYS A 24 -7.340 -6.886 -8.756 1.00 33.22 H new ATOM 0 HD2 LYS A 24 -8.028 -4.442 -10.423 1.00 32.51 H new ATOM 0 HD3 LYS A 24 -8.956 -5.928 -10.356 1.00 32.51 H new ATOM 0 HE2 LYS A 24 -9.461 -5.550 -7.983 1.00 53.45 H new ATOM 0 HE3 LYS A 24 -8.444 -4.123 -7.964 1.00 53.45 H new ATOM 0 HZ1 LYS A 24 -10.763 -3.543 -8.230 1.00 54.43 H new ATOM 0 HZ2 LYS A 24 -9.891 -3.104 -9.618 1.00 54.43 H new ATOM 0 HZ3 LYS A 24 -10.876 -4.487 -9.637 1.00 54.43 H new ATOM 393 N HIS A 25 -3.769 -4.890 -6.425 1.00 30.33 N ATOM 394 CA HIS A 25 -2.986 -3.984 -5.550 1.00 70.22 C ATOM 395 C HIS A 25 -3.131 -4.370 -4.083 1.00 22.11 C ATOM 396 O HIS A 25 -4.049 -5.139 -3.731 1.00 23.21 O ATOM 397 CB HIS A 25 -3.358 -2.503 -5.737 1.00 23.24 C ATOM 398 CG HIS A 25 -4.804 -2.158 -5.574 1.00 30.44 C ATOM 399 ND1 HIS A 25 -5.730 -2.934 -4.901 1.00 72.13 N ATOM 400 CD2 HIS A 25 -5.479 -1.114 -6.039 1.00 23.41 C ATOM 401 CE1 HIS A 25 -6.911 -2.360 -4.985 1.00 75.55 C ATOM 402 NE2 HIS A 25 -6.784 -1.258 -5.671 1.00 20.40 N ATOM 0 H HIS A 25 -4.271 -5.616 -5.914 1.00 30.33 H new ATOM 0 HA HIS A 25 -1.945 -4.102 -5.852 1.00 70.22 H new ATOM 0 HB2 HIS A 25 -2.783 -1.913 -5.023 1.00 23.24 H new ATOM 0 HB3 HIS A 25 -3.043 -2.194 -6.734 1.00 23.24 H new ATOM 0 HD1 HIS A 25 -5.530 -3.810 -4.418 1.00 72.13 H new ATOM 0 HD2 HIS A 25 -5.067 -0.294 -6.609 1.00 23.41 H new ATOM 0 HE1 HIS A 25 -7.829 -2.737 -4.559 1.00 75.55 H new ATOM 411 N LEU A 26 -2.301 -3.777 -3.235 1.00 3.22 N ATOM 412 CA LEU A 26 -2.244 -4.120 -1.808 1.00 44.30 C ATOM 413 C LEU A 26 -2.650 -2.925 -0.947 1.00 63.23 C ATOM 414 O LEU A 26 -2.479 -1.784 -1.344 1.00 3.34 O ATOM 415 CB LEU A 26 -0.795 -4.543 -1.383 1.00 32.11 C ATOM 416 CG LEU A 26 -0.169 -5.855 -1.953 1.00 33.12 C ATOM 417 CD1 LEU A 26 0.001 -5.813 -3.459 1.00 74.22 C ATOM 418 CD2 LEU A 26 1.181 -6.118 -1.295 1.00 23.53 C ATOM 0 H LEU A 26 -1.646 -3.045 -3.510 1.00 3.22 H new ATOM 0 HA LEU A 26 -2.934 -4.950 -1.656 1.00 44.30 H new ATOM 0 HB2 LEU A 26 -0.127 -3.723 -1.647 1.00 32.11 H new ATOM 0 HB3 LEU A 26 -0.786 -4.624 -0.296 1.00 32.11 H new ATOM 0 HG LEU A 26 -0.863 -6.664 -1.724 1.00 33.12 H new ATOM 0 HD11 LEU A 26 0.440 -6.750 -3.802 1.00 74.22 H new ATOM 0 HD12 LEU A 26 -0.971 -5.674 -3.931 1.00 74.22 H new ATOM 0 HD13 LEU A 26 0.657 -4.985 -3.728 1.00 74.22 H new ATOM 0 HD21 LEU A 26 1.610 -7.035 -1.699 1.00 23.53 H new ATOM 0 HD22 LEU A 26 1.853 -5.284 -1.497 1.00 23.53 H new ATOM 0 HD23 LEU A 26 1.047 -6.224 -0.218 1.00 23.53 H new ATOM 430 N LYS A 27 -3.209 -3.200 0.208 1.00 44.32 N ATOM 431 CA LYS A 27 -3.521 -2.191 1.188 1.00 52.23 C ATOM 432 C LYS A 27 -2.904 -2.564 2.511 1.00 32.13 C ATOM 433 O LYS A 27 -3.211 -3.620 3.072 1.00 13.24 O ATOM 434 CB LYS A 27 -5.028 -1.961 1.314 1.00 4.34 C ATOM 435 CG LYS A 27 -5.396 -0.955 2.394 1.00 10.43 C ATOM 436 CD LYS A 27 -6.759 -0.363 2.146 1.00 44.33 C ATOM 437 CE LYS A 27 -7.838 -1.405 1.966 1.00 72.15 C ATOM 438 NZ LYS A 27 -8.093 -2.225 3.188 1.00 74.11 N ATOM 0 H LYS A 27 -3.463 -4.145 0.496 1.00 44.32 H new ATOM 0 HA LYS A 27 -3.095 -1.245 0.855 1.00 52.23 H new ATOM 0 HB2 LYS A 27 -5.417 -1.614 0.357 1.00 4.34 H new ATOM 0 HB3 LYS A 27 -5.516 -2.911 1.531 1.00 4.34 H new ATOM 0 HG2 LYS A 27 -5.380 -1.442 3.369 1.00 10.43 H new ATOM 0 HG3 LYS A 27 -4.651 -0.160 2.423 1.00 10.43 H new ATOM 0 HD2 LYS A 27 -7.024 0.284 2.982 1.00 44.33 H new ATOM 0 HD3 LYS A 27 -6.718 0.266 1.256 1.00 44.33 H new ATOM 0 HE2 LYS A 27 -8.763 -0.909 1.673 1.00 72.15 H new ATOM 0 HE3 LYS A 27 -7.558 -2.067 1.147 1.00 72.15 H new ATOM 0 HZ1 LYS A 27 -8.844 -2.917 2.991 1.00 74.11 H new ATOM 0 HZ2 LYS A 27 -7.222 -2.726 3.458 1.00 74.11 H new ATOM 0 HZ3 LYS A 27 -8.391 -1.604 3.967 1.00 74.11 H new ATOM 452 N ILE A 28 -2.044 -1.710 3.000 1.00 1.04 N ATOM 453 CA ILE A 28 -1.315 -1.954 4.215 1.00 42.41 C ATOM 454 C ILE A 28 -1.937 -1.145 5.328 1.00 42.22 C ATOM 455 O ILE A 28 -2.342 0.016 5.117 1.00 74.10 O ATOM 456 CB ILE A 28 0.179 -1.544 4.117 1.00 2.12 C ATOM 457 CG1 ILE A 28 0.842 -2.117 2.866 1.00 50.31 C ATOM 458 CG2 ILE A 28 0.930 -2.034 5.359 1.00 2.52 C ATOM 459 CD1 ILE A 28 2.312 -1.758 2.758 1.00 72.02 C ATOM 0 H ILE A 28 -1.828 -0.815 2.560 1.00 1.04 H new ATOM 0 HA ILE A 28 -1.363 -3.026 4.404 1.00 42.41 H new ATOM 0 HB ILE A 28 0.222 -0.457 4.055 1.00 2.12 H new ATOM 0 HG12 ILE A 28 0.738 -3.202 2.871 1.00 50.31 H new ATOM 0 HG13 ILE A 28 0.318 -1.750 1.983 1.00 50.31 H new ATOM 0 HG21 ILE A 28 1.979 -1.745 5.288 1.00 2.52 H new ATOM 0 HG22 ILE A 28 0.490 -1.587 6.250 1.00 2.52 H new ATOM 0 HG23 ILE A 28 0.857 -3.120 5.424 1.00 2.52 H new ATOM 0 HD11 ILE A 28 2.727 -2.194 1.849 1.00 72.02 H new ATOM 0 HD12 ILE A 28 2.420 -0.674 2.723 1.00 72.02 H new ATOM 0 HD13 ILE A 28 2.846 -2.148 3.624 1.00 72.02 H new ATOM 471 N LEU A 29 -2.060 -1.764 6.463 1.00 62.35 N ATOM 472 CA LEU A 29 -2.590 -1.157 7.645 1.00 33.30 C ATOM 473 C LEU A 29 -1.964 -1.800 8.864 1.00 53.44 C ATOM 474 O LEU A 29 -1.668 -2.989 8.858 1.00 3.42 O ATOM 475 CB LEU A 29 -4.100 -1.349 7.701 1.00 31.21 C ATOM 476 CG LEU A 29 -4.554 -2.777 7.480 1.00 70.42 C ATOM 477 CD1 LEU A 29 -5.516 -3.198 8.555 1.00 51.33 C ATOM 478 CD2 LEU A 29 -5.205 -2.890 6.122 1.00 50.53 C ATOM 0 H LEU A 29 -1.785 -2.737 6.595 1.00 62.35 H new ATOM 0 HA LEU A 29 -2.363 -0.091 7.628 1.00 33.30 H new ATOM 0 HB2 LEU A 29 -4.462 -1.011 8.672 1.00 31.21 H new ATOM 0 HB3 LEU A 29 -4.564 -0.712 6.948 1.00 31.21 H new ATOM 0 HG LEU A 29 -3.688 -3.437 7.523 1.00 70.42 H new ATOM 0 HD11 LEU A 29 -5.831 -4.227 8.379 1.00 51.33 H new ATOM 0 HD12 LEU A 29 -5.028 -3.129 9.527 1.00 51.33 H new ATOM 0 HD13 LEU A 29 -6.388 -2.544 8.540 1.00 51.33 H new ATOM 0 HD21 LEU A 29 -5.533 -3.917 5.960 1.00 50.53 H new ATOM 0 HD22 LEU A 29 -6.065 -2.223 6.074 1.00 50.53 H new ATOM 0 HD23 LEU A 29 -4.487 -2.612 5.350 1.00 50.53 H new ATOM 490 N ASN A 30 -1.740 -1.027 9.879 1.00 31.21 N ATOM 491 CA ASN A 30 -1.231 -1.552 11.130 1.00 60.30 C ATOM 492 C ASN A 30 -2.211 -1.248 12.235 1.00 21.43 C ATOM 493 O ASN A 30 -2.326 -0.096 12.678 1.00 10.35 O ATOM 494 CB ASN A 30 0.170 -0.990 11.492 1.00 70.25 C ATOM 495 CG ASN A 30 1.320 -1.480 10.601 1.00 0.51 C ATOM 496 OD1 ASN A 30 1.141 -1.814 9.430 1.00 11.21 O ATOM 497 ND2 ASN A 30 2.514 -1.508 11.151 1.00 51.31 N ATOM 0 H ASN A 30 -1.900 -0.020 9.876 1.00 31.21 H new ATOM 0 HA ASN A 30 -1.116 -2.629 11.011 1.00 60.30 H new ATOM 0 HB2 ASN A 30 0.131 0.098 11.442 1.00 70.25 H new ATOM 0 HB3 ASN A 30 0.394 -1.254 12.525 1.00 70.25 H new ATOM 0 HD21 ASN A 30 3.320 -1.812 10.605 1.00 51.31 H new ATOM 0 HD22 ASN A 30 2.634 -1.226 12.124 1.00 51.31 H new ATOM 504 N THR A 31 -2.942 -2.253 12.651 1.00 54.15 N ATOM 505 CA THR A 31 -3.885 -2.104 13.720 1.00 33.22 C ATOM 506 C THR A 31 -3.152 -2.261 15.082 1.00 1.34 C ATOM 507 O THR A 31 -2.181 -3.021 15.181 1.00 71.41 O ATOM 508 CB THR A 31 -5.075 -3.101 13.553 1.00 3.51 C ATOM 509 OG1 THR A 31 -4.570 -4.417 13.372 1.00 32.10 O ATOM 510 CG2 THR A 31 -5.925 -2.739 12.333 1.00 74.42 C ATOM 0 H THR A 31 -2.897 -3.192 12.256 1.00 54.15 H new ATOM 0 HA THR A 31 -4.320 -1.105 13.692 1.00 33.22 H new ATOM 0 HB THR A 31 -5.692 -3.045 14.450 1.00 3.51 H new ATOM 0 HG1 THR A 31 -4.732 -4.944 14.182 1.00 32.10 H new ATOM 0 HG21 THR A 31 -6.747 -3.449 12.239 1.00 74.42 H new ATOM 0 HG22 THR A 31 -6.326 -1.733 12.455 1.00 74.42 H new ATOM 0 HG23 THR A 31 -5.308 -2.777 11.435 1.00 74.42 H new ATOM 518 N PRO A 32 -3.614 -1.550 16.137 1.00 23.34 N ATOM 519 CA PRO A 32 -2.906 -1.431 17.460 1.00 0.54 C ATOM 520 C PRO A 32 -2.686 -2.736 18.285 1.00 61.21 C ATOM 521 O PRO A 32 -2.374 -2.664 19.470 1.00 54.23 O ATOM 522 CB PRO A 32 -3.811 -0.466 18.240 1.00 53.44 C ATOM 523 CG PRO A 32 -5.148 -0.614 17.609 1.00 21.31 C ATOM 524 CD PRO A 32 -4.878 -0.783 16.149 1.00 5.43 C ATOM 0 HA PRO A 32 -1.880 -1.110 17.283 1.00 0.54 H new ATOM 0 HB2 PRO A 32 -3.842 -0.721 19.299 1.00 53.44 H new ATOM 0 HB3 PRO A 32 -3.451 0.560 18.169 1.00 53.44 H new ATOM 0 HG2 PRO A 32 -5.680 -1.475 18.013 1.00 21.31 H new ATOM 0 HG3 PRO A 32 -5.770 0.261 17.795 1.00 21.31 H new ATOM 0 HD2 PRO A 32 -5.683 -1.321 15.648 1.00 5.43 H new ATOM 0 HD3 PRO A 32 -4.774 0.177 15.643 1.00 5.43 H new ATOM 532 N ASN A 33 -2.821 -3.892 17.680 1.00 31.13 N ATOM 533 CA ASN A 33 -2.606 -5.155 18.412 1.00 63.14 C ATOM 534 C ASN A 33 -2.167 -6.236 17.436 1.00 52.01 C ATOM 535 O ASN A 33 -2.128 -7.432 17.748 1.00 24.52 O ATOM 536 CB ASN A 33 -3.907 -5.571 19.125 1.00 12.32 C ATOM 537 CG ASN A 33 -3.767 -6.793 20.048 1.00 32.20 C ATOM 538 OD1 ASN A 33 -2.638 -6.941 20.692 1.00 31.12 O flip ATOM 539 ND2 ASN A 33 -4.699 -7.563 20.209 1.00 63.34 N flip ATOM 0 H ASN A 33 -3.074 -4.003 16.698 1.00 31.13 H new ATOM 0 HA ASN A 33 -1.827 -5.017 19.162 1.00 63.14 H new ATOM 0 HB2 ASN A 33 -4.270 -4.728 19.713 1.00 12.32 H new ATOM 0 HB3 ASN A 33 -4.666 -5.785 18.373 1.00 12.32 H new ATOM 0 HD21 ASN A 33 -5.569 -7.425 19.695 1.00 63.34 H new ATOM 0 HD22 ASN A 33 -4.609 -8.345 20.858 1.00 63.34 H new ATOM 546 N CYS A 34 -1.785 -5.818 16.275 1.00 44.03 N ATOM 547 CA CYS A 34 -1.489 -6.737 15.221 1.00 43.22 C ATOM 548 C CYS A 34 -0.190 -6.321 14.583 1.00 14.24 C ATOM 549 O CYS A 34 0.270 -5.188 14.801 1.00 2.43 O ATOM 550 CB CYS A 34 -2.648 -6.689 14.217 1.00 34.54 C ATOM 551 SG CYS A 34 -4.270 -6.829 15.034 1.00 62.02 S ATOM 0 H CYS A 34 -1.669 -4.835 16.028 1.00 44.03 H new ATOM 0 HA CYS A 34 -1.382 -7.758 15.587 1.00 43.22 H new ATOM 0 HB2 CYS A 34 -2.604 -5.754 13.658 1.00 34.54 H new ATOM 0 HB3 CYS A 34 -2.535 -7.498 13.495 1.00 34.54 H new ATOM 556 N ALA A 35 0.447 -7.220 13.868 1.00 60.12 N ATOM 557 CA ALA A 35 1.656 -6.876 13.146 1.00 10.23 C ATOM 558 C ALA A 35 1.262 -6.061 11.920 1.00 65.34 C ATOM 559 O ALA A 35 0.076 -5.723 11.751 1.00 21.23 O ATOM 560 CB ALA A 35 2.416 -8.151 12.731 1.00 54.13 C ATOM 0 H ALA A 35 0.152 -8.191 13.769 1.00 60.12 H new ATOM 0 HA ALA A 35 2.319 -6.290 13.783 1.00 10.23 H new ATOM 0 HB1 ALA A 35 3.321 -7.875 12.190 1.00 54.13 H new ATOM 0 HB2 ALA A 35 2.684 -8.720 13.621 1.00 54.13 H new ATOM 0 HB3 ALA A 35 1.781 -8.760 12.088 1.00 54.13 H new ATOM 566 N CYS A 36 2.228 -5.728 11.086 1.00 71.24 N ATOM 567 CA CYS A 36 1.935 -5.039 9.841 1.00 65.23 C ATOM 568 C CYS A 36 0.965 -5.923 9.070 1.00 3.35 C ATOM 569 O CYS A 36 1.201 -7.119 8.940 1.00 24.24 O ATOM 570 CB CYS A 36 3.234 -4.823 9.053 1.00 72.22 C ATOM 571 SG CYS A 36 3.051 -3.906 7.490 1.00 44.51 S ATOM 0 H CYS A 36 3.217 -5.921 11.245 1.00 71.24 H new ATOM 0 HA CYS A 36 1.494 -4.058 10.016 1.00 65.23 H new ATOM 0 HB2 CYS A 36 3.941 -4.289 9.688 1.00 72.22 H new ATOM 0 HB3 CYS A 36 3.674 -5.796 8.835 1.00 72.22 H new ATOM 576 N GLN A 37 -0.130 -5.381 8.631 1.00 25.31 N ATOM 577 CA GLN A 37 -1.149 -6.186 8.022 1.00 54.00 C ATOM 578 C GLN A 37 -1.355 -5.739 6.592 1.00 11.21 C ATOM 579 O GLN A 37 -1.452 -4.539 6.315 1.00 44.21 O ATOM 580 CB GLN A 37 -2.453 -6.039 8.807 1.00 53.32 C ATOM 581 CG GLN A 37 -3.455 -7.131 8.548 1.00 51.41 C ATOM 582 CD GLN A 37 -2.942 -8.455 9.064 1.00 74.32 C ATOM 583 OE1 GLN A 37 -2.288 -9.206 8.357 1.00 11.30 O ATOM 584 NE2 GLN A 37 -3.196 -8.728 10.323 1.00 30.22 N ATOM 0 H GLN A 37 -0.343 -4.385 8.682 1.00 25.31 H new ATOM 0 HA GLN A 37 -0.843 -7.232 8.030 1.00 54.00 H new ATOM 0 HB2 GLN A 37 -2.222 -6.018 9.872 1.00 53.32 H new ATOM 0 HB3 GLN A 37 -2.906 -5.079 8.560 1.00 53.32 H new ATOM 0 HG2 GLN A 37 -4.400 -6.887 9.033 1.00 51.41 H new ATOM 0 HG3 GLN A 37 -3.654 -7.203 7.479 1.00 51.41 H new ATOM 0 HE21 GLN A 37 -3.746 -8.078 10.885 1.00 30.22 H new ATOM 0 HE22 GLN A 37 -2.844 -9.590 10.739 1.00 30.22 H new ATOM 593 N ILE A 38 -1.403 -6.682 5.690 1.00 55.02 N ATOM 594 CA ILE A 38 -1.568 -6.372 4.294 1.00 71.34 C ATOM 595 C ILE A 38 -2.756 -7.112 3.703 1.00 33.24 C ATOM 596 O ILE A 38 -2.824 -8.326 3.747 1.00 34.55 O ATOM 597 CB ILE A 38 -0.281 -6.687 3.481 1.00 41.12 C ATOM 598 CG1 ILE A 38 0.884 -5.821 3.993 1.00 25.21 C ATOM 599 CG2 ILE A 38 -0.513 -6.456 1.995 1.00 32.41 C ATOM 600 CD1 ILE A 38 2.189 -6.009 3.246 1.00 21.04 C ATOM 0 H ILE A 38 -1.330 -7.678 5.898 1.00 55.02 H new ATOM 0 HA ILE A 38 -1.758 -5.301 4.226 1.00 71.34 H new ATOM 0 HB ILE A 38 -0.025 -7.737 3.620 1.00 41.12 H new ATOM 0 HG12 ILE A 38 0.594 -4.772 3.931 1.00 25.21 H new ATOM 0 HG13 ILE A 38 1.049 -6.044 5.047 1.00 25.21 H new ATOM 0 HG21 ILE A 38 0.400 -6.682 1.445 1.00 32.41 H new ATOM 0 HG22 ILE A 38 -1.317 -7.105 1.647 1.00 32.41 H new ATOM 0 HG23 ILE A 38 -0.789 -5.415 1.827 1.00 32.41 H new ATOM 0 HD11 ILE A 38 2.951 -5.359 3.676 1.00 21.04 H new ATOM 0 HD12 ILE A 38 2.509 -7.048 3.329 1.00 21.04 H new ATOM 0 HD13 ILE A 38 2.047 -5.756 2.195 1.00 21.04 H new ATOM 612 N VAL A 39 -3.684 -6.370 3.168 1.00 75.14 N ATOM 613 CA VAL A 39 -4.841 -6.936 2.512 1.00 51.52 C ATOM 614 C VAL A 39 -4.734 -6.651 1.019 1.00 70.54 C ATOM 615 O VAL A 39 -4.551 -5.506 0.617 1.00 62.43 O ATOM 616 CB VAL A 39 -6.166 -6.333 3.075 1.00 42.22 C ATOM 617 CG1 VAL A 39 -7.389 -6.913 2.367 1.00 1.35 C ATOM 618 CG2 VAL A 39 -6.263 -6.574 4.575 1.00 45.05 C ATOM 0 H VAL A 39 -3.664 -5.350 3.172 1.00 75.14 H new ATOM 0 HA VAL A 39 -4.865 -8.010 2.696 1.00 51.52 H new ATOM 0 HB VAL A 39 -6.148 -5.259 2.888 1.00 42.22 H new ATOM 0 HG11 VAL A 39 -8.294 -6.471 2.784 1.00 1.35 H new ATOM 0 HG12 VAL A 39 -7.333 -6.689 1.302 1.00 1.35 H new ATOM 0 HG13 VAL A 39 -7.414 -7.993 2.510 1.00 1.35 H new ATOM 0 HG21 VAL A 39 -7.192 -6.148 4.953 1.00 45.05 H new ATOM 0 HG22 VAL A 39 -6.249 -7.646 4.773 1.00 45.05 H new ATOM 0 HG23 VAL A 39 -5.418 -6.101 5.075 1.00 45.05 H new ATOM 628 N ALA A 40 -4.841 -7.667 0.207 1.00 31.35 N ATOM 629 CA ALA A 40 -4.715 -7.502 -1.223 1.00 71.22 C ATOM 630 C ALA A 40 -6.009 -7.850 -1.911 1.00 64.43 C ATOM 631 O ALA A 40 -6.642 -8.864 -1.614 1.00 53.43 O ATOM 632 CB ALA A 40 -3.567 -8.337 -1.778 1.00 32.35 C ATOM 0 H ALA A 40 -5.016 -8.625 0.510 1.00 31.35 H new ATOM 0 HA ALA A 40 -4.488 -6.454 -1.421 1.00 71.22 H new ATOM 0 HB1 ALA A 40 -3.499 -8.191 -2.856 1.00 32.35 H new ATOM 0 HB2 ALA A 40 -2.633 -8.028 -1.310 1.00 32.35 H new ATOM 0 HB3 ALA A 40 -3.748 -9.391 -1.566 1.00 32.35 H new ATOM 638 N ARG A 41 -6.415 -7.014 -2.818 1.00 32.50 N ATOM 639 CA ARG A 41 -7.631 -7.254 -3.526 1.00 72.13 C ATOM 640 C ARG A 41 -7.347 -7.874 -4.872 1.00 14.54 C ATOM 641 O ARG A 41 -6.518 -7.360 -5.654 1.00 60.14 O ATOM 642 CB ARG A 41 -8.482 -5.988 -3.652 1.00 31.25 C ATOM 643 CG ARG A 41 -9.781 -6.214 -4.409 1.00 53.13 C ATOM 644 CD ARG A 41 -10.662 -4.990 -4.406 1.00 13.25 C ATOM 645 NE ARG A 41 -11.159 -4.651 -3.064 1.00 42.43 N ATOM 646 CZ ARG A 41 -12.157 -3.791 -2.826 1.00 75.12 C ATOM 647 NH1 ARG A 41 -12.698 -3.104 -3.825 1.00 14.04 N ATOM 648 NH2 ARG A 41 -12.599 -3.616 -1.587 1.00 34.34 N ATOM 0 H ARG A 41 -5.922 -6.162 -3.083 1.00 32.50 H new ATOM 0 HA ARG A 41 -8.219 -7.964 -2.945 1.00 72.13 H new ATOM 0 HB2 ARG A 41 -8.711 -5.611 -2.655 1.00 31.25 H new ATOM 0 HB3 ARG A 41 -7.902 -5.217 -4.160 1.00 31.25 H new ATOM 0 HG2 ARG A 41 -9.556 -6.495 -5.438 1.00 53.13 H new ATOM 0 HG3 ARG A 41 -10.320 -7.049 -3.961 1.00 53.13 H new ATOM 0 HD2 ARG A 41 -10.103 -4.144 -4.806 1.00 13.25 H new ATOM 0 HD3 ARG A 41 -11.509 -5.156 -5.071 1.00 13.25 H new ATOM 0 HE ARG A 41 -10.715 -5.100 -2.263 1.00 42.43 H new ATOM 0 HH11 