USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 943 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 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 48 GLN : amide:sc= -0.2 X(o=-0.2,f=-0.66) USER MOD Set 2.1: A 33 ASN : amide:sc= -0.0369 X(o=-0.037,f=-0.34) USER MOD Set 2.2: A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0.0105 USER MOD Single : A 17 HIS : no HD1:sc= -0.328 X(o=-0.33,f=-0.031) USER MOD Single : A 22 ASN : amide:sc= -4.22! C(o=-4.2!,f=-7.9!) USER MOD Single : A 24 LYS NZ :NH3+ 166:sc= -0.0163 (180deg=-0.19) USER MOD Single : A 25 HIS : no HD1:sc= -0.0641 X(o=-0.064,f=-0.057) USER MOD Single : A 30 ASN : amide:sc= 0.171 X(o=0.17,f=-0.28) USER MOD Single : A 31 THR OG1 : rot 48:sc= -0.119 USER MOD Single : A 37 GLN : amide:sc= -1.28 K(o=-1.3,f=-3.1!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ -169:sc= 1.17 (180deg=1.14) USER MOD Single : A 56 LYS NZ :NH3+ 166:sc= 1.07 (180deg=0.601) USER MOD Single : A 59 GLN : amide:sc= -0.402 X(o=-0.4,f=-0.28) USER MOD Single : A 61 TYR OH : rot -130:sc= -3.55! USER MOD Single : A 64 LYS NZ :NH3+ 167:sc= -0.0232 (180deg=-0.197) USER MOD Single : A 67 ASN :FLIP amide:sc=-0.00327 F(o=-0.55,f=-0.0033) USER MOD Single : C 216 SER OG : rot 180:sc= 0.00397 USER MOD Single : C 217 HIS : no HD1:sc= -0.414 X(o=-0.41,f=-0.074) USER MOD Single : C 222 ASN : amide:sc= -0.768 K(o=-0.77,f=-3.4!) USER MOD Single : C 224 LYS NZ :NH3+ 167:sc= -0.0271 (180deg=-0.267) USER MOD Single : C 225 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : C 227 LYS NZ :NH3+ 140:sc= -0.5 (180deg=-2.18!) USER MOD Single : C 230 ASN : amide:sc= 0.833 K(o=0.83,f=-4.7!) USER MOD Single : C 231 THR OG1 : rot 69:sc= 0.515 USER MOD Single : C 233 ASN : amide:sc= 0.443 K(o=0.44,f=-5.2!) USER MOD Single : C 234 CYS SG : rot 4:sc=0.000453 USER MOD Single : C 237 GLN : amide:sc= -1.97 K(o=-2,f=-3.5!) USER MOD Single : C 243 LYS NZ :NH3+ -149:sc= 0.0112 (180deg=0) USER MOD Single : C 248 GLN : amide:sc= -1.15 K(o=-1.2,f=-4.3!) USER MOD Single : C 254 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 256 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 259 GLN :FLIP amide:sc= 0.0232 F(o=-1.6!,f=0.023) USER MOD Single : C 261 TYR OH : rot 37:sc= -3.4! USER MOD Single : C 264 LYS NZ :NH3+ 166:sc= -0.0154 (180deg=-0.192) USER MOD Single : C 267 ASN :FLIP amide:sc= -0.0036 F(o=-0.6,f=-0.0036) USER MOD Single : C 268 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.121) USER MOD ----------------------------------------------------------------- ATOM 163 N CYS A 11 0.073 0.862 -13.795 1.00 33.52 N ATOM 164 CA CYS A 11 -1.098 1.682 -13.978 1.00 24.13 C ATOM 165 C CYS A 11 -0.850 3.178 -13.902 1.00 14.25 C ATOM 166 O CYS A 11 -0.778 3.739 -12.822 1.00 65.11 O ATOM 167 CB CYS A 11 -2.210 1.262 -13.042 1.00 45.13 C ATOM 168 SG CYS A 11 -2.840 -0.430 -13.328 1.00 12.55 S ATOM 0 HA CYS A 11 -1.409 1.503 -15.007 1.00 24.13 H new ATOM 0 HB2 CYS A 11 -1.851 1.334 -12.015 1.00 45.13 H new ATOM 0 HB3 CYS A 11 -3.037 1.966 -13.141 1.00 45.13 H new ATOM 173 N ARG A 12 -0.698 3.827 -15.033 1.00 53.42 N ATOM 174 CA ARG A 12 -0.618 5.281 -15.016 1.00 61.44 C ATOM 175 C ARG A 12 -1.998 5.865 -15.232 1.00 21.54 C ATOM 176 O ARG A 12 -2.257 7.034 -14.945 1.00 50.24 O ATOM 177 CB ARG A 12 0.403 5.843 -15.998 1.00 52.04 C ATOM 178 CG ARG A 12 1.840 5.466 -15.663 1.00 12.51 C ATOM 179 CD ARG A 12 2.816 6.145 -16.598 1.00 13.35 C ATOM 180 NE ARG A 12 2.575 5.806 -18.006 1.00 43.32 N ATOM 181 CZ ARG A 12 3.092 6.478 -19.040 1.00 0.34 C ATOM 182 NH1 ARG A 12 3.877 7.530 -18.822 1.00 33.54 N ATOM 183 NH2 ARG A 12 2.822 6.102 -20.285 1.00 24.10 N ATOM 0 H ARG A 12 -0.628 3.394 -15.954 1.00 53.42 H new ATOM 0 HA ARG A 12 -0.253 5.581 -14.034 1.00 61.44 H new ATOM 0 HB2 ARG A 12 0.166 5.486 -17.000 1.00 52.04 H new ATOM 0 HB3 ARG A 12 0.316 6.929 -16.018 1.00 52.04 H new ATOM 0 HG2 ARG A 12 2.062 5.748 -14.634 1.00 12.51 H new ATOM 0 HG3 ARG A 12 1.960 4.385 -15.730 1.00 12.51 H new ATOM 0 HD2 ARG A 12 2.745 7.225 -16.470 1.00 13.35 H new ATOM 0 HD3 ARG A 12 3.832 5.859 -16.328 1.00 13.35 H new ATOM 0 HE ARG A 12 1.975 5.007 -18.208 1.00 43.32 H new ATOM 0 HH11 ARG A 12 4.084 7.823 -17.867 1.00 33.54 H new ATOM 0 HH12 ARG A 12 4.272 8.044 -19.610 1.00 33.54 H new ATOM 0 HH21 ARG A 12 2.218 5.298 -20.455 1.00 24.10 H new ATOM 0 HH22 ARG A 12 3.218 6.618 -21.071 1.00 24.10 H new ATOM 197 N PHE A 13 -2.881 5.027 -15.729 1.00 21.32 N ATOM 198 CA PHE A 13 -4.276 5.351 -15.870 1.00 54.33 C ATOM 199 C PHE A 13 -4.972 4.763 -14.665 1.00 12.32 C ATOM 200 O PHE A 13 -4.627 3.649 -14.233 1.00 22.42 O ATOM 201 CB PHE A 13 -4.838 4.789 -17.184 1.00 2.05 C ATOM 202 CG PHE A 13 -4.239 5.427 -18.422 1.00 62.14 C ATOM 203 CD1 PHE A 13 -3.018 5.003 -18.925 1.00 12.45 C ATOM 204 CD2 PHE A 13 -4.898 6.457 -19.071 1.00 63.42 C ATOM 205 CE1 PHE A 13 -2.471 5.589 -20.047 1.00 51.30 C ATOM 206 CE2 PHE A 13 -4.355 7.047 -20.195 1.00 70.30 C ATOM 207 CZ PHE A 13 -3.139 6.614 -20.682 1.00 72.00 C ATOM 0 H PHE A 13 -2.643 4.089 -16.050 1.00 21.32 H new ATOM 0 HA PHE A 13 -4.433 6.429 -15.914 1.00 54.33 H new ATOM 0 HB2 PHE A 13 -4.658 3.714 -17.216 1.00 2.05 H new ATOM 0 HB3 PHE A 13 -5.918 4.932 -17.198 1.00 2.05 H new ATOM 0 HD1 PHE A 13 -2.488 4.202 -18.431 1.00 12.45 H new ATOM 0 HD2 PHE A 13 -5.849 6.803 -18.693 1.00 63.42 H new ATOM 0 HE1 PHE A 13 -1.521 5.245 -20.428 1.00 51.30 H new ATOM 0 HE2 PHE A 13 -4.882 7.847 -20.693 1.00 70.30 H new ATOM 0 HZ PHE A 13 -2.711 7.077 -21.559 1.00 72.00 H new ATOM 217 N PHE A 14 -5.925 5.474 -14.118 1.00 62.43 N ATOM 218 CA PHE A 14 -6.461 5.098 -12.826 1.00 75.55 C ATOM 219 C PHE A 14 -7.987 5.040 -12.815 1.00 52.32 C ATOM 220 O PHE A 14 -8.657 5.711 -13.608 1.00 30.12 O ATOM 221 CB PHE A 14 -5.967 6.071 -11.743 1.00 61.52 C ATOM 222 CG PHE A 14 -6.706 7.385 -11.669 1.00 43.05 C ATOM 223 CD1 PHE A 14 -6.434 8.431 -12.535 1.00 4.10 C ATOM 224 CD2 PHE A 14 -7.692 7.553 -10.713 1.00 70.32 C ATOM 225 CE1 PHE A 14 -7.138 9.620 -12.438 1.00 61.41 C ATOM 226 CE2 PHE A 14 -8.395 8.718 -10.606 1.00 71.33 C ATOM 227 CZ PHE A 14 -8.124 9.763 -11.470 1.00 1.23 C ATOM 0 H PHE A 14 -6.344 6.305 -14.536 1.00 62.43 H new ATOM 0 HA PHE A 14 -6.099 4.092 -12.614 1.00 75.55 H new ATOM 0 HB2 PHE A 14 -6.040 5.577 -10.774 1.00 61.52 H new ATOM 0 HB3 PHE A 14 -4.911 6.277 -11.917 1.00 61.52 H new ATOM 0 HD1 PHE A 14 -5.669 8.319 -13.290 1.00 4.10 H new ATOM 0 HD2 PHE A 14 -7.911 6.742 -10.034 1.00 70.32 H new ATOM 0 HE1 PHE A 14 -6.921 10.434 -13.114 1.00 61.41 H new ATOM 0 HE2 PHE A 14 -9.159 8.823 -9.850 1.00 71.33 H new ATOM 0 HZ PHE A 14 -8.677 10.687 -11.392 1.00 1.23 H new ATOM 237 N GLU A 15 -8.520 4.226 -11.937 1.00 32.10 N ATOM 238 CA GLU A 15 -9.945 4.112 -11.732 1.00 52.41 C ATOM 239 C GLU A 15 -10.396 5.240 -10.803 1.00 52.23 C ATOM 240 O GLU A 15 -9.790 5.469 -9.758 1.00 31.53 O ATOM 241 CB GLU A 15 -10.262 2.746 -11.114 1.00 33.02 C ATOM 242 CG GLU A 15 -11.717 2.541 -10.719 1.00 51.35 C ATOM 243 CD GLU A 15 -12.678 2.654 -11.861 1.00 3.20 C ATOM 244 OE1 GLU A 15 -13.130 3.785 -12.157 1.00 14.54 O ATOM 245 OE2 GLU A 15 -13.019 1.618 -12.459 1.00 24.52 O ATOM 0 H GLU A 15 -7.968 3.614 -11.335 1.00 32.10 H new ATOM 0 HA GLU A 15 -10.475 4.194 -12.681 1.00 52.41 H new ATOM 0 HB2 GLU A 15 -9.981 1.969 -11.825 1.00 33.02 H new ATOM 0 HB3 GLU A 15 -9.639 2.610 -10.230 1.00 33.02 H new ATOM 0 HG2 GLU A 15 -11.824 1.557 -10.263 1.00 51.35 H new ATOM 0 HG3 GLU A 15 -11.984 3.275 -9.959 1.00 51.35 H new ATOM 252 N SER A 16 -11.438 5.930 -11.182 1.00 34.33 N ATOM 253 CA SER A 16 -11.913 7.054 -10.422 1.00 53.55 C ATOM 254 C SER A 16 -13.060 6.684 -9.481 1.00 35.25 C ATOM 255 O SER A 16 -13.363 7.424 -8.546 1.00 62.53 O ATOM 256 CB SER A 16 -12.302 8.183 -11.371 1.00 71.33 C ATOM 257 OG SER A 16 -13.167 7.709 -12.399 1.00 23.54 O ATOM 0 H SER A 16 -11.979 5.730 -12.023 1.00 34.33 H new ATOM 0 HA SER A 16 -11.102 7.395 -9.778 1.00 53.55 H new ATOM 0 HB2 SER A 16 -12.796 8.978 -10.813 1.00 71.33 H new ATOM 0 HB3 SER A 16 -11.405 8.615 -11.815 1.00 71.33 H new ATOM 0 HG SER A 16 -13.405 8.450 -12.994 1.00 23.54 H new ATOM 263 N HIS A 17 -13.675 5.528 -9.705 1.00 13.14 N ATOM 264 CA HIS A 17 -14.808 5.075 -8.882 1.00 62.00 C ATOM 265 C HIS A 17 -14.266 4.350 -7.637 1.00 33.31 C ATOM 266 O HIS A 17 -14.689 3.248 -7.297 1.00 74.51 O ATOM 267 CB HIS A 17 -15.706 4.132 -9.728 1.00 13.25 C ATOM 268 CG HIS A 17 -17.059 3.780 -9.121 1.00 63.44 C ATOM 269 ND1 HIS A 17 -18.214 4.447 -9.443 1.00 23.34 N ATOM 270 CD2 HIS A 17 -17.431 2.817 -8.239 1.00 31.43 C ATOM 271 CE1 HIS A 17 -19.226 3.923 -8.794 1.00 32.34 C ATOM 272 NE2 HIS A 17 -18.782 2.934 -8.056 1.00 42.51 N ATOM 0 H HIS A 17 -13.413 4.881 -10.449 1.00 13.14 H new ATOM 0 HA HIS A 17 -15.408 5.925 -8.556 1.00 62.00 H new ATOM 0 HB2 HIS A 17 -15.875 4.598 -10.699 1.00 13.25 H new ATOM 0 HB3 HIS A 17 -15.159 3.207 -9.909 1.00 13.25 H new ATOM 0 HD2 HIS A 17 -16.781 2.093 -7.769 1.00 31.43 H new ATOM 0 HE1 HIS A 17 -20.253 4.251 -8.857 1.00 32.34 H new ATOM 0 HE2 HIS A 17 -19.351 2.348 -7.445 1.00 42.51 H new ATOM 281 N VAL A 18 -13.341 4.978 -6.949 1.00 43.32 N ATOM 282 CA VAL A 18 -12.731 4.352 -5.801 1.00 44.32 C ATOM 283 C VAL A 18 -12.858 5.231 -4.570 1.00 50.10 C ATOM 284 O VAL A 18 -12.288 6.333 -4.506 1.00 41.31 O ATOM 285 CB VAL A 18 -11.246 3.995 -6.058 1.00 54.24 C ATOM 286 CG1 VAL A 18 -10.682 3.183 -4.914 1.00 13.00 C ATOM 287 CG2 VAL A 18 -11.137 3.229 -7.350 1.00 2.53 C ATOM 0 H VAL A 18 -12.997 5.914 -7.162 1.00 43.32 H new ATOM 0 HA VAL A 18 -13.269 3.421 -5.622 1.00 44.32 H new ATOM 0 HB VAL A 18 -10.666 4.915 -6.131 1.00 54.24 H new ATOM 0 HG11 VAL A 18 -9.638 2.944 -5.117 1.00 13.00 H new ATOM 0 HG12 VAL A 18 -10.750 3.759 -3.991 1.00 13.00 H new ATOM 0 HG13 VAL A 18 -11.251 2.260 -4.808 1.00 13.00 H new ATOM 0 HG21 VAL A 18 -10.093 2.975 -7.536 1.00 2.53 H new ATOM 0 HG22 VAL A 18 -11.726 2.315 -7.282 1.00 2.53 H new ATOM 0 HG23 VAL A 18 -11.513 3.842 -8.169 1.00 2.53 H new ATOM 297 N ALA A 19 -13.630 4.758 -3.626 1.00 41.22 N ATOM 298 CA ALA A 19 -13.861 5.434 -2.375 1.00 61.15 C ATOM 299 C ALA A 19 -13.201 4.648 -1.261 1.00 65.44 C ATOM 300 O ALA A 19 -13.165 3.414 -1.313 1.00 31.01 O ATOM 301 CB ALA A 19 -15.359 5.515 -2.118 1.00 35.43 C ATOM 0 H ALA A 19 -14.127 3.871 -3.707 1.00 41.22 H new ATOM 0 HA ALA A 19 -13.443 6.440 -2.414 1.00 61.15 H new ATOM 0 HB1 ALA A 19 -15.539 6.026 -1.172 1.00 35.43 H new ATOM 0 HB2 ALA A 19 -15.837 6.068 -2.926 1.00 35.43 H new ATOM 0 HB3 ALA A 19 -15.775 4.509 -2.072 1.00 35.43 H new ATOM 307 N ARG A 20 -12.698 5.335 -0.243 1.00 62.21 N ATOM 308 CA ARG A 20 -12.052 4.655 0.887 1.00 71.21 C ATOM 309 C ARG A 20 -13.062 3.830 1.667 1.00 11.33 C ATOM 310 O ARG A 20 -12.727 2.832 2.298 1.00 34.24 O ATOM 311 CB ARG A 20 -11.348 5.637 1.822 1.00 23.14 C ATOM 312 CG ARG A 20 -10.660 4.931 2.971 1.00 12.20 C ATOM 313 CD ARG A 20 -9.885 5.855 3.859 1.00 11.05 C ATOM 314 NE ARG A 20 -9.312 5.091 4.976 1.00 24.23 N ATOM 315 CZ ARG A 20 -8.294 5.460 5.745 1.00 32.11 C ATOM 316 NH1 ARG A 20 -7.749 6.666 5.615 1.00 14.31 N ATOM 317 NH2 ARG A 20 -7.841 4.618 6.658 1.00 63.40 N ATOM 0 H ARG A 20 -12.721 6.352 -0.171 1.00 62.21 H new ATOM 0 HA ARG A 20 -11.294 3.993 0.468 1.00 71.21 H new ATOM 0 HB2 ARG A 20 -10.614 6.212 1.258 1.00 23.14 H new ATOM 0 HB3 ARG A 20 -12.075 6.347 2.216 1.00 23.14 H new ATOM 0 HG2 ARG A 20 -11.408 4.409 3.567 1.00 12.20 H new ATOM 0 HG3 ARG A 20 -9.986 4.173 2.571 1.00 12.20 H new ATOM 0 HD2 ARG A 20 -9.092 6.342 3.292 1.00 11.05 H new ATOM 0 HD3 ARG A 20 -10.535 6.643 4.239 1.00 11.05 H new ATOM 0 HE ARG A 20 -9.739 4.187 5.181 1.00 24.23 H new ATOM 0 HH11 ARG A 20 -8.113 7.318 4.920 1.00 14.31 H new ATOM 0 HH12 ARG A 20 -6.967 6.939 6.211 1.00 14.31 H new ATOM 0 HH21 ARG A 20 -8.273 3.700 6.764 1.00 63.40 H new ATOM 0 HH22 ARG A 20 -7.060 4.886 7.256 1.00 63.40 H new ATOM 331 N ALA A 21 -14.305 4.242 1.588 1.00 13.11 N ATOM 332 CA ALA A 21 -15.393 3.545 2.240 1.00 31.20 C ATOM 333 C ALA A 21 -15.646 2.185 1.579 1.00 21.21 C ATOM 334 O ALA A 21 -16.395 1.365 2.100 1.00 5.45 O ATOM 335 CB ALA A 21 -16.655 4.395 2.208 1.00 4.33 C ATOM 0 H ALA A 21 -14.593 5.072 1.069 1.00 13.11 H new ATOM 0 HA ALA A 21 -15.114 3.369 3.279 1.00 31.20 H new ATOM 0 HB1 ALA A 21 -17.467 3.860 2.701 1.00 4.33 H new ATOM 0 HB2 ALA A 21 -16.473 5.336 2.726 1.00 4.33 H new ATOM 0 HB3 ALA A 21 -16.931 4.598 1.173 1.00 4.33 H new ATOM 341 N ASN A 22 -15.033 1.963 0.421 1.00 20.25 N ATOM 342 CA ASN A 22 -15.195 0.756 -0.307 1.00 13.44 C ATOM 343 C ASN A 22 -13.865 -0.023 -0.252 1.00 74.42 C ATOM 344 O ASN A 22 -13.853 -1.257 -0.129 1.00 51.41 O ATOM 345 CB ASN A 22 -15.520 1.128 -1.749 1.00 41.22 C ATOM 346 CG ASN A 22 -16.042 -0.008 -2.591 1.00 23.14 C ATOM 347 OD1 ASN A 22 -15.790 -1.189 -2.337 1.00 1.33 O ATOM 348 ND2 ASN A 22 -16.737 0.342 -3.628 1.00 53.44 N ATOM 0 H ASN A 22 -14.409 2.636 -0.024 1.00 20.25 H new ATOM 0 HA ASN A 22 -15.993 0.140 0.108 1.00 13.44 H new ATOM 0 HB2 ASN A 22 -16.259 1.929 -1.745 1.00 41.22 H new ATOM 0 HB3 ASN A 22 -14.621 1.527 -2.218 1.00 41.22 H new ATOM 0 HD21 ASN A 22 -17.095 -0.369 -4.266 1.00 53.44 H new ATOM 0 HD22 ASN A 22 -16.926 1.328 -3.806 1.00 53.44 H new ATOM 355 N VAL A 23 -12.742 0.724 -0.330 1.00 63.31 N ATOM 356 CA VAL A 23 -11.391 0.144 -0.310 1.00 40.03 C ATOM 357 C VAL A 23 -11.089 -0.648 0.962 1.00 72.24 C ATOM 358 O VAL A 23 -11.252 -0.166 2.092 1.00 63.31 O ATOM 359 CB VAL A 23 -10.263 1.197 -0.590 1.00 75.41 C ATOM 360 CG1 VAL A 23 -8.889 0.584 -0.502 1.00 53.24 C ATOM 361 CG2 VAL A 23 -10.446 1.775 -1.943 1.00 64.33 C ATOM 0 H VAL A 23 -12.751 1.741 -0.408 1.00 63.31 H new ATOM 0 HA VAL A 23 -11.388 -0.565 -1.138 1.00 40.03 H new ATOM 0 HB VAL A 23 -10.341 1.973 0.172 1.00 75.41 H new ATOM 0 HG11 VAL A 23 -8.137 1.347 -0.702 1.00 53.24 H new ATOM 0 HG12 VAL A 23 -8.736 0.177 0.497 1.00 53.24 H new ATOM 0 HG13 VAL A 23 -8.800 -0.216 -1.237 1.00 53.24 H new ATOM 0 HG21 VAL A 23 -9.661 2.506 -2.135 1.00 64.33 H new ATOM 0 HG22 VAL A 23 -10.393 0.981 -2.688 1.00 64.33 H new ATOM 0 HG23 VAL A 23 -11.419 2.263 -2.002 1.00 64.33 H new ATOM 371 N LYS A 24 -10.668 -1.869 0.736 1.00 3.05 N ATOM 372 CA LYS A 24 -10.289 -2.806 1.764 1.00 62.40 C ATOM 373 C LYS A 24 -8.832 -2.563 2.129 1.00 54.34 C ATOM 374 O LYS A 24 -8.440 -2.606 3.299 1.00 40.31 O ATOM 375 CB LYS A 24 -10.372 -4.198 1.177 1.00 54.43 C ATOM 376 CG LYS A 24 -11.684 -4.549 0.544 1.00 14.12 C ATOM 377 CD LYS A 24 -11.569 -5.873 -0.183 1.00 5.33 C ATOM 378 CE LYS A 24 -11.386 -7.044 0.771 1.00 42.03 C ATOM 379 NZ LYS A 24 -12.564 -7.237 1.652 1.00 71.30 N ATOM 0 H LYS A 24 -10.577 -2.251 -0.205 1.00 3.05 H new ATOM 0 HA LYS A 24 -10.936 -2.694 2.634 1.00 62.40 H new ATOM 0 HB2 LYS A 24 -9.586 -4.307 0.430 1.00 54.43 H new ATOM 0 HB3 LYS A 24 -10.163 -4.920 1.966 1.00 54.43 H new ATOM 0 HG2 LYS A 24 -12.461 -4.609 1.306 1.00 14.12 H new ATOM 0 HG3 LYS A 24 -11.982 -3.766 -0.153 1.00 14.12 H new ATOM 0 HD2 LYS A 24 -12.464 -6.034 -0.784 1.00 5.33 H new ATOM 0 HD3 LYS A 24 -10.725 -5.834 -0.872 1.00 5.33 H new ATOM 0 HE2 LYS A 24 -11.210 -7.954 0.197 1.00 42.03 H new ATOM 0 HE3 LYS A 24 -10.500 -6.877 1.383 1.00 42.03 H new ATOM 0 HZ1 LYS A 24 -12.505 -8.168 2.112 1.00 71.30 H new ATOM 0 HZ2 LYS A 24 -12.580 -6.493 2.378 1.00 71.30 H new ATOM 0 HZ3 LYS A 24 -13.434 -7.186 1.085 1.00 71.30 H new ATOM 393 N HIS A 25 -8.019 -2.357 1.093 1.00 32.42 N ATOM 394 CA HIS A 25 -6.588 -2.114 1.255 1.00 63.42 C ATOM 395 C HIS A 25 -5.977 -1.515 -0.018 1.00 61.12 C ATOM 396 O HIS A 25 -6.528 -1.688 -1.122 1.00 51.41 O ATOM 397 CB HIS A 25 -5.831 -3.409 1.680 1.00 10.33 C ATOM 398 CG HIS A 25 -5.931 -4.553 0.721 1.00 51.32 C ATOM 399 ND1 HIS A 25 -6.839 -5.571 0.865 1.00 3.03 N ATOM 400 CD2 HIS A 25 -5.225 -4.840 -0.392 1.00 63.23 C ATOM 401 CE1 HIS A 25 -6.693 -6.427 -0.115 1.00 30.00 C ATOM 402 NE2 HIS A 25 -5.721 -6.013 -0.898 1.00 74.42 N ATOM 0 H HIS A 25 -8.333 -2.354 0.123 1.00 32.42 H new ATOM 0 HA HIS A 25 -6.473 -1.386 2.058 1.00 63.42 H new ATOM 0 HB2 HIS A 25 -4.778 -3.165 1.820 