ARG A 41 -12.353 -3.231 -4.777 1.00 14.04 H new ATOM 0 HH12 ARG A 41 -13.458 -2.449 -3.641 1.00 14.04 H new ATOM 0 HH21 ARG A 41 -12.178 -4.136 -0.817 1.00 34.34 H new ATOM 0 HH22 ARG A 41 -13.359 -2.961 -1.405 1.00 34.34 H new ATOM 662 N LEU A 42 -8.025 -8.968 -5.124 1.00 65.22 N ATOM 663 CA LEU A 42 -7.890 -9.742 -6.331 1.00 42.22 C ATOM 664 C LEU A 42 -8.484 -8.998 -7.549 1.00 23.51 C ATOM 665 O LEU A 42 -9.162 -7.967 -7.403 1.00 43.51 O ATOM 666 CB LEU A 42 -8.556 -11.117 -6.116 1.00 41.51 C ATOM 667 CG LEU A 42 -7.967 -11.970 -4.965 1.00 70.25 C ATOM 668 CD1 LEU A 42 -8.782 -13.238 -4.738 1.00 72.32 C ATOM 669 CD2 LEU A 42 -6.509 -12.317 -5.227 1.00 31.42 C ATOM 0 H LEU A 42 -8.708 -9.355 -4.472 1.00 65.22 H new ATOM 0 HA LEU A 42 -6.833 -9.890 -6.551 1.00 42.22 H new ATOM 0 HB2 LEU A 42 -9.617 -10.961 -5.923 1.00 41.51 H new ATOM 0 HB3 LEU A 42 -8.481 -11.687 -7.042 1.00 41.51 H new ATOM 0 HG LEU A 42 -8.018 -11.367 -4.058 1.00 70.25 H new ATOM 0 HD11 LEU A 42 -8.341 -13.813 -3.924 1.00 72.32 H new ATOM 0 HD12 LEU A 42 -9.807 -12.971 -4.480 1.00 72.32 H new ATOM 0 HD13 LEU A 42 -8.782 -13.838 -5.648 1.00 72.32 H new ATOM 0 HD21 LEU A 42 -6.124 -12.916 -4.402 1.00 31.42 H new ATOM 0 HD22 LEU A 42 -6.431 -12.884 -6.155 1.00 31.42 H new ATOM 0 HD23 LEU A 42 -5.926 -11.400 -5.313 1.00 31.42 H new ATOM 681 N LYS A 43 -8.218 -9.528 -8.724 1.00 43.21 N ATOM 682 CA LYS A 43 -8.621 -8.959 -10.034 1.00 44.11 C ATOM 683 C LYS A 43 -10.123 -8.978 -10.356 1.00 14.03 C ATOM 684 O LYS A 43 -10.501 -9.159 -11.519 1.00 13.32 O ATOM 685 CB LYS A 43 -7.812 -9.635 -11.122 1.00 43.13 C ATOM 686 CG LYS A 43 -6.417 -9.048 -11.267 1.00 63.01 C ATOM 687 CD LYS A 43 -5.478 -9.953 -12.029 1.00 41.44 C ATOM 688 CE LYS A 43 -6.068 -10.481 -13.351 1.00 53.24 C ATOM 689 NZ LYS A 43 -6.425 -9.423 -14.335 1.00 51.34 N ATOM 0 H LYS A 43 -7.697 -10.400 -8.818 1.00 43.21 H new ATOM 0 HA LYS A 43 -8.403 -7.893 -9.977 1.00 44.11 H new ATOM 0 HB2 LYS A 43 -7.733 -10.700 -10.902 1.00 43.13 H new ATOM 0 HB3 LYS A 43 -8.340 -9.544 -12.071 1.00 43.13 H new ATOM 0 HG2 LYS A 43 -6.483 -8.087 -11.778 1.00 63.01 H new ATOM 0 HG3 LYS A 43 -6.004 -8.855 -10.277 1.00 63.01 H new ATOM 0 HD2 LYS A 43 -4.557 -9.410 -12.243 1.00 41.44 H new ATOM 0 HD3 LYS A 43 -5.210 -10.799 -11.397 1.00 41.44 H new ATOM 0 HE2 LYS A 43 -5.348 -11.158 -13.810 1.00 53.24 H new ATOM 0 HE3 LYS A 43 -6.959 -11.067 -13.128 1.00 53.24 H new ATOM 0 HZ1 LYS A 43 -6.782 -9.865 -15.206 1.00 51.34 H new ATOM 0 HZ2 LYS A 43 -7.161 -8.808 -13.932 1.00 51.34 H new ATOM 0 HZ3 LYS A 43 -5.582 -8.855 -14.555 1.00 51.34 H new ATOM 703 N ASN A 44 -10.953 -8.689 -9.354 1.00 21.30 N ATOM 704 CA ASN A 44 -12.432 -8.613 -9.480 1.00 51.22 C ATOM 705 C ASN A 44 -13.019 -10.014 -9.707 1.00 3.54 C ATOM 706 O ASN A 44 -12.284 -10.939 -10.109 1.00 2.22 O ATOM 707 CB ASN A 44 -12.874 -7.614 -10.585 1.00 50.01 C ATOM 708 CG ASN A 44 -14.362 -7.304 -10.544 1.00 12.43 C ATOM 709 OD1 ASN A 44 -14.976 -7.322 -9.478 1.00 44.35 O ATOM 710 ND2 ASN A 44 -14.945 -7.010 -11.676 1.00 30.11 N ATOM 0 H ASN A 44 -10.623 -8.495 -8.409 1.00 21.30 H new ATOM 0 HA ASN A 44 -12.830 -8.225 -8.542 1.00 51.22 H new ATOM 0 HB2 ASN A 44 -12.312 -6.687 -10.475 1.00 50.01 H new ATOM 0 HB3 ASN A 44 -12.621 -8.026 -11.562 1.00 50.01 H new ATOM 0 HD21 ASN A 44 -15.940 -6.786 -11.694 1.00 30.11 H new ATOM 0 HD22 ASN A 44 -14.405 -7.005 -12.541 1.00 30.11 H new ATOM 717 N ASN A 45 -14.332 -10.187 -9.413 1.00 12.34 N ATOM 718 CA ASN A 45 -15.038 -11.517 -9.423 1.00 71.45 C ATOM 719 C ASN A 45 -14.567 -12.346 -8.228 1.00 74.42 C ATOM 720 O ASN A 45 -15.356 -12.951 -7.491 1.00 33.41 O ATOM 721 CB ASN A 45 -14.852 -12.284 -10.756 1.00 73.22 C ATOM 722 CG ASN A 45 -15.487 -13.672 -10.746 1.00 21.30 C ATOM 723 OD1 ASN A 45 -14.846 -14.658 -10.391 1.00 54.25 O ATOM 724 ND2 ASN A 45 -16.740 -13.760 -11.132 1.00 42.12 N ATOM 0 H ASN A 45 -14.944 -9.411 -9.160 1.00 12.34 H new ATOM 0 HA ASN A 45 -16.109 -11.333 -9.337 1.00 71.45 H new ATOM 0 HB2 ASN A 45 -15.285 -11.699 -11.567 1.00 73.22 H new ATOM 0 HB3 ASN A 45 -13.787 -12.381 -10.966 1.00 73.22 H new ATOM 0 HD21 ASN A 45 -17.208 -14.666 -11.143 1.00 42.12 H new ATOM 0 HD22 ASN A 45 -17.245 -12.922 -11.421 1.00 42.12 H new ATOM 731 N ASN A 46 -13.280 -12.341 -8.055 1.00 74.03 N ATOM 732 CA ASN A 46 -12.626 -12.888 -6.925 1.00 11.52 C ATOM 733 C ASN A 46 -12.762 -11.856 -5.809 1.00 44.14 C ATOM 734 O ASN A 46 -13.145 -10.716 -6.073 1.00 54.41 O ATOM 735 CB ASN A 46 -11.149 -13.122 -7.243 1.00 10.31 C ATOM 736 CG ASN A 46 -10.906 -14.081 -8.396 1.00 60.32 C ATOM 737 OD1 ASN A 46 -10.783 -15.293 -8.202 1.00 23.20 O ATOM 738 ND2 ASN A 46 -10.818 -13.553 -9.597 1.00 32.34 N ATOM 0 H ASN A 46 -12.636 -11.935 -8.734 1.00 74.03 H new ATOM 0 HA ASN A 46 -13.062 -13.844 -6.636 1.00 11.52 H new ATOM 0 HB2 ASN A 46 -10.683 -12.165 -7.477 1.00 10.31 H new ATOM 0 HB3 ASN A 46 -10.654 -13.509 -6.352 1.00 10.31 H new ATOM 0 HD21 ASN A 46 -10.643 -14.150 -10.405 1.00 32.34 H new ATOM 0 HD22 ASN A 46 -10.925 -12.546 -9.721 1.00 32.34 H new ATOM 745 N ARG A 47 -12.428 -12.205 -4.611 1.00 43.53 N ATOM 746 CA ARG A 47 -12.660 -11.300 -3.490 1.00 22.11 C ATOM 747 C ARG A 47 -11.368 -10.716 -2.946 1.00 3.22 C ATOM 748 O ARG A 47 -10.334 -10.897 -3.531 1.00 0.32 O ATOM 749 CB ARG A 47 -13.550 -11.981 -2.422 1.00 63.34 C ATOM 750 CG ARG A 47 -13.080 -13.328 -1.827 1.00 10.32 C ATOM 751 CD ARG A 47 -11.921 -13.178 -0.864 1.00 4.21 C ATOM 752 NE ARG A 47 -11.537 -14.452 -0.250 1.00 55.03 N ATOM 753 CZ ARG A 47 -10.802 -14.565 0.877 1.00 12.32 C ATOM 754 NH1 ARG A 47 -10.431 -13.478 1.556 1.00 14.21 N ATOM 755 NH2 ARG A 47 -10.450 -15.755 1.322 1.00 2.03 N ATOM 0 H ARG A 47 -11.997 -13.096 -4.365 1.00 43.53 H new ATOM 0 HA ARG A 47 -13.217 -10.435 -3.849 1.00 22.11 H new ATOM 0 HB2 ARG A 47 -13.676 -11.279 -1.598 1.00 63.34 H new ATOM 0 HB3 ARG A 47 -14.535 -12.137 -2.861 1.00 63.34 H new ATOM 0 HG2 ARG A 47 -13.915 -13.802 -1.311 1.00 10.32 H new ATOM 0 HG3 ARG A 47 -12.787 -13.995 -2.638 1.00 10.32 H new ATOM 0 HD2 ARG A 47 -11.064 -12.760 -1.393 1.00 4.21 H new ATOM 0 HD3 ARG A 47 -12.191 -12.468 -0.082 1.00 4.21 H new ATOM 0 HE ARG A 47 -11.846 -15.311 -0.705 1.00 55.03 H new ATOM 0 HH11 ARG A 47 -10.703 -12.552 1.225 1.00 14.21 H new ATOM 0 HH12 ARG A 47 -9.876 -13.573 2.406 1.00 14.21 H new ATOM 0 HH21 ARG A 47 -10.733 -16.593 0.815 1.00 2.03 H new ATOM 0 HH22 ARG A 47 -9.895 -15.837 2.174 1.00 2.03 H new ATOM 769 N GLN A 48 -11.419 -9.997 -1.854 1.00 63.53 N ATOM 770 CA GLN A 48 -10.189 -9.473 -1.311 1.00 11.22 C ATOM 771 C GLN A 48 -9.686 -10.359 -0.207 1.00 64.14 C ATOM 772 O GLN A 48 -10.443 -10.776 0.686 1.00 14.22 O ATOM 773 CB GLN A 48 -10.285 -8.002 -0.887 1.00 23.23 C ATOM 774 CG GLN A 48 -11.398 -7.679 0.079 1.00 33.05 C ATOM 775 CD GLN A 48 -11.376 -6.236 0.522 1.00 1.30 C ATOM 776 OE1 GLN A 48 -10.919 -5.347 -0.208 1.00 63.54 O ATOM 777 NE2 GLN A 48 -11.893 -5.981 1.682 1.00 2.35 N ATOM 0 H GLN A 48 -12.267 -9.766 -1.337 1.00 63.53 H new ATOM 0 HA GLN A 48 -9.454 -9.481 -2.116 1.00 11.22 H new ATOM 0 HB2 GLN A 48 -9.338 -7.709 -0.435 1.00 23.23 H new ATOM 0 HB3 GLN A 48 -10.414 -7.391 -1.781 1.00 23.23 H new ATOM 0 HG2 GLN A 48 -12.357 -7.897 -0.390 1.00 33.05 H new ATOM 0 HG3 GLN A 48 -11.316 -8.326 0.953 1.00 33.05 H new ATOM 0 HE21 GLN A 48 -12.260 -6.741 2.255 1.00 2.35 H new ATOM 0 HE22 GLN A 48 -11.934 -5.020 2.022 1.00 2.35 H new ATOM 786 N VAL A 49 -8.435 -10.667 -0.289 1.00 1.54 N ATOM 787 CA VAL A 49 -7.795 -11.593 0.596 1.00 31.32 C ATOM 788 C VAL A 49 -6.801 -10.870 1.489 1.00 54.03 C ATOM 789 O VAL A 49 -6.316 -9.796 1.147 1.00 65.41 O ATOM 790 CB VAL A 49 -7.083 -12.741 -0.204 1.00 3.21 C ATOM 791 CG1 VAL A 49 -8.094 -13.584 -0.957 1.00 35.33 C ATOM 792 CG2 VAL A 49 -6.078 -12.188 -1.196 1.00 22.44 C ATOM 0 H VAL A 49 -7.809 -10.273 -0.991 1.00 1.54 H new ATOM 0 HA VAL A 49 -8.562 -12.047 1.223 1.00 31.32 H new ATOM 0 HB VAL A 49 -6.561 -13.357 0.528 1.00 3.21 H new ATOM 0 HG11 VAL A 49 -7.576 -14.372 -1.503 1.00 35.33 H new ATOM 0 HG12 VAL A 49 -8.793 -14.031 -0.250 1.00 35.33 H new ATOM 0 HG13 VAL A 49 -8.641 -12.955 -1.660 1.00 35.33 H new ATOM 0 HG21 VAL A 49 -5.605 -13.011 -1.732 1.00 22.44 H new ATOM 0 HG22 VAL A 49 -6.588 -11.538 -1.907 1.00 22.44 H new ATOM 0 HG23 VAL A 49 -5.318 -11.617 -0.663 1.00 22.44 H new ATOM 802 N CYS A 50 -6.510 -11.438 2.603 1.00 13.20 N ATOM 803 CA CYS A 50 -5.584 -10.852 3.520 1.00 53.02 C ATOM 804 C CYS A 50 -4.315 -11.617 3.368 1.00 52.20 C ATOM 805 O CYS A 50 -4.335 -12.815 3.351 1.00 11.12 O ATOM 806 CB CYS A 50 -6.104 -10.958 4.948 1.00 3.23 C ATOM 807 SG CYS A 50 -5.051 -10.140 6.185 1.00 50.24 S ATOM 0 H CYS A 50 -6.906 -12.326 2.911 1.00 13.20 H new ATOM 0 HA CYS A 50 -5.437 -9.792 3.313 1.00 53.02 H new ATOM 0 HB2 CYS A 50 -7.103 -10.524 4.993 1.00 3.23 H new ATOM 0 HB3 CYS A 50 -6.202 -12.011 5.210 1.00 3.23 H new ATOM 812 N ILE A 51 -3.232 -10.942 3.241 1.00 12.31 N ATOM 813 CA ILE A 51 -2.006 -11.588 2.890 1.00 51.31 C ATOM 814 C ILE A 51 -1.077 -11.645 4.076 1.00 2.33 C ATOM 815 O ILE A 51 -1.110 -10.761 4.934 1.00 41.13 O ATOM 816 CB ILE A 51 -1.280 -10.780 1.771 1.00 20.43 C ATOM 817 CG1 ILE A 51 -2.211 -10.464 0.615 1.00 74.32 C ATOM 818 CG2 ILE A 51 -0.096 -11.556 1.244 1.00 51.24 C ATOM 819 CD1 ILE A 51 -2.762 -11.672 -0.090 1.00 20.10 C ATOM 0 H ILE A 51 -3.162 -9.933 3.375 1.00 12.31 H new ATOM 0 HA ILE A 51 -2.248 -12.595 2.550 1.00 51.31 H new ATOM 0 HB ILE A 51 -0.945 -9.844 2.218 1.00 20.43 H new ATOM 0 HG12 ILE A 51 -3.042 -9.866 0.988 1.00 74.32 H new ATOM 0 HG13 ILE A 51 -1.676 -9.849 -0.109 1.00 74.32 H new ATOM 0 HG21 ILE A 51 0.400 -10.978 0.464 1.00 51.24 H new ATOM 0 HG22 ILE A 51 0.606 -11.745 2.056 1.00 51.24 H new ATOM 0 HG23 ILE A 51 -0.438 -12.505 0.831 1.00 51.24 H new ATOM 0 HD11 ILE A 51 -3.416 -11.353 -0.901 1.00 20.10 H new ATOM 0 HD12 ILE A 51 -1.941 -12.262 -0.497 1.00 20.10 H new ATOM 0 HD13 ILE A 51 -3.329 -12.278 0.616 1.00 20.10 H new ATOM 831 N ASP A 52 -0.272 -12.696 4.132 1.00 72.43 N ATOM 832 CA ASP A 52 0.831 -12.736 5.073 1.00 23.54 C ATOM 833 C ASP A 52 1.820 -11.714 4.588 1.00 74.53 C ATOM 834 O ASP A 52 2.406 -11.868 3.505 1.00 14.31 O ATOM 835 CB ASP A 52 1.514 -14.115 5.128 1.00 32.11 C ATOM 836 CG ASP A 52 2.690 -14.146 6.121 1.00 4.01 C ATOM 837 OD1 ASP A 52 2.455 -14.296 7.331 1.00 0.11 O ATOM 838 OD2 ASP A 52 3.858 -14.025 5.691 1.00 4.15 O ATOM 0 H ASP A 52 -0.362 -13.523 3.542 1.00 72.43 H new ATOM 0 HA ASP A 52 0.464 -12.534 6.079 1.00 23.54 H new ATOM 0 HB2 ASP A 52 0.781 -14.870 5.413 1.00 32.11 H new ATOM 0 HB3 ASP A 52 1.874 -14.379 4.134 1.00 32.11 H new ATOM 843 N PRO A 53 2.018 -10.647 5.341 1.00 15.40 N ATOM 844 CA PRO A 53 2.855 -9.535 4.912 1.00 60.42 C ATOM 845 C PRO A 53 4.324 -9.886 4.902 1.00 74.42 C ATOM 846 O PRO A 53 5.167 -9.052 4.584 1.00 23.32 O ATOM 847 CB PRO A 53 2.577 -8.467 5.961 1.00 40.02 C ATOM 848 CG PRO A 53 2.187 -9.228 7.171 1.00 32.02 C ATOM 849 CD PRO A 53 1.455 -10.434 6.688 1.00 52.43 C ATOM 0 HA PRO A 53 2.630 -9.227 3.891 1.00 60.42 H new ATOM 0 HB2 PRO A 53 3.458 -7.853 6.145 1.00 40.02 H new ATOM 0 HB3 PRO A 53 1.781 -7.794 5.641 1.00 40.02 H new ATOM 0 HG2 PRO A 53 3.065 -9.512 7.751 1.00 32.02 H new ATOM 0 HG3 PRO A 53 1.555 -8.625 7.823 1.00 32.02 H new ATOM 0 HD2 PRO A 53 1.623 -11.294 7.336 1.00 52.43 H new ATOM 0 HD3 PRO A 53 0.379 -10.266 6.654 1.00 52.43 H new ATOM 857 N LYS A 54 4.638 -11.106 5.264 1.00 71.35 N ATOM 858 CA LYS A 54 5.956 -11.533 5.277 1.00 11.33 C ATOM 859 C LYS A 54 6.251 -12.500 4.110 1.00 33.32 C ATOM 860 O LYS A 54 7.327 -13.046 4.030 1.00 20.12 O ATOM 861 CB LYS A 54 6.320 -12.089 6.649 1.00 35.31 C ATOM 862 CG LYS A 54 6.058 -11.081 7.782 1.00 24.21 C ATOM 863 CD LYS A 54 6.606 -11.540 9.122 1.00 73.34 C ATOM 864 CE LYS A 54 8.120 -11.672 9.049 1.00 22.04 C ATOM 865 NZ LYS A 54 8.750 -12.077 10.336 1.00 30.43 N ATOM 0 H LYS A 54 3.960 -11.811 5.554 1.00 71.35 H new ATOM 0 HA LYS A 54 6.610 -10.677 5.108 1.00 11.33 H new ATOM 0 HB2 LYS A 54 5.745 -12.996 6.834 1.00 35.31 H new ATOM 0 HB3 LYS A 54 7.373 -12.372 6.655 1.00 35.31 H new ATOM 0 HG2 LYS A 54 6.508 -10.123 7.520 1.00 24.21 H new ATOM 0 HG3 LYS A 54 4.985 -10.915 7.872 1.00 24.21 H new ATOM 0 HD2 LYS A 54 6.332 -10.827 9.899 1.00 73.34 H new ATOM 0 HD3 LYS A 54 6.162 -12.497 9.397 1.00 73.34 H new ATOM 0 HE2 LYS A 54 8.375 -12.405 8.284 1.00 22.04 H new ATOM 0 HE3 LYS A 54 8.544 -10.719 8.732 1.00 22.04 H new ATOM 0 HZ1 LYS A 54 9.769 -11.872 10.303 1.00 30.43 H new ATOM 0 HZ2 LYS A 54 8.315 -11.546 11.118 1.00 30.43 H new ATOM 0 HZ3 LYS A 54 8.606 -13.096 10.487 1.00 30.43 H new ATOM 879 N LEU A 55 5.275 -12.687 3.196 1.00 72.14 N ATOM 880 CA LEU A 55 5.529 -13.450 1.947 1.00 72.24 C ATOM 881 C LEU A 55 6.695 -12.835 1.208 1.00 22.35 C ATOM 882 O LEU A 55 6.814 -11.617 1.168 1.00 45.03 O ATOM 883 CB LEU A 55 4.304 -13.449 1.020 1.00 11.23 C ATOM 884 CG LEU A 55 3.162 -14.388 1.367 1.00 53.11 C ATOM 885 CD1 LEU A 55 1.995 -14.153 0.433 1.00 51.23 C ATOM 886 CD2 LEU A 55 3.630 -15.804 1.201 1.00 41.21 C ATOM 0 H LEU A 55 4.324 -12.331 3.291 1.00 72.14 H new ATOM 0 HA LEU A 55 5.749 -14.480 2.228 1.00 72.24 H new ATOM 0 HB2 LEU A 55 3.907 -12.434 0.988 1.00 11.23 H new ATOM 0 HB3 LEU A 55 4.644 -13.690 0.013 1.00 11.23 H new ATOM 0 HG LEU A 55 2.848 -14.205 2.395 1.00 53.11 H new ATOM 0 HD11 LEU A 55 1.181 -14.831 0.690 1.00 51.23 H new ATOM 0 HD12 LEU A 55 1.653 -13.123 0.530 1.00 51.23 H new ATOM 0 HD13 LEU A 55 2.309 -14.336 -0.595 1.00 51.23 H new ATOM 0 HD21 LEU A 55 2.817 -16.487 1.448 1.00 41.21 H new ATOM 0 HD22 LEU A 55 3.940 -15.966 0.169 1.00 41.21 H new ATOM 0 HD23 LEU A 55 4.474 -15.989 1.866 1.00 41.21 H new ATOM 898 N LYS A 56 7.546 -13.655 0.599 1.00 32.14 N ATOM 899 CA LYS A 56 8.729 -13.115 -0.032 1.00 13.21 C ATOM 900 C LYS A 56 8.425 -12.188 -1.207 1.00 73.01 C ATOM 901 O LYS A 56 9.140 -11.205 -1.410 1.00 10.10 O ATOM 902 CB LYS A 56 9.769 -14.157 -0.386 1.00 4.31 C ATOM 903 CG LYS A 56 11.060 -13.491 -0.814 1.00 22.44 C ATOM 904 CD LYS A 56 12.163 -14.453 -1.053 1.00 62.23 C ATOM 905 CE LYS A 56 13.428 -13.703 -1.436 1.00 1.13 C ATOM 906 NZ LYS A 56 14.577 -14.593 -1.596 1.00 21.01 N ATOM 0 H LYS A 56 7.438 -14.667 0.533 1.00 32.14 H new ATOM 0 HA LYS A 56 9.180 -12.494 0.742 1.00 13.21 H new ATOM 0 HB2 LYS A 56 9.953 -14.803 0.473 1.00 4.31 H new ATOM 0 HB3 LYS A 56 9.397 -14.793 -1.189 1.00 4.31 H new ATOM 0 HG2 LYS A 56 10.882 -12.919 -1.725 1.00 22.44 H new ATOM 0 HG3 LYS A 56 11.366 -12.780 -0.046 1.00 22.44 H new ATOM 0 HD2 LYS A 56 12.339 -15.048 -0.157 1.00 62.23 H new ATOM 0 HD3 LYS A 56 11.887 -15.147 -1.847 1.00 62.23 H new ATOM 0 HE2 LYS A 56 13.259 -13.162 -2.367 1.00 1.13 H new ATOM 0 HE3 LYS A 56 13.652 -12.959 -0.671 1.00 1.13 H new ATOM 0 HZ1 LYS A 56 15.415 -14.035 -1.857 1.00 21.01 H new ATOM 0 HZ2 LYS A 56 14.758 -15.091 -0.701 1.00 21.01 H new ATOM 0 HZ3 LYS A 56 14.377 -15.287 -2.344 1.00 21.01 H new ATOM 920 N TRP A 57 7.348 -12.454 -1.966 1.00 34.42 N ATOM 921 CA TRP A 57 7.005 -11.518 -3.033 1.00 72.22 C ATOM 922 C TRP A 57 6.579 -10.183 -2.441 1.00 70.35 C ATOM 923 O TRP A 57 6.755 -9.153 -3.049 1.00 52.21 O ATOM 924 CB TRP A 57 6.000 -12.053 -4.110 1.00 24.15 C ATOM 925 CG TRP A 57 4.621 -12.471 -3.663 1.00 41.45 C ATOM 926 CD1 TRP A 57 4.226 -13.685 -3.147 1.00 12.41 C ATOM 927 CD2 TRP A 57 3.432 -11.679 -3.761 1.00 0.44 C ATOM 928 NE1 TRP A 57 2.869 -13.681 -2.932 1.00 24.45 N ATOM 929 CE2 TRP A 57 2.362 -12.461 -3.292 1.00 21.53 C ATOM 930 CE3 TRP A 57 3.172 -10.377 -4.200 1.00 21.44 C ATOM 931 CZ2 TRP A 57 1.054 -11.984 -3.251 1.00 75.24 C ATOM 932 CZ3 TRP A 57 1.876 -9.909 -4.162 1.00 53.01 C ATOM 933 CH2 TRP A 57 0.835 -10.714 -3.691 1.00 73.23 C ATOM 0 H TRP A 57 6.735 -13.263 -1.866 1.00 34.42 H new ATOM 0 HA TRP A 57 7.920 -11.378 -3.609 1.00 72.22 H new ATOM 0 HB2 TRP A 57 5.882 -11.278 -4.867 1.00 24.15 H new ATOM 0 HB3 TRP A 57 6.464 -12.909 -4.600 1.00 24.15 H new ATOM 0 HD1 TRP A 57 4.884 -14.516 -2.942 1.00 12.41 H new ATOM 0 HE1 TRP A 57 2.326 -14.462 -2.563 1.00 24.45 H new ATOM 0 HE3 TRP A 57 3.973 -9.749 -4.562 1.00 21.44 H new ATOM 0 HZ2 TRP A 57 0.245 -12.598 -2.884 1.00 75.24 H new ATOM 0 HZ3 TRP A 57 1.662 -8.906 -4.501 1.00 53.01 H new ATOM 0 HH2 TRP A 57 -0.170 -10.318 -3.676 1.00 73.23 H new ATOM 944 N ILE A 58 6.050 -10.231 -1.223 1.00 63.35 N ATOM 945 CA ILE A 58 5.683 -9.036 -0.488 1.00 20.23 C ATOM 946 C ILE A 58 6.955 -8.345 0.033 1.00 62.41 C ATOM 947 O ILE A 58 7.095 -7.136 -0.081 1.00 11.44 O ATOM 948 CB ILE A 58 4.746 -9.364 0.716 1.00 64.53 C ATOM 949 CG1 ILE A 58 3.432 -10.016 0.244 1.00 4.12 C ATOM 950 CG2 ILE A 58 4.455 -8.114 1.529 1.00 42.32 C ATOM 951 CD1 ILE A 58 2.601 -9.135 -0.629 1.00 65.50 C ATOM 0 H ILE A 58 5.866 -11.100 -0.722 1.00 63.35 H new ATOM 0 HA ILE A 58 5.143 -8.377 -1.168 1.00 20.23 H new ATOM 0 HB ILE A 58 5.267 -10.079 1.353 1.00 64.53 H new ATOM 0 HG12 ILE A 58 3.666 -10.932 -0.298 1.00 4.12 H new ATOM 0 HG13 ILE A 58 2.846 -10.303 1.117 1.00 4.12 H new ATOM 0 HG21 ILE A 58 3.800 -8.367 2.363 1.00 42.32 H new ATOM 0 HG22 ILE A 58 5.389 -7.704 1.913 1.00 42.32 H new ATOM 0 HG23 ILE A 58 3.967 -7.373 0.896 1.00 42.32 H new ATOM 0 HD11 ILE A 58 1.693 -9.663 -0.920 1.00 65.50 H new ATOM 0 HD12 ILE A 58 2.335 -8.230 -0.084 1.00 65.50 H new ATOM 0 HD13 ILE A 58 3.168 -8.868 -1.521 1.00 65.50 H new ATOM 963 N GLN A 59 7.878 -9.146 0.588 1.00 21.24 N ATOM 964 CA GLN A 59 9.154 -8.640 1.140 1.00 63.23 C ATOM 965 C GLN A 59 9.905 -7.871 0.078 1.00 74.31 C ATOM 966 O GLN A 59 10.300 -6.718 0.280 1.00 41.22 O ATOM 967 CB GLN A 59 10.036 -9.806 1.605 1.00 41.51 C ATOM 968 CG GLN A 59 9.398 -10.709 2.639 1.00 1.23 C ATOM 969 CD GLN A 59 9.097 -10.014 3.936 1.00 32.23 C ATOM 970 OE1 GLN A 59 9.914 -9.999 4.845 1.00 45.25 O ATOM 971 NE2 GLN A 59 7.931 -9.431 4.035 1.00 21.11 N ATOM 0 H GLN A 59 7.767 -10.157 0.669 1.00 21.24 H new ATOM 0 HA GLN A 59 8.925 -7.991 1.985 1.00 63.23 H new ATOM 0 HB2 GLN A 59 10.308 -10.406 0.737 1.00 41.51 H new ATOM 0 HB3 GLN A 59 10.961 -9.402 2.016 1.00 41.51 H new ATOM 0 HG2 GLN A 59 8.473 -11.118 2.232 1.00 1.23 H new ATOM 0 HG3 GLN A 59 10.061 -11.552 2.833 1.00 1.23 H new ATOM 0 HE21 GLN A 59 7.276 -9.465 3.254 1.00 21.11 H new ATOM 0 HE22 GLN A 59 7.677 -8.942 4.893 1.00 21.11 H new ATOM 980 N GLU A 60 10.065 -8.500 -1.072 1.00 1.40 N ATOM 981 CA GLU A 60 10.731 -7.873 -2.176 1.00 31.32 C ATOM 982 C GLU A 60 9.950 -6.674 -2.640 1.00 45.21 C ATOM 983 O GLU A 60 10.519 -5.645 -2.871 1.00 13.22 O ATOM 984 CB GLU A 60 10.938 -8.845 -3.333 1.00 61.43 C ATOM 985 CG GLU A 60 11.880 -9.999 -3.040 1.00 42.10 C ATOM 986 CD GLU A 60 13.270 -9.532 -2.674 1.00 65.30 C ATOM 987 OE1 GLU A 60 13.923 -8.840 -3.499 1.00 21.55 O ATOM 988 OE2 GLU A 60 13.758 -9.880 -1.583 1.00 1.34 O ATOM 0 H GLU A 60 9.738 -9.448 -1.256 1.00 1.40 H new ATOM 0 HA GLU A 60 11.714 -7.551 -1.832 1.00 31.32 H new ATOM 0 HB2 GLU A 60 9.969 -9.251 -3.624 1.00 61.43 H new ATOM 0 HB3 GLU A 60 11.322 -8.291 -4.189 1.00 61.43 H new ATOM 0 HG2 GLU A 60 11.474 -10.597 -2.224 1.00 42.10 H new ATOM 0 HG3 GLU A 60 11.937 -10.649 -3.913 1.00 42.10 H new ATOM 995 N TYR A 61 8.632 -6.814 -2.731 1.00 14.44 N ATOM 996 CA TYR A 61 7.750 -5.743 -3.198 1.00 52.12 C ATOM 997 C TYR A 61 7.986 -4.474 -2.375 1.00 62.33 C ATOM 998 O TYR A 61 8.210 -3.389 -2.935 1.00 14.20 O ATOM 999 CB TYR A 61 6.294 -6.191 -3.061 1.00 65.43 C ATOM 1000 CG TYR A 61 5.294 -5.291 -3.717 1.00 71.22 C ATOM 1001 CD1 TYR A 61 4.716 -4.229 -3.037 1.00 51.13 C ATOM 1002 CD2 TYR A 61 4.922 -5.514 -5.028 1.00 50.04 C ATOM 1003 CE1 TYR A 61 3.804 -3.425 -3.651 1.00 34.41 C ATOM 1004 CE2 TYR A 61 4.009 -4.707 -5.647 1.00 42.23 C ATOM 1005 CZ TYR A 61 3.454 -3.664 -4.952 1.00 62.14 C ATOM 1006 OH TYR A 61 2.549 -2.866 -5.561 1.00 23.02 O ATOM 0 H TYR A 61 8.141 -7.673 -2.483 1.00 14.44 H new ATOM 0 HA TYR A 61 7.966 -5.527 -4.244 1.00 52.12 H new ATOM 0 HB2 TYR A 61 6.195 -7.190 -3.485 1.00 65.43 H new ATOM 0 HB3 TYR A 61 6.051 -6.269 -2.001 1.00 65.43 H new ATOM 0 HD1 TYR A 61 4.992 -4.038 -2.010 1.00 51.13 H new ATOM 0 HD2 TYR A 61 5.359 -6.338 -5.572 1.00 50.04 H new ATOM 0 HE1 TYR A 61 3.359 -2.601 -3.113 1.00 34.41 H new ATOM 0 HE2 TYR A 61 3.728 -4.889 -6.674 1.00 42.23 H new ATOM 0 HH TYR A 61 3.005 -2.089 -5.947 1.00 23.02 H new ATOM 1016 N LEU A 62 7.960 -4.636 -1.055 1.00 65.44 N ATOM 1017 CA LEU A 62 8.222 -3.550 -0.112 1.00 12.04 C ATOM 1018 C LEU A 62 9.596 -2.930 -0.384 1.00 32.22 C ATOM 1019 O LEU A 62 9.723 -1.712 -0.534 1.00 54.11 O ATOM 1020 CB LEU A 62 8.177 -4.092 1.328 1.00 51.31 C ATOM 1021 CG LEU A 62 6.843 -4.697 1.798 1.00 75.21 C ATOM 1022 CD1 LEU A 62 6.996 -5.327 3.170 1.00 41.32 C ATOM 1023 CD2 LEU A 62 5.756 -3.641 1.840 1.00 74.15 C ATOM 0 H LEU A 62 7.756 -5.529 -0.606 1.00 65.44 H new ATOM 0 HA LEU A 62 7.457 -2.783 -0.237 1.00 12.04 H new ATOM 0 HB2 LEU A 62 8.950 -4.854 1.429 1.00 51.31 H new ATOM 0 HB3 LEU A 62 8.439 -3.280 2.006 1.00 51.31 H new ATOM 0 HG LEU A 62 6.556 -5.468 1.083 1.00 75.21 H new ATOM 0 HD11 LEU A 62 6.042 -5.749 3.485 1.00 41.32 H new ATOM 0 HD12 LEU A 62 7.746 -6.117 3.126 1.00 41.32 H new ATOM 0 HD13 LEU A 62 7.311 -4.568 3.886 1.00 41.32 H new ATOM 0 HD21 LEU A 62 4.822 -4.093 2.175 1.00 74.15 H new ATOM 0 HD22 LEU A 62 6.045 -2.849 2.531 1.00 74.15 H new ATOM 0 HD23 LEU A 62 5.618 -3.221 0.844 1.00 74.15 H new ATOM 1035 N GLU A 63 10.609 -3.783 -0.477 1.00 64.40 N ATOM 1036 CA GLU A 63 11.973 -3.344 -0.717 1.00 63.33 C ATOM 1037 C GLU A 63 12.173 -2.674 -2.084 1.00 15.42 C ATOM 1038 O GLU A 63 12.833 -1.632 -2.172 1.00 70.10 O ATOM 1039 CB GLU A 63 12.981 -4.488 -0.557 1.00 63.11 C ATOM 1040 CG GLU A 63 13.152 -5.013 0.856 1.00 71.44 C ATOM 1041 CD GLU A 63 14.315 -5.971 0.951 1.00 13.23 C ATOM 1042 OE1 GLU A 63 15.470 -5.526 0.795 1.00 22.15 O ATOM 1043 OE2 GLU A 63 14.113 -7.176 1.155 1.00 12.50 O ATOM 0 H GLU A 63 10.506 -4.794 -0.388 1.00 64.40 H new ATOM 0 HA GLU A 63 12.159 -2.590 0.048 1.00 63.33 H new ATOM 0 HB2 GLU A 63 12.672 -5.314 -1.198 1.00 63.11 H new ATOM 0 HB3 GLU A 63 13.951 -4.148 -0.920 1.00 63.11 H new ATOM 0 HG2 GLU A 63 13.309 -4.178 1.539 1.00 71.44 H new ATOM 0 HG3 GLU A 63 12.238 -5.516 1.172 1.00 71.44 H new ATOM 1050 N LYS A 64 11.601 -3.258 -3.140 1.00 31.40 N ATOM 1051 CA LYS A 64 11.833 -2.755 -4.498 1.00 43.14 C ATOM 1052 C LYS A 64 11.189 -1.386 -4.646 1.00 24.20 C ATOM 1053 O LYS A 64 11.792 -0.480 -5.184 1.00 10.01 O ATOM 1054 CB LYS A 64 11.231 -3.665 -5.620 1.00 5.14 C ATOM 1055 CG LYS A 64 11.448 -5.201 -5.593 1.00 13.13 C ATOM 1056 CD LYS A 64 12.893 -5.714 -5.562 1.00 71.11 C ATOM 1057 CE LYS A 64 13.562 -5.521 -4.207 1.00 71.42 C ATOM 1058 NZ LYS A 64 14.770 -6.351 -4.056 1.00 74.11 N ATOM 0 H LYS A 64 10.983 -4.067 -3.084 1.00 31.40 H new ATOM 0 HA LYS A 64 12.915 -2.728 -4.623 1.00 43.14 H new ATOM 0 HB2 LYS A 64 10.155 -3.493 -5.630 1.00 5.14 H new ATOM 0 HB3 LYS A 64 11.621 -3.302 -6.571 1.00 5.14 H new ATOM 0 HG2 LYS A 64 10.932 -5.598 -4.719 1.00 13.13 H new ATOM 0 HG3 LYS A 64 10.960 -5.625 -6.471 1.00 13.13 H new ATOM 0 HD2 LYS A 64 12.903 -6.773 -5.819 1.00 71.11 H new ATOM 0 HD3 LYS A 64 13.474 -5.196 -6.325 1.00 71.11 H new ATOM 0 HE2 LYS A 64 13.827 -4.471 -4.082 1.00 71.42 H new ATOM 0 HE3 LYS A 64 12.853 -5.767 -3.416 1.00 71.42 H new ATOM 0 HZ1 LYS A 64 15.400 -5.922 -3.348 1.00 74.11 H new ATOM 0 HZ2 LYS A 64 14.499 -7.305 -3.745 1.00 74.11 H new ATOM 0 HZ3 LYS A 64 15.265 -6.412 -4.968 1.00 74.11 H new ATOM 1072 N CYS A 65 9.960 -1.259 -4.125 1.00 55.22 N ATOM 1073 CA CYS A 65 9.136 -0.044 -4.248 1.00 10.32 C ATOM 1074 C CYS A 65 9.844 1.227 -3.794 1.00 12.25 C ATOM 1075 O CYS A 65 9.777 2.249 -4.473 1.00 62.14 O ATOM 1076 CB CYS A 65 7.804 -0.208 -3.487 1.00 72.12 C ATOM 1077 SG CYS A 65 6.725 1.274 -3.498 1.00 73.11 S ATOM 0 H CYS A 65 9.503 -2.005 -3.600 1.00 55.22 H new ATOM 0 HA CYS A 65 8.940 0.074 -5.314 1.00 10.32 H new ATOM 0 HB2 CYS A 65 7.254 -1.043 -3.921 1.00 72.12 H new ATOM 0 HB3 CYS A 65 8.023 -0.473 -2.453 1.00 72.12 H new ATOM 1082 N LEU A 66 10.524 1.176 -2.676 1.00 33.02 N ATOM 1083 CA LEU A 66 11.149 2.374 -2.165 1.00 33.12 C ATOM 1084 C LEU A 66 12.441 2.735 -2.914 1.00 74.41 C ATOM 1085 O LEU A 66 12.792 3.916 -3.046 1.00 41.12 O ATOM 1086 CB LEU A 66 11.325 2.289 -0.635 1.00 1.12 C ATOM 1087 CG LEU A 66 12.274 1.240 -0.034 1.00 41.13 C ATOM 1088 CD1 LEU A 66 13.738 1.627 -0.211 1.00 30.11 C ATOM 1089 CD2 LEU A 66 11.953 1.045 1.422 1.00 0.14 C ATOM 0 H LEU A 66 10.659 0.338 -2.111 1.00 33.02 H new ATOM 0 HA LEU A 66 10.477 3.210 -2.359 1.00 33.12 H new ATOM 0 HB2 LEU A 66 11.661 3.267 -0.291 1.00 1.12 H new ATOM 0 HB3 LEU A 66 10.339 2.121 -0.203 1.00 1.12 H new ATOM 0 HG LEU A 66 12.124 0.303 -0.570 1.00 41.13 H new ATOM 0 HD11 LEU A 66 14.373 0.858 0.228 1.00 30.11 H new ATOM 0 HD12 LEU A 66 13.964 1.721 -1.273 1.00 30.11 H new ATOM 0 HD13 LEU A 66 13.925 2.579 0.285 1.00 30.11 H new ATOM 0 HD21 LEU A 66 12.627 0.301 1.847 1.00 0.14 H new ATOM 0 HD22 LEU A 66 12.076 1.990 1.951 1.00 0.14 H new ATOM 0 HD23 LEU A 66 10.923 0.703 1.525 1.00 0.14 H new ATOM 1101 N ASN A 67 13.112 1.728 -3.443 1.00 20.43 N ATOM 1102 CA ASN A 67 14.384 1.929 -4.124 1.00 53.35 C ATOM 1103 C ASN A 67 14.160 2.234 -5.609 1.00 53.12 C ATOM 1104 O ASN A 67 14.342 3.380 -6.051 1.00 32.55 O ATOM 1105 CB ASN A 67 15.287 0.692 -3.937 1.00 20.53 C ATOM 1106 CG ASN A 67 16.660 0.832 -4.585 1.00 33.22 C ATOM 1107 OD1 ASN A 67 16.853 0.475 -5.749 1.00 51.41 O ATOM 1108 ND2 ASN A 67 17.622 1.316 -3.832 1.00 32.43 N ATOM 0 H ASN A 67 12.798 0.758 -3.415 1.00 20.43 H new ATOM 0 HA ASN A 67 14.888 2.789 -3.682 1.00 53.35 H new ATOM 0 HB2 ASN A 67 15.416 0.505 -2.871 1.00 20.53 H new ATOM 0 HB3 ASN A 67 14.785 -0.180 -4.355 1.00 20.53 H new ATOM 0 HD21 ASN A 67 18.566 1.407 -4.207 1.00 32.43 H new ATOM 0 HD22 ASN A 67 17.424 1.601 -2.873 1.00 32.43 H new ATOM 1115 N LYS A 68 13.719 1.220 -6.353 1.00 75.21 N ATOM 1116 CA LYS A 68 13.450 1.318 -7.802 1.00 14.15 C ATOM 1117 C LYS A 68 14.604 1.917 -8.600 1.00 1.10 C ATOM 1118 O LYS A 68 15.781 1.682 -8.289 1.00 63.24 O ATOM 1119 CB LYS A 68 12.148 2.064 -8.079 1.00 0.14 C ATOM 1120 CG LYS A 68 10.929 1.367 -7.517 1.00 34.04 C ATOM 1121 CD LYS A 68 9.601 2.037 -7.872 1.00 33.34 C ATOM 1122 CE LYS A 68 9.383 3.441 -7.253 1.00 11.45 C ATOM 1123 NZ LYS A 68 10.285 4.500 -7.766 1.00 51.13 N ATOM 0 H LYS A 68 13.534 0.293 -5.969 1.00 75.21 H new ATOM 0 HA LYS A 68 13.342 0.291 -8.150 1.00 14.15 H new ATOM 0 HB2 LYS A 68 12.214 3.066 -7.654 1.00 0.14 H new ATOM 0 HB3 LYS A 68 12.027 2.182 -9.156 1.00 0.14 H new ATOM 0 HG2 LYS A 68 10.913 0.340 -7.880 1.00 34.04 H new ATOM 0 HG3 LYS A 68 11.020 1.320 -6.432 1.00 34.04 H new ATOM 0 HD2 LYS A 68 9.534 2.121 -8.957 1.00 33.34 H new ATOM 0 HD3 LYS A 68 8.787 1.386 -7.552 1.00 33.34 H new ATOM 0 HE2 LYS A 68 8.352 3.745 -7.433 1.00 11.45 H new ATOM 0 HE3 LYS A 68 9.510 3.369 -6.173 1.00 11.45 H new ATOM 0 HZ1 LYS A 68 9.758 5.392 -7.855 1.00 51.13 H new ATOM 0 HZ2 LYS A 68 11.078 4.631 -7.106 1.00 51.13 H new ATOM 0 HZ3 LYS A 68 10.653 4.221 -8.698 1.00 51.13 H new ATOM 1207 N ILE B 106 1.749 3.993 14.956 1.00 61.22 N ATOM 1208 CA ILE B 106 0.797 3.687 13.909 1.00 25.24 C ATOM 1209 C ILE B 106 -0.007 4.931 13.514 1.00 62.11 C ATOM 1210 O ILE B 106 0.233 6.029 14.023 1.00 14.41 O ATOM 1211 CB ILE B 106 -0.174 2.565 14.348 1.00 61.23 C ATOM 1212 CG1 ILE B 106 -0.969 2.986 15.599 1.00 61.43 C ATOM 1213 CG2 ILE B 106 0.592 1.267 14.595 1.00 4.10 C ATOM 1214 CD1 ILE B 106 -2.019 1.986 16.028 1.00 74.30 C ATOM 0 HA ILE B 106 1.367 3.344 13.046 1.00 25.24 H new ATOM 0 HB ILE B 106 -0.889 2.392 13.544 1.00 61.23 H new ATOM 0 HG12 ILE B 106 -0.273 3.142 16.423 1.00 61.43 H new ATOM 0 HG13 ILE B 106 -1.452 3.943 15.404 1.00 61.43 H new ATOM 0 HG21 ILE B 106 -0.104 0.487 14.903 1.00 4.10 H new ATOM 0 HG22 ILE B 106 1.096 0.962 13.678 1.00 4.10 H new ATOM 0 HG23 ILE B 106 1.331 1.425 15.380 1.00 4.10 H new ATOM 0 HD11 ILE B 106 -2.533 2.356 16.915 1.00 74.30 H new ATOM 0 HD12 ILE B 106 -2.740 1.847 15.222 1.00 74.30 H new ATOM 0 HD13 ILE B 106 -1.542 1.033 16.257 1.00 74.30 H new ATOM 1226 N TYR B 107 -0.961 4.763 12.623 1.00 51.24 N ATOM 1227 CA TYR B 107 -1.765 5.884 12.175 1.00 63.34 C ATOM 1228 C TYR B 107 -2.716 6.281 13.302 1.00 14.13 C ATOM 1229 O TYR B 107 -3.084 7.437 13.450 1.00 74.20 O ATOM 1230 CB TYR B 107 -2.680 5.478 11.030 1.00 45.43 C ATOM 1231 CG TYR B 107 -2.214 4.452 10.069 1.00 62.04 C ATOM 1232 CD1 TYR B 107 -1.243 4.721 9.141 1.00 71.25 C ATOM 1233 CD2 TYR B 107 -2.839 3.226 10.038 1.00 14.30 C ATOM 1234 CE1 TYR B 107 -0.904 3.796 8.204 1.00 11.31 C ATOM 1235 CE2 TYR B 107 -2.497 2.287 9.123 1.00 50.44 C ATOM 1236 CZ TYR B 107 -1.536 2.572 8.203 1.00 3.12 C ATOM 1237 OH TYR B 107 -1.234 1.657 7.258 1.00 22.21 O ATOM 0 H TYR B 107 -1.199 3.868 12.196 1.00 51.24 H new ATOM 0 HA TYR B 107 -1.082 6.679 11.875 1.00 63.34 H new ATOM 0 HB2 TYR B 107 -3.614 5.122 11.465 1.00 45.43 H new ATOM 0 HB3 TYR B 107 -2.916 6.378 10.462 1.00 45.43 H new ATOM 0 HD1 TYR B 107 -0.742 5.678 9.154 1.00 71.25 H new ATOM 0 HD2 TYR B 107 -3.616 3.009 10.756 1.00 14.30 H new ATOM 0 HE1 TYR B 107 -0.146 4.019 7.467 1.00 11.31 H new ATOM 0 HE2 TYR B 107 -2.982 1.322 9.124 1.00 50.44 H new ATOM 0 HH TYR B 107 -0.287 1.414 7.329 1.00 22.21 H new ATOM 1247 N THR B 108 -3.065 5.272 14.102 1.00 34.41 N ATOM 1248 CA THR B 108 -4.123 5.334 15.081 1.00 45.14 C ATOM 1249 C THR B 108 -5.459 5.280 14.340 1.00 55.25 C ATOM 1250 O THR B 108 -6.037 6.298 13.935 1.00 35.05 O ATOM 1251 CB THR B 108 -4.019 6.539 16.063 1.00 21.41 C ATOM 1252 OG1 THR B 108 -2.785 6.438 16.805 1.00 0.54 O ATOM 1253 CG2 THR B 108 -5.186 6.547 17.044 1.00 1.32 C ATOM 0 H THR B 108 -2.597 4.366 14.076 1.00 34.41 H new ATOM 0 HA THR B 108 -4.031 4.472 15.742 1.00 45.14 H new ATOM 0 HB THR B 108 -4.044 7.461 15.483 1.00 21.41 H new ATOM 0 HG1 THR B 108 -2.713 7.194 17.424 1.00 0.54 H new ATOM 0 HG21 THR B 108 -5.089 7.398 17.718 1.00 1.32 H new ATOM 0 HG22 THR B 108 -6.124 6.625 16.494 1.00 1.32 H new ATOM 0 HG23 THR B 108 -5.181 5.623 17.623 1.00 1.32 H new ATOM 1261 N SER B 109 -5.890 4.068 14.099 1.00 25.13 N ATOM 1262 CA SER B 109 -7.054 3.801 13.324 1.00 73.30 C ATOM 1263 C SER B 109 -8.330 3.978 14.132 1.00 52.51 C ATOM 1264 O SER B 109 -8.485 3.396 15.214 1.00 12.13 O ATOM 1265 CB SER B 109 -6.944 2.391 12.737 1.00 71.14 C ATOM 1266 OG SER B 109 -6.626 1.439 13.749 1.00 74.12 O ATOM 0 H SER B 109 -5.426 3.229 14.447 1.00 25.13 H new ATOM 0 HA SER B 109 -7.113 4.525 12.511 1.00 73.30 H new ATOM 0 HB2 SER B 109 -7.885 2.118 12.259 1.00 71.14 H new ATOM 0 HB3 SER B 109 -6.177 2.374 11.963 1.00 71.14 H new ATOM 0 HG SER B 109 -7.039 1.711 14.595 1.00 74.12 H new ATOM 1272 N ASP B 110 -9.221 4.806 13.618 1.00 45.13 N ATOM 1273 CA ASP B 110 -10.519 5.046 14.244 1.00 4.50 C ATOM 1274 C ASP B 110 -11.355 3.797 14.111 1.00 52.52 C ATOM 1275 O ASP B 110 -12.033 3.375 15.047 1.00 61.34 O ATOM 1276 CB ASP B 110 -11.243 6.194 13.540 1.00 5.31 C ATOM 1277 CG ASP B 110 -10.425 7.451 13.463 1.00 24.45 C ATOM 1278 OD1 ASP B 110 -9.666 7.606 12.474 1.00 32.12 O ATOM 1279 OD2 ASP B 110 -10.514 8.293 14.360 1.00 33.44 O ATOM 0 H ASP B 110 -9.071 5.332 12.757 1.00 45.13 H new ATOM 0 HA ASP B 110 -10.370 5.305 15.292 1.00 4.50 H new ATOM 0 HB2 ASP B 110 -11.512 5.881 12.531 1.00 5.31 H new ATOM 0 HB3 ASP B 110 -12.173 6.405 14.067 1.00 5.31 H new ATOM 1284 N ASN B 111 -11.297 3.213 12.926 1.00 71.14 N ATOM 1285 CA ASN B 111 -11.988 1.984 12.615 1.00 53.13 C ATOM 1286 C ASN B 111 -11.446 1.483 11.293 1.00 62.02 C ATOM 1287 O ASN B 111 -11.171 2.285 10.386 1.00 33.24 O ATOM 1288 CB ASN B 111 -13.507 2.234 12.486 1.00 11.24 C ATOM 1289 CG ASN B 111 -14.350 0.954 12.420 1.00 63.43 C ATOM 1290 OD1 ASN B 111 -13.917 -0.083 11.953 1.00 4.31 O ATOM 1291 ND2 ASN B 111 -15.555 1.031 12.896 1.00 11.21 N ATOM 0 H ASN B 111 -10.759 3.589 12.145 1.00 71.14 H new ATOM 0 HA ASN B 111 -11.831 1.254 13.409 1.00 53.13 H new ATOM 0 HB2 ASN B 111 -13.839 2.831 13.335 1.00 11.24 H new ATOM 0 HB3 ASN B 111 -13.692 2.825 11.589 1.00 11.24 H new ATOM 0 HD21 ASN B 111 -16.162 0.211 12.884 1.00 11.21 H new ATOM 0 HD22 ASN B 111 -15.895 1.911 13.282 1.00 11.21 H new ATOM 1417 N TYR B 121 -6.538 -19.757 1.646 1.00 4.32 N ATOM 1418 CA TYR B 121 -6.158 -19.703 0.259 1.00 21.42 C ATOM 1419 C TYR B 121 -5.098 -20.774 0.089 1.00 35.22 C ATOM 1420 O TYR B 121 -5.113 -21.548 -0.869 1.00 51.43 O ATOM 1421 CB TYR B 121 -5.576 -18.323 -0.047 1.00 14.03 C ATOM 1422 CG TYR B 121 -5.363 -17.994 -1.482 1.00 25.34 C ATOM 1423 CD1 TYR B 121 -4.350 -18.567 -2.192 1.00 10.33 C ATOM 1424 CD2 TYR B 121 -6.162 -17.056 -2.098 1.00 54.44 C ATOM 1425 CE1 TYR B 121 -4.120 -18.215 -3.518 1.00 3.33 C ATOM 1426 CE2 TYR B 121 -5.966 -16.692 -3.409 1.00 3.04 C ATOM 1427 CZ TYR B 121 -4.939 -17.268 -4.122 1.00 61.04 C ATOM 1428 OH TYR B 121 -4.723 -16.888 -5.436 1.00 43.34 O ATOM 0 HA TYR B 121 -7.000 -19.867 -0.413 1.00 21.42 H new ATOM 0 HB2 TYR B 121 -6.239 -17.571 0.380 1.00 14.03 H new ATOM 0 HB3 TYR B 121 -4.620 -18.234 0.469 1.00 14.03 H new ATOM 0 HD1 TYR B 121 -3.718 -19.304 -1.719 1.00 10.33 H new ATOM 0 HD2 TYR B 121 -6.962 -16.595 -1.537 1.00 54.44 H new ATOM 0 HE1 TYR B 121 -3.314 -18.673 -4.072 1.00 3.33 H new ATOM 0 HE2 TYR B 121 -6.611 -15.962 -3.875 1.00 3.04 H new ATOM 0 HH TYR B 121 -5.389 -16.218 -5.696 1.00 43.34 H new ATOM 1438 N ASP B 122 -4.181 -20.790 1.055 1.00 72.31 N ATOM 1439 CA ASP B 122 -3.112 -21.771 1.180 1.00 42.53 C ATOM 1440 C ASP B 122 -2.406 -21.428 2.510 1.00 12.03 C ATOM 1441 O ASP B 122 -2.864 -20.501 3.212 1.00 23.34 O ATOM 1442 CB ASP B 122 -2.142 -21.668 -0.006 1.00 2.12 C ATOM 1443 CG ASP B 122 -1.199 -22.856 -0.141 1.00 1.34 C ATOM 1444 OD1 ASP B 122 -0.173 -22.896 0.539 1.00 32.14 O ATOM 1445 OD2 ASP B 122 -1.481 -23.765 -0.962 1.00 22.42 O ATOM 0 H ASP B 122 -4.164 -20.092 1.799 1.00 72.31 H new ATOM 0 HA ASP B 122 -3.489 -22.794 1.177 1.00 42.53 H new ATOM 0 HB2 ASP B 122 -2.718 -21.569 -0.926 1.00 2.12 H new ATOM 0 HB3 ASP B 122 -1.551 -20.758 0.100 1.00 2.12 H new ATOM 1450 N SER B 123 -1.327 -22.097 2.851 1.00 1.55 N ATOM 1451 CA SER B 123 -0.687 -21.895 4.143 1.00 3.50 C ATOM 1452 C SER B 123 0.842 -21.688 4.030 1.00 50.45 C ATOM 1453 O SER B 123 1.519 -22.412 3.297 1.00 54.14 O ATOM 1454 CB SER B 123 -1.023 -23.078 5.059 1.00 34.13 C ATOM 1455 OG SER B 123 -0.707 -24.320 4.429 1.00 41.11 O ATOM 0 H SER B 123 -0.870 -22.787 2.255 1.00 1.55 H new ATOM 0 HA SER B 123 -1.078 -20.973 4.574 1.00 3.50 H new ATOM 0 HB2 SER B 123 -0.468 -22.988 5.993 1.00 34.13 H new ATOM 0 HB3 SER B 123 -2.082 -23.055 5.314 1.00 34.13 H new ATOM 0 HG SER B 123 -0.928 -25.059 5.033 1.00 41.11 H new ATOM 1461 N MET B 124 1.356 -20.689 4.766 1.00 30.24 N ATOM 1462 CA MET B 124 2.794 -20.325 4.816 1.00 11.44 C ATOM 1463 C MET B 124 2.929 -19.032 5.590 1.00 54.43 C ATOM 1464 O MET B 124 2.082 -18.150 5.457 1.00 53.13 O ATOM 1465 CB MET B 124 3.362 -20.094 3.410 1.00 72.51 C ATOM 1466 CG MET B 124 4.836 -19.683 3.353 1.00 23.52 C ATOM 1467 SD MET B 124 5.954 -20.958 3.954 1.00 63.23 S ATOM 1468 CE MET B 124 7.540 -20.146 3.728 1.00 53.42 C ATOM 0 H MET B 124 0.776 -20.095 5.358 1.00 30.24 H new ATOM 0 HA MET B 124 3.341 -21.141 5.287 1.00 11.44 H new ATOM 0 HB2 MET B 124 3.236 -21.009 2.831 1.00 72.51 H new ATOM 0 HB3 MET B 124 2.769 -19.322 2.920 1.00 72.51 H new ATOM 0 HG2 MET B 124 5.098 -19.436 2.324 1.00 23.52 H new ATOM 0 HG3 MET B 124 4.977 -18.778 3.944 1.00 23.52 H new ATOM 0 HE1 MET B 124 8.282 -20.879 3.410 1.00 53.42 H new ATOM 0 HE2 MET B 124 7.447 -19.371 2.968 1.00 53.42 H new ATOM 0 HE3 MET B 124 7.855 -19.695 4.669 1.00 53.42 H new ATOM 1478 N LYS B 125 3.956 -18.913 6.388 1.00 11.24 N ATOM 1479 CA LYS B 125 4.192 -17.694 7.137 1.00 52.23 C ATOM 1480 C LYS B 125 5.673 -17.395 7.141 1.00 33.44 C ATOM 1481 O LYS B 125 6.479 -18.303 7.395 1.00 73.23 O ATOM 1482 CB LYS B 125 3.698 -17.832 8.592 1.00 1.50 C ATOM 1483 CG LYS B 125 2.219 -18.154 8.729 1.00 71.23 C ATOM 1484 CD LYS B 125 1.793 -18.245 10.182 1.00 12.22 C ATOM 1485 CE LYS B 125 0.319 -18.585 10.298 1.00 10.04 C ATOM 1486 NZ LYS B 125 -0.123 -18.694 11.705 1.00 62.42 N ATOM 0 H LYS B 125 4.649 -19.645 6.541 1.00 11.24 H new ATOM 0 HA LYS B 125 3.641 -16.883 6.661 1.00 52.23 H new ATOM 0 HB2 LYS B 125 4.274 -18.615 9.085 1.00 1.50 H new ATOM 0 HB3 LYS B 125 3.905 -16.902 9.122 1.00 1.50 H new ATOM 0 HG2 LYS B 125 1.632 -17.386 8.226 1.00 71.23 H new ATOM 0 HG3 LYS B 125 2.005 -19.098 8.228 1.00 71.23 H new ATOM 0 HD2 LYS B 125 2.386 -19.005 10.691 1.00 12.22 H new ATOM 0 HD3 LYS B 125 1.991 -17.297 10.683 1.00 12.22 H new ATOM 0 HE2 LYS B 125 -0.269 -17.819 9.793 1.00 10.04 H new ATOM 0 HE3 LYS B 125 0.124 -19.526 9.784 1.00 10.04 H new ATOM 0 HZ1 LYS B 125 -1.136 -18.927 11.734 1.00 62.42 H new ATOM 0 HZ2 LYS B 125 0.418 -19.443 12.182 1.00 62.42 H new ATOM 0 HZ3 LYS B 125 0.037 -17.788 12.190 1.00 62.42 H new ATOM 1500 N GLU B 126 6.032 -16.133 6.830 1.00 42.53 N ATOM 1501 CA GLU B 126 7.414 -15.641 6.872 1.00 70.23 C ATOM 1502 C GLU B 126 8.261 -16.083 5.651 1.00 51.13 C ATOM 1503 O GLU B 126 8.107 -17.196 5.131 1.00 13.13 O ATOM 1504 CB GLU B 126 8.083 -15.948 8.228 1.00 23.05 C ATOM 1505 CG GLU B 126 7.310 -15.358 9.400 1.00 44.13 C ATOM 1506 CD GLU B 126 7.974 -15.576 10.718 1.00 41.21 C ATOM 1507 OE1 GLU B 126 8.833 -14.758 11.077 1.00 11.12 O ATOM 1508 OE2 GLU B 126 7.637 -16.555 11.428 1.00 1.24 O ATOM 0 H GLU B 126 5.359 -15.423 6.540 1.00 42.53 H new ATOM 0 HA GLU B 126 7.363 -14.555 6.789 1.00 70.23 H new ATOM 0 HB2 GLU B 126 8.163 -17.028 8.355 1.00 23.05 H new ATOM 0 HB3 GLU B 126 9.098 -15.551 8.228 1.00 23.05 H new ATOM 0 HG2 GLU B 126 7.182 -14.288 9.239 1.00 44.13 H new ATOM 0 HG3 GLU B 126 6.313 -15.798 9.427 1.00 44.13 H new ATOM 1515 N PRO B 127 9.165 -15.202 5.184 1.00 24.33 N ATOM 1516 CA PRO B 127 9.944 -15.412 3.955 1.00 33.11 C ATOM 1517 C PRO B 127 11.187 -16.272 4.138 1.00 61.23 C ATOM 1518 O PRO B 127 11.350 -16.993 5.132 1.00 24.22 O ATOM 1519 CB PRO B 127 10.391 -13.989 3.632 1.00 61.25 C ATOM 1520 CG PRO B 127 10.647 -13.410 4.977 1.00 73.34 C ATOM 1521 CD PRO B 127 9.507 -13.895 5.812 1.00 44.31 C ATOM 0 HA PRO B 127 9.355 -15.931 3.198 1.00 33.11 H new ATOM 0 HB2 PRO B 127 11.286 -13.978 3.010 1.00 61.25 H new ATOM 0 HB3 PRO B 127 9.622 -13.436 3.093 1.00 61.25 H new ATOM 0 HG2 PRO B 127 11.604 -13.744 5.378 1.00 73.34 H new ATOM 0 HG3 PRO B 127 10.679 -12.321 4.942 1.00 73.34 H new ATOM 0 HD2 PRO B 127 9.793 -14.012 6.857 1.00 44.31 H new ATOM 0 HD3 PRO B 127 8.665 -13.203 5.787 1.00 44.31 H new ATOM 1846 N CYS C 209 -2.557 7.282 -15.250 1.00 44.54 N ATOM 1847 CA CYS C 209 -2.114 7.126 -13.910 1.00 12.52 C ATOM 1848 C CYS C 209 -3.146 7.630 -12.929 1.00 53.50 C ATOM 1849 O CYS C 209 -3.763 8.672 -13.144 1.00 3.01 O ATOM 1850 CB CYS C 209 -0.747 7.775 -13.691 1.00 30.44 C ATOM 1851 SG CYS C 209 0.579 7.002 -14.671 1.00 72.13 S ATOM 0 HA CYS C 209 -1.990 6.059 -13.724 1.00 12.52 H new ATOM 0 HB2 CYS C 209 -0.809 8.833 -13.946 1.00 30.44 H new ATOM 0 HB3 CYS C 209 -0.490 7.717 -12.633 1.00 30.44 H new ATOM 1856 N PRO C 210 -3.368 6.861 -11.851 1.00 30.12 N ATOM 1857 CA PRO C 210 -4.318 7.214 -10.785 1.00 4.24 C ATOM 1858 C PRO C 210 -3.940 8.536 -10.129 1.00 33.10 C ATOM 1859 O PRO C 210 -4.774 9.418 -9.936 1.00 21.41 O ATOM 1860 CB PRO C 210 -4.150 6.050 -9.805 1.00 55.32 C ATOM 1861 CG PRO C 210 -2.836 5.459 -10.121 1.00 12.20 C ATOM 1862 CD PRO C 210 -2.704 5.582 -11.584 1.00 4.02 C ATOM 0 HA PRO C 210 -5.341 7.349 -11.138 1.00 4.24 H new ATOM 0 HB2 PRO C 210 -4.187 6.397 -8.772 1.00 55.32 H new ATOM 0 HB3 PRO C 210 -4.949 5.318 -9.924 1.00 55.32 H new ATOM 0 HG2 PRO C 210 -2.032 5.986 -9.607 1.00 12.20 H new ATOM 0 HG3 PRO C 210 -2.786 4.417 -9.807 1.00 12.20 H new ATOM 0 HD2 PRO C 210 -1.660 5.592 -11.899 1.00 4.02 H new ATOM 0 HD3 PRO C 210 -3.187 4.756 -12.107 1.00 4.02 H new ATOM 1870 N CYS C 211 -2.680 8.657 -9.787 1.00 33.14 N ATOM 1871 CA CYS C 211 -2.157 9.865 -9.242 1.00 64.44 C ATOM 1872 C CYS C 211 -1.459 10.645 -10.332 1.00 42.34 C ATOM 1873 O CYS C 211 -0.492 10.159 -10.936 1.00 61.44 O ATOM 1874 CB CYS C 211 -1.181 9.570 -8.119 1.00 33.13 C ATOM 1875 SG CYS C 211 -1.883 8.582 -6.770 1.00 61.34 S ATOM 0 H CYS C 211 -1.993 7.910 -9.884 1.00 33.14 H new ATOM 0 HA CYS C 211 -2.981 10.452 -8.836 1.00 64.44 H new ATOM 0 HB2 CYS C 211 -0.319 9.044 -8.530 1.00 33.13 H new ATOM 0 HB3 CYS C 211 -0.815 10.513 -7.712 1.00 33.13 H new ATOM 1880 N ARG C 212 -1.956 11.815 -10.611 1.00 23.35 N ATOM 1881 CA ARG C 212 -1.317 12.701 -11.559 1.00 43.45 C ATOM 1882 C ARG C 212 -0.482 13.732 -10.814 1.00 71.03 C ATOM 1883 O ARG C 212 0.435 14.346 -11.374 1.00 4.23 O ATOM 1884 CB ARG C 212 -2.331 13.350 -12.498 1.00 22.41 C ATOM 1885 CG ARG C 212 -3.491 14.041 -11.814 1.00 50.32 C ATOM 1886 CD ARG C 212 -4.382 14.702 -12.837 1.00 31.43 C ATOM 1887 NE ARG C 212 -4.898 13.744 -13.828 1.00 11.23 N ATOM 1888 CZ ARG C 212 -5.175 14.045 -15.101 1.00 11.12 C ATOM 1889 NH1 ARG C 212 -4.994 15.282 -15.552 1.00 70.34 N ATOM 1890 NH2 ARG C 212 -5.629 13.107 -15.922 1.00 43.14 N ATOM 0 H ARG C 212 -2.810 12.186 -10.195 1.00 23.35 H new ATOM 0 HA ARG C 212 -0.651 12.115 -12.193 1.00 43.45 H new ATOM 0 HB2 ARG C 212 -1.811 14.078 -13.121 1.00 22.41 H new ATOM 0 HB3 ARG C 212 -2.727 12.584 -13.165 1.00 22.41 H new ATOM 0 HG2 ARG C 212 -4.065 13.317 -11.235 1.00 50.32 H new ATOM 0 HG3 ARG C 212 -3.117 14.786 -11.112 1.00 50.32 H new ATOM 0 HD2 ARG C 212 -5.218 15.184 -12.330 1.00 31.43 H new ATOM 0 HD3 ARG C 212 -3.825 15.487 -13.349 1.00 31.43 H new ATOM 0 HE ARG C 212 -5.055 12.784 -13.522 1.00 11.23 H new ATOM 0 HH11 ARG C 212 -4.642 16.007 -14.926 1.00 70.34 H new ATOM 0 HH12 ARG C 212 -5.207 15.507 -16.524 1.00 70.34 H new ATOM 0 HH21 ARG C 212 -5.767 12.155 -15.582 1.00 43.14 H new ATOM 0 HH22 ARG C 212 -5.840 13.338 -16.893 1.00 43.14 H new ATOM 1904 N PHE C 213 -0.813 13.905 -9.554 1.00 23.15 N ATOM 1905 CA PHE C 213 -0.091 14.747 -8.626 1.00 43.52 C ATOM 1906 C PHE C 213 0.017 13.968 -7.350 1.00 12.04 C ATOM 1907 O PHE C 213 -0.753 13.021 -7.158 1.00 64.32 O ATOM 1908 CB PHE C 213 -0.795 16.096 -8.373 1.00 43.41 C ATOM 1909 CG PHE C 213 -0.949 16.949 -9.600 1.00 44.11 C ATOM 1910 CD1 PHE C 213 0.128 17.658 -10.101 1.00 70.02 C ATOM 1911 CD2 PHE C 213 -2.163 17.034 -10.254 1.00 33.11 C ATOM 1912 CE1 PHE C 213 -0.004 18.438 -11.232 1.00 20.03 C ATOM 1913 CE2 PHE C 213 -2.302 17.809 -11.385 1.00 1.02 C ATOM 1914 CZ PHE C 213 -1.222 18.512 -11.874 1.00 21.13 C ATOM 0 H PHE C 213 -1.621 13.447 -9.132 1.00 23.15 H new ATOM 0 HA PHE C 213 0.886 14.998 -9.039 1.00 43.52 H new ATOM 0 HB2 PHE C 213 -1.782 15.905 -7.951 1.00 43.41 H new ATOM 0 HB3 PHE C 213 -0.231 16.653 -7.625 1.00 43.41 H new ATOM 0 HD1 PHE C 213 1.084 17.600 -9.601 1.00 70.02 H new ATOM 0 HD2 PHE C 213 -3.013 16.487 -9.874 1.00 33.11 H new ATOM 0 HE1 PHE C 213 0.844 18.988 -11.613 1.00 20.03 H new ATOM 0 HE2 PHE C 213 -3.256 17.865 -11.888 1.00 1.02 H new ATOM 0 HZ PHE C 213 -1.330 19.121 -12.760 1.00 21.13 H new ATOM 1924 N PHE C 214 0.927 14.323 -6.497 1.00 23.40 N ATOM 1925 CA PHE C 214 1.120 13.556 -5.298 1.00 53.13 C ATOM 1926 C PHE C 214 1.241 14.450 -4.085 1.00 60.00 C ATOM 1927 O PHE C 214 1.715 15.594 -4.172 1.00 41.31 O ATOM 1928 CB PHE C 214 2.351 12.636 -5.415 1.00 10.42 C ATOM 1929 CG PHE C 214 3.671 13.357 -5.516 1.00 2.22 C ATOM 1930 CD1 PHE C 214 4.149 13.813 -6.734 1.00 43.25 C ATOM 1931 CD2 PHE C 214 4.425 13.582 -4.383 1.00 74.21 C ATOM 1932 CE1 PHE C 214 5.356 14.478 -6.811 1.00 61.11 C ATOM 1933 CE2 PHE C 214 5.627 14.246 -4.450 1.00 3.33 C ATOM 1934 CZ PHE C 214 6.094 14.695 -5.662 1.00 22.33 C ATOM 0 H PHE C 214 1.543 15.129 -6.603 1.00 23.40 H new ATOM 0 HA PHE C 214 0.237 12.929 -5.170 1.00 53.13 H new ATOM 0 HB2 PHE C 214 2.378 11.977 -4.547 1.00 10.42 H new ATOM 0 HB3 PHE C 214 2.231 12.002 -6.293 1.00 10.42 H new ATOM 0 HD1 PHE C 214 3.572 13.647 -7.631 1.00 43.25 H new ATOM 0 HD2 PHE C 214 4.065 13.231 -3.427 1.00 74.21 H new ATOM 0 HE1 PHE C 214 5.723 14.827 -7.765 1.00 61.11 H new ATOM 0 HE2 PHE C 214 6.203 14.414 -3.552 1.00 3.33 H new ATOM 0 HZ PHE C 214 7.038 15.217 -5.717 1.00 22.33 H new ATOM 1944 N GLU C 215 0.820 13.935 -2.981 1.00 64.14 N ATOM 1945 CA GLU C 215 0.886 14.598 -1.730 1.00 62.25 C ATOM 1946 C GLU C 215 2.094 14.120 -0.954 1.00 23.24 C ATOM 1947 O GLU C 215 2.230 12.932 -0.642 1.00 14.44 O ATOM 1948 CB GLU C 215 -0.383 14.343 -0.906 1.00 23.31 C ATOM 1949 CG GLU C 215 -1.650 15.074 -1.361 1.00 52.23 C ATOM 1950 CD GLU C 215 -2.188 14.656 -2.722 1.00 21.32 C ATOM 1951 OE1 GLU C 215 -1.785 15.238 -3.731 1.00 35.34 O ATOM 1952 OE2 GLU C 215 -3.066 13.770 -2.768 1.00 44.14 O ATOM 0 H GLU C 215 0.405 13.005 -2.926 1.00 64.14 H new ATOM 0 HA GLU C 215 0.971 15.668 -1.918 1.00 62.25 H new ATOM 0 HB2 GLU C 215 -0.585 13.272 -0.913 1.00 23.31 H new ATOM 0 HB3 GLU C 215 -0.181 14.622 0.128 1.00 23.31 H new ATOM 0 HG2 GLU C 215 -2.429 14.914 -0.616 1.00 52.23 H new ATOM 0 HG3 GLU C 215 -1.444 16.144 -1.383 1.00 52.23 H new ATOM 1959 N SER C 216 2.970 15.017 -0.649 1.00 51.53 N ATOM 1960 CA SER C 216 4.110 14.680 0.115 1.00 55.13 C ATOM 1961 C SER C 216 4.016 15.397 1.467 1.00 10.25 C ATOM 1962 O SER C 216 3.256 16.357 1.597 1.00 43.15 O ATOM 1963 CB SER C 216 5.371 15.046 -0.646 1.00 44.42 C ATOM 1964 OG SER C 216 6.511 14.573 0.017 1.00 40.53 O ATOM 0 H SER C 216 2.912 15.998 -0.923 1.00 51.53 H new ATOM 0 HA SER C 216 4.152 13.606 0.297 1.00 55.13 H new ATOM 0 HB2 SER C 216 5.329 14.625 -1.651 1.00 44.42 H new ATOM 0 HB3 SER C 216 5.433 16.129 -0.756 1.00 44.42 H new ATOM 0 HG SER C 216 7.244 14.470 -0.625 1.00 40.53 H new