1.00 10.33 H new ATOM 0 HB3 HIS A 25 -6.214 -3.733 2.648 1.00 10.33 H new ATOM 0 HD2 HIS A 25 -4.418 -4.254 -0.807 1.00 63.23 H new ATOM 0 HE1 HIS A 25 -7.275 -7.325 -0.257 1.00 30.00 H new ATOM 0 HE2 HIS A 25 -5.392 -6.485 -1.740 1.00 74.42 H new ATOM 411 N LEU A 26 -4.839 -0.869 0.148 1.00 23.33 N ATOM 412 CA LEU A 26 -4.097 -0.194 -0.919 1.00 44.55 C ATOM 413 C LEU A 26 -2.780 -0.895 -1.156 1.00 30.04 C ATOM 414 O LEU A 26 -2.258 -1.541 -0.272 1.00 5.22 O ATOM 415 CB LEU A 26 -3.775 1.258 -0.526 1.00 72.55 C ATOM 416 CG LEU A 26 -4.927 2.204 -0.305 1.00 71.15 C ATOM 417 CD1 LEU A 26 -4.391 3.564 0.019 1.00 5.12 C ATOM 418 CD2 LEU A 26 -5.791 2.300 -1.521 1.00 25.44 C ATOM 0 H LEU A 26 -4.384 -0.792 1.057 1.00 23.33 H new ATOM 0 HA LEU A 26 -4.719 -0.214 -1.814 1.00 44.55 H new ATOM 0 HB2 LEU A 26 -3.184 1.233 0.389 1.00 72.55 H new ATOM 0 HB3 LEU A 26 -3.140 1.681 -1.304 1.00 72.55 H new ATOM 0 HG LEU A 26 -5.530 1.822 0.519 1.00 71.15 H new ATOM 0 HD11 LEU A 26 -5.220 4.253 0.180 1.00 5.12 H new ATOM 0 HD12 LEU A 26 -3.784 3.510 0.922 1.00 5.12 H new ATOM 0 HD13 LEU A 26 -3.779 3.921 -0.809 1.00 5.12 H new ATOM 0 HD21 LEU A 26 -6.613 2.990 -1.330 1.00 25.44 H new ATOM 0 HD22 LEU A 26 -5.199 2.665 -2.360 1.00 25.44 H new ATOM 0 HD23 LEU A 26 -6.192 1.315 -1.761 1.00 25.44 H new ATOM 430 N LYS A 27 -2.284 -0.800 -2.351 1.00 64.22 N ATOM 431 CA LYS A 27 -0.999 -1.330 -2.712 1.00 22.45 C ATOM 432 C LYS A 27 -0.169 -0.229 -3.357 1.00 34.35 C ATOM 433 O LYS A 27 -0.633 0.417 -4.272 1.00 75.04 O ATOM 434 CB LYS A 27 -1.154 -2.442 -3.715 1.00 30.34 C ATOM 435 CG LYS A 27 0.153 -3.117 -4.016 1.00 21.53 C ATOM 436 CD LYS A 27 0.073 -4.003 -5.217 1.00 24.05 C ATOM 437 CE LYS A 27 -0.983 -5.083 -5.098 1.00 12.42 C ATOM 438 NZ LYS A 27 -0.990 -5.960 -6.291 1.00 34.43 N ATOM 0 H LYS A 27 -2.770 -0.342 -3.122 1.00 64.22 H new ATOM 0 HA LYS A 27 -0.514 -1.709 -1.813 1.00 22.45 H new ATOM 0 HB2 LYS A 27 -1.862 -3.178 -3.334 1.00 30.34 H new ATOM 0 HB3 LYS A 27 -1.576 -2.042 -4.637 1.00 30.34 H new ATOM 0 HG2 LYS A 27 0.921 -2.360 -4.176 1.00 21.53 H new ATOM 0 HG3 LYS A 27 0.462 -3.707 -3.153 1.00 21.53 H new ATOM 0 HD2 LYS A 27 -0.138 -3.394 -6.096 1.00 24.05 H new ATOM 0 HD3 LYS A 27 1.044 -4.471 -5.380 1.00 24.05 H new ATOM 0 HE2 LYS A 27 -0.797 -5.680 -4.206 1.00 12.42 H new ATOM 0 HE3 LYS A 27 -1.964 -4.624 -4.975 1.00 12.42 H new ATOM 0 HZ1 LYS A 27 -1.723 -6.690 -6.181 1.00 34.43 H new ATOM 0 HZ2 LYS A 27 -1.191 -5.392 -7.138 1.00 34.43 H new ATOM 0 HZ3 LYS A 27 -0.061 -6.415 -6.393 1.00 34.43 H new ATOM 452 N ILE A 28 1.025 -0.024 -2.874 1.00 25.50 N ATOM 453 CA ILE A 28 1.944 0.939 -3.434 1.00 61.30 C ATOM 454 C ILE A 28 3.079 0.151 -4.086 1.00 73.42 C ATOM 455 O ILE A 28 3.799 -0.546 -3.395 1.00 31.01 O ATOM 456 CB ILE A 28 2.567 1.806 -2.322 1.00 52.21 C ATOM 457 CG1 ILE A 28 1.491 2.512 -1.488 1.00 32.53 C ATOM 458 CG2 ILE A 28 3.471 2.854 -2.955 1.00 3.35 C ATOM 459 CD1 ILE A 28 0.818 3.627 -2.203 1.00 35.30 C ATOM 0 H ILE A 28 1.397 -0.527 -2.068 1.00 25.50 H new ATOM 0 HA ILE A 28 1.416 1.580 -4.140 1.00 61.30 H new ATOM 0 HB ILE A 28 3.137 1.153 -1.661 1.00 52.21 H new ATOM 0 HG12 ILE A 28 0.741 1.781 -1.185 1.00 32.53 H new ATOM 0 HG13 ILE A 28 1.946 2.899 -0.576 1.00 32.53 H new ATOM 0 HG21 ILE A 28 3.915 3.471 -2.174 1.00 3.35 H new ATOM 0 HG22 ILE A 28 4.261 2.360 -3.520 1.00 3.35 H new ATOM 0 HG23 ILE A 28 2.885 3.483 -3.625 1.00 3.35 H new ATOM 0 HD11 ILE A 28 0.070 4.078 -1.551 1.00 35.30 H new ATOM 0 HD12 ILE A 28 1.557 4.378 -2.483 1.00 35.30 H new ATOM 0 HD13 ILE A 28 0.333 3.243 -3.101 1.00 35.30 H new ATOM 471 N LEU A 29 3.224 0.240 -5.385 1.00 40.02 N ATOM 472 CA LEU A 29 4.252 -0.530 -6.090 1.00 31.42 C ATOM 473 C LEU A 29 5.565 0.237 -6.172 1.00 13.11 C ATOM 474 O LEU A 29 5.570 1.461 -6.331 1.00 64.42 O ATOM 475 CB LEU A 29 3.810 -0.970 -7.517 1.00 61.13 C ATOM 476 CG LEU A 29 2.580 -1.909 -7.656 1.00 73.42 C ATOM 477 CD1 LEU A 29 1.280 -1.221 -7.256 1.00 21.02 C ATOM 478 CD2 LEU A 29 2.477 -2.441 -9.073 1.00 51.11 C ATOM 0 H LEU A 29 2.651 0.833 -5.986 1.00 40.02 H new ATOM 0 HA LEU A 29 4.401 -1.433 -5.498 1.00 31.42 H new ATOM 0 HB2 LEU A 29 3.605 -0.068 -8.093 1.00 61.13 H new ATOM 0 HB3 LEU A 29 4.659 -1.464 -7.989 1.00 61.13 H new ATOM 0 HG LEU A 29 2.732 -2.741 -6.969 1.00 73.42 H new ATOM 0 HD11 LEU A 29 0.450 -1.918 -7.370 1.00 21.02 H new ATOM 0 HD12 LEU A 29 1.343 -0.899 -6.216 1.00 21.02 H new ATOM 0 HD13 LEU A 29 1.116 -0.353 -7.895 1.00 21.02 H new ATOM 0 HD21 LEU A 29 1.610 -3.097 -9.153 1.00 51.11 H new ATOM 0 HD22 LEU A 29 2.367 -1.608 -9.767 1.00 51.11 H new ATOM 0 HD23 LEU A 29 3.380 -3.001 -9.318 1.00 51.11 H new ATOM 490 N ASN A 30 6.674 -0.482 -6.051 1.00 54.24 N ATOM 491 CA ASN A 30 7.999 0.116 -6.130 1.00 5.21 C ATOM 492 C ASN A 30 8.474 0.121 -7.562 1.00 20.50 C ATOM 493 O ASN A 30 8.803 -0.928 -8.135 1.00 21.25 O ATOM 494 CB ASN A 30 8.967 -0.686 -5.234 1.00 34.44 C ATOM 495 CG ASN A 30 10.398 -0.196 -5.198 1.00 11.31 C ATOM 496 OD1 ASN A 30 10.690 0.977 -5.451 1.00 22.45 O ATOM 497 ND2 ASN A 30 11.292 -1.078 -4.814 1.00 62.14 N ATOM 0 H ASN A 30 6.680 -1.490 -5.896 1.00 54.24 H new ATOM 0 HA ASN A 30 7.964 1.148 -5.780 1.00 5.21 H new ATOM 0 HB2 ASN A 30 8.577 -0.681 -4.216 1.00 34.44 H new ATOM 0 HB3 ASN A 30 8.967 -1.723 -5.571 1.00 34.44 H new ATOM 0 HD21 ASN A 30 12.269 -0.804 -4.715 1.00 62.14 H new ATOM 0 HD22 ASN A 30 11.009 -2.037 -4.615 1.00 62.14 H new ATOM 504 N THR A 31 8.488 1.282 -8.136 1.00 42.01 N ATOM 505 CA THR A 31 8.924 1.479 -9.483 1.00 41.52 C ATOM 506 C THR A 31 10.117 2.447 -9.527 1.00 5.21 C ATOM 507 O THR A 31 10.290 3.248 -8.608 1.00 25.51 O ATOM 508 CB THR A 31 7.751 1.962 -10.367 1.00 32.44 C ATOM 509 OG1 THR A 31 7.031 2.999 -9.691 1.00 44.34 O ATOM 510 CG2 THR A 31 6.803 0.814 -10.700 1.00 53.24 C ATOM 0 H THR A 31 8.190 2.139 -7.671 1.00 42.01 H new ATOM 0 HA THR A 31 9.265 0.526 -9.888 1.00 41.52 H new ATOM 0 HB THR A 31 8.164 2.347 -11.299 1.00 32.44 H new ATOM 0 HG1 THR A 31 7.663 3.664 -9.346 1.00 44.34 H new ATOM 0 HG21 THR A 31 5.988 1.184 -11.322 1.00 53.24 H new ATOM 0 HG22 THR A 31 7.347 0.037 -11.238 1.00 53.24 H new ATOM 0 HG23 THR A 31 6.396 0.399 -9.778 1.00 53.24 H new ATOM 518 N PRO A 32 10.965 2.382 -10.570 1.00 75.15 N ATOM 519 CA PRO A 32 12.136 3.251 -10.684 1.00 33.33 C ATOM 520 C PRO A 32 11.800 4.657 -11.225 1.00 51.55 C ATOM 521 O PRO A 32 12.077 5.675 -10.584 1.00 70.43 O ATOM 522 CB PRO A 32 13.049 2.507 -11.683 1.00 5.41 C ATOM 523 CG PRO A 32 12.327 1.238 -12.050 1.00 73.21 C ATOM 524 CD PRO A 32 10.886 1.445 -11.695 1.00 23.52 C ATOM 0 HA PRO A 32 12.589 3.426 -9.708 1.00 33.33 H new ATOM 0 HB2 PRO A 32 13.237 3.117 -12.567 1.00 5.41 H new ATOM 0 HB3 PRO A 32 14.018 2.287 -11.235 1.00 5.41 H new ATOM 0 HG2 PRO A 32 12.437 1.024 -13.113 1.00 73.21 H new ATOM 0 HG3 PRO A 32 12.741 0.387 -11.509 1.00 73.21 H new ATOM 0 HD2 PRO A 32 10.319 1.859 -12.528 1.00 23.52 H new ATOM 0 HD3 PRO A 32 10.400 0.511 -11.412 1.00 23.52 H new ATOM 532 N ASN A 33 11.190 4.698 -12.391 1.00 52.50 N ATOM 533 CA ASN A 33 10.881 5.957 -13.078 1.00 43.12 C ATOM 534 C ASN A 33 9.514 6.493 -12.683 1.00 40.04 C ATOM 535 O ASN A 33 9.063 7.512 -13.192 1.00 14.54 O ATOM 536 CB ASN A 33 10.984 5.761 -14.584 1.00 44.12 C ATOM 537 CG ASN A 33 10.045 4.700 -15.088 1.00 62.41 C ATOM 538 OD1 ASN A 33 10.380 3.522 -15.052 1.00 72.23 O ATOM 539 ND2 ASN A 33 8.904 5.095 -15.580 1.00 41.11 N ATOM 0 H ASN A 33 10.890 3.865 -12.898 1.00 52.50 H new ATOM 0 HA ASN A 33 11.612 6.704 -12.770 1.00 43.12 H new ATOM 0 HB2 ASN A 33 10.767 6.704 -15.086 1.00 44.12 H new ATOM 0 HB3 ASN A 33 12.007 5.490 -14.844 1.00 44.12 H new ATOM 0 HD21 ASN A 33 8.247 4.412 -15.956 1.00 41.11 H new ATOM 0 HD22 ASN A 33 8.668 6.087 -15.589 1.00 41.11 H new ATOM 546 N CYS A 34 8.878 5.806 -11.786 1.00 44.23 N ATOM 547 CA CYS A 34 7.626 6.235 -11.222 1.00 43.22 C ATOM 548 C CYS A 34 7.782 6.200 -9.718 1.00 20.41 C ATOM 549 O CYS A 34 8.357 5.250 -9.179 1.00 75.22 O ATOM 550 CB CYS A 34 6.460 5.340 -11.696 1.00 14.02 C ATOM 551 SG CYS A 34 6.196 5.354 -13.499 1.00 73.42 S ATOM 0 H CYS A 34 9.215 4.917 -11.416 1.00 44.23 H new ATOM 0 HA CYS A 34 7.381 7.244 -11.553 1.00 43.22 H new ATOM 0 HB2 CYS A 34 6.649 4.316 -11.375 1.00 14.02 H new ATOM 0 HB3 CYS A 34 5.544 5.664 -11.203 1.00 14.02 H new ATOM 0 HG CYS A 34 5.200 4.574 -13.798 1.00 73.42 H new ATOM 556 N ALA A 35 7.320 7.219 -9.051 1.00 44.13 N ATOM 557 CA ALA A 35 7.515 7.347 -7.625 1.00 65.31 C ATOM 558 C ALA A 35 6.496 6.562 -6.818 1.00 70.42 C ATOM 559 O ALA A 35 6.851 5.910 -5.839 1.00 72.31 O ATOM 560 CB ALA A 35 7.497 8.808 -7.221 1.00 11.04 C ATOM 0 H ALA A 35 6.798 7.986 -9.474 1.00 44.13 H new ATOM 0 HA ALA A 35 8.492 6.919 -7.399 1.00 65.31 H new ATOM 0 HB1 ALA A 35 7.645 8.890 -6.144 1.00 11.04 H new ATOM 0 HB2 ALA A 35 8.296 9.338 -7.738 1.00 11.04 H new ATOM 0 HB3 ALA A 35 6.537 9.248 -7.490 1.00 11.04 H new ATOM 566 N CYS A 36 5.248 6.614 -7.223 1.00 22.22 N ATOM 567 CA CYS A 36 4.201 5.995 -6.448 1.00 10.45 C ATOM 568 C CYS A 36 3.079 5.441 -7.341 1.00 20.12 C ATOM 569 O CYS A 36 2.344 6.199 -7.986 1.00 75.20 O ATOM 570 CB CYS A 36 3.647 7.026 -5.439 1.00 20.31 C ATOM 571 SG CYS A 36 2.324 6.422 -4.346 1.00 4.14 S ATOM 0 H CYS A 36 4.936 7.075 -8.078 1.00 22.22 H new ATOM 0 HA CYS A 36 4.620 5.144 -5.910 1.00 10.45 H new ATOM 0 HB2 CYS A 36 4.471 7.381 -4.820 1.00 20.31 H new ATOM 0 HB3 CYS A 36 3.271 7.886 -5.994 1.00 20.31 H new ATOM 576 N GLN A 37 2.998 4.124 -7.416 1.00 3.23 N ATOM 577 CA GLN A 37 1.928 3.438 -8.118 1.00 74.03 C ATOM 578 C GLN A 37 0.982 2.833 -7.094 1.00 25.45 C ATOM 579 O GLN A 37 1.401 2.023 -6.282 1.00 31.22 O ATOM 580 CB GLN A 37 2.502 2.326 -9.007 1.00 54.44 C ATOM 581 CG GLN A 37 3.386 2.817 -10.146 1.00 23.24 C ATOM 582 CD GLN A 37 2.658 3.765 -11.071 1.00 32.35 C ATOM 583 OE1 GLN A 37 3.251 4.651 -11.672 1.00 1.45 O ATOM 584 NE2 GLN A 37 1.381 3.596 -11.185 1.00 44.13 N ATOM 0 H GLN A 37 3.678 3.496 -6.988 1.00 3.23 H new ATOM 0 HA GLN A 37 1.394 4.148 -8.750 1.00 74.03 H new ATOM 0 HB2 GLN A 37 3.080 1.643 -8.384 1.00 54.44 H new ATOM 0 HB3 GLN A 37 1.676 1.752 -9.427 1.00 54.44 H new ATOM 0 HG2 GLN A 37 4.262 3.317 -9.733 1.00 23.24 H new ATOM 0 HG3 GLN A 37 3.747 1.962 -10.717 1.00 23.24 H new ATOM 0 HE21 GLN A 37 0.918 2.847 -10.670 1.00 44.13 H new ATOM 0 HE22 GLN A 37 0.837 4.211 -11.790 1.00 44.13 H new ATOM 593 N ILE A 38 -0.275 3.225 -7.126 1.00 44.13 N ATOM 594 CA ILE A 38 -1.224 2.768 -6.130 1.00 74.30 C ATOM 595 C ILE A 38 -2.336 1.875 -6.736 1.00 31.13 C ATOM 596 O ILE A 38 -2.837 2.127 -7.836 1.00 70.30 O ATOM 597 CB ILE A 38 -1.866 3.975 -5.399 1.00 5.00 C ATOM 598 CG1 ILE A 38 -0.764 4.961 -5.000 1.00 43.02 C ATOM 599 CG2 ILE A 38 -2.645 3.512 -4.160 1.00 42.42 C ATOM 600 CD1 ILE A 38 -1.216 6.086 -4.123 1.00 23.11 C ATOM 0 H ILE A 38 -0.663 3.856 -7.827 1.00 44.13 H new ATOM 0 HA ILE A 38 -0.664 2.161 -5.418 1.00 74.30 H new ATOM 0 HB ILE A 38 -2.571 4.466 -6.070 1.00 5.00 H new ATOM 0 HG12 ILE A 38 0.026 4.413 -4.486 1.00 43.02 H new ATOM 0 HG13 ILE A 38 -0.325 5.379 -5.906 1.00 43.02 H new ATOM 0 HG21 ILE A 38 -3.086 4.376 -3.664 1.00 42.42 H new ATOM 0 HG22 ILE A 38 -3.435 2.825 -4.463 1.00 42.42 H new ATOM 0 HG23 ILE A 38 -1.967 3.006 -3.472 1.00 42.42 H new ATOM 0 HD11 ILE A 38 -0.368 6.731 -3.893 1.00 23.11 H new ATOM 0 HD12 ILE A 38 -1.983 6.664 -4.639 1.00 23.11 H new ATOM 0 HD13 ILE A 38 -1.627 5.683 -3.197 1.00 23.11 H new ATOM 612 N VAL A 39 -2.677 0.835 -6.019 1.00 61.12 N ATOM 613 CA VAL A 39 -3.761 -0.080 -6.361 1.00 15.52 C ATOM 614 C VAL A 39 -4.727 -0.225 -5.193 1.00 43.32 C ATOM 615 O VAL A 39 -4.307 -0.335 -4.058 1.00 71.11 O ATOM 616 CB VAL A 39 -3.224 -1.488 -6.831 1.00 63.21 C ATOM 617 CG1 VAL A 39 -4.254 -2.577 -6.609 1.00 61.23 C ATOM 618 CG2 VAL A 39 -2.928 -1.437 -8.305 1.00 53.15 C ATOM 0 H VAL A 39 -2.200 0.585 -5.153 1.00 61.12 H new ATOM 0 HA VAL A 39 -4.299 0.352 -7.205 1.00 15.52 H new ATOM 0 HB VAL A 39 -2.330 -1.713 -6.249 1.00 63.21 H new ATOM 0 HG11 VAL A 39 -3.851 -3.533 -6.944 1.00 61.23 H new ATOM 0 HG12 VAL A 39 -4.497 -2.637 -5.548 1.00 61.23 H new ATOM 0 HG13 VAL A 39 -5.156 -2.345 -7.175 1.00 61.23 H new ATOM 0 HG21 VAL A 39 -2.557 -2.407 -8.635 1.00 53.15 H new ATOM 0 HG22 VAL A 39 -3.839 -1.192 -8.851 1.00 53.15 H new ATOM 0 HG23 VAL A 39 -2.173 -0.675 -8.498 1.00 53.15 H new ATOM 628 N ALA A 40 -6.010 -0.201 -5.480 1.00 53.13 N ATOM 629 CA ALA A 40 -7.018 -0.369 -4.466 1.00 31.30 C ATOM 630 C ALA A 40 -7.839 -1.624 -4.696 1.00 1.41 C ATOM 631 O ALA A 40 -8.141 -1.980 -5.845 1.00 21.13 O ATOM 632 CB ALA A 40 -7.944 0.816 -4.468 1.00 43.45 C ATOM 0 H ALA A 40 -6.379 -0.065 -6.421 1.00 53.13 H new ATOM 0 HA ALA A 40 -6.507 -0.456 -3.507 1.00 31.30 H new ATOM 0 HB1 ALA A 40 -8.705 0.684 -3.699 1.00 43.45 H new ATOM 0 HB2 ALA A 40 -7.375 1.723 -4.264 1.00 43.45 H new ATOM 0 HB3 ALA A 40 -8.424 0.901 -5.443 1.00 43.45 H new ATOM 638 N ARG A 41 -8.165 -2.333 -3.631 1.00 72.42 N ATOM 639 CA ARG A 41 -9.142 -3.377 -3.743 1.00 33.12 C ATOM 640 C ARG A 41 -10.351 -3.020 -3.016 1.00 22.43 C ATOM 641 O ARG A 41 -10.307 -2.691 -1.833 1.00 74.41 O ATOM 642 CB ARG A 41 -8.710 -4.794 -3.374 1.00 73.10 C ATOM 643 CG ARG A 41 -7.762 -5.406 -4.356 1.00 52.00 C ATOM 644 CD ARG A 41 -8.001 -6.916 -4.533 1.00 21.13 C ATOM 645 NE ARG A 41 -7.952 -7.715 -3.288 1.00 22.50 N ATOM 646 CZ ARG A 41 -8.960 -8.537 -2.882 1.00 14.23 C ATOM 647 NH1 ARG A 41 -10.143 -8.501 -3.496 1.00 21.23 N ATOM 648 NH2 ARG A 41 -8.786 -9.365 -1.853 1.00 72.01 N ATOM 0 H ARG A 41 -7.771 -2.202 -2.699 1.00 72.42 H new ATOM 0 HA ARG A 41 -9.317 -3.436 -4.817 1.00 33.12 H new ATOM 0 HB2 ARG A 41 -8.240 -4.777 -2.390 1.00 73.10 H new ATOM 0 HB3 ARG A 41 -9.595 -5.425 -3.294 1.00 73.10 H new ATOM 0 HG2 ARG A 41 -7.868 -4.908 -5.320 1.00 52.00 H new ATOM 0 HG3 ARG A 41 -6.738 -5.239 -4.022 1.00 52.00 H new ATOM 0 HD2 ARG A 41 -8.975 -7.061 -5.000 1.00 21.13 H new ATOM 0 HD3 ARG A 41 -7.255 -7.306 -5.225 1.00 21.13 H new ATOM 0 HE ARG A 41 -7.119 -7.647 -2.703 1.00 22.50 H new ATOM 0 HH11 ARG A 41 -10.295 -7.857 -4.272 1.00 21.23 H new ATOM 0 HH12 ARG A 41 -10.896 -9.118 -3.190 1.00 21.23 H new ATOM 0 HH21 ARG A 41 -7.892 -9.387 -1.362 1.00 72.01 H new ATOM 0 HH22 ARG A 41 -9.546 -9.977 -1.556 1.00 72.01 H new ATOM 662 N LEU A 42 -11.401 -3.075 -3.712 1.00 5.41 N ATOM 663 CA LEU A 42 -12.699 -2.770 -3.184 1.00 32.13 C ATOM 664 C LEU A 42 -13.348 -4.071 -2.762 1.00 52.53 C ATOM 665 O LEU A 42 -12.865 -5.148 -3.151 1.00 45.13 O ATOM 666 CB LEU A 42 -13.553 -2.060 -4.238 1.00 14.31 C ATOM 667 CG LEU A 42 -12.952 -0.798 -4.855 1.00 15.12 C ATOM 668 CD1 LEU A 42 -13.871 -0.226 -5.918 1.00 12.33 C ATOM 669 CD2 LEU A 42 -12.721 0.221 -3.785 1.00 2.51 C ATOM 0 H LEU A 42 -11.408 -3.339 -4.697 1.00 5.41 H new ATOM 0 HA LEU A 42 -12.610 -2.101 -2.328 1.00 32.13 H new ATOM 0 HB2 LEU A 42 -13.764 -2.767 -5.041 1.00 14.31 H new ATOM 0 HB3 LEU A 42 -14.509 -1.798 -3.785 1.00 14.31 H new ATOM 0 HG LEU A 42 -12.004 -1.059 -5.325 1.00 15.12 H new ATOM 0 HD11 LEU A 42 -13.422 0.672 -6.343 1.00 12.33 H new ATOM 0 HD12 LEU A 42 -14.020 -0.964 -6.706 1.00 12.33 H new ATOM 0 HD13 LEU A 42 -14.832 0.026 -5.470 1.00 12.33 H new ATOM 0 HD21 LEU A 42 -12.292 1.121 -4.226 1.00 2.51 H new ATOM 0 HD22 LEU A 42 -13.669 0.468 -3.307 1.00 2.51 H new ATOM 0 HD23 LEU A 42 -12.033 -0.182 -3.041 1.00 2.51 H new ATOM 681 N LYS A 43 -14.382 -3.992 -1.953 1.00 2.24 N ATOM 682 CA LYS A 43 -15.093 -5.188 -1.481 1.00 51.13 C ATOM 683 C LYS A 43 -15.651 -6.041 -2.632 1.00 11.33 C ATOM 684 O LYS A 43 -15.712 -5.591 -3.799 1.00 20.00 O ATOM 685 CB LYS A 43 -16.194 -4.824 -0.481 1.00 3.01 C ATOM 686 CG LYS A 43 -17.267 -3.884 -0.995 1.00 71.20 C ATOM 687 CD LYS A 43 -18.286 -3.614 0.094 1.00 35.21 C ATOM 688 CE LYS A 43 -19.389 -2.685 -0.371 1.00 41.05 C ATOM 689 NZ LYS A 43 -20.412 -2.473 0.679 1.00 41.33 N ATOM 0 H LYS A 43 -14.760 -3.113 -1.600 1.00 2.24 H new ATOM 0 HA LYS A 43 -14.354 -5.802 -0.966 1.00 51.13 H new ATOM 0 HB2 LYS A 43 -16.673 -5.744 -0.146 1.00 3.01 H new ATOM 0 HB3 LYS