ATOM 1970 N HIS C 217 4.778 14.921 2.463 1.00 13.32 N ATOM 1971 CA HIS C 217 4.715 15.434 3.867 1.00 24.21 C ATOM 1972 C HIS C 217 3.375 15.193 4.509 1.00 22.12 C ATOM 1973 O HIS C 217 3.040 15.832 5.501 1.00 23.44 O ATOM 1974 CB HIS C 217 5.084 16.916 4.021 1.00 53.42 C ATOM 1975 CG HIS C 217 6.533 17.221 3.946 1.00 0.21 C ATOM 1976 ND1 HIS C 217 7.382 17.061 5.015 1.00 73.41 N ATOM 1977 CD2 HIS C 217 7.282 17.701 2.948 1.00 73.41 C ATOM 1978 CE1 HIS C 217 8.589 17.429 4.673 1.00 40.42 C ATOM 1979 NE2 HIS C 217 8.565 17.827 3.422 1.00 3.20 N ATOM 0 H HIS C 217 5.458 14.172 2.333 1.00 13.32 H new ATOM 0 HA HIS C 217 5.479 14.853 4.384 1.00 24.21 H new ATOM 0 HB2 HIS C 217 4.570 17.484 3.245 1.00 53.42 H new ATOM 0 HB3 HIS C 217 4.704 17.270 4.980 1.00 53.42 H new ATOM 0 HD2 HIS C 217 6.941 17.945 1.953 1.00 73.41 H new ATOM 0 HE1 HIS C 217 9.459 17.409 5.312 1.00 40.42 H new ATOM 0 HE2 HIS C 217 9.365 18.172 2.891 1.00 3.20 H new ATOM 1988 N VAL C 218 2.625 14.258 3.966 1.00 34.42 N ATOM 1989 CA VAL C 218 1.350 13.912 4.527 1.00 41.21 C ATOM 1990 C VAL C 218 1.532 13.413 5.939 1.00 33.24 C ATOM 1991 O VAL C 218 2.430 12.604 6.210 1.00 12.05 O ATOM 1992 CB VAL C 218 0.608 12.866 3.683 1.00 2.12 C ATOM 1993 CG1 VAL C 218 -0.705 12.444 4.356 1.00 25.41 C ATOM 1994 CG2 VAL C 218 0.336 13.428 2.302 1.00 43.20 C ATOM 0 H VAL C 218 2.883 13.726 3.135 1.00 34.42 H new ATOM 0 HA VAL C 218 0.736 14.813 4.532 1.00 41.21 H new ATOM 0 HB VAL C 218 1.237 11.980 3.595 1.00 2.12 H new ATOM 0 HG11 VAL C 218 -1.210 11.703 3.736 1.00 25.41 H new ATOM 0 HG12 VAL C 218 -0.491 12.014 5.334 1.00 25.41 H new ATOM 0 HG13 VAL C 218 -1.349 13.315 4.476 1.00 25.41 H new ATOM 0 HG21 VAL C 218 -0.191 12.684 1.704 1.00 43.20 H new ATOM 0 HG22 VAL C 218 -0.277 14.325 2.388 1.00 43.20 H new ATOM 0 HG23 VAL C 218 1.280 13.679 1.819 1.00 43.20 H new ATOM 2004 N ALA C 219 0.717 13.923 6.825 1.00 74.25 N ATOM 2005 CA ALA C 219 0.802 13.576 8.200 1.00 63.04 C ATOM 2006 C ALA C 219 0.477 12.112 8.424 1.00 72.41 C ATOM 2007 O ALA C 219 -0.634 11.643 8.148 1.00 14.51 O ATOM 2008 CB ALA C 219 -0.076 14.478 9.051 1.00 72.52 C ATOM 0 H ALA C 219 -0.022 14.590 6.603 1.00 74.25 H new ATOM 0 HA ALA C 219 1.834 13.731 8.515 1.00 63.04 H new ATOM 0 HB1 ALA C 219 0.011 14.187 10.098 1.00 72.52 H new ATOM 0 HB2 ALA C 219 0.244 15.513 8.934 1.00 72.52 H new ATOM 0 HB3 ALA C 219 -1.114 14.381 8.732 1.00 72.52 H new ATOM 2014 N ARG C 220 1.455 11.426 8.932 1.00 70.20 N ATOM 2015 CA ARG C 220 1.413 10.022 9.269 1.00 24.32 C ATOM 2016 C ARG C 220 0.437 9.824 10.459 1.00 25.54 C ATOM 2017 O ARG C 220 -0.042 8.725 10.729 1.00 12.14 O ATOM 2018 CB ARG C 220 2.896 9.610 9.552 1.00 53.21 C ATOM 2019 CG ARG C 220 3.235 8.168 9.964 1.00 23.13 C ATOM 2020 CD ARG C 220 2.816 7.844 11.371 1.00 44.22 C ATOM 2021 NE ARG C 220 3.323 8.833 12.336 1.00 32.20 N ATOM 2022 CZ ARG C 220 2.688 9.213 13.449 1.00 3.14 C ATOM 2023 NH1 ARG C 220 1.536 8.642 13.793 1.00 52.23 N ATOM 2024 NH2 ARG C 220 3.214 10.152 14.221 1.00 73.44 N ATOM 0 H ARG C 220 2.360 11.849 9.137 1.00 70.20 H new ATOM 0 HA ARG C 220 1.028 9.379 8.478 1.00 24.32 H new ATOM 0 HB2 ARG C 220 3.470 9.832 8.652 1.00 53.21 H new ATOM 0 HB3 ARG C 220 3.269 10.266 10.338 1.00 53.21 H new ATOM 0 HG2 ARG C 220 2.748 7.476 9.277 1.00 23.13 H new ATOM 0 HG3 ARG C 220 4.309 8.011 9.866 1.00 23.13 H new ATOM 0 HD2 ARG C 220 1.728 7.807 11.426 1.00 44.22 H new ATOM 0 HD3 ARG C 220 3.183 6.853 11.640 1.00 44.22 H new ATOM 0 HE ARG C 220 4.228 9.261 12.140 1.00 32.20 H new ATOM 0 HH11 ARG C 220 1.134 7.911 13.206 1.00 52.23 H new ATOM 0 HH12 ARG C 220 1.055 8.935 14.643 1.00 52.23 H new ATOM 0 HH21 ARG C 220 4.102 10.584 13.966 1.00 73.44 H new ATOM 0 HH22 ARG C 220 2.731 10.443 15.071 1.00 73.44 H new ATOM 2038 N ALA C 221 0.172 10.910 11.155 1.00 64.44 N ATOM 2039 CA ALA C 221 -0.814 10.943 12.228 1.00 50.44 C ATOM 2040 C ALA C 221 -2.260 11.156 11.694 1.00 23.51 C ATOM 2041 O ALA C 221 -3.219 11.032 12.438 1.00 72.24 O ATOM 2042 CB ALA C 221 -0.456 12.029 13.236 1.00 70.20 C ATOM 0 H ALA C 221 0.636 11.804 10.995 1.00 64.44 H new ATOM 0 HA ALA C 221 -0.793 9.970 12.720 1.00 50.44 H new ATOM 0 HB1 ALA C 221 -1.199 12.045 14.033 1.00 70.20 H new ATOM 0 HB2 ALA C 221 0.527 11.822 13.660 1.00 70.20 H new ATOM 0 HB3 ALA C 221 -0.439 12.998 12.737 1.00 70.20 H new ATOM 2048 N ASN C 222 -2.398 11.492 10.406 1.00 63.41 N ATOM 2049 CA ASN C 222 -3.720 11.854 9.831 1.00 1.15 C ATOM 2050 C ASN C 222 -4.206 10.804 8.798 1.00 73.45 C ATOM 2051 O ASN C 222 -5.206 10.992 8.121 1.00 71.33 O ATOM 2052 CB ASN C 222 -3.614 13.266 9.180 1.00 13.45 C ATOM 2053 CG ASN C 222 -4.938 13.860 8.670 1.00 71.55 C ATOM 2054 OD1 ASN C 222 -6.026 13.547 9.167 1.00 24.11 O ATOM 2055 ND2 ASN C 222 -4.841 14.770 7.713 1.00 13.22 N ATOM 0 H ASN C 222 -1.626 11.524 9.740 1.00 63.41 H new ATOM 0 HA ASN C 222 -4.460 11.871 10.631 1.00 1.15 H new ATOM 0 HB2 ASN C 222 -3.185 13.952 9.910 1.00 13.45 H new ATOM 0 HB3 ASN C 222 -2.915 13.211 8.345 1.00 13.45 H new ATOM 0 HD21 ASN C 222 -5.679 15.235 7.365 1.00 13.22 H new ATOM 0 HD22 ASN C 222 -3.928 15.006 7.324 1.00 13.22 H new ATOM 2062 N VAL C 223 -3.521 9.701 8.728 1.00 23.55 N ATOM 2063 CA VAL C 223 -3.824 8.637 7.759 1.00 1.20 C ATOM 2064 C VAL C 223 -4.571 7.447 8.425 1.00 11.01 C ATOM 2065 O VAL C 223 -4.444 7.240 9.606 1.00 22.32 O ATOM 2066 CB VAL C 223 -2.496 8.157 7.059 1.00 45.14 C ATOM 2067 CG1 VAL C 223 -1.417 7.946 8.081 1.00 50.34 C ATOM 2068 CG2 VAL C 223 -2.699 6.862 6.336 1.00 54.12 C ATOM 0 H VAL C 223 -2.728 9.493 9.335 1.00 23.55 H new ATOM 0 HA VAL C 223 -4.493 9.045 7.002 1.00 1.20 H new ATOM 0 HB VAL C 223 -2.209 8.933 6.349 1.00 45.14 H new ATOM 0 HG11 VAL C 223 -0.505 7.615 7.584 1.00 50.34 H new ATOM 0 HG12 VAL C 223 -1.225 8.882 8.606 1.00 50.34 H new ATOM 0 HG13 VAL C 223 -1.737 7.188 8.796 1.00 50.34 H new ATOM 0 HG21 VAL C 223 -1.765 6.558 5.864 1.00 54.12 H new ATOM 0 HG22 VAL C 223 -3.014 6.095 7.044 1.00 54.12 H new ATOM 0 HG23 VAL C 223 -3.467 6.988 5.573 1.00 54.12 H new ATOM 2078 N LYS C 224 -5.409 6.715 7.655 1.00 43.22 N ATOM 2079 CA LYS C 224 -6.056 5.501 8.176 1.00 23.35 C ATOM 2080 C LYS C 224 -5.380 4.224 7.673 1.00 43.51 C ATOM 2081 O LYS C 224 -5.470 3.186 8.316 1.00 24.01 O ATOM 2082 CB LYS C 224 -7.544 5.439 7.821 1.00 1.32 C ATOM 2083 CG LYS C 224 -8.315 6.597 8.374 1.00 51.10 C ATOM 2084 CD LYS C 224 -9.822 6.454 8.219 1.00 1.41 C ATOM 2085 CE LYS C 224 -10.275 6.377 6.776 1.00 72.23 C ATOM 2086 NZ LYS C 224 -11.752 6.343 6.680 1.00 2.04 N ATOM 0 H LYS C 224 -5.646 6.942 6.689 1.00 43.22 H new ATOM 0 HA LYS C 224 -5.949 5.560 9.259 1.00 23.35 H new ATOM 0 HB2 LYS C 224 -7.655 5.418 6.737 1.00 1.32 H new ATOM 0 HB3 LYS C 224 -7.967 4.510 8.203 1.00 1.32 H new ATOM 0 HG2 LYS C 224 -8.076 6.710 9.431 1.00 51.10 H new ATOM 0 HG3 LYS C 224 -7.992 7.510 7.874 1.00 51.10 H new ATOM 0 HD2 LYS C 224 -10.150 5.556 8.743 1.00 1.41 H new ATOM 0 HD3 LYS C 224 -10.311 7.301 8.701 1.00 1.41 H new ATOM 0 HE2 LYS C 224 -9.892 7.236 6.225 1.00 72.23 H new ATOM 0 HE3 LYS C 224 -9.857 5.486 6.308 1.00 72.23 H new ATOM 0 HZ1 LYS C 224 -12.034 6.290 5.680 1.00 2.04 H new ATOM 0 HZ2 LYS C 224 -12.114 5.510 7.186 1.00 2.04 H new ATOM 0 HZ3 LYS C 224 -12.148 7.205 7.106 1.00 2.04 H new ATOM 2100 N HIS C 225 -4.744 4.308 6.492 1.00 24.35 N ATOM 2101 CA HIS C 225 -4.031 3.161 5.842 1.00 31.32 C ATOM 2102 C HIS C 225 -3.514 3.545 4.458 1.00 13.35 C ATOM 2103 O HIS C 225 -3.988 4.541 3.879 1.00 23.52 O ATOM 2104 CB HIS C 225 -4.905 1.882 5.726 1.00 24.41 C ATOM 2105 CG HIS C 225 -6.241 2.061 5.052 1.00 65.22 C ATOM 2106 ND1 HIS C 225 -6.526 3.065 4.149 1.00 22.31 N ATOM 2107 CD2 HIS C 225 -7.383 1.372 5.202 1.00 31.00 C ATOM 2108 CE1 HIS C 225 -7.789 2.976 3.789 1.00 52.53 C ATOM 2109 NE2 HIS C 225 -8.324 1.961 4.413 1.00 10.41 N ATOM 0 H HIS C 225 -4.702 5.170 5.948 1.00 24.35 H new ATOM 0 HA HIS C 225 -3.192 2.929 6.498 1.00 31.32 H new ATOM 0 HB2 HIS C 225 -4.341 1.127 5.178 1.00 24.41 H new ATOM 0 HB3 HIS C 225 -5.074 1.488 6.728 1.00 24.41 H new ATOM 0 HD1 HIS C 225 -5.864 3.765 3.814 1.00 22.31 H new ATOM 0 HD2 HIS C 225 -7.529 0.508 5.833 1.00 31.00 H new ATOM 0 HE1 HIS C 225 -8.296 3.631 3.096 1.00 52.53 H new ATOM 2118 N LEU C 226 -2.629 2.719 3.911 1.00 61.22 N ATOM 2119 CA LEU C 226 -1.989 2.965 2.603 1.00 40.31 C ATOM 2120 C LEU C 226 -2.384 1.881 1.599 1.00 40.32 C ATOM 2121 O LEU C 226 -2.473 0.721 1.946 1.00 4.34 O ATOM 2122 CB LEU C 226 -0.425 2.932 2.711 1.00 31.10 C ATOM 2123 CG LEU C 226 0.336 4.067 3.453 1.00 42.15 C ATOM 2124 CD1 LEU C 226 -0.045 4.154 4.910 1.00 61.23 C ATOM 2125 CD2 LEU C 226 1.846 3.853 3.322 1.00 14.33 C ATOM 0 H LEU C 226 -2.327 1.853 4.357 1.00 61.22 H new ATOM 0 HA LEU C 226 -2.325 3.949 2.276 1.00 40.31 H new ATOM 0 HB2 LEU C 226 -0.155 1.993 3.195 1.00 31.10 H new ATOM 0 HB3 LEU C 226 -0.033 2.891 1.695 1.00 31.10 H new ATOM 0 HG LEU C 226 0.052 5.010 2.985 1.00 42.15 H new ATOM 0 HD11 LEU C 226 0.513 4.961 5.384 1.00 61.23 H new ATOM 0 HD12 LEU C 226 -1.113 4.352 4.995 1.00 61.23 H new ATOM 0 HD13 LEU C 226 0.190 3.211 5.404 1.00 61.23 H new ATOM 0 HD21 LEU C 226 2.373 4.652 3.844 1.00 14.33 H new ATOM 0 HD22 LEU C 226 2.117 2.892 3.760 1.00 14.33 H new ATOM 0 HD23 LEU C 226 2.125 3.862 2.268 1.00 14.33 H new ATOM 2137 N LYS C 227 -2.639 2.279 0.380 1.00 52.34 N ATOM 2138 CA LYS C 227 -2.871 1.363 -0.712 1.00 24.32 C ATOM 2139 C LYS C 227 -1.783 1.512 -1.738 1.00 22.44 C ATOM 2140 O LYS C 227 -1.606 2.592 -2.299 1.00 43.11 O ATOM 2141 CB LYS C 227 -4.244 1.566 -1.342 1.00 3.50 C ATOM 2142 CG LYS C 227 -4.473 0.722 -2.594 1.00 55.42 C ATOM 2143 CD LYS C 227 -5.932 0.614 -2.907 1.00 1.31 C ATOM 2144 CE LYS C 227 -6.599 1.951 -3.006 1.00 61.52 C ATOM 2145 NZ LYS C 227 -6.062 2.793 -4.104 1.00 2.10 N ATOM 0 H LYS C 227 -2.693 3.262 0.112 1.00 52.34 H new ATOM 0 HA LYS C 227 -2.852 0.348 -0.314 1.00 24.32 H new ATOM 0 HB2 LYS C 227 -5.011 1.325 -0.606 1.00 3.50 H new ATOM 0 HB3 LYS C 227 -4.366 2.619 -1.596 1.00 3.50 H new ATOM 0 HG2 LYS C 227 -3.948 1.168 -3.439 1.00 55.42 H new ATOM 0 HG3 LYS C 227 -4.054 -0.274 -2.448 1.00 55.42 H new ATOM 0 HD2 LYS C 227 -6.060 0.078 -3.847 1.00 1.31 H new ATOM 0 HD3 LYS C 227 -6.423 0.023 -2.134 1.00 1.31 H new ATOM 0 HE2 LYS C 227 -7.669 1.806 -3.158 1.00 61.52 H new ATOM 0 HE3 LYS C 227 -6.480 2.480 -2.060 1.00 61.52 H new ATOM 0 HZ1 LYS C 227 -6.587 3.690 -4.142 1.00 2.10 H new ATOM 0 HZ2 LYS C 227 -5.055 2.988 -3.932 1.00 2.10 H new ATOM 0 HZ3 LYS C 227 -6.168 2.292 -5.009 1.00 2.10 H new ATOM 2159 N ILE C 228 -1.076 0.446 -1.992 1.00 43.02 N ATOM 2160 CA ILE C 228 0.030 0.468 -2.920 1.00 4.42 C ATOM 2161 C ILE C 228 -0.445 -0.156 -4.204 1.00 40.32 C ATOM 2162 O ILE C 228 -1.096 -1.217 -4.183 1.00 20.44 O ATOM 2163 CB ILE C 228 1.239 -0.365 -2.411 1.00 23.01 C ATOM 2164 CG1 ILE C 228 1.634 0.027 -0.987 1.00 42.23 C ATOM 2165 CG2 ILE C 228 2.434 -0.181 -3.348 1.00 40.40 C ATOM 2166 CD1 ILE C 228 2.822 -0.752 -0.465 1.00 70.11 C ATOM 0 H ILE C 228 -1.247 -0.464 -1.564 1.00 43.02 H new ATOM 0 HA ILE C 228 0.355 1.501 -3.045 1.00 4.42 H new ATOM 0 HB ILE C 228 0.939 -1.413 -2.401 1.00 23.01 H new ATOM 0 HG12 ILE C 228 1.865 1.092 -0.961 1.00 42.23 H new ATOM 0 HG13 ILE C 228 0.784 -0.131 -0.324 1.00 42.23 H new ATOM 0 HG21 ILE C 228 3.276 -0.769 -2.983 1.00 40.40 H new ATOM 0 HG22 ILE C 228 2.165 -0.515 -4.350 1.00 40.40 H new ATOM 0 HG23 ILE C 228 2.713 0.872 -3.379 1.00 40.40 H new ATOM 0 HD11 ILE C 228 3.052 -0.427 0.550 1.00 70.11 H new ATOM 0 HD12 ILE C 228 2.586 -1.816 -0.461 1.00 70.11 H new ATOM 0 HD13 ILE C 228 3.684 -0.574 -1.107 1.00 70.11 H new ATOM 2178 N LEU C 229 -0.158 0.498 -5.293 1.00 53.22 N ATOM 2179 CA LEU C 229 -0.562 0.057 -6.588 1.00 2.34 C ATOM 2180 C LEU C 229 0.562 0.325 -7.605 1.00 0.41 C ATOM 2181 O LEU C 229 1.091 1.435 -7.698 1.00 33.44 O ATOM 2182 CB LEU C 229 -1.917 0.746 -6.957 1.00 71.44 C ATOM 2183 CG LEU C 229 -1.921 2.281 -6.989 1.00 12.05 C ATOM 2184 CD1 LEU C 229 -1.538 2.812 -8.345 1.00 24.31 C ATOM 2185 CD2 LEU C 229 -3.239 2.833 -6.555 1.00 51.31 C ATOM 0 H LEU C 229 0.374 1.369 -5.301 1.00 53.22 H new ATOM 0 HA LEU C 229 -0.734 -1.019 -6.601 1.00 2.34 H new ATOM 0 HB2 LEU C 229 -2.228 0.384 -7.937 1.00 71.44 H new ATOM 0 HB3 LEU C 229 -2.672 0.418 -6.242 1.00 71.44 H new ATOM 0 HG LEU C 229 -1.166 2.616 -6.278 1.00 12.05 H new ATOM 0 HD11 LEU C 229 -1.553 3.902 -8.326 1.00 24.31 H new ATOM 0 HD12 LEU C 229 -0.536 2.467 -8.601 1.00 24.31 H new ATOM 0 HD13 LEU C 229 -2.247 2.452 -9.090 1.00 24.31 H new ATOM 0 HD21 LEU C 229 -3.207 3.922 -6.590 1.00 51.31 H new ATOM 0 HD22 LEU C 229 -4.022 2.472 -7.222 1.00 51.31 H new ATOM 0 HD23 LEU C 229 -3.452 2.509 -5.536 1.00 51.31 H new ATOM 2197 N ASN C 230 0.962 -0.697 -8.299 1.00 63.04 N ATOM 2198 CA ASN C 230 1.982 -0.572 -9.332 1.00 64.00 C ATOM 2199 C ASN C 230 1.374 -0.596 -10.706 1.00 14.04 C ATOM 2200 O ASN C 230 0.922 -1.647 -11.195 1.00 22.33 O ATOM 2201 CB ASN C 230 3.090 -1.639 -9.215 1.00 32.12 C ATOM 2202 CG ASN C 230 4.039 -1.425 -8.043 1.00 24.24 C ATOM 2203 OD1 ASN C 230 3.682 -0.870 -7.019 1.00 44.25 O ATOM 2204 ND2 ASN C 230 5.265 -1.872 -8.194 1.00 32.15 N ATOM 0 H ASN C 230 0.601 -1.643 -8.177 1.00 63.04 H new ATOM 0 HA ASN C 230 2.454 0.398 -9.174 1.00 64.00 H new ATOM 0 HB2 ASN C 230 2.626 -2.620 -9.118 1.00 32.12 H new ATOM 0 HB3 ASN C 230 3.668 -1.650 -10.139 1.00 32.12 H new ATOM 0 HD21 ASN C 230 5.945 -1.758 -7.443 1.00 32.15 H new ATOM 0 HD22 ASN C 230 5.536 -2.333 -9.062 1.00 32.15 H new ATOM 2211 N THR C 231 1.340 0.554 -11.318 1.00 25.12 N ATOM 2212 CA THR C 231 0.809 0.696 -12.644 1.00 72.41 C ATOM 2213 C THR C 231 1.914 0.453 -13.671 1.00 4.55 C ATOM 2214 O THR C 231 3.088 0.568 -13.346 1.00 15.43 O ATOM 2215 CB THR C 231 0.244 2.119 -12.849 1.00 61.54 C ATOM 2216 OG1 THR C 231 1.278 3.092 -12.620 1.00 44.43 O ATOM 2217 CG2 THR C 231 -0.917 2.391 -11.909 1.00 42.34 C ATOM 0 H THR C 231 1.682 1.424 -10.909 1.00 25.12 H new ATOM 0 HA THR C 231 0.009 -0.033 -12.775 1.00 72.41 H new ATOM 0 HB THR C 231 -0.117 2.193 -13.875 1.00 61.54 H new ATOM 0 HG1 THR C 231 2.132 2.634 -12.474 1.00 44.43 H new ATOM 0 HG21 THR C 231 -1.293 3.400 -12.077 1.00 42.34 H new ATOM 0 HG22 THR C 231 -1.714 1.671 -12.097 1.00 42.34 H new ATOM 0 HG23 THR C 231 -0.579 2.297 -10.877 1.00 42.34 H new ATOM 2225 N PRO C 232 1.565 0.111 -14.918 1.00 34.42 N ATOM 2226 CA PRO C 232 2.551 -0.065 -15.974 1.00 24.14 C ATOM 2227 C PRO C 232 2.891 1.271 -16.667 1.00 73.44 C ATOM 2228 O PRO C 232 3.609 1.300 -17.663 1.00 50.05 O ATOM 2229 CB PRO C 232 1.841 -1.012 -16.944 1.00 40.43 C ATOM 2230 CG PRO C 232 0.392 -0.677 -16.808 1.00 5.22 C ATOM 2231 CD PRO C 232 0.190 -0.180 -15.394 1.00 0.53 C ATOM 0 HA PRO C 232 3.503 -0.445 -15.604 1.00 24.14 H new ATOM 0 HB2 PRO C 232 2.187 -0.864 -17.967 1.00 40.43 H new ATOM 0 HB3 PRO C 232 2.032 -2.055 -16.691 1.00 40.43 H new ATOM 0 HG2 PRO C 232 0.102 0.085 -17.531 1.00 5.22 H new ATOM 0 HG3 PRO C 232 -0.227 -1.553 -17.002 1.00 5.22 H new ATOM 0 HD2 PRO C 232 -0.438 0.711 -15.369 1.00 0.53 H new ATOM 0 HD3 PRO C 232 -0.297 -0.931 -14.772 1.00 0.53 H new ATOM 2239 N ASN C 233 2.373 2.368 -16.124 1.00 2.34 N ATOM 2240 CA ASN C 233 2.597 3.686 -16.717 1.00 33.50 