A 43 -15.729 -4.370 0.394 1.00 3.01 H new ATOM 0 HG2 LYS A 43 -16.815 -2.947 -1.322 1.00 71.20 H new ATOM 0 HG3 LYS A 43 -17.759 -4.321 -1.864 1.00 71.20 H new ATOM 0 HD2 LYS A 43 -18.722 -4.557 0.423 1.00 35.21 H new ATOM 0 HD3 LYS A 43 -17.785 -3.177 0.958 1.00 35.21 H new ATOM 0 HE2 LYS A 43 -18.959 -1.725 -0.658 1.00 41.05 H new ATOM 0 HE3 LYS A 43 -19.863 -3.100 -1.261 1.00 41.05 H new ATOM 0 HZ1 LYS A 43 -21.149 -1.832 0.321 1.00 41.33 H new ATOM 0 HZ2 LYS A 43 -20.841 -3.385 0.935 1.00 41.33 H new ATOM 0 HZ3 LYS A 43 -19.965 -2.053 1.519 1.00 41.33 H new ATOM 745 N ARG A 47 -13.921 -4.925 -8.438 1.00 52.33 N ATOM 746 CA ARG A 47 -12.718 -5.654 -8.816 1.00 4.55 C ATOM 747 C ARG A 47 -11.502 -5.081 -8.089 1.00 63.12 C ATOM 748 O ARG A 47 -11.626 -4.399 -7.057 1.00 43.04 O ATOM 749 CB ARG A 47 -12.491 -5.465 -10.322 1.00 54.11 C ATOM 750 CG ARG A 47 -13.548 -6.053 -11.234 1.00 31.21 C ATOM 751 CD ARG A 47 -13.297 -5.604 -12.665 1.00 61.50 C ATOM 752 NE ARG A 47 -13.485 -4.147 -12.800 1.00 44.21 N ATOM 753 CZ ARG A 47 -12.628 -3.278 -13.359 1.00 41.43 C ATOM 754 NH1 ARG A 47 -11.442 -3.680 -13.817 1.00 21.52 N ATOM 755 NH2 ARG A 47 -12.964 -2.002 -13.449 1.00 64.10 N ATOM 0 HA ARG A 47 -12.842 -6.705 -8.557 1.00 4.55 H new ATOM 0 HB2 ARG A 47 -12.417 -4.397 -10.526 1.00 54.11 H new ATOM 0 HB3 ARG A 47 -11.529 -5.907 -10.582 1.00 54.11 H new ATOM 0 HG2 ARG A 47 -13.528 -7.141 -11.175 1.00 31.21 H new ATOM 0 HG3 ARG A 47 -14.539 -5.734 -10.911 1.00 31.21 H new ATOM 0 HD2 ARG A 47 -12.283 -5.873 -12.962 1.00 61.50 H new ATOM 0 HD3 ARG A 47 -13.976 -6.126 -13.339 1.00 61.50 H new ATOM 0 HE ARG A 47 -14.354 -3.761 -12.431 1.00 44.21 H new ATOM 0 HH11 ARG A 47 -11.174 -4.661 -13.745 1.00 21.52 H new ATOM 0 HH12 ARG A 47 -10.803 -3.006 -14.239 1.00 21.52 H new ATOM 0 HH21 ARG A 47 -13.867 -1.686 -13.095 1.00 64.10 H new ATOM 0 HH22 ARG A 47 -12.320 -1.334 -13.872 1.00 64.10 H new ATOM 769 N GLN A 48 -10.340 -5.398 -8.613 1.00 62.14 N ATOM 770 CA GLN A 48 -9.101 -4.808 -8.193 1.00 63.21 C ATOM 771 C GLN A 48 -8.815 -3.728 -9.196 1.00 41.41 C ATOM 772 O GLN A 48 -8.923 -3.966 -10.404 1.00 52.03 O ATOM 773 CB GLN A 48 -7.979 -5.841 -8.230 1.00 52.44 C ATOM 774 CG GLN A 48 -6.610 -5.281 -7.870 1.00 73.02 C ATOM 775 CD GLN A 48 -5.522 -6.313 -7.948 1.00 71.34 C ATOM 776 OE1 GLN A 48 -5.585 -7.245 -8.737 1.00 22.34 O ATOM 777 NE2 GLN A 48 -4.524 -6.169 -7.128 1.00 14.45 N ATOM 0 H GLN A 48 -10.234 -6.087 -9.357 1.00 62.14 H new ATOM 0 HA GLN A 48 -9.166 -4.426 -7.174 1.00 63.21 H new ATOM 0 HB2 GLN A 48 -8.222 -6.651 -7.542 1.00 52.44 H new ATOM 0 HB3 GLN A 48 -7.931 -6.275 -9.229 1.00 52.44 H new ATOM 0 HG2 GLN A 48 -6.371 -4.456 -8.542 1.00 73.02 H new ATOM 0 HG3 GLN A 48 -6.644 -4.871 -6.861 1.00 73.02 H new ATOM 0 HE21 GLN A 48 -4.504 -5.379 -6.483 1.00 14.45 H new ATOM 0 HE22 GLN A 48 -3.761 -6.846 -7.130 1.00 14.45 H new ATOM 786 N VAL A 49 -8.449 -2.575 -8.741 1.00 61.42 N ATOM 787 CA VAL A 49 -8.333 -1.444 -9.606 1.00 32.40 C ATOM 788 C VAL A 49 -7.095 -0.675 -9.290 1.00 25.20 C ATOM 789 O VAL A 49 -6.558 -0.767 -8.184 1.00 41.21 O ATOM 790 CB VAL A 49 -9.579 -0.500 -9.511 1.00 64.33 C ATOM 791 CG1 VAL A 49 -10.839 -1.187 -10.034 1.00 2.40 C ATOM 792 CG2 VAL A 49 -9.796 -0.037 -8.075 1.00 73.53 C ATOM 0 H VAL A 49 -8.223 -2.389 -7.764 1.00 61.42 H new ATOM 0 HA VAL A 49 -8.279 -1.824 -10.626 1.00 32.40 H new ATOM 0 HB VAL A 49 -9.380 0.370 -10.137 1.00 64.33 H new ATOM 0 HG11 VAL A 49 -11.685 -0.505 -9.954 1.00 2.40 H new ATOM 0 HG12 VAL A 49 -10.695 -1.466 -11.078 1.00 2.40 H new ATOM 0 HG13 VAL A 49 -11.037 -2.082 -9.444 1.00 2.40 H new ATOM 0 HG21 VAL A 49 -10.666 0.618 -8.031 1.00 73.53 H new ATOM 0 HG22 VAL A 49 -9.961 -0.903 -7.434 1.00 73.53 H new ATOM 0 HG23 VAL A 49 -8.916 0.506 -7.731 1.00 73.53 H new ATOM 802 N CYS A 50 -6.645 0.070 -10.228 1.00 41.42 N ATOM 803 CA CYS A 50 -5.485 0.873 -10.033 1.00 73.01 C ATOM 804 C CYS A 50 -5.931 2.271 -9.829 1.00 14.44 C ATOM 805 O CYS A 50 -6.745 2.770 -10.586 1.00 65.21 O ATOM 806 CB CYS A 50 -4.583 0.820 -11.245 1.00 0.03 C ATOM 807 SG CYS A 50 -3.898 -0.819 -11.651 1.00 71.13 S ATOM 0 H CYS A 50 -7.065 0.145 -11.154 1.00 41.42 H new ATOM 0 HA CYS A 50 -4.928 0.503 -9.173 1.00 73.01 H new ATOM 0 HB2 CYS A 50 -5.142 1.183 -12.107 1.00 0.03 H new ATOM 0 HB3 CYS A 50 -3.755 1.511 -11.089 1.00 0.03 H new ATOM 812 N ILE A 51 -5.439 2.899 -8.814 1.00 60.11 N ATOM 813 CA ILE A 51 -5.833 4.230 -8.530 1.00 20.14 C ATOM 814 C ILE A 51 -4.666 5.167 -8.556 1.00 33.14 C ATOM 815 O ILE A 51 -3.545 4.757 -8.841 1.00 40.00 O ATOM 816 CB ILE A 51 -6.603 4.335 -7.231 1.00 72.53 C ATOM 817 CG1 ILE A 51 -5.843 3.736 -6.096 1.00 64.44 C ATOM 818 CG2 ILE A 51 -7.910 3.639 -7.377 1.00 61.35 C ATOM 819 CD1 ILE A 51 -6.535 3.916 -4.790 1.00 75.52 C ATOM 0 H ILE A 51 -4.758 2.505 -8.165 1.00 60.11 H new ATOM 0 HA ILE A 51 -6.515 4.533 -9.325 1.00 20.14 H new ATOM 0 HB ILE A 51 -6.760 5.391 -7.011 1.00 72.53 H new ATOM 0 HG12 ILE A 51 -5.696 2.672 -6.282 1.00 64.44 H new ATOM 0 HG13 ILE A 51 -4.854 4.190 -6.045 1.00 64.44 H new ATOM 0 HG21 ILE A 51 -8.468 3.712 -6.443 1.00 61.35 H new ATOM 0 HG22 ILE A 51 -8.483 4.105 -8.179 1.00 61.35 H new ATOM 0 HG23 ILE A 51 -7.739 2.589 -7.616 1.00 61.35 H new ATOM 0 HD11 ILE A 51 -5.940 3.462 -3.997 1.00 75.52 H new ATOM 0 HD12 ILE A 51 -6.658 4.980 -4.587 1.00 75.52 H new ATOM 0 HD13 ILE A 51 -7.514 3.438 -4.828 1.00 75.52 H new ATOM 831 N ASP A 52 -4.911 6.405 -8.274 1.00 73.21 N ATOM 832 CA ASP A 52 -3.881 7.408 -8.409 1.00 4.34 C ATOM 833 C ASP A 52 -3.662 8.145 -7.091 1.00 24.22 C ATOM 834 O ASP A 52 -4.613 8.398 -6.364 1.00 20.14 O ATOM 835 CB ASP A 52 -4.317 8.401 -9.463 1.00 32.33 C ATOM 836 CG ASP A 52 -3.204 9.296 -9.904 1.00 75.03 C ATOM 837 OD1 ASP A 52 -2.900 10.238 -9.204 1.00 74.13 O ATOM 838 OD2 ASP A 52 -2.608 9.053 -10.975 1.00 65.05 O ATOM 0 H ASP A 52 -5.812 6.756 -7.948 1.00 73.21 H new ATOM 0 HA ASP A 52 -2.947 6.923 -8.692 1.00 4.34 H new ATOM 0 HB2 ASP A 52 -4.708 7.862 -10.326 1.00 32.33 H new ATOM 0 HB3 ASP A 52 -5.133 9.008 -9.070 1.00 32.33 H new ATOM 843 N PRO A 53 -2.404 8.487 -6.754 1.00 51.52 N ATOM 844 CA PRO A 53 -2.095 9.253 -5.540 1.00 64.25 C ATOM 845 C PRO A 53 -2.715 10.670 -5.505 1.00 71.33 C ATOM 846 O PRO A 53 -2.733 11.311 -4.455 1.00 22.44 O ATOM 847 CB PRO A 53 -0.573 9.338 -5.512 1.00 62.12 C ATOM 848 CG PRO A 53 -0.100 8.932 -6.867 1.00 12.41 C ATOM 849 CD PRO A 53 -1.186 8.108 -7.495 1.00 44.45 C ATOM 0 HA PRO A 53 -2.523 8.755 -4.670 1.00 64.25 H new ATOM 0 HB2 PRO A 53 -0.246 10.350 -5.274 1.00 62.12 H new ATOM 0 HB3 PRO A 53 -0.162 8.681 -4.745 1.00 62.12 H new ATOM 0 HG2 PRO A 53 0.117 9.809 -7.476 1.00 12.41 H new ATOM 0 HG3 PRO A 53 0.824 8.358 -6.795 1.00 12.41 H new ATOM 0 HD2 PRO A 53 -1.284 8.323 -8.559 1.00 44.45 H new ATOM 0 HD3 PRO A 53 -0.980 7.042 -7.403 1.00 44.45 H new ATOM 857 N LYS A 54 -3.197 11.164 -6.650 1.00 5.41 N ATOM 858 CA LYS A 54 -3.887 12.458 -6.710 1.00 54.44 C ATOM 859 C LYS A 54 -5.238 12.435 -5.993 1.00 24.42 C ATOM 860 O LYS A 54 -5.905 13.462 -5.879 1.00 75.14 O ATOM 861 CB LYS A 54 -4.062 12.919 -8.158 1.00 15.21 C ATOM 862 CG LYS A 54 -2.763 13.153 -8.931 1.00 74.34 C ATOM 863 CD LYS A 54 -2.029 14.455 -8.603 1.00 75.02 C ATOM 864 CE LYS A 54 -1.615 14.603 -7.154 1.00 43.52 C ATOM 865 NZ LYS A 54 -0.778 15.790 -6.947 1.00 1.13 N ATOM 0 H LYS A 54 -3.122 10.687 -7.549 1.00 5.41 H new ATOM 0 HA LYS A 54 -3.253 13.173 -6.185 1.00 54.44 H new ATOM 0 HB2 LYS A 54 -4.653 12.174 -8.690 1.00 15.21 H new ATOM 0 HB3 LYS A 54 -4.639 13.844 -8.160 1.00 15.21 H new ATOM 0 HG2 LYS A 54 -2.090 12.318 -8.738 1.00 74.34 H new ATOM 0 HG3 LYS A 54 -2.988 13.141 -9.998 1.00 74.34 H new ATOM 0 HD2 LYS A 54 -1.139 14.522 -9.229 1.00 75.02 H new ATOM 0 HD3 LYS A 54 -2.671 15.295 -8.871 1.00 75.02 H new ATOM 0 HE2 LYS A 54 -2.504 14.671 -6.527 1.00 43.52 H new ATOM 0 HE3 LYS A 54 -1.069 13.714 -6.839 1.00 43.52 H new ATOM 0 HZ1 LYS A 54 -0.362 15.760 -5.994 1.00 1.13 H new ATOM 0 HZ2 LYS A 54 -0.018 15.807 -7.656 1.00 1.13 