C ATOM 2241 C ASN C 233 3.354 4.605 -15.749 1.00 62.23 C ATOM 2242 O ASN C 233 4.154 5.438 -16.166 1.00 51.10 O ATOM 2243 CB ASN C 233 1.268 4.330 -17.131 1.00 15.21 C ATOM 2244 CG ASN C 233 1.446 5.634 -17.913 1.00 71.32 C ATOM 2245 OD1 ASN C 233 2.487 5.724 -18.714 1.00 55.14 O flip ATOM 2246 ND2 ASN C 233 0.624 6.532 -17.823 1.00 44.04 N flip ATOM 0 H ASN C 233 1.799 2.374 -15.281 1.00 2.34 H new ATOM 0 HA ASN C 233 3.209 3.549 -17.608 1.00 33.50 H new ATOM 0 HB2 ASN C 233 0.704 3.623 -17.740 1.00 15.21 H new ATOM 0 HB3 ASN C 233 0.674 4.528 -16.239 1.00 15.21 H new ATOM 0 HD21 ASN C 233 -0.172 6.433 -17.193 1.00 44.04 H new ATOM 0 HD22 ASN C 233 0.734 7.381 -18.377 1.00 44.04 H new ATOM 2253 N CYS C 234 3.112 4.442 -14.481 1.00 75.34 N ATOM 2254 CA CYS C 234 3.785 5.213 -13.451 1.00 32.54 C ATOM 2255 C CYS C 234 4.429 4.274 -12.459 1.00 41.50 C ATOM 2256 O CYS C 234 4.064 3.096 -12.401 1.00 42.10 O ATOM 2257 CB CYS C 234 2.816 6.190 -12.745 1.00 22.34 C ATOM 2258 SG CYS C 234 2.283 7.611 -13.775 1.00 61.22 S ATOM 0 H CYS C 234 2.438 3.767 -14.119 1.00 75.34 H new ATOM 0 HA CYS C 234 4.558 5.820 -13.922 1.00 32.54 H new ATOM 0 HB2 CYS C 234 1.932 5.638 -12.425 1.00 22.34 H new ATOM 0 HB3 CYS C 234 3.297 6.571 -11.844 1.00 22.34 H new ATOM 2263 N ALA C 235 5.396 4.783 -11.703 1.00 31.33 N ATOM 2264 CA ALA C 235 6.132 3.990 -10.724 1.00 24.45 C ATOM 2265 C ALA C 235 5.218 3.499 -9.589 1.00 34.12 C ATOM 2266 O ALA C 235 4.006 3.756 -9.603 1.00 74.35 O ATOM 2267 CB ALA C 235 7.292 4.815 -10.159 1.00 24.04 C ATOM 0 H ALA C 235 5.692 5.758 -11.752 1.00 31.33 H new ATOM 0 HA ALA C 235 6.527 3.108 -11.228 1.00 24.45 H new ATOM 0 HB1 ALA C 235 7.840 4.220 -9.428 1.00 24.04 H new ATOM 0 HB2 ALA C 235 7.963 5.102 -10.969 1.00 24.04 H new ATOM 0 HB3 ALA C 235 6.901 5.711 -9.677 1.00 24.04 H new ATOM 2273 N CYS C 236 5.814 2.780 -8.628 1.00 21.23 N ATOM 2274 CA CYS C 236 5.101 2.288 -7.444 1.00 11.35 C ATOM 2275 C CYS C 236 4.374 3.463 -6.818 1.00 73.32 C ATOM 2276 O CYS C 236 4.996 4.477 -6.490 1.00 54.03 O ATOM 2277 CB CYS C 236 6.105 1.682 -6.448 1.00 11.14 C ATOM 2278 SG CYS C 236 5.370 0.917 -4.967 1.00 70.42 S ATOM 0 H CYS C 236 6.801 2.524 -8.650 1.00 21.23 H new ATOM 0 HA CYS C 236 4.386 1.512 -7.718 1.00 11.35 H new ATOM 0 HB2 CYS C 236 6.698 0.930 -6.968 1.00 11.14 H new ATOM 0 HB3 CYS C 236 6.792 2.465 -6.129 1.00 11.14 H new ATOM 2283 N GLN C 237 3.086 3.348 -6.703 1.00 24.32 N ATOM 2284 CA GLN C 237 2.276 4.443 -6.288 1.00 55.01 C ATOM 2285 C GLN C 237 1.523 4.073 -5.023 1.00 14.42 C ATOM 2286 O GLN C 237 1.022 2.954 -4.899 1.00 3.43 O ATOM 2287 CB GLN C 237 1.293 4.764 -7.414 1.00 55.22 C ATOM 2288 CG GLN C 237 0.571 6.067 -7.250 1.00 55.10 C ATOM 2289 CD GLN C 237 1.535 7.218 -7.288 1.00 54.12 C ATOM 2290 OE1 GLN C 237 2.059 7.628 -6.270 1.00 62.31 O ATOM 2291 NE2 GLN C 237 1.788 7.735 -8.471 1.00 74.23 N ATOM 0 H GLN C 237 2.570 2.489 -6.895 1.00 24.32 H new ATOM 0 HA GLN C 237 2.895 5.315 -6.077 1.00 55.01 H new ATOM 0 HB2 GLN C 237 1.834 4.779 -8.360 1.00 55.22 H new ATOM 0 HB3 GLN C 237 0.559 3.961 -7.479 1.00 55.22 H new ATOM 0 HG2 GLN C 237 -0.169 6.180 -8.042 1.00 55.10 H new ATOM 0 HG3 GLN C 237 0.029 6.071 -6.304 1.00 55.10 H new ATOM 0 HE21 GLN C 237 1.327 7.361 -9.300 1.00 74.23 H new ATOM 0 HE22 GLN C 237 2.446 8.510 -8.559 1.00 74.23 H new ATOM 2300 N ILE C 238 1.449 4.994 -4.091 1.00 24.52 N ATOM 2301 CA ILE C 238 0.781 4.743 -2.835 1.00 23.14 C ATOM 2302 C ILE C 238 -0.292 5.787 -2.572 1.00 73.12 C ATOM 2303 O ILE C 238 -0.026 6.969 -2.618 1.00 4.34 O ATOM 2304 CB ILE C 238 1.788 4.709 -1.647 1.00 63.42 C ATOM 2305 CG1 ILE C 238 2.808 3.574 -1.848 1.00 32.24 C ATOM 2306 CG2 ILE C 238 1.056 4.553 -0.316 1.00 23.32 C ATOM 2307 CD1 ILE C 238 3.816 3.426 -0.724 1.00 30.31 C ATOM 0 H ILE C 238 1.846 5.930 -4.180 1.00 24.52 H new ATOM 0 HA ILE C 238 0.310 3.763 -2.912 1.00 23.14 H new ATOM 0 HB ILE C 238 2.325 5.657 -1.622 1.00 63.42 H new ATOM 0 HG12 ILE C 238 2.268 2.634 -1.961 1.00 32.24 H new ATOM 0 HG13 ILE C 238 3.346 3.747 -2.780 1.00 32.24 H new ATOM 0 HG21 ILE C 238 1.781 4.532 0.498 1.00 23.32 H new ATOM 0 HG22 ILE C 238 0.376 5.393 -0.174 1.00 23.32 H new ATOM 0 HG23 ILE C 238 0.488 3.623 -0.320 1.00 23.32 H new ATOM 0 HD11 ILE C 238 4.494 2.603 -0.950 1.00 30.31 H new ATOM 0 HD12 ILE C 238 4.386 4.349 -0.623 1.00 30.31 H new ATOM 0 HD13 ILE C 238 3.292 3.219 0.209 1.00 30.31 H new ATOM 2319 N VAL C 239 -1.489 5.338 -2.307 1.00 10.42 N ATOM 2320 CA VAL C 239 -2.598 6.219 -1.993 1.00 51.44 C ATOM 2321 C VAL C 239 -3.019 5.978 -0.545 1.00 22.50 C ATOM 2322 O VAL C 239 -3.266 4.839 -0.155 1.00 13.34 O ATOM 2323 CB VAL C 239 -3.814 5.962 -2.939 1.00 33.20 C ATOM 2324 CG1 VAL C 239 -4.969 6.910 -2.626 1.00 42.12 C ATOM 2325 CG2 VAL C 239 -3.402 6.092 -4.398 1.00 64.24 C ATOM 0 H VAL C 239 -1.731 4.347 -2.301 1.00 10.42 H new ATOM 0 HA VAL C 239 -2.276 7.251 -2.133 1.00 51.44 H new ATOM 0 HB VAL C 239 -4.157 4.942 -2.765 1.00 33.20 H new ATOM 0 HG11 VAL C 239 -5.800 6.706 -3.301 1.00 42.12 H new ATOM 0 HG12 VAL C 239 -5.293 6.761 -1.596 1.00 42.12 H new ATOM 0 HG13 VAL C 239 -4.639 7.941 -2.757 1.00 42.12 H new ATOM 0 HG21 VAL C 239 -4.265 5.909 -5.038 1.00 64.24 H new ATOM 0 HG22 VAL C 239 -3.022 7.097 -4.581 1.00 64.24 H new ATOM 0 HG23 VAL C 239 -2.623 5.363 -4.622 1.00 64.24 H new ATOM 2335 N ALA C 240 -3.097 7.021 0.240 1.00 63.03 N ATOM 2336 CA ALA C 240 -3.466 6.889 1.630 1.00 0.55 C ATOM 2337 C ALA C 240 -4.717 7.684 1.916 1.00 30.43 C ATOM 2338 O ALA C 240 -4.863 8.817 1.480 1.00 15.13 O ATOM 2339 CB ALA C 240 -2.330 7.321 2.547 1.00 33.34 C ATOM 0 H ALA C 240 -2.909 7.978 -0.060 1.00 63.03 H new ATOM 0 HA ALA C 240 -3.668 5.837 1.829 1.00 0.55 H new ATOM 0 HB1 ALA C 240 -2.639 7.210 3.586 1.00 33.34 H new ATOM 0 HB2 ALA C 240 -1.455 6.699 2.360 1.00 33.34 H new ATOM 0 HB3 ALA C 240 -2.082 8.364 2.352 1.00 33.34 H new ATOM 2345 N ARG C 241 -5.616 7.101 2.632 1.00 75.45 N ATOM 2346 CA ARG C 241 -6.844 7.776 2.938 1.00 60.44 C ATOM 2347 C ARG C 241 -6.794 8.341 4.341 1.00 21.23 C ATOM 2348 O ARG C 241 -6.493 7.614 5.300 1.00 23.53 O ATOM 2349 CB ARG C 241 -8.045 6.853 2.720 1.00 61.41 C ATOM 2350 CG ARG C 241 -9.387 7.504 2.997 1.00 1.44 C ATOM 2351 CD ARG C 241 -10.529 6.609 2.574 1.00 34.21 C ATOM 2352 NE ARG C 241 -10.517 6.361 1.128 1.00 3.24 N ATOM 2353 CZ ARG C 241 -11.153 5.361 0.507 1.00 11.31 C ATOM 2354 NH1 ARG C 241 -11.891 4.496 1.199 1.00 51.32 N ATOM 2355 NH2 ARG C 241 -11.062 5.251 -0.810 1.00 24.21 N ATOM 0 H ARG C 241 -5.531 6.161 3.019 1.00 75.45 H new ATOM 0 HA ARG C 241 -6.969 8.615 2.254 1.00 60.44 H new ATOM 0 HB2 ARG C 241 -8.033 6.496 1.690 1.00 61.41 H new ATOM 0 HB3 ARG C 241 -7.938 5.979 3.362 1.00 61.41 H new ATOM 0 HG2 ARG C 241 -9.472 7.728 4.060 1.00 1.44 H new ATOM 0 HG3 ARG C 241 -9.450 8.453 2.465 1.00 1.44 H new ATOM 0 HD2 ARG C 241 -10.464 5.660 3.107 1.00 34.21 H new ATOM 0 HD3 ARG C 241 -11.476 7.069 2.857 1.00 34.21 H new ATOM 0 HE ARG C 241 -9.979 7.005 0.548 1.00 3.24 H new ATOM 0 HH11 ARG C 241 -11.975 4.593 2.211 1.00 51.32 H new ATOM 0 HH12 ARG C 241 -12.372 3.737 0.717 1.00 51.32 H new ATOM 0 HH21 ARG C 241 -10.511 5.925 -1.341 1.00 24.21 H new ATOM 0 HH22 ARG C 241 -11.543 4.492 -1.293 1.00 24.21 H new ATOM 2369 N LEU C 242 -7.062 9.633 4.441 1.00 63.20 N ATOM 2370 CA LEU C 242 -7.016 10.381 5.692 1.00 24.12 C ATOM 2371 C LEU C 242 -8.113 9.930 6.682 1.00 14.23 C ATOM 2372 O LEU C 242 -9.094 9.283 6.296 1.00 22.43 O ATOM 2373 CB LEU C 242 -7.091 11.902 5.403 1.00 60.22 C ATOM 2374 CG LEU C 242 -5.943 12.486 4.535 1.00 43.23 C ATOM 2375 CD1 LEU C 242 -6.182 13.961 4.228 1.00 21.24 C ATOM 2376 CD2 LEU C 242 -4.589 12.292 5.198 1.00 62.35 C ATOM 0 H LEU C 242 -7.324 10.206 3.638 1.00 63.20 H new ATOM 0 HA LEU C 242 -6.064 10.168 6.178 1.00 24.12 H new ATOM 0 HB2 LEU C 242 -8.038 12.111 4.906 1.00 60.22 H new ATOM 0 HB3 LEU C 242 -7.106 12.433 6.355 1.00 60.22 H new ATOM 0 HG LEU C 242 -5.937 11.937 3.594 1.00 43.23 H new ATOM 0 HD11 LEU C 242 -5.363 14.343 3.619 1.00 21.24 H new ATOM 0 HD12 LEU C 242 -7.120 14.072 3.685 1.00 21.24 H new ATOM 0 HD13 LEU C 242 -6.234 14.523 5.161 1.00 21.24 H new ATOM 0 HD21 LEU C 242 -3.809 12.712 4.563 1.00 62.35 H new ATOM 0 HD22 LEU C 242 -4.581 12.797 6.164 1.00 62.35 H new ATOM 0 HD23 LEU C 242 -4.404 11.228 5.343 1.00 62.35 H new ATOM 2388 N LYS C 243 -7.920 10.276 7.946 1.00 3.35 N ATOM 2389 CA LYS C 243 -8.776 9.870 9.088 1.00 61.14 C ATOM 2390 C LYS C 243 -10.196 10.472 9.138 1.00 71.54 C ATOM 2391 O LYS C 243 -10.650 10.881 10.207 1.00 31.24 O ATOM 2392 CB LYS C 243 -8.024 10.103 10.398 1.00 33.43 C ATOM 2393 CG LYS C 243 -6.919 9.084 10.645 1.00 35.21 C ATOM 2394 CD LYS C 243 -5.997 9.473 11.793 1.00 43.51 C ATOM 2395 CE LYS C 243 -6.731 9.745 13.098 1.00 12.13 C ATOM 2396 NZ LYS C 243 -7.461 8.562 13.586 1.00 0.31 N ATOM 0 H LYS C 243 -7.140 10.868 8.231 1.00 3.35 H new ATOM 0 HA LYS C 243 -8.969 8.809 8.932 1.00 61.14 H new ATOM 0 HB2 LYS C 243 -7.591 11.103 10.388 1.00 33.43 H new ATOM 0 HB3 LYS C 243 -8.732 10.070 11.226 1.00 33.43 H new ATOM 0 HG2 LYS C 243 -7.368 8.114 10.859 1.00 35.21 H new ATOM 0 HG3 LYS C 243 -6.329 8.968 9.736 1.00 35.21 H new ATOM 0 HD2 LYS C 243 -5.273 8.674 11.953 1.00 43.51 H new ATOM 0 HD3 LYS C 243 -5.434 10.362 11.510 1.00 43.51 H new ATOM 0 HE2 LYS C 243 -6.015 10.065 13.855 1.00 12.13 H new ATOM 0 HE3 LYS C 243 -7.432 10.567 12.954 1.00 12.13 H new ATOM 0 HZ1 LYS C 243 -7.959 8.800 14.468 1.00 0.31 H new ATOM 0 HZ2 LYS C 243 -8.152 8.260 12.869 1.00 0.31 H new ATOM 0 HZ3 LYS C 243 -6.789 7.789 13.766 1.00 0.31 H new ATOM 2410 N ASN C 244 -10.908 10.427 8.004 1.00 53.33 N ATOM 2411 CA ASN C 244 -12.326 10.888 7.890 1.00 3.13 C ATOM 2412 C ASN C 244 -12.430 12.407 7.986 1.00 73.44 C ATOM 2413 O ASN C 244 -11.595 13.055 8.618 1.00 14.31 O ATOM 2414 CB ASN C 244 -13.244 10.193 8.928 1.00 50.21 C ATOM 2415 CG ASN C 244 -14.716 10.561 8.807 1.00 2.54 C ATOM 2416 OD1 ASN C 244 -15.223 10.831 7.716 1.00 4.01 O ATOM 2417 ND2 ASN C 244 -15.401 10.583 9.915 1.00 72.45 N ATOM 0 H ASN C 244 -10.528 10.070 7.127 1.00 53.33 H new ATOM 0 HA ASN C 244 -12.678 10.596 6.901 1.00 3.13 H new ATOM 0 HB2 ASN C 244 -13.141 9.113 8.821 1.00 50.21 H new ATOM 0 HB3 ASN C 244 -12.899 10.448 9.930 1.00 50.21 H new ATOM 0 HD21 ASN C 244 -16.391 10.830 9.898 1.00 72.45 H new ATOM 0 HD22 ASN C 244 -14.948 10.354 10.799 1.00 72.45 H new ATOM 2424 N ASN C 245 -13.433 12.976 7.301 1.00 44.24 N ATOM 2425 CA ASN C 245 -13.670 14.448 7.191 1.00 72.41 C ATOM 2426 C ASN C 245 -12.624 15.069 6.256 1.00 3.25 C ATOM 2427 O ASN C 245 -12.847 16.098 5.618 1.00 13.43 O ATOM 2428 CB ASN C 245 -13.681 15.154 8.570 1.00 71.12 C ATOM 2429 CG ASN C 245 -14.075 16.631 8.500 1.00 52.22 C ATOM 2430 OD1 ASN C 245 -14.988 16.969 7.619 1.00 73.44 O flip ATOM 2431 ND2 ASN C 245 -13.583 17.456 9.277 1.00 4.30 N flip ATOM 0 H ASN C 245 -14.125 12.425 6.792 1.00 44.24 H new ATOM 0 HA ASN C 245 -14.664 14.596 6.768 1.00 72.41 H new ATOM 0 HB2 ASN C 245 -14.374 14.633 9.230 1.00 71.12 H new ATOM 0 HB3 ASN C 245 -12.691 15.072 9.019 1.00 71.12 H new ATOM 0 HD21 ASN C 245 -12.875 17.163 9.951 1.00 4.30 H new ATOM 0 HD22 ASN C 245 -13.885 18.430 9.245 1.00 4.30 H new ATOM 2438 N ASN C 246 -11.502 14.430 6.204 1.00 34.41 N ATOM 2439 CA ASN C 246 -10.443 14.742 5.318 1.00 33.15 C ATOM 2440 C ASN C 246 -10.506 13.777 4.153 1.00 53.50 C ATOM 2441 O ASN C 246 -11.116 12.694 4.257 1.00 22.24 O ATOM 2442 CB ASN C 246 -9.097 14.650 6.040 1.00 24.13 C ATOM 2443 CG ASN C 246 -8.908 15.726 7.093 1.00 40.31 C ATOM 2444 OD1 ASN C 246 -9.420 16.841 6.958 1.00 75.23 O ATOM 2445 ND2 ASN C 246 -8.172 15.419 8.137 1.00 2.12 N ATOM 0 H ASN C 246 -11.294 13.637 6.811 1.00 34.41 H new ATOM 0 HA ASN C 246 -10.543 15.764 4.952 1.00 33.15 H new ATOM 0 HB2 ASN C 246 -9.011 13.671 6.511 1.00 24.13 H new ATOM 0 HB3 ASN C 246 -8.293 14.723 5.307 1.00 24.13 H new ATOM 0 HD21 ASN C 246 -8.009 16.112 8.868 1.00 2.12 H new ATOM 0 HD22 ASN C 246 -7.764 14.488 8.217 1.00 2.12 H new ATOM 2452 N ARG C 247 -9.868 14.128 3.083 1.00 41.42 N ATOM 2453 CA ARG C 247 -9.987 13.382 1.847 1.00 34.15 C ATOM 2454 C ARG C 247 -8.891 12.343 1.691 1.00 51.00 C ATOM 2455 O ARG C 247 -8.135 12.118 2.596 1.00 31.01 O ATOM 2456 CB ARG C 247 -10.107 14.356 0.642 1.00 2.23 C ATOM 2457 CG ARG C 247 -9.006 15.424 0.443 1.00 10.55 C ATOM 2458 CD ARG C 247 -7.697 14.852 -0.060 1.00 34.35 C ATOM 2459 NE ARG C 247 -6.695 15.893 -0.332 1.00 0.34 N ATOM 2460 CZ ARG C 247 -5.609 15.716 -1.113 1.00 22.20 C ATOM 2461 NH1 ARG C 247 -5.430 14.559 -1.772 1.00 42.22 N ATOM 2462 NH2 ARG C 247 -4.714 16.694 -1.237 1.00 64.45 N ATOM 0 H ARG C 247 -9.248 14.936 3.029 1.00 41.42 H new ATOM 0 HA ARG C 247 -10.909 12.802 1.879 1.00 34.15 H new ATOM 0 HB2 ARG C 247 -10.154 13.755 -0.266 1.00 2.23 H new ATOM 0 HB3 ARG C 247 -11.061 14.876 0.730 1.00 2.23 H new ATOM 0 HG2 ARG C 247 -9.361 16.174 -0.263 1.00 10.55 H new ATOM 0 HG3 ARG C 247 -8.831 15.935 1.390 1.00 10.55 H new ATOM 0 HD2 ARG C 247 -7.301 14.155 0.679 1.00 34.35 H new ATOM 0 HD3 ARG C 247 -7.880 14.281 -0.971 1.00 34.35 H new ATOM 0 HE ARG C 247 -6.830 16.808 0.098 1.00 0.34 H new ATOM 0 HH11 ARG C 247 -6.117 13.810 -1.683 1.00 42.22 H new ATOM 0 HH12 ARG C 247 -4.608 14.430 -2.361 1.00 42.22 H new ATOM 0 HH21 ARG C 247 -4.850 17.575 -0.742 1.00 64.45 H new ATOM 0 HH22 ARG C 247 -3.893 16.562 -1.827 1.00 64.45 H new ATOM 2476 N GLN C 248 -8.823 11.685 0.571 1.00 12.02 N ATOM 2477 CA GLN C 248 -7.754 10.744 0.379 1.00 11.44 C ATOM 2478 C GLN C 248 -6.645 11.387 -0.407 1.00 42.31 C ATOM 2479 O GLN C 248 -6.885 12.141 -1.363 1.00 64.14 O ATOM 2480 CB GLN C 248 -8.210 9.445 -0.277 1.00 65.04 C ATOM 2481 CG GLN C 248 -8.842 9.601 -1.636 1.00 62.31 C ATOM 2482 CD GLN C 248 -9.093 8.272 -2.290 1.00 33.11 C ATOM 2483 OE1 GLN C 248 -9.324 7.258 -1.619 1.00 15.11 O ATOM 2484 NE2 GLN C 248 -9.035 8.251 -3.578 1.00 42.41 N ATOM 0 H GLN C 248 -9.476 11.776 -0.207 1.00 12.02 H new ATOM 0 HA GLN C 248 -7.386 10.466 1.367 1.00 11.44 H new ATOM 0 HB2 GLN C 248 -7.350 8.781 -0.368 1.00 65.04 H new ATOM 0 HB3 GLN C 248 -8.924 8.954 0.384 1.00 65.04 H new ATOM 0 HG2 GLN C 248 -9.783 10.142 -1.539 1.00 62.31 H new ATOM 0 HG3 GLN C 248 -8.193 10.202 -2.272 1.00 62.31 H new ATOM 0 HE21 GLN C 248 -8.842 9.109 -4.094 1.00 42.41 H new ATOM 0 HE22 GLN C 248 -9.182 7.376 -4.081 1.00 42.41 H new ATOM 2493 N VAL C 249 -5.454 11.120 -0.002 1.00 25.00 N ATOM 2494 CA VAL C 249 -4.294 11.724 -0.574 1.00 11.25 C ATOM 2495 C VAL C 249 -3.443 10.675 -1.250 1.00 20.12 C ATOM 2496 O VAL C 249 -3.517 9.493 -0.913 1.00 61.42 O ATOM 2497 CB VAL C 249 -3.448 12.470 0.519 1.00 63.53 C ATOM 2498 CG1 VAL C 249 -4.216 13.630 1.111 1.00 64.14 C ATOM 2499 CG2 VAL C 249 -3.052 11.532 1.637 1.00 62.32 C ATOM 0 H VAL C 249 -5.250 10.463 0.751 1.00 25.00 H new ATOM 0 HA VAL C 249 -4.623 12.455 -1.312 1.00 11.25 H new ATOM 0 HB VAL C 249 -2.553 12.844 0.023 1.00 63.53 H new ATOM 0 HG11 VAL C 249 -3.603 14.126 1.864 1.00 64.14 H new ATOM 0 HG12 VAL C 249 -4.467 14.340 0.323 1.00 64.14 H new ATOM 0 HG13 VAL C 249 -5.132 13.262 1.573 1.00 64.14 H new ATOM 0 HG21 VAL C 249 -2.467 12.076 2.379 1.00 62.32 H new ATOM 0 HG22 VAL C 249 -3.948 11.127 2.107 1.00 62.32 H new ATOM 0 HG23 VAL C 249 -2.454 10.715 1.232 1.00 62.32 H new ATOM 2509 N CYS C 250 -2.667 11.075 -2.183 1.00 11.03 N ATOM 2510 CA CYS C 250 -1.760 10.164 -2.804 1.00 75.31 C ATOM 2511 C CYS C 250 -0.426 10.471 -2.219 1.00 1.34 C ATOM 2512 O CYS C 250 -0.076 11.608 -2.106 1.00 71.13 O ATOM 2513 CB CYS C 250 -1.739 10.345 -4.313 1.00 52.11 C ATOM 2514 SG CYS C 250 -0.734 9.105 -5.186 1.00 3.24 S ATOM 0 H CYS C 250 -2.634 12.029 -2.541 1.00 11.03 H new ATOM 0 HA CYS C 250 -2.055 9.130 -2.627 1.00 75.31 H new ATOM 0 HB2 CYS C 250 -2.761 10.301 -4.689 1.00 52.11 H new ATOM 0 HB3 CYS C 250 -1.356 11.339 -4.545 1.00 52.11 H new ATOM 2519 N ILE C 251 0.311 9.494 -1.845 1.00 32.10 N ATOM 2520 CA ILE C 251 1.508 9.742 -1.102 1.00 65.02 C ATOM 2521 C ILE C 251 2.705 9.539 -1.973 1.00 73.02 C ATOM 2522 O ILE C 251 2.683 8.713 -2.883 1.00 12.41 O ATOM 2523 CB ILE C 251 1.644 8.760 0.103 1.00 70.41 C ATOM 2524 CG1 ILE C 251 0.379 8.712 0.933 1.00 13.12 C ATOM 2525 CG2 ILE C 251 2.790 9.198 0.998 1.00 1.31 C ATOM 2526 CD1 ILE C 251 0.016 10.021 1.571 1.00 54.22 C ATOM 0 H ILE C 251 0.115 8.511 -2.036 1.00 32.10 H new ATOM 0 HA ILE C 251 1.452 10.769 -0.741 1.00 65.02 H new ATOM 0 HB ILE C 251 1.832 7.768 -0.306 1.00 70.41 H new ATOM 0 HG12 ILE C 251 -0.446 8.387 0.300 1.00 13.12 H new ATOM 0 HG13 ILE C 251 0.497 7.960 1.713 1.00 13.12 H new ATOM 0 HG21 ILE C 251 2.880 8.509 1.837 1.00 1.31 H new ATOM 0 HG22 ILE C 251 3.718 9.197 0.427 1.00 1.31 H new ATOM 0 HG23 ILE C 251 2.595 10.203 1.373 1.00 1.31 H new ATOM 0 HD11 ILE C 251 -0.901 9.903 2.148 1.00 54.22 H new ATOM 0 HD12 ILE C 251 0.822 10.339 2.232 1.00 54.22 H new ATOM 0 HD13 ILE C 251 -0.136 10.773 0.797 1.00 54.22 H new ATOM 2538 N ASP C 252 3.730 10.313 -1.728 1.00 33.20 N ATOM 2539 CA ASP C 252 4.999 10.072 -2.354 1.00 10.50 C ATOM 2540 C ASP C 252 5.600 8.853 -1.668 1.00 10.13 C ATOM 2541 O ASP C 252 5.920 8.897 -0.474 1.00 40.25 O ATOM 2542 CB ASP C 252 5.935 11.272 -2.214 1.00 54.53 C ATOM 2543 CG ASP C 252 7.238 11.065 -2.952 1.00 13.40 C ATOM 2544 OD1 ASP C 252 7.293 11.367 -4.168 1.00 41.42 O ATOM 2545 OD2 ASP C 252 8.205 10.590 -2.343 1.00 15.33 O ATOM 0 H ASP C 252 3.709 11.115 -1.099 1.00 33.20 H new ATOM 0 HA ASP C 252 4.864 9.906 -3.423 1.00 10.50 H new ATOM 0 HB2 ASP C 252 5.440 12.164 -2.597 1.00 54.53 H new ATOM 0 HB3 ASP C 252 6.141 11.450 -1.158 1.00 54.53 H new ATOM 2550 N PRO C 253 5.736 7.739 -2.390 1.00 1.51 N ATOM 2551 CA PRO C 253 6.198 6.470 -1.815 1.00 74.33 C ATOM 2552 C PRO C 253 7.690 6.470 -1.516 1.00 64.00 C ATOM 2553 O PRO C 253 8.263 5.455 -1.127 1.00 31.52 O ATOM 2554 CB PRO C 253 5.878 5.455 -2.911 1.00 43.53 C ATOM 2555 CG PRO C 253 5.927 6.236 -4.171 1.00 4.04 C ATOM 2556 CD PRO C 253 5.456 7.620 -3.832 1.00 51.53 C ATOM 0 HA PRO C 253 5.720 6.260 -0.858 1.00 74.33 H new ATOM 0 HB2 PRO C 253 6.603 4.641 -2.921 1.00 43.53 H new ATOM 0 HB3 PRO C 253 4.896 5.006 -2.761 1.00 43.53 H new ATOM 0 HG2 PRO C 253 6.939 6.259 -4.575 1.00 4.04 H new ATOM 0 HG3 PRO C 253 5.290 5.785 -4.932 1.00 4.04 H new ATOM 0 HD2 PRO C 253 5.989 8.377 -4.407 1.00 51.53 H new ATOM 0 HD3 PRO C 253 4.395 7.746 -4.046 1.00 51.53 H new ATOM 2564 N LYS C 254 8.298 7.603 -1.691 1.00 71.33 N ATOM 2565 CA LYS C 254 9.690 7.762 -1.509 1.00 32.43 C ATOM 2566 C LYS C 254 9.965 8.605 -0.245 1.00 23.44 C ATOM 2567 O LYS C 254 11.112 8.914 0.080 1.00 11.12 O ATOM 2568 CB LYS C 254 10.249 8.349 -2.799 1.00 61.11 C ATOM 2569 CG LYS C 254 10.017 7.409 -3.996 1.00 72.22 C ATOM 2570 CD LYS C 254 10.285 8.076 -5.328 1.00 74.31 C ATOM 2571 CE LYS C 254 11.702 8.585 -5.439 1.00 53.24 C ATOM 2572 NZ LYS C 254 11.922 9.270 -6.720 1.00 15.12 N ATOM 0 H LYS C 254 7.819 8.459 -1.971 1.00 71.33 H new ATOM 0 HA LYS C 254 10.199 6.815 -1.328 1.00 32.43 H new ATOM 0 HB2 LYS C 254 9.778 9.312 -2.995 1.00 61.11 H new ATOM 0 HB3 LYS C 254 11.317 8.534 -2.683 1.00 61.11 H new ATOM 0 HG2 LYS C 254 10.662 6.536 -3.896 1.00 72.22 H new ATOM 0 HG3 LYS C 254 8.988 7.050 -3.976 1.00 72.22 H new ATOM 0 HD2 LYS C 254 10.092 7.366 -6.133 1.00 74.31 H new ATOM 0 HD3 LYS C 254 9.592 8.906 -5.462 1.00 74.31 H new ATOM 0 HE2 LYS C 254 11.911 9.270 -4.617 1.00 53.24 H new ATOM 0 HE3 LYS C 254 12.399 7.752 -5.345 1.00 53.24 H new ATOM 0 HZ1 LYS C 254 12.850 9.740 -6.708 1.00 15.12 H new ATOM 0 HZ2 LYS C 254 11.896 8.576 -7.494 1.00 15.12 H new ATOM 0 HZ3 LYS C 254 11.176 9.980 -6.866 1.00 15.12 H new ATOM 2586 N LEU C 255 8.873 8.957 0.473 1.00 13.44 N ATOM 2587 CA LEU C 255 8.956 9.608 1.800 1.00 52.12 C ATOM 2588 C LEU C 255 9.665 8.700 2.772 1.00 53.32 C ATOM 2589 O LEU C 255 9.537 7.477 2.674 1.00 21.33 O ATOM 2590 CB LEU C 255 7.555 9.909 2.353 1.00 62.31 C ATOM 2591 CG LEU C 255 6.814 11.097 1.764 1.00 20.41 C ATOM 2592 CD1 LEU C 255 5.390 11.124 2.282 1.00 44.20 C ATOM 2593 CD2 LEU C 255 7.501 12.359 2.193 1.00 11.42 C ATOM 0 H LEU C 255 7.918 8.799 0.152 1.00 13.44 H new ATOM 0 HA LEU C 255 9.505 10.542 1.680 1.00 52.12 H new ATOM 0 HB2 LEU C 255 6.938 9.022 2.210 1.00 62.31 H new ATOM 0 HB3 LEU C 255 7.643 10.066 3.428 1.00 62.31 H new ATOM 0 HG LEU C 255 6.807 11.014 0.677 1.00 20.41 H new ATOM 0 HD11 LEU C 255 4.864 11.978 1.856 1.00 44.20 H new ATOM 0 HD12 LEU C 255 4.881 10.204 1.995 1.00 44.20 H new ATOM 0 HD13 LEU C 255 5.400 11.209 3.369 1.00 44.20 H new ATOM 0 HD21 LEU C 255 6.977 13.219 1.775 1.00 11.42 H new ATOM 0 HD22 LEU C 255 7.496 12.424 3.281 1.00 11.42 H new ATOM 0 HD23 LEU C 255 8.530 12.353 1.835 1.00 11.42 H new ATOM 2605 N LYS C 256 10.362 9.274 3.748 1.00 51.44 N ATOM 2606 CA LYS C 256 11.128 8.466 4.661 1.00 65.24 C ATOM 2607 C LYS C 256 10.238 7.661 5.582 1.00 51.53 C ATOM 2608 O LYS C 256 10.553 6.514 5.872 1.00 65.34 O ATOM 2609 CB LYS C 256 12.158 9.256 5.443 1.00 60.34 C ATOM 2610 CG LYS C 256 13.117 8.343 6.191 1.00 40.14 C ATOM 2611 CD LYS C 256 14.139 9.119 6.945 1.00 12.44 C ATOM 2612 CE LYS C 256 15.138 8.207 7.665 1.00 42.11 C ATOM 2613 NZ LYS C 256 14.491 7.299 8.645 1.00 1.42 N ATOM 0 H LYS C 256 10.406 10.279 3.917 1.00 51.44 H new ATOM 0 HA LYS C 256 11.687 7.768 4.038 1.00 65.24 H new ATOM 0 HB2 LYS C 256 12.720 9.895 4.762 1.00 60.34 H new ATOM 0 HB3 LYS C 256 11.652 9.912 6.152 1.00 60.34 H new ATOM 0 HG2 LYS C 256 12.556 7.713 6.881 1.00 40.14 H new ATOM 0 HG3 LYS C 256 13.613 7.678 5.484 1.00 40.14 H new ATOM 0 HD2 LYS C 256 14.676 9.774 6.259 1.00 12.44 H new ATOM 0 HD3 LYS C 256 13.643 9.759 7.674 1.00 12.44 H new ATOM 0 HE2 LYS C 256 15.676 7.612 6.927 1.00 42.11 H new ATOM 0 HE3 LYS C 256 15.877 8.821 8.180 1.00 42.11 H new ATOM 0 HZ1 LYS C 256 15.141 7.123 9.437 1.00 1.42 H new ATOM 0 HZ2 LYS C 256 13.620 7.739 9.003 1.00 1.42 H new ATOM 0 HZ3 LYS C 256 14.258 6.397 8.182 1.00 1.42 H new ATOM 2627 N TRP C 257 9.094 8.230 6.030 1.00 72.53 N ATOM 2628 CA TRP C 257 8.185 7.434 6.858 1.00 0.31 C ATOM 2629 C TRP C 257 7.614 6.286 6.059 1.00 33.43 C ATOM 2630 O TRP C 257 7.287 5.256 6.607 1.00 74.42 O ATOM 2631 CB TRP C 257 7.071 8.225 7.634 1.00 43.34 C ATOM 2632 CG TRP C 257 6.028 8.970 6.832 1.00 2.44 C ATOM 2633 CD1 TRP C 257 6.105 10.240 6.323 1.00 1.54 C ATOM 2634 CD2 TRP C 257 4.711 8.492 6.506 1.00 4.33 C ATOM 2635 NE1 TRP C 257 4.920 10.570 5.707 1.00 10.24 N ATOM 2636 CE2 TRP C 257 4.054 9.516 5.798 1.00 2.00 C ATOM 2637 CE3 TRP C 257 4.027 7.292 6.742 1.00 21.54 C ATOM 2638 CZ2 TRP C 257 2.747 9.380 5.328 1.00 11.21 C ATOM 2639 CZ3 TRP C 257 2.733 7.162 6.276 1.00 72.14 C ATOM 2640 CH2 TRP C 257 2.109 8.198 5.577 1.00 14.43 C ATOM 0 H TRP C 257 8.797 9.187 5.840 1.00 72.53 H new ATOM 0 HA TRP C 257 8.811 7.049 7.663 1.00 0.31 H new ATOM 0 HB2 TRP C 257 6.551 7.518 8.280 1.00 43.34 H new ATOM 0 HB3 TRP C 257 7.567 8.946 8.284 1.00 43.34 H new ATOM 0 HD1 TRP C 257 6.968 10.886 6.395 1.00 1.54 H new ATOM 0 HE1 TRP C 257 4.719 11.461 5.254 1.00 10.24 H new ATOM 0 HE3 TRP C 257 4.502 6.484 7.278 1.00 21.54 H new ATOM 0 HZ2 TRP C 257 2.259 10.178 4.788 1.00 11.21 H new ATOM 0 HZ3 TRP C 257 2.194 6.243 6.455 1.00 72.14 H new ATOM 0 HH2 TRP C 257 1.097 8.061 5.225 1.00 14.43 H new ATOM 2651 N ILE C 258 7.520 6.466 4.745 1.00 31.51 N ATOM 2652 CA ILE C 258 7.076 5.402 3.873 1.00 3.30 C ATOM 2653 C ILE C 258 8.187 4.360 3.724 1.00 75.14 C ATOM 2654 O ILE C 258 7.917 3.163 3.750 1.00 43.24 O ATOM 2655 CB ILE C 258 6.629 5.915 2.466 1.00 52.41 C ATOM 2656 CG1 ILE C 258 5.445 6.895 2.586 1.00 2.15 C ATOM 2657 CG2 ILE C 258 6.261 4.742 1.565 1.00 51.44 C ATOM 2658 CD1 ILE C 258 4.225 6.302 3.225 1.00 61.33 C ATOM 0 H ILE C 258 7.746 7.339 4.269 1.00 31.51 H new ATOM 0 HA ILE C 258 6.198 4.951 4.336 1.00 3.30 H new ATOM 0 HB ILE C 258 7.466 6.450 2.018 1.00 52.41 H new ATOM 0 HG12 ILE C 258 5.762 7.762 3.166 1.00 2.15 H new ATOM 0 HG13 ILE C 258 5.183 7.256 1.591 1.00 2.15 H new ATOM 0 HG21 ILE C 258 5.952 5.116 0.589 1.00 51.44 H new ATOM 0 HG22 ILE C 258 7.126 4.089 1.446 1.00 51.44 H new ATOM 0 HG23 ILE C 258 5.442 4.181 2.015 1.00 51.44 H new ATOM 0 HD11 ILE C 258 3.437 7.054 3.273 1.00 61.33 H new ATOM 0 HD12 ILE C 258 3.881 5.453 2.634 1.00 61.33 H new ATOM 0 HD13 ILE C 258 4.469 5.967 4.233 1.00 61.33 H new ATOM 2670 N GLN C 259 9.445 4.832 3.596 1.00 62.32 N ATOM 2671 CA GLN C 259 10.609 3.929 3.489 1.00 54.43 C ATOM 2672 C GLN C 259 10.629 3.035 4.711 1.00 2.13 C ATOM 2673 O GLN C 259 10.672 1.808 4.603 1.00 3.51 O ATOM 2674 CB GLN C 259 11.938 4.717 3.450 1.00 55.21 C ATOM 2675 CG GLN C 259 12.041 5.788 2.371 1.00 43.42 C ATOM 2676 CD GLN C 259 11.869 5.265 0.974 1.00 33.05 C ATOM 2677 OE1 GLN C 259 12.824 4.878 0.322 1.00 74.30 O ATOM 2678 NE2 GLN C 259 10.653 5.276 0.498 1.00 1.40 N ATOM 0 H GLN C 259 9.679 5.824 3.564 1.00 62.32 H new ATOM 0 HA GLN C 259 10.517 3.356 2.566 1.00 54.43 H new ATOM 0 HB2 GLN C 259 12.087 5.190 4.421 1.00 55.21 H new ATOM 0 HB3 GLN C 259 12.755 4.009 3.312 1.00 55.21 H new ATOM 0 HG2 GLN C 259 11.286 6.551 2.558 1.00 43.42 H new ATOM 0 HG3 GLN C 259 13.013 6.275 2.449 1.00 43.42 H new ATOM 0 HE21 GLN C 259 9.882 5.608 1.077 1.00 1.40 H new ATOM 0 HE22 GLN C 259 10.475 4.953 -0.453 1.00 1.40 H new ATOM 2687 N GLU C 260 10.538 3.678 5.877 1.00 22.52 N ATOM 2688 CA GLU C 260 10.491 2.987 7.150 1.00 30.25 C ATOM 2689 C GLU C 260 9.323 2.043 7.158 1.00 33.04 C ATOM 2690 O GLU C 260 9.475 0.895 7.441 1.00 41.11 O ATOM 2691 CB GLU C 260 10.276 3.975 8.308 1.00 53.32 C ATOM 2692 CG GLU C 260 11.324 5.047 8.492 1.00 1.40 C ATOM 2693 CD GLU C 260 12.672 4.500 8.818 1.00 1.23 C ATOM 2694 OE1 GLU C 260 12.834 3.901 9.907 1.00 52.52 O ATOM 2695 OE2 GLU C 260 13.605 4.701 8.024 1.00 24.11 O ATOM 0 H GLU C 260 10.495 4.694 5.956 1.00 22.52 H new ATOM 0 HA GLU C 260 11.438 2.462 7.278 1.00 30.25 H new ATOM 0 HB2 GLU C 260 9.312 4.463 8.163 1.00 53.32 H new ATOM 0 HB3 GLU C 260 10.208 3.404 9.234 1.00 53.32 H new ATOM 0 HG2 GLU C 260 11.391 5.641 7.581 1.00 1.40 H new ATOM 0 HG3 GLU C 260 11.010 5.720 9.289 1.00 1.40 H new ATOM 2702 N TYR C 261 8.161 2.551 6.814 1.00 75.12 N ATOM 2703 CA TYR C 261 6.935 1.791 6.898 1.00 73.33 C ATOM 2704 C TYR C 261 7.016 0.495 6.075 1.00 45.42 C ATOM 2705 O TYR C 261 6.561 -0.556 6.524 1.00 74.25 O ATOM 2706 CB TYR C 261 5.753 2.644 6.455 1.00 22.30 C ATOM 2707 CG TYR C 261 4.445 2.101 6.913 1.00 2.35 C ATOM 2708 CD1 TYR C 261 3.978 2.416 8.177 1.00 5.11 C ATOM 2709 CD2 TYR C 261 3.686 1.269 6.118 1.00 41.04 C ATOM 2710 CE1 TYR C 261 2.794 1.922 8.637 1.00 33.44 C ATOM 2711 CE2 TYR C 261 2.496 0.765 6.577 1.00 71.05 C ATOM 2712 CZ TYR C 261 2.059 1.096 7.838 1.00 31.41 C ATOM 2713 OH TYR C 261 0.883 0.602 8.301 1.00 64.23 O ATOM 0 H TYR C 261 8.040 3.503 6.468 1.00 75.12 H new ATOM 0 HA TYR C 261 6.787 1.505 7.939 1.00 73.33 H new ATOM 0 HB2 TYR C 261 5.876 3.656 6.841 1.00 22.30 H new ATOM 0 HB3 TYR C 261 5.750 2.716 5.367 1.00 22.30 H new ATOM 0 HD1 TYR C 261 4.563 3.066 8.811 1.00 5.11 H new ATOM 0 HD2 TYR C 261 4.031 1.012 5.127 1.00 41.04 H new ATOM 0 HE1 TYR C 261 2.441 2.182 9.624 1.00 33.44 H new ATOM 0 HE2 TYR C 261 1.906 0.112 5.952 1.00 71.05 H new ATOM 0 HH TYR C 261 0.949 -0.372 8.389 1.00 64.23 H new ATOM 2723 N LEU C 262 7.606 0.583 4.892 1.00 11.22 N ATOM 2724 CA LEU C 262 7.800 -0.580 4.032 1.00 11.20 C ATOM 2725 C LEU C 262 8.852 -1.530 4.628 1.00 73.10 C ATOM 2726 O LEU C 262 8.602 -2.724 4.811 1.00 41.24 O ATOM 2727 CB LEU C 262 8.241 -0.124 2.630 1.00 14.25 C ATOM 2728 CG LEU C 262 7.247 0.750 1.848 1.00 5.20 C ATOM 2729 CD1 LEU C 262 7.872 1.241 0.560 1.00 11.13 C ATOM 2730 CD2 LEU C 262 5.984 -0.022 1.533 1.00 22.40 C ATOM 0 H LEU C 262 7.962 1.455 4.501 1.00 11.22 H new ATOM 0 HA LEU C 262 6.854 -1.117 3.958 1.00 11.20 H new ATOM 0 HB2 LEU C 262 9.176 0.428 2.729 1.00 14.25 H new ATOM 0 HB3 LEU C 262 8.456 -1.011 2.035 1.00 14.25 H new ATOM 0 HG LEU C 262 6.992 1.606 2.473 1.00 5.20 H new ATOM 0 HD11 LEU C 262 7.154 1.858 0.019 1.00 11.13 H new ATOM 0 HD12 LEU C 262 8.759 1.832 0.788 1.00 11.13 H new ATOM 0 HD13 LEU C 262 8.153 0.387 -0.056 1.00 11.13 H new ATOM 0 HD21 LEU C 262 5.296 0.617 0.979 1.00 22.40 H new ATOM 0 HD22 LEU C 262 6.232 -0.896 0.931 1.00 22.40 H new ATOM 0 HD23 LEU C 262 5.513 -0.344 2.462 1.00 22.40 H new ATOM 2742 N GLU C 263 10.006 -0.981 4.968 1.00 3.40 N ATOM 2743 CA GLU C 263 11.124 -1.755 5.519 1.00 64.10 C ATOM 2744 C GLU C 263 10.789 -2.381 6.871 1.00 14.04 C ATOM 2745 O GLU C 263 11.045 -3.563 7.122 1.00 23.52 O ATOM 2746 CB GLU C 263 12.350 -0.857 5.651 1.00 74.52 C ATOM 2747 CG GLU C 263 12.918 -0.405 4.329 1.00 73.20 C ATOM 2748 CD GLU C 263 14.219 0.327 4.475 1.00 12.22 C ATOM 2749 OE1 GLU C 263 14.215 1.515 4.821 1.00 71.42 O ATOM 2750 OE2 GLU C 263 15.284 -0.295 4.236 1.00 10.12 O ATOM 0 H GLU C 263 10.202 0.015 4.873 1.00 3.40 H new ATOM 0 HA GLU C 263 11.330 -2.573 4.828 1.00 64.10 H new ATOM 0 HB2 GLU C 263 12.085 0.020 6.241 1.00 74.52 H new ATOM 0 HB3 GLU C 263 13.122 -1.391 6.204 1.00 74.52 H new ATOM 0 HG2 GLU C 263 13.065 -1.273 3.686 1.00 73.20 H new ATOM 0 HG3 GLU C 263 12.196 0.242 3.831 1.00 73.20 H new ATOM 2757 N LYS C 264 10.189 -1.605 7.706 1.00 24.32 N ATOM 2758 CA LYS C 264 9.877 -1.983 9.063 1.00 64.22 C ATOM 2759 C LYS C 264 8.596 -2.806 9.133 1.00 51.13 C ATOM 2760 O LYS C 264 8.158 -3.168 10.190 1.00 53.13 O ATOM 2761 CB LYS C 264 9.866 -0.757 9.982 1.00 65.41 C ATOM 2762 CG LYS C 264 11.140 0.072 9.844 1.00 61.03 C ATOM 2763 CD LYS C 264 12.368 -0.698 10.280 1.00 3.52 C ATOM 2764 CE LYS C 264 13.641 -0.016 9.818 1.00 11.50 C ATOM 2765 NZ LYS C 264 13.784 1.375 10.309 1.00 62.44 N ATOM 0 H LYS C 264 9.888 -0.660 7.468 1.00 24.32 H new ATOM 0 HA LYS C 264 10.667 -2.637 9.432 1.00 64.22 H new ATOM 0 HB2 LYS C 264 9.002 -0.136 9.747 1.00 65.41 H new ATOM 0 HB3 LYS C 264 9.754 -1.081 11.017 1.00 65.41 H new ATOM 0 HG2 LYS C 264 11.258 0.385 8.807 1.00 61.03 H new ATOM 0 HG3 LYS C 264 11.049 0.979 10.442 1.00 61.03 H new ATOM 0 HD2 LYS C 264 12.376 -0.789 11.366 1.00 3.52 H new ATOM 0 HD3 LYS C 264 12.328 -1.709 9.876 1.00 3.52 H new ATOM 0 HE2 LYS C 264 14.498 -0.600 10.154 1.00 11.50 H new ATOM 0 HE3 LYS C 264 13.665 -0.011 8.728 1.00 11.50 H new ATOM 0 HZ1 LYS C 264 14.762 1.696 10.162 1.00 62.44 H new ATOM 0 HZ2 LYS C 264 13.133 1.996 9.787 1.00 62.44 H new ATOM 0 HZ3 LYS C 264 13.557 1.410 11.323 1.00 62.44 H new ATOM 2779 N CYS C 265 7.983 -3.025 7.991 1.00 