H new ATOM 0 HZ3 LYS A 54 -1.360 16.646 -7.044 1.00 1.13 H new ATOM 879 N LEU A 55 -5.651 11.278 -5.546 1.00 4.44 N ATOM 880 CA LEU A 55 -6.847 11.151 -4.762 1.00 35.34 C ATOM 881 C LEU A 55 -6.534 11.645 -3.351 1.00 13.23 C ATOM 882 O LEU A 55 -5.602 11.156 -2.710 1.00 52.03 O ATOM 883 CB LEU A 55 -7.272 9.690 -4.741 1.00 0.34 C ATOM 884 CG LEU A 55 -7.564 9.061 -6.111 1.00 14.02 C ATOM 885 CD1 LEU A 55 -7.777 7.571 -5.973 1.00 22.55 C ATOM 886 CD2 LEU A 55 -8.777 9.711 -6.757 1.00 23.53 C ATOM 0 H LEU A 55 -5.166 10.397 -5.717 1.00 4.44 H new ATOM 0 HA LEU A 55 -7.662 11.740 -5.183 1.00 35.34 H new ATOM 0 HB2 LEU A 55 -6.488 9.110 -4.255 1.00 0.34 H new ATOM 0 HB3 LEU A 55 -8.165 9.599 -4.123 1.00 0.34 H new ATOM 0 HG LEU A 55 -6.701 9.232 -6.755 1.00 14.02 H new ATOM 0 HD11 LEU A 55 -7.983 7.141 -6.953 1.00 22.55 H new ATOM 0 HD12 LEU A 55 -6.880 7.112 -5.556 1.00 22.55 H new ATOM 0 HD13 LEU A 55 -8.622 7.384 -5.310 1.00 22.55 H new ATOM 0 HD21 LEU A 55 -8.964 9.249 -7.726 1.00 23.53 H new ATOM 0 HD22 LEU A 55 -9.648 9.575 -6.116 1.00 23.53 H new ATOM 0 HD23 LEU A 55 -8.590 10.776 -6.893 1.00 23.53 H new ATOM 898 N LYS A 56 -7.298 12.605 -2.868 1.00 1.24 N ATOM 899 CA LYS A 56 -7.002 13.229 -1.588 1.00 2.34 C ATOM 900 C LYS A 56 -7.195 12.252 -0.436 1.00 41.42 C ATOM 901 O LYS A 56 -6.429 12.274 0.529 1.00 34.15 O ATOM 902 CB LYS A 56 -7.792 14.566 -1.420 1.00 12.31 C ATOM 903 CG LYS A 56 -7.446 15.421 -0.167 1.00 34.10 C ATOM 904 CD LYS A 56 -8.106 14.958 1.130 1.00 72.55 C ATOM 905 CE LYS A 56 -9.620 15.104 1.079 1.00 51.43 C ATOM 906 NZ LYS A 56 -10.249 14.762 2.371 1.00 11.35 N ATOM 0 H LYS A 56 -8.126 12.971 -3.338 1.00 1.24 H new ATOM 0 HA LYS A 56 -5.946 13.500 -1.568 1.00 2.34 H new ATOM 0 HB2 LYS A 56 -7.623 15.176 -2.307 1.00 12.31 H new ATOM 0 HB3 LYS A 56 -8.856 14.333 -1.391 1.00 12.31 H new ATOM 0 HG2 LYS A 56 -6.365 15.416 -0.029 1.00 34.10 H new ATOM 0 HG3 LYS A 56 -7.738 16.454 -0.358 1.00 34.10 H new ATOM 0 HD2 LYS A 56 -7.848 13.916 1.317 1.00 72.55 H new ATOM 0 HD3 LYS A 56 -7.713 15.538 1.965 1.00 72.55 H new ATOM 0 HE2 LYS A 56 -9.877 16.128 0.810 1.00 51.43 H new ATOM 0 HE3 LYS A 56 -10.021 14.459 0.298 1.00 51.43 H new ATOM 0 HZ1 LYS A 56 -11.235 15.094 2.376 1.00 11.35 H new ATOM 0 HZ2 LYS A 56 -10.231 13.731 2.504 1.00 11.35 H new ATOM 0 HZ3 LYS A 56 -9.725 15.220 3.144 1.00 11.35 H new ATOM 920 N TRP A 57 -8.177 11.357 -0.548 1.00 62.10 N ATOM 921 CA TRP A 57 -8.395 10.381 0.522 1.00 52.45 C ATOM 922 C TRP A 57 -7.205 9.414 0.612 1.00 71.42 C ATOM 923 O TRP A 57 -6.906 8.879 1.677 1.00 3.21 O ATOM 924 CB TRP A 57 -9.744 9.621 0.388 1.00 11.53 C ATOM 925 CG TRP A 57 -9.862 8.660 -0.758 1.00 44.25 C ATOM 926 CD1 TRP A 57 -10.490 8.861 -1.945 1.00 10.21 C ATOM 927 CD2 TRP A 57 -9.354 7.327 -0.794 1.00 55.44 C ATOM 928 NE1 TRP A 57 -10.400 7.727 -2.716 1.00 42.10 N ATOM 929 CE2 TRP A 57 -9.702 6.777 -2.027 1.00 23.22 C ATOM 930 CE3 TRP A 57 -8.631 6.552 0.107 1.00 33.21 C ATOM 931 CZ2 TRP A 57 -9.354 5.484 -2.377 1.00 62.30 C ATOM 932 CZ3 TRP A 57 -8.291 5.283 -0.241 1.00 3.12 C ATOM 933 CH2 TRP A 57 -8.647 4.760 -1.463 1.00 52.24 C ATOM 0 H TRP A 57 -8.815 11.286 -1.340 1.00 62.10 H new ATOM 0 HA TRP A 57 -8.463 10.938 1.456 1.00 52.45 H new ATOM 0 HB2 TRP A 57 -9.919 9.071 1.313 1.00 11.53 H new ATOM 0 HB3 TRP A 57 -10.543 10.357 0.299 1.00 11.53 H new ATOM 0 HD1 TRP A 57 -10.986 9.774 -2.239 1.00 10.21 H new ATOM 0 HE1 TRP A 57 -10.791 7.613 -3.651 1.00 42.10 H new ATOM 0 HE3 TRP A 57 -8.344 6.953 1.068 1.00 33.21 H new ATOM 0 HZ2 TRP A 57 -9.631 5.066 -3.334 1.00 62.30 H new ATOM 0 HZ3 TRP A 57 -7.732 4.674 0.454 1.00 3.12 H new ATOM 0 HH2 TRP A 57 -8.358 3.748 -1.705 1.00 52.24 H new ATOM 944 N ILE A 58 -6.533 9.206 -0.524 1.00 23.03 N ATOM 945 CA ILE A 58 -5.330 8.383 -0.599 1.00 1.12 C ATOM 946 C ILE A 58 -4.255 8.952 0.266 1.00 33.34 C ATOM 947 O ILE A 58 -3.612 8.238 1.044 1.00 11.21 O ATOM 948 CB ILE A 58 -4.821 8.254 -2.064 1.00 11.45 C ATOM 949 CG1 ILE A 58 -5.602 7.200 -2.812 1.00 74.53 C ATOM 950 CG2 ILE A 58 -3.329 7.959 -2.131 1.00 2.23 C ATOM 951 CD1 ILE A 58 -5.286 5.819 -2.331 1.00 71.00 C ATOM 0 H ILE A 58 -6.812 9.607 -1.419 1.00 23.03 H new ATOM 0 HA ILE A 58 -5.588 7.387 -0.240 1.00 1.12 H new ATOM 0 HB ILE A 58 -4.983 9.219 -2.544 1.00 11.45 H new ATOM 0 HG12 ILE A 58 -6.669 7.389 -2.695 1.00 74.53 H new ATOM 0 HG13 ILE A 58 -5.380 7.272 -3.877 1.00 74.53 H new ATOM 0 HG21 ILE A 58 -3.021 7.878 -3.173 1.00 2.23 H new ATOM 0 HG22 ILE A 58 -2.776 8.767 -1.651 1.00 2.23 H new ATOM 0 HG23 ILE A 58 -3.120 7.021 -1.617 1.00 2.23 H new ATOM 0 HD11 ILE A 58 -5.871 5.094 -2.897 1.00 71.00 H new ATOM 0 HD12 ILE A 58 -4.224 5.619 -2.472 1.00 71.00 H new ATOM 0 HD13 ILE A 58 -5.533 5.737 -1.273 1.00 71.00 H new ATOM 963 N GLN A 59 -4.070 10.228 0.148 1.00 13.14 N ATOM 964 CA GLN A 59 -3.094 10.893 0.911 1.00 74.35 C ATOM 965 C GLN A 59 -3.424 10.835 2.385 1.00 72.41 C ATOM 966 O GLN A 59 -2.553 10.666 3.192 1.00 65.20 O ATOM 967 CB GLN A 59 -2.885 12.287 0.384 1.00 20.23 C ATOM 968 CG GLN A 59 -2.433 12.218 -1.055 1.00 5.45 C ATOM 969 CD GLN A 59 -2.025 13.496 -1.650 1.00 53.30 C ATOM 970 OE1 GLN A 59 -2.500 14.565 -1.296 1.00 4.20 O ATOM 971 NE2 GLN A 59 -1.132 13.388 -2.578 1.00 33.25 N ATOM 0 H GLN A 59 -4.599 10.829 -0.485 1.00 13.14 H new ATOM 0 HA GLN A 59 -2.138 10.380 0.809 1.00 74.35 H new ATOM 0 HB2 GLN A 59 -3.810 12.858 0.459 1.00 20.23 H new ATOM 0 HB3 GLN A 59 -2.140 12.807 0.986 1.00 20.23 H new ATOM 0 HG2 GLN A 59 -1.597 11.522 -1.122 1.00 5.45 H new ATOM 0 HG3 GLN A 59 -3.243 11.801 -1.653 1.00 5.45 H new ATOM 0 HE21 GLN A 59 -0.770 12.469 -2.833 1.00 33.25 H new ATOM 0 HE22 GLN A 59 -0.789 14.222 -3.055 1.00 33.25 H new ATOM 980 N GLU A 60 -4.703 10.889 2.715 1.00 33.50 N ATOM 981 CA GLU A 60 -5.133 10.790 4.108 1.00 34.31 C ATOM 982 C GLU A 60 -4.916 9.367 4.644 1.00 54.15 C ATOM 983 O GLU A 60 -4.674 9.174 5.836 1.00 43.44 O ATOM 984 CB GLU A 60 -6.598 11.141 4.261 1.00 31.21 C ATOM 985 CG GLU A 60 -6.997 12.482 3.703 1.00 34.43 C ATOM 986 CD GLU A 60 -8.425 12.804 4.026 1.00 71.04 C ATOM 987 OE1 GLU A 60 -9.335 12.380 3.275 1.00 20.32 O ATOM 988 OE2 GLU A 60 -8.673 13.473 5.048 1.00 64.43 O ATOM 0 H GLU A 60 -5.463 11.000 2.044 1.00 33.50 H new ATOM 0 HA GLU A 60 -4.532 11.499 4.677 1.00 34.31 H new ATOM 0 HB2 GLU A 60 -7.193 10.370 3.772 1.00 31.21 H new ATOM 0 HB3 GLU A 60 -6.853 11.116 5.321 1.00 31.21 H new ATOM 0 HG2 GLU A 60 -6.346 13.256 4.111 1.00 34.43 H new ATOM 0 HG3 GLU A 60 -6.857 12.485 2.622 1.00 34.43 H new ATOM 995 N TYR A 61 -5.008 8.383 3.750 1.00 44.00 N ATOM 996 CA TYR A 61 -4.840 6.961 4.099 1.00 32.43 C ATOM 997 C TYR A 61 -3.425 6.798 4.634 1.00 4.44 C ATOM 998 O TYR A 61 -3.206 6.268 5.730 1.00 44.03 O ATOM 999 CB TYR A 61 -4.990 6.120 2.820 1.00 33.41 C ATOM 1000 CG TYR A 61 -5.525 4.718 2.952 1.00 65.42 C ATOM 1001 CD1 TYR A 61 -4.710 3.682 3.280 1.00 15.54 C ATOM 1002 CD2 TYR A 61 -6.845 4.432 2.638 1.00 64.10 C ATOM 1003 CE1 TYR A 61 -5.178 2.387 3.289 1.00 62.32 C ATOM 1004 CE2 TYR A 61 -7.320 3.137 2.668 1.00 15.12 C ATOM 1005 CZ TYR A 61 -6.465 2.124 2.989 1.00 4.13 C ATOM 1006 OH TYR A 61 -6.892 0.830 2.972 1.00 71.23 O ATOM 0 H TYR A 61 -5.201 8.543 2.761 1.00 44.00 H new ATOM 0 HA TYR A 61 -5.578 6.642 4.835 1.00 32.43 H new ATOM 0 HB2 TYR A 61 -5.644 6.664 2.138 1.00 33.41 H new ATOM 0 HB3 TYR A 61 -4.011 6.060 2.344 1.00 33.41 H new ATOM 0 HD1 TYR A 61 -3.679 3.877 3.538 1.00 15.54 H new ATOM 0 HD2 TYR A 61 -7.512 5.236 2.365 1.00 64.10 H new ATOM 0 HE1 TYR A 61 -4.509 1.577 3.538 1.00 62.32 H new ATOM 0 HE2 TYR A 61 -8.355 2.928 2.440 1.00 15.12 H new ATOM 0 HH TYR A 61 -7.372 0.655 2.136 1.00 71.23 H new ATOM 1016 N LEU A 62 -2.481 7.302 3.853 1.00 30.03 N ATOM 1017 CA LEU A 62 -1.084 7.262 4.179 1.00 52.42 C ATOM 1018 C LEU A 62 -0.694 8.278 5.291 1.00 32.53 C ATOM 1019 O LEU A 62 0.249 8.055 6.041 1.00 64.15 O ATOM 1020 CB LEU A 62 -0.206 7.274 2.893 1.00 60.33 C ATOM 1021 CG LEU A 62 -0.387 8.419 1.892 1.00 71.42 C ATOM 1022 CD1 LEU A 62 0.297 9.649 