53.24 N ATOM 2780 CA CYS C 265 6.848 -3.918 7.863 1.00 10.30 C ATOM 2781 C CYS C 265 7.362 -5.340 7.699 1.00 22.32 C ATOM 2782 O CYS C 265 6.728 -6.302 8.144 1.00 14.44 O ATOM 2783 CB CYS C 265 5.974 -3.534 6.648 1.00 23.22 C ATOM 2784 SG CYS C 265 4.543 -4.637 6.325 1.00 51.33 S ATOM 0 H CYS C 265 8.260 -2.584 7.114 1.00 53.24 H new ATOM 0 HA CYS C 265 6.231 -3.840 8.758 1.00 10.30 H new ATOM 0 HB2 CYS C 265 5.603 -2.520 6.795 1.00 23.22 H new ATOM 0 HB3 CYS C 265 6.605 -3.517 5.759 1.00 23.22 H new ATOM 2789 N LEU C 266 8.528 -5.481 7.071 1.00 62.33 N ATOM 2790 CA LEU C 266 9.092 -6.798 6.879 1.00 61.30 C ATOM 2791 C LEU C 266 10.161 -7.107 7.927 1.00 54.33 C ATOM 2792 O LEU C 266 10.166 -8.184 8.516 1.00 32.21 O ATOM 2793 CB LEU C 266 9.595 -6.991 5.415 1.00 70.31 C ATOM 2794 CG LEU C 266 10.857 -6.253 4.910 1.00 62.51 C ATOM 2795 CD1 LEU C 266 12.146 -6.924 5.392 1.00 32.31 C ATOM 2796 CD2 LEU C 266 10.846 -6.183 3.410 1.00 33.41 C ATOM 0 H LEU C 266 9.084 -4.712 6.697 1.00 62.33 H new ATOM 0 HA LEU C 266 8.300 -7.532 7.029 1.00 61.30 H new ATOM 0 HB2 LEU C 266 9.769 -8.058 5.274 1.00 70.31 H new ATOM 0 HB3 LEU C 266 8.774 -6.712 4.754 1.00 70.31 H new ATOM 0 HG LEU C 266 10.835 -5.245 5.325 1.00 62.51 H new ATOM 0 HD11 LEU C 266 13.007 -6.372 5.014 1.00 32.31 H new ATOM 0 HD12 LEU C 266 12.168 -6.929 6.482 1.00 32.31 H new ATOM 0 HD13 LEU C 266 12.182 -7.949 5.024 1.00 32.31 H new ATOM 0 HD21 LEU C 266 11.738 -5.662 3.064 1.00 33.41 H new ATOM 0 HD22 LEU C 266 10.833 -7.192 2.999 1.00 33.41 H new ATOM 0 HD23 LEU C 266 9.959 -5.644 3.077 1.00 33.41 H new ATOM 2808 N ASN C 267 11.038 -6.145 8.179 1.00 41.02 N ATOM 2809 CA ASN C 267 12.142 -6.333 9.120 1.00 60.52 C ATOM 2810 C ASN C 267 11.640 -6.166 10.536 1.00 43.20 C ATOM 2811 O ASN C 267 11.902 -6.993 11.407 1.00 53.21 O ATOM 2812 CB ASN C 267 13.261 -5.322 8.828 1.00 22.12 C ATOM 2813 CG ASN C 267 14.479 -5.464 9.732 1.00 13.51 C ATOM 2814 OD1 ASN C 267 14.802 -6.670 10.127 1.00 45.14 O flip ATOM 2815 ND2 ASN C 267 15.146 -4.478 10.039 1.00 34.32 N flip ATOM 0 H ASN C 267 11.009 -5.222 7.745 1.00 41.02 H new ATOM 0 HA ASN C 267 12.544 -7.339 9.004 1.00 60.52 H new ATOM 0 HB2 ASN C 267 13.577 -5.435 7.791 1.00 22.12 H new ATOM 0 HB3 ASN C 267 12.861 -4.313 8.931 1.00 22.12 H new ATOM 0 HD21 ASN C 267 14.867 -3.552 9.715 1.00 34.32 H new ATOM 0 HD22 ASN C 267 15.979 -4.586 10.618 1.00 34.32 H new ATOM 2822 N LYS C 268 10.897 -5.090 10.741 1.00 62.34 N ATOM 2823 CA LYS C 268 10.248 -4.773 12.021 1.00 22.14 C ATOM 2824 C LYS C 268 11.242 -4.692 13.176 1.00 35.03 C ATOM 2825 O LYS C 268 12.288 -4.020 13.061 1.00 20.44 O ATOM 2826 CB LYS C 268 9.132 -5.783 12.307 1.00 42.13 C ATOM 2827 CG LYS C 268 8.171 -5.882 11.145 1.00 43.11 C ATOM 2828 CD LYS C 268 6.930 -6.722 11.364 1.00 11.41 C ATOM 2829 CE LYS C 268 7.198 -8.229 11.598 1.00 55.01 C ATOM 2830 NZ LYS C 268 7.843 -8.544 12.909 1.00 4.22 N ATOM 0 H LYS C 268 10.720 -4.395 10.016 1.00 62.34 H new ATOM 0 HA LYS C 268 9.807 -3.780 11.933 1.00 22.14 H new ATOM 0 HB2 LYS C 268 9.567 -6.762 12.506 1.00 42.13 H new ATOM 0 HB3 LYS C 268 8.591 -5.486 13.205 1.00 42.13 H new ATOM 0 HG2 LYS C 268 7.857 -4.874 10.875 1.00 43.11 H new ATOM 0 HG3 LYS C 268 8.711 -6.288 10.289 1.00 43.11 H new ATOM 0 HD2 LYS C 268 6.388 -6.326 12.223 1.00 11.41 H new ATOM 0 HD3 LYS C 268 6.278 -6.614 10.497 1.00 11.41 H new ATOM 0 HE2 LYS C 268 6.253 -8.768 11.533 1.00 55.01 H new ATOM 0 HE3 LYS C 268 7.834 -8.602 10.795 1.00 55.01 H new ATOM 0 HZ1 LYS C 268 7.409 -9.398 13.313 1.00 4.22 H new ATOM 0 HZ2 LYS C 268 8.860 -8.708 12.765 1.00 4.22 H new ATOM 0 HZ3 LYS C 268 7.710 -7.746 13.562 1.00 4.22 H new ATOM 2914 N ILE D 306 5.123 -7.443 -12.202 1.00 53.13 N ATOM 2915 CA ILE D 306 4.035 -6.783 -11.514 1.00 62.03 C ATOM 2916 C ILE D 306 2.821 -7.718 -11.398 1.00 10.12 C ATOM 2917 O ILE D 306 2.862 -8.853 -11.882 1.00 42.12 O ATOM 2918 CB ILE D 306 3.630 -5.471 -12.233 1.00 22.43 C ATOM 2919 CG1 ILE D 306 3.222 -5.743 -13.699 1.00 11.33 C ATOM 2920 CG2 ILE D 306 4.760 -4.444 -12.150 1.00 11.05 C ATOM 2921 CD1 ILE D 306 2.808 -4.503 -14.471 1.00 34.43 C ATOM 0 HA ILE D 306 4.382 -6.530 -10.512 1.00 62.03 H new ATOM 0 HB ILE D 306 2.760 -5.056 -11.724 1.00 22.43 H new ATOM 0 HG12 ILE D 306 4.058 -6.216 -14.215 1.00 11.33 H new ATOM 0 HG13 ILE D 306 2.397 -6.455 -13.708 1.00 11.33 H new ATOM 0 HG21 ILE D 306 4.458 -3.529 -12.660 1.00 11.05 H new ATOM 0 HG22 ILE D 306 4.975 -4.223 -11.104 1.00 11.05 H new ATOM 0 HG23 ILE D 306 5.654 -4.847 -12.626 1.00 11.05 H new ATOM 0 HD11 ILE D 306 2.538 -4.782 -15.489 1.00 34.43 H new ATOM 0 HD12 ILE D 306 1.951 -4.039 -13.982 1.00 34.43 H new ATOM 0 HD13 ILE D 306 3.638 -3.796 -14.496 1.00 34.43 H new ATOM 2933 N TYR D 307 1.738 -7.227 -10.782 1.00 1.43 N ATOM 2934 CA TYR D 307 0.540 -8.036 -10.520 1.00 11.12 C ATOM 2935 C TYR D 307 0.044 -8.650 -11.811 1.00 42.21 C ATOM 2936 O TYR D 307 -0.236 -9.836 -11.881 1.00 12.15 O ATOM 2937 CB TYR D 307 -0.617 -7.178 -10.041 1.00 42.34 C ATOM 2938 CG TYR D 307 -0.325 -6.079 -9.106 1.00 70.40 C ATOM 2939 CD1 TYR D 307 -0.102 -6.316 -7.780 1.00 23.22 C ATOM 2940 CD2 TYR D 307 -0.367 -4.781 -9.550 1.00 51.04 C ATOM 2941 CE1 TYR D 307 0.077 -5.295 -6.913 1.00 34.41 C ATOM 2942 CE2 TYR D 307 -0.174 -3.746 -8.708 1.00 42.40 C ATOM 2943 CZ TYR D 307 0.042 -3.993 -7.387 1.00 14.40 C ATOM 2944 OH TYR D 307 0.187 -2.948 -6.542 1.00 53.45 O ATOM 0 H TYR D 307 1.667 -6.264 -10.453 1.00 1.43 H new ATOM 0 HA TYR D 307 0.826 -8.777 -9.773 1.00 11.12 H new ATOM 0 HB2 TYR D 307 -1.100 -6.749 -10.919 1.00 42.34 H new ATOM 0 HB3 TYR D 307 -1.345 -7.835 -9.566 1.00 42.34 H new ATOM 0 HD1 TYR D 307 -0.068 -7.333 -7.419 1.00 23.22 H new ATOM 0 HD2 TYR D 307 -0.558 -4.585 -10.595 1.00 51.04 H new ATOM 0 HE1 TYR D 307 0.245 -5.491 -5.864 1.00 34.41 H new ATOM 0 HE2 TYR D 307 -0.191 -2.731 -9.078 1.00 42.40 H new ATOM 0 HH TYR D 307 1.103 -2.933 -6.194 1.00 53.45 H new ATOM 2954 N THR D 308 -0.010 -7.800 -12.832 1.00 45.14 N ATOM 2955 CA THR D 308 -0.590 -8.105 -14.105 1.00 33.54 C ATOM 2956 C THR D 308 -2.107 -8.054 -13.964 1.00 2.41 C ATOM 2957 O THR D 308 -2.822 -9.059 -14.011 1.00 34.21 O ATOM 2958 CB THR D 308 -0.080 -9.440 -14.721 1.00 72.53 C ATOM 2959 OG1 THR D 308 1.367 -9.391 -14.779 1.00 72.04 O ATOM 2960 CG2 THR D 308 -0.628 -9.644 -16.139 1.00 23.43 C ATOM 0 H THR D 308 0.365 -6.853 -12.779 1.00 45.14 H new ATOM 0 HA THR D 308 -0.267 -7.353 -14.825 1.00 33.54 H new ATOM 0 HB THR D 308 -0.422 -10.268 -14.100 1.00 72.53 H new ATOM 0 HG1 THR D 308 1.730 -9.358 -13.869 1.00 72.04 H new ATOM 0 HG21 THR D 308 -0.254 -10.585 -16.542 1.00 23.43 H new ATOM 0 HG22 THR D 308 -1.717 -9.670 -16.108 1.00 23.43 H new ATOM 0 HG23 THR D 308 -0.303 -8.822 -16.776 1.00 23.43 H new ATOM 2968 N SER D 309 -2.569 -6.867 -13.687 1.00 32.10 N ATOM 2969 CA SER D 309 -3.948 -6.620 -13.519 1.00 5.22 C ATOM 2970 C SER D 309 -4.530 -6.170 -14.837 1.00 74.43 C ATOM 2971 O SER D 309 -3.794 -6.007 -15.814 1.00 63.23 O ATOM 2972 CB SER D 309 -4.147 -5.566 -12.426 1.00 25.23 C ATOM 2973 OG SER D 309 -3.424 -4.384 -12.726 1.00 4.54 O ATOM 0 H SER D 309 -1.980 -6.042 -13.573 1.00 32.10 H new ATOM 0 HA SER D 309 -4.465 -7.528 -13.207 1.00 5.22 H new ATOM 0 HB2 SER D 309 -5.207 -5.334 -12.328 1.00 25.23 H new ATOM 0 HB3 SER D 309 -3.818 -5.965 -11.466 1.00 25.23 H new ATOM 0 HG SER D 309 -3.567 -3.724 -12.016 1.00 4.54 H new ATOM 2979 N ASP D 310 -5.825 -6.007 -14.879 1.00 33.12 N ATOM 2980 CA ASP D 310 -6.519 -5.557 -16.073 1.00 73.32 C ATOM 2981 C ASP D 310 -6.001 -4.184 -16.448 1.00 61.53 C ATOM 2982 O ASP D 310 -5.449 -3.988 -17.530 1.00 42.15 O ATOM 2983 CB ASP D 310 -8.026 -5.515 -15.795 1.00 60.41 C ATOM 2984 CG ASP D 310 -8.565 -6.871 -15.386 1.00 55.24 C ATOM 2985 OD1 ASP D 310 -8.211 -7.359 -14.271 1.00 53.52 O ATOM 2986 OD2 ASP D 310 -9.348 -7.471 -16.149 1.00 30.13 O ATOM 0 H ASP D 310 -6.440 -6.182 -14.084 1.00 33.12 H new ATOM 0 HA ASP D 310 -6.340 -6.242 -16.902 1.00 73.32 H new ATOM 0 HB2 ASP D 310 -8.229 -4.791 -15.006 1.00 60.41 H new ATOM 0 HB3 ASP D 310 -8.550 -5.170 -16.687 1.00 60.41 H new ATOM 2991 N ASN D 311 -6.149 -3.258 -15.520 1.00 64.44 N ATOM 2992 CA ASN D 311 -5.652 -1.895 -15.626 1.00 62.12 C ATOM 2993 C ASN D 311 -6.090 -1.194 -14.357 1.00 22.31 C ATOM 2994 O ASN D 311 -6.995 -1.696 -13.671 1.00 0.31 O ATOM 2995 CB ASN D 311 -6.232 -1.179 -16.876 1.00 71.45 C ATOM 2996 CG ASN D 311 -5.622 0.190 -17.128 1.00 14.22 C ATOM 2997 OD1 ASN D 311 -6.112 1.193 -16.648 1.00 22.41 O ATOM 2998 ND2 ASN D 311 -4.536 0.229 -17.874 1.00 4.51 N ATOM 0 H ASN D 311 -6.635 -3.438 -14.641 1.00 64.44 H new ATOM 0 HA ASN D 311 -4.568 -1.881 -15.740 1.00 62.12 H new ATOM 0 HB2 ASN D 311 -6.070 -1.807 -17.752 1.00 71.45 H new ATOM 0 HB3 ASN D 311 -7.310 -1.071 -16.756 1.00 71.45 H new ATOM 0 HD21 ASN D 311 -4.080 1.121 -18.064 1.00 4.51 H new ATOM 0 HD22 ASN D 311 -4.152 -0.633 -18.261 1.00 4.51 H new ATOM 3124 N TYR D 321 -0.420 18.835 -0.688 1.00 22.11 N ATOM 3125 CA TYR D 321 -0.367 18.712 0.724 1.00 2.13 C ATOM 3126 C TYR D 321 0.867 19.514 1.117 1.00 73.22 C ATOM 3127 O TYR D 321 0.808 20.428 1.937 1.00 75.31 O ATOM 3128 CB TYR D 321 -0.198 17.248 1.095 1.00 44.10 C ATOM 3129 CG TYR D 321 -0.610 16.906 2.483 1.00 32.51 C ATOM 3130 CD1 TYR D 321 0.178 17.210 3.561 1.00 31.52 C ATOM 3131 CD2 TYR D 321 -1.794 16.238 2.691 1.00 30.55 C ATOM 3132 CE1 TYR D 321 -0.210 16.850 4.850 1.00 1.42 C ATOM 3133 CE2 TYR D 321 -2.206 15.875 3.952 1.00 43.30 C ATOM 3134 CZ TYR D 321 -1.413 16.178 5.035 1.00 74.32 C ATOM 3135 OH TYR D 321 -1.815 15.788 6.307 1.00 31.12 O ATOM 0 HA TYR D 321 -1.266 19.068 1.226 1.00 2.13 H new ATOM 0 HB2 TYR D 321 -0.778 16.642 0.399 1.00 44.10 H new ATOM 0 HB3 TYR D 321 0.848 16.972 0.963 1.00 44.10 H new ATOM 0 HD1 TYR D 321 1.110 17.734 3.410 1.00 31.52 H new ATOM 0 HD2 TYR D 321 -2.416 15.992 1.843 1.00 30.55 H new ATOM 0 HE1 TYR D 321 0.417 17.090 5.696 1.00 1.42 H new ATOM 0 HE2 TYR D 321 -3.143 15.357 4.091 1.00 43.30 H new ATOM 0 HH TYR D 321 -1.459 16.416 6.970 1.00 31.12 H new ATOM 3145 N ASP D 322 1.977 19.156 0.468 1.00 14.22 N ATOM 3146 CA ASP D 322 3.255 19.859 0.527 1.00 21.33 C ATOM 3147 C ASP D 322 4.173 19.098 -0.438 1.00 0.31 C ATOM 3148 O ASP D 322 3.706 18.124 -1.064 1.00 52.25 O ATOM 3149 CB ASP D 322 3.840 19.891 1.958 1.00 24.21 C ATOM 3150 CG ASP D 322 4.999 20.872 2.113 1.00 34.45 C ATOM 3151 OD1 ASP D 322 6.154 20.504 1.849 1.00 44.03 O ATOM 3152 OD2 ASP D 322 4.760 22.043 2.486 1.00 30.40 O ATOM 0 H ASP D 322 2.009 18.335 -0.137 1.00 14.22 H new ATOM 0 HA ASP D 322 3.144 20.907 0.247 1.00 21.33 H new ATOM 0 HB2 ASP D 322 3.050 20.158 2.660 1.00 24.21 H new ATOM 0 HB3 ASP D 322 4.181 18.891 2.227 1.00 24.21 H new ATOM 3157 N SER D 323 5.421 19.470 -0.558 1.00 60.02 N ATOM 3158 CA SER D 323 6.293 18.855 -1.528 1.00 63.34 C ATOM 3159 C SER D 323 7.608 18.350 -0.910 1.00 10.32 C ATOM 3160 O SER D 323 8.232 19.028 -0.086 1.00 41.04 O ATOM 3161 CB SER D 323 6.540 19.822 -2.686 1.00 11.11 C ATOM 3162 OG SER D 323 6.955 21.096 -2.210 1.00 5.21 O ATOM 0 H SER D 323 5.859 20.199 0.006 1.00 60.02 H new ATOM 0 HA SER D 323 5.792 17.967 -1.913 1.00 63.34 H new ATOM 0 HB2 SER D 323 7.302 19.413 -3.349 1.00 11.11 H new ATOM 0 HB3 SER D 323 5.629 19.929 -3.275 1.00 11.11 H new ATOM 0 HG SER D 323 7.108 21.695 -2.970 1.00 5.21 H new ATOM 3168 N MET D 324 8.000 17.148 -1.303 1.00 11.42 N ATOM 3169 CA MET D 324 9.224 16.498 -0.848 1.00 51.20 C ATOM 3170 C MET D 324 9.485 15.317 -1.750 1.00 11.13 C ATOM 3171 O MET D 324 8.565 14.542 -2.017 1.00 54.24 O ATOM 3172 CB MET D 324 9.078 16.017 0.604 1.00 24.24 C ATOM 3173 CG MET D 324 10.277 15.272 1.166 1.00 14.12 C ATOM 3174 SD MET D 324 11.756 16.283 1.261 1.00 34.44 S ATOM 3175 CE MET D 324 12.900 15.091 1.960 1.00 54.54 C ATOM 0 H MET D 324 7.465 16.583 -1.962 1.00 11.42 H new ATOM 0 HA MET D 324 10.052 17.206 -0.886 1.00 51.20 H new ATOM 0 HB2 MET D 324 8.879 16.882 1.237 1.00 24.24 H new ATOM 0 HB3 MET D 324 8.205 15.367 0.668 1.00 24.24 H new ATOM 0 HG2 MET D 324 10.033 14.902 2.162 1.00 14.12 H new ATOM 0 HG3 MET D 324 10.480 14.401 0.543 1.00 14.12 H new ATOM 0 HE1 MET D 324 13.878 15.556 2.087 1.00 54.54 H new ATOM 0 HE2 MET D 324 12.529 14.755 2.928 1.00 54.54 H new ATOM 0 HE3 MET D 324 12.989 14.236 1.290 1.00 54.54 H new ATOM 3185 N LYS D 325 10.701 15.196 -2.230 1.00 73.12 N ATOM 3186 CA LYS D 325 11.073 14.110 -3.125 1.00 23.44 C ATOM 3187 C LYS D 325 12.385 13.475 -2.693 1.00 41.53 C ATOM 3188 O LYS D 325 13.214 14.132 -2.037 1.00 5.44 O ATOM 3189 CB LYS D 325 11.207 14.610 -4.572 1.00 2.34 C ATOM 3190 CG LYS D 325 9.920 15.123 -5.196 1.00 33.22 C ATOM 3191 CD LYS D 325 10.179 15.642 -6.597 1.00 14.35 C ATOM 3192 CE LYS D 325 8.905 16.124 -7.263 1.00 35.21 C ATOM 3193 NZ LYS D 325 9.159 16.667 -8.611 1.00 62.34 N ATOM 0 H LYS D 325 11.461 15.841 -2.016 1.00 73.12 H new ATOM 0 HA LYS D 325 10.280 13.364 -3.076 1.00 23.44 H new ATOM 0 HB2 LYS D 325 11.949 15.408 -4.597 1.00 2.34 H new ATOM 0 HB3 LYS D 325 11.592 13.797 -5.187 1.00 2.34 H new ATOM 0 HG2 LYS D 325 9.181 14.323 -5.229 1.00 33.22 H new ATOM 0 HG3 LYS D 325 9.501 15.918 -4.579 1.00 33.22 H new ATOM 0 HD2 LYS D 325 10.899 16.459 -6.555 1.00 14.35 H new ATOM 0 HD3 LYS D 325 10.628 14.853 -7.200 1.00 14.35 H new ATOM 0 HE2 LYS D 325 8.197 15.298 -7.332 1.00 35.21 H new ATOM 0 HE3 LYS D 325 8.440 16.892 -6.644 1.00 35.21 H new ATOM 0 HZ1 LYS D 325 8.263 16.985 -9.032 1.00 62.34 H new ATOM 0 HZ2 LYS D 325 9.815 17.471 -8.543 1.00 62.34 H new ATOM 0 HZ3 LYS D 325 9.579 15.928 -9.210 1.00 62.34 H new ATOM 3207 N GLU D 326 12.561 12.203 -3.086 1.00 53.03 N ATOM 3208 CA GLU D 326 13.759 11.371 -2.808 1.00 22.42 C ATOM 3209 C GLU D 326 13.898 11.014 -1.315 1.00 42.35 C ATOM 3210 O GLU D 326 13.809 11.886 -0.444 1.00 43.43 O ATOM 3211 CB GLU D 326 15.064 12.019 -3.320 1.00 11.14 C ATOM 3212 CG GLU D 326 15.095 12.319 -4.814 1.00 62.11 C ATOM 3213 CD GLU D 326 14.811 11.111 -5.672 1.00 33.42 C ATOM 3214 OE1 GLU D 326 15.599 10.162 -5.672 1.00 13.14 O ATOM 3215 OE2 GLU D 326 13.772 11.093 -6.358 1.00 15.40 O ATOM 0 H GLU D 326 11.854 11.702 -3.624 1.00 53.03 H new ATOM 0 HA GLU D 326 13.600 10.447 -3.364 1.00 22.42 H new ATOM 0 HB2 GLU D 326 15.228 12.949 -2.775 1.00 11.14 H new ATOM 0 HB3 GLU D 326 15.897 11.359 -3.081 1.00 11.14 H new ATOM 0 HG2 GLU D 326 14.362 13.095 -5.037 1.00 62.11 H new ATOM 0 HG3 GLU D 326 16.074 12.720 -5.077 1.00 62.11 H new ATOM 3222 N PRO D 327 14.123 9.723 -0.996 1.00 1.12 N ATOM 3223 CA PRO D 327 14.303 9.283 0.386 1.00 25.54 C ATOM 3224 C PRO D 327 15.643 9.728 0.964 1.00 71.53 C ATOM 3225 O PRO D 327 16.572 10.115 0.227 1.00 23.04 O ATOM 3226 CB PRO D 327 14.287 7.761 0.272 1.00 34.42 C ATOM 3227 CG PRO D 327 14.782 7.493 -1.099 1.00 35.14 C ATOM 3228 CD PRO D 327 14.202 8.578 -1.940 1.00 34.14 C ATOM 0 HA PRO D 327 13.539 9.698 1.044 1.00 25.54 H new ATOM 0 HB2 PRO D 327 14.927 7.299 1.024 1.00 34.42 H new ATOM 0 HB3 PRO D 327 13.283 7.361 0.418 1.00 34.42 H new ATOM 0 HG2 PRO D 327 15.871 7.506 -1.134 1.00 35.14 H new ATOM 0 HG3 PRO D 327 14.464 6.511 -1.448 1.00 35.14 H new ATOM 0 HD2 PRO D 327 14.834 8.805 -2.799 1.00 34.14 H new ATOM 0 HD3 PRO D 327 13.221 8.307 -2.329 1.00 34.14 H new