2.363 1.00 61.55 C ATOM 1023 CD2 LEU A 62 0.073 8.031 0.476 1.00 30.13 C ATOM 0 H LEU A 62 -2.680 7.756 2.961 1.00 30.03 H new ATOM 0 HA LEU A 62 -0.863 6.304 4.650 1.00 52.42 H new ATOM 0 HB2 LEU A 62 0.838 7.269 3.205 1.00 60.33 H new ATOM 0 HB3 LEU A 62 -0.384 6.339 2.362 1.00 60.33 H new ATOM 0 HG LEU A 62 -1.455 8.627 1.830 1.00 71.42 H new ATOM 0 HD11 LEU A 62 0.153 10.447 1.634 1.00 61.55 H new ATOM 0 HD12 LEU A 62 -0.122 9.954 3.322 1.00 61.55 H new ATOM 0 HD13 LEU A 62 1.363 9.451 2.479 1.00 61.55 H new ATOM 0 HD21 LEU A 62 -0.075 8.874 -0.198 1.00 30.13 H new ATOM 0 HD22 LEU A 62 1.130 7.764 0.497 1.00 30.13 H new ATOM 0 HD23 LEU A 62 -0.510 7.179 0.125 1.00 30.13 H new ATOM 1035 N GLU A 63 -1.436 9.391 5.387 1.00 41.52 N ATOM 1036 CA GLU A 63 -1.279 10.378 6.491 1.00 64.32 C ATOM 1037 C GLU A 63 -1.467 9.740 7.858 1.00 33.23 C ATOM 1038 O GLU A 63 -0.870 10.173 8.839 1.00 61.32 O ATOM 1039 CB GLU A 63 -2.246 11.546 6.323 1.00 32.05 C ATOM 1040 CG GLU A 63 -1.814 12.598 5.308 1.00 42.32 C ATOM 1041 CD GLU A 63 -0.920 13.663 5.896 1.00 20.10 C ATOM 1042 OE1 GLU A 63 0.281 13.451 6.049 1.00 32.43 O ATOM 1043 OE2 GLU A 63 -1.442 14.758 6.233 1.00 62.21 O ATOM 0 H GLU A 63 -2.159 9.641 4.712 1.00 41.52 H new ATOM 0 HA GLU A 63 -0.257 10.753 6.434 1.00 64.32 H new ATOM 0 HB2 GLU A 63 -3.218 11.153 6.026 1.00 32.05 H new ATOM 0 HB3 GLU A 63 -2.380 12.030 7.291 1.00 32.05 H new ATOM 0 HG2 GLU A 63 -1.292 12.108 4.487 1.00 42.32 H new ATOM 0 HG3 GLU A 63 -2.701 13.070 4.885 1.00 42.32 H new ATOM 1050 N LYS A 64 -2.272 8.697 7.923 1.00 24.11 N ATOM 1051 CA LYS A 64 -2.505 8.008 9.183 1.00 53.20 C ATOM 1052 C LYS A 64 -1.312 7.121 9.536 1.00 62.21 C ATOM 1053 O LYS A 64 -1.183 6.640 10.659 1.00 40.03 O ATOM 1054 CB LYS A 64 -3.791 7.184 9.132 1.00 42.43 C ATOM 1055 CG LYS A 64 -5.029 7.981 8.766 1.00 74.33 C ATOM 1056 CD LYS A 64 -5.245 9.144 9.712 1.00 55.53 C ATOM 1057 CE LYS A 64 -6.488 9.924 9.352 1.00 41.52 C ATOM 1058 NZ LYS A 64 -7.722 9.116 9.501 1.00 62.14 N ATOM 0 H LYS A 64 -2.774 8.308 7.125 1.00 24.11 H new ATOM 0 HA LYS A 64 -2.621 8.761 9.962 1.00 53.20 H new ATOM 0 HB2 LYS A 64 -3.664 6.379 8.408 1.00 42.43 H new ATOM 0 HB3 LYS A 64 -3.948 6.717 10.104 1.00 42.43 H new ATOM 0 HG2 LYS A 64 -4.934 8.354 7.746 1.00 74.33 H new ATOM 0 HG3 LYS A 64 -5.902 7.328 8.786 1.00 74.33 H new ATOM 0 HD2 LYS A 64 -5.329 8.773 10.734 1.00 55.53 H new ATOM 0 HD3 LYS A 64 -4.378 9.804 9.683 1.00 55.53 H new ATOM 0 HE2 LYS A 64 -6.556 10.808 9.986 1.00 41.52 H new ATOM 0 HE3 LYS A 64 -6.408 10.276 8.323 1.00 41.52 H new ATOM 0 HZ1 LYS A 64 -8.553 9.740 9.460 1.00 62.14 H new ATOM 0 HZ2 LYS A 64 -7.775 8.418 8.732 1.00 62.14 H new ATOM 0 HZ3 LYS A 64 -7.705 8.622 10.416 1.00 62.14 H new ATOM 1072 N CYS A 65 -0.449 6.909 8.565 1.00 74.33 N ATOM 1073 CA CYS A 65 0.760 6.148 8.769 1.00 23.00 C ATOM 1074 C CYS A 65 1.854 7.120 9.159 1.00 34.45 C ATOM 1075 O CYS A 65 2.870 6.750 9.739 1.00 14.21 O ATOM 1076 CB CYS A 65 1.169 5.494 7.465 1.00 34.52 C ATOM 1077 SG CYS A 65 -0.217 4.705 6.547 1.00 63.52 S ATOM 0 H CYS A 65 -0.568 7.260 7.615 1.00 74.33 H new ATOM 0 HA CYS A 65 0.601 5.389 9.535 1.00 23.00 H new ATOM 0 HB2 CYS A 65 1.632 6.245 6.825 1.00 34.52 H new ATOM 0 HB3 CYS A 65 1.928 4.740 7.673 1.00 34.52 H new ATOM 1082 N LEU A 66 1.619 8.376 8.833 1.00 23.32 N ATOM 1083 CA LEU A 66 2.544 9.422 9.047 1.00 15.01 C ATOM 1084 C LEU A 66 2.524 9.936 10.430 1.00 44.12 C ATOM 1085 O LEU A 66 1.490 10.344 10.966 1.00 44.12 O ATOM 1086 CB LEU A 66 2.358 10.531 8.038 1.00 30.22 C ATOM 1087 CG LEU A 66 2.795 10.171 6.637 1.00 3.51 C ATOM 1088 CD1 LEU A 66 2.365 11.205 5.636 1.00 64.24 C ATOM 1089 CD2 LEU A 66 4.299 10.030 6.614 1.00 4.12 C ATOM 0 H LEU A 66 0.748 8.684 8.401 1.00 23.32 H new ATOM 0 HA LEU A 66 3.535 8.994 8.899 1.00 15.01 H new ATOM 0 HB2 LEU A 66 1.306 10.816 8.017 1.00 30.22 H new ATOM 0 HB3 LEU A 66 2.918 11.406 8.368 1.00 30.22 H new ATOM 0 HG LEU A 66 2.321 9.230 6.360 1.00 3.51 H new ATOM 0 HD11 LEU A 66 2.698 10.909 4.641 1.00 64.24 H new ATOM 0 HD12 LEU A 66 1.278 11.290 5.644 1.00 64.24 H new ATOM 0 HD13 LEU A 66 2.806 12.168 5.895 1.00 64.24 H new ATOM 0 HD21 LEU A 66 4.625 9.770 5.607 1.00 4.12 H new ATOM 0 HD22 LEU A 66 4.757 10.973 6.912 1.00 4.12 H new ATOM 0 HD23 LEU A 66 4.601 9.245 7.307 1.00 4.12 H new ATOM 1101 N ASN A 67 3.695 9.867 11.002 1.00 12.10 N ATOM 1102 CA ASN A 67 4.033 10.352 12.319 1.00 41.34 C ATOM 1103 C ASN A 67 3.268 9.597 13.414 1.00 62.50 C ATOM 1104 O ASN A 67 3.249 10.003 14.580 1.00 11.03 O ATOM 1105 CB ASN A 67 3.824 11.869 12.406 1.00 20.23 C ATOM 1106 CG ASN A 67 4.494 12.653 11.250 1.00 13.10 C ATOM 1107 OD1 ASN A 67 5.554 12.110 10.673 1.00 42.33 O flip ATOM 1108 ND2 ASN A 67 4.036 13.735 10.873 1.00 23.21 N flip ATOM 0 H ASN A 67 4.494 9.442 10.531 1.00 12.10 H new ATOM 0 HA ASN A 67 5.091 10.156 12.492 1.00 41.34 H new ATOM 0 HB2 ASN A 67 2.755 12.081 12.406 1.00 20.23 H new ATOM 0 HB3 ASN A 67 4.220 12.228 13.356 1.00 20.23 H new ATOM 0 HD21 ASN A 67 3.218 14.131 11.335 1.00 23.21 H new ATOM 0 HD22 ASN A 67 4.476 14.233 10.099 1.00 23.21 H new ATOM 1300 N CYS C 211 -2.264 -7.539 11.554 1.00 74.20 N ATOM 1301 CA CYS C 211 -0.880 -7.400 11.873 1.00 21.52 C ATOM 1302 C CYS C 211 -0.751 -6.444 13.044 1.00 33.32 C ATOM 1303 O CYS C 211 -1.368 -5.392 13.047 1.00 10.11 O ATOM 1304 CB CYS C 211 -0.111 -6.840 10.656 1.00 51.21 C ATOM 1305 SG CYS C 211 -0.388 -7.737 9.060 1.00 54.33 S ATOM 0 HA CYS C 211 -0.460 -8.372 12.133 1.00 21.52 H new ATOM 0 HB2 CYS C 211 -0.392 -5.796 10.520 1.00 51.21 H new ATOM 0 HB3 CYS C 211 0.955 -6.857 10.882 1.00 51.21 H new ATOM 1310 N ARG C 212 -0.021 -6.830 14.050 1.00 42.22 N ATOM 1311 CA ARG C 212 0.254 -5.949 15.175 1.00 70.04 C ATOM 1312 C ARG C 212 1.746 -5.854 15.381 1.00 61.00 C ATOM 1313 O ARG C 212 2.291 -4.784 15.677 1.00 23.30 O ATOM 1314 CB ARG C 212 -0.454 -6.399 16.453 1.00 41.22 C ATOM 1315 CG ARG C 212 -1.974 -6.372 16.361 1.00 52.33 C ATOM 1316 CD ARG C 212 -2.611 -6.729 17.687 1.00 1.30 C ATOM 1317 NE ARG C 212 -2.246 -8.072 18.133 1.00 71.43 N ATOM 1318 CZ ARG C 212 -2.349 -8.509 19.390 1.00 22.01 C ATOM 1319 NH1 ARG C 212 -2.773 -7.695 20.349 1.00 21.22 N ATOM 1320 NH2 ARG C 212 -2.011 -9.753 19.686 1.00 24.34 N ATOM 0 H ARG C 212 0.403 -7.755 14.125 1.00 42.22 H new ATOM 0 HA ARG C 212 -0.143 -4.962 14.940 1.00 70.04 H new ATOM 0 HB2 ARG C 212 -0.133 -7.412 16.697 1.00 41.22 H new ATOM 0 HB3 ARG C 212 -0.139 -5.758 17.276 1.00 41.22 H new ATOM 0 HG2 ARG C 212 -2.304 -5.380 16.052 1.00 52.33 H new ATOM 0 HG3 ARG C 212 -2.307 -7.072 15.595 1.00 52.33 H new ATOM 0 HD2 ARG C 212 -2.307 -6.003 18.441 1.00 1.30 H new ATOM 0 HD3 ARG C 212 -3.695 -6.660 17.597 1.00 1.30 H new ATOM 0 HE ARG C 212 -1.887 -8.722 17.434 1.00 71.43 H new ATOM 0 HH11 ARG C 212 -3.022 -6.731 20.127 1.00 21.22 H new ATOM 0 HH12 ARG C 212 -2.850 -8.033 21.308 1.00 21.22 H new ATOM 0 HH21 ARG C 212 -1.672 -10.377 18.954 1.00 24.34 H new ATOM 0 HH22 ARG C 212 -2.089 -10.088 20.646 1.00 24.34 H new ATOM 1334 N PHE C 213 2.407 -6.960 15.160 1.00 23.20 N ATOM 1335 CA PHE C 213 3.832 -7.033 15.257 1.00 44.54 C ATOM 1336 C PHE C 213 4.375 -6.863 13.869 1.00 44.51 C ATOM 1337 O PHE C 213 3.755 -7.323 12.896 1.00 74.43 O ATOM 1338 CB PHE C 213 4.267 -8.386 15.839 1.00 43.21 C ATOM 1339 CG PHE C 213 3.782 -8.639 17.246 1.00 13.24 C ATOM 1340 CD1 PHE C 213 2.543 -9.216 17.481 1.00 42.51 C ATOM 1341 CD2 PHE C 213 4.569 -8.298 18.330 1.00 21.13 C ATOM 1342 CE1 PHE C 213 2.106 -9.449 18.767 1.00 4.42 C ATOM 1343 CE2 PHE C 213 4.137 -8.530 19.618 1.00 40.43 C ATOM 1344 CZ PHE C 213 2.903 -9.104 19.835 1.00 2.33 C ATOM 0 H PHE C 213 1.962 -7.842 14.905 1.00 23.20 H new ATOM 0 HA PHE C 213 4.212 -6.257 15.922 1.00 44.54 H new ATOM 0 HB2 PHE C 213 3.900 -9.182 15.191 1.00 43.21 H new ATOM 0 HB3 PHE C 213 5.356 -8.441 15.826 1.00 43.21 H new ATOM 0 HD1 PHE C 213 1.913 -9.486 16.646 1.00 42.51 H new ATOM 0 HD2 PHE C 213 5.535 -7.844 18.165 1.00 21.13 H new ATOM 0 HE1 PHE C 213 1.140 -9.901 18.937 1.00 4.42 H new ATOM 0 HE2 PHE C 213 4.764 -8.263 20.456 1.00 40.43 H new ATOM 0 HZ PHE C 213 2.561 -9.283 20.844 1.00 2.33 H new ATOM 1354 N PHE C 214 5.481 -6.204 13.746 1.00 12.24 N ATOM 1355 CA PHE C 214 5.996 -5.902 12.451 1.00 22.25 C ATOM 1356 C PHE C 214 7.324 -6.593 12.250 1.00 21.12 C ATOM 1357 O PHE C 214 8.046 -6.869 13.217 1.00 31.54 O ATOM 1358 CB PHE C 214 6.139 -4.384 12.251 1.00 22.32 C ATOM 1359 CG PHE C 214 7.393 -3.763 12.813 1.00 2.52 C ATOM 1360 CD1 PHE C 214 7.496 -3.399 14.143 1.00 0.55 C ATOM 1361 CD2 PHE C 214 8.472 -3.540 11.975 1.00 44.32 C ATOM 1362 CE1 PHE C 214 8.660 -2.826 14.621 1.00 44.45 C ATOM 1363 CE2 PHE C 214 9.628 -2.978 12.434 1.00 53.23 C ATOM 1364 CZ PHE C 214 9.731 -2.615 13.766 1.00 4.13 C ATOM 0 H PHE C 214 6.045 -5.865 14.526 1.00 12.24 H new ATOM 0 HA PHE C 214 5.290 -6.269 11.706 1.00 22.25 H new ATOM 0 HB2 PHE C 214 6.099 -4.172 11.183 1.00 22.32 H new ATOM 0 HB3 PHE C 214 5.278 -3.894 12.706 1.00 22.32 H new ATOM 0 HD1 PHE C 214 6.664 -3.563 14.811 1.00 0.55 H new ATOM 0 HD2 PHE C 214 8.397 -3.817 10.934 1.00 44.32 H new ATOM 0 HE1 PHE C 214 8.735 -2.543 15.660 1.00 44.45 H new ATOM 0 HE2 PHE C 214 10.458 -2.817 11.762 1.00 53.23 H new ATOM 0 HZ PHE C 214 10.642 -2.169 14.138 1.00 4.13 H new ATOM 1374 N GLU C 215 7.629 -6.899 11.029 1.00 40.43 N ATOM 1375 CA GLU C 215 8.864 -7.516 10.707 1.00 31.31 C ATOM 1376 C GLU C 215 9.932 -6.427 10.505 1.00 1.32 C ATOM 1377 O GLU C 215 9.713 -5.465 9.771 1.00 73.22 O ATOM 1378 CB GLU C 215 8.682 -8.346 9.452 1.00 64.54 C ATOM 1379 CG GLU C 215 9.882 -9.153 9.095 1.00 51.01 C ATOM 1380 CD GLU C 215 10.270 -10.078 10.221 1.00 4.40 C ATOM 1381 OE1 GLU C 215 9.636 -11.142 10.383 1.00 71.33 O ATOM 1382 OE2 GLU C 215 11.201 -9.738 10.985 1.00 22.01 O ATOM 0 H GLU C 215 7.022 -6.725 10.228 1.00 40.43 H new ATOM 0 HA GLU C 215 9.191 -8.172 11.514 1.00 31.31 H new ATOM 0 HB2 GLU C 215 7.832 -9.014 9.588 1.00 64.54 H new ATOM 0 HB3 GLU C 215 8.438 -7.685 8.621 1.00 64.54 H new ATOM 0 HG2 GLU C 215 9.678 -9.735 8.196 1.00 51.01 H new ATOM 0 HG3 GLU C 215 10.715 -8.489 8.863 1.00 51.01 H new ATOM 1389 N SER C 216 11.073 -6.595 11.136 1.00 31.21 N ATOM 1390 CA SER C 216 12.124 -5.590 11.116 1.00 43.42 C ATOM 1391 C SER C 216 13.284 -5.971 10.180 1.00 34.22 C ATOM 1392 O SER C 216 14.349 -5.348 10.186 1.00 71.40 O ATOM 1393 CB SER C 216 12.597 -5.353 12.548 1.00 55.23 C ATOM 1394 OG SER C 216 12.898 -6.588 13.201 1.00 21.15 O ATOM 0 H SER C 216 11.303 -7.428 11.677 1.00 31.21 H new ATOM 0 HA SER C 216 11.720 -4.663 10.710 1.00 43.42 H new ATOM 0 HB2 SER C 216 13.482 -4.716 12.541 1.00 55.23 H new ATOM 0 HB3 SER C 216 11.826 -4.822 13.106 1.00 55.23 H new ATOM 0 HG SER C 216 13.200 -6.409 14.116 1.00 21.15 H new ATOM 1400 N HIS C 217 13.045 -6.960 9.356 1.00 52.41 N ATOM 1401 CA HIS C 217 14.037 -7.453 8.398 1.00 51.05 C ATOM 1402 C HIS C 217 13.708 -6.863 7.013 1.00 74.23 C ATOM 1403 O HIS C 217 14.176 -7.324 5.984 1.00 33.20 O ATOM 1404 CB HIS C 217 13.941 -9.007 8.381 1.00 42.02 C ATOM 1405 CG HIS C 217 14.981 -9.744 7.563 1.00 5.11 C ATOM 1406 ND1 HIS C 217 16.154 -10.214 8.096 1.00 13.44 N ATOM 1407 CD2 HIS C 217 14.994 -10.118 6.261 1.00 53.04 C ATOM 1408 CE1 HIS C 217 16.845 -10.835 7.166 1.00 21.31 C ATOM 1409 NE2 HIS C 217 16.163 -10.793 6.040 1.00 34.32 N ATOM 0 H HIS C 217 12.155 -7.457 9.321 1.00 52.41 H new ATOM 0 HA HIS C 217 15.050 -7.157 8.670 1.00 51.05 H new ATOM 0 HB2 HIS C 217 14.002 -9.363 9.409 1.00 42.02 H new ATOM 0 HB3 HIS C 217 12.955 -9.283 8.006 1.00 42.02 H new ATOM 0 HD2 HIS C 217 14.223 -9.920 5.531 1.00 53.04 H new ATOM 0 HE1 HIS C 217 17.810 -11.301 7.302 1.00 21.31 H new ATOM 0 HE2 HIS C 217 16.458 -11.197 5.151 1.00 34.32 H new ATOM 1418 N VAL C 218 12.931 -5.816 7.009 1.00 14.14 N ATOM 1419 CA VAL C 218 12.421 -5.288 5.775 1.00 71.10 C ATOM 1420 C VAL C 218 13.183 -4.074 5.267 1.00 75.23 C ATOM 1421 O VAL C 218 13.136 -2.981 5.854 1.00 11.42 O ATOM 1422 CB VAL C 218 10.922 -5.005 5.875 1.00 34.34 C ATOM 1423 CG1 VAL C 218 10.377 -4.526 4.552 1.00 14.31 C ATOM 1424 CG2 VAL C 218 10.236 -6.271 6.319 1.00 0.41 C ATOM 0 H VAL C 218 12.637 -5.312 7.846 1.00 14.14 H new ATOM 0 HA VAL C 218 12.578 -6.066 5.028 1.00 71.10 H new ATOM 0 HB VAL C 218 10.738 -4.212 6.600 1.00 34.34 H new ATOM 0 HG11 VAL C 218 9.309 -4.331 4.648 1.00 14.31 H new ATOM 0 HG12 VAL C 218 10.888 -3.609 4.258 1.00 14.31 H new ATOM 0 HG13 VAL C 218 10.540 -5.291 3.793 1.00 14.31 H new ATOM 0 HG21 VAL C 218 9.163 -6.095 6.398 1.00 0.41 H new ATOM 0 HG22 VAL C 218 10.421 -7.060 5.590 1.00 0.41 H new ATOM 0 HG23 VAL C 218 10.626 -6.575 7.290 1.00 0.41 H new ATOM 1434 N ALA C 219 13.893 -4.293 4.194 1.00 3.34 N ATOM 1435 CA ALA C 219 14.636 -3.265 3.512 1.00 21.12 C ATOM 1436 C ALA C 219 13.836 -2.818 2.300 1.00 20.41 C ATOM 1437 O ALA C 219 13.225 -3.646 1.615 1.00 25.15 O ATOM 1438 CB ALA C 219 15.981 -3.818 3.073 1.00 72.34 C ATOM 0 H ALA C 219 13.974 -5.212 3.758 1.00 3.34 H new ATOM 0 HA ALA C 219 14.806 -2.417 4.175 1.00 21.12 H new ATOM 0 HB1 ALA C 219 16.543 -3.040 2.557 1.00 72.34 H new ATOM 0 HB2 ALA C 219 16.541 -4.151 3.947 1.00 72.34 H new ATOM 0 HB3 ALA C 219 15.826 -4.661 2.399 1.00 72.34 H new ATOM 1444 N ARG C 220 13.855 -1.537 2.031 1.00 54.22 N ATOM 1445 CA ARG C 220 13.073 -0.934 0.948 1.00 73.22 C ATOM 1446 C ARG C 220 13.444 -1.481 -0.439 1.00 20.51 C ATOM 1447 O ARG C 220 12.593 -1.608 -1.307 1.00 21.43 O ATOM 1448 CB ARG C 220 13.222 0.580 1.001 1.00 30.42 C ATOM 1449 CG ARG C 220 12.460 1.337 -0.061 1.00 64.24 C ATOM 1450 CD ARG C 220 12.538 2.814 0.208 1.00 71.25 C ATOM 1451 NE ARG C 220 11.875 3.598 -0.817 1.00 14.41 N ATOM 1452 CZ ARG C 220 11.911 4.924 -0.898 1.00 15.24 C ATOM 1453 NH1 ARG C 220 12.518 5.645 0.052 1.00 3.42 N ATOM 1454 NH2 ARG C 220 11.330 5.537 -1.930 1.00 44.13 N ATOM 0 H ARG C 220 14.415 -0.865 2.555 1.00 54.22 H new ATOM 0 HA ARG C 220 12.029 -1.206 1.102 1.00 73.22 H new ATOM 0 HB2 ARG C 220 12.892 0.928 1.980 1.00 30.42 H new ATOM 0 HB3 ARG C 220 14.280 0.829 0.914 1.00 30.42 H new ATOM 0 HG2 ARG C 220 12.873 1.115 -1.045 1.00 64.24 H new ATOM 0 HG3 ARG C 220 11.419 1.015 -0.073 1.00 64.24 H new ATOM 0 HD2 ARG C 220 12.085 3.029 1.176 1.00 71.25 H new ATOM 0 HD3 ARG C 220 13.584 3.114 0.272 1.00 71.25 H new ATOM 0 HE ARG C 220 11.343 3.095 -1.527 1.00 14.41 H new ATOM 0 HH11 ARG C 220 12.957 5.177 0.845 1.00 3.42 H new ATOM 0 HH12 ARG C 220 12.542 6.662 -0.017 1.00 3.42 H new ATOM 0 HH21 ARG C 220 10.862 4.988 -2.651 1.00 44.13 H new ATOM 0 HH22 ARG C 220 11.354 6.554 -1.998 1.00 44.13 H new ATOM 1468 N ALA C 221 14.698 -1.832 -0.618 1.00 34.14 N ATOM 1469 CA ALA C 221 15.171 -2.360 -1.890 1.00 51.44 C ATOM 1470 C ALA C 221 14.746 -3.814 -2.075 1.00 32.04 C ATOM 1471 O ALA C 221 14.843 -4.373 -3.180 1.00 44.53 O ATOM 1472 CB ALA C 221 16.685 -2.230 -1.992 1.00 53.35 C ATOM 0 H ALA C 221 15.417 -1.763 0.102 1.00 34.14 H new ATOM 0 HA ALA C 221 14.716 -1.773 -2.688 1.00 51.44 H new ATOM 0 HB1 ALA C 221 17.021 -2.630 -2.949 1.00 53.35 H new ATOM 0 HB2 ALA C 221 16.966 -1.179 -1.919 1.00 53.35 H new ATOM 0 HB3 ALA C 221 17.154 -2.788 -1.181 1.00 53.35 H new ATOM 1478 N ASN C 222 14.264 -4.425 -1.010 1.00 3.22 N ATOM 1479 CA ASN C 222 13.848 -5.785 -1.060 1.00 44.33 C ATOM 1480 C ASN C 222 12.339 -5.816 -1.254 1.00 3.42 C ATOM 1481 O ASN C 222 11.793 -6.760 -1.799 1.00 61.44 O ATOM 1482 CB ASN C 222 14.287 -6.510 0.231 1.00 14.12 C ATOM 1483 CG ASN C 222 14.076 -8.016 0.199 1.00 20.33 C ATOM 1484 OD1 ASN C 222 14.093 -8.642 -0.852 1.00 31.15 O ATOM 1485 ND2 ASN C 222 13.929 -8.611 1.358 1.00 24.53 N ATOM 0 H ASN C 222 14.156 -3.983 -0.097 1.00 3.22 H new ATOM 0 HA ASN C 222 14.314 -6.308 -1.895 1.00 44.33 H new ATOM 0 HB2 ASN C 222 15.343 -6.305 0.409 1.00 14.12 H new ATOM 0 HB3 ASN C 222 13.735 -6.094 1.074 1.00 14.12 H new ATOM 0 HD21 ASN C 222 13.825 -9.625 1.401 1.00 24.53 H new ATOM 0 HD22 ASN C 222 13.919 -8.060 2.216 1.00 24.53 H new ATOM 1492 N VAL C 223 11.673 -4.745 -0.814 1.00 31.33 N ATOM 1493 CA VAL C 223 10.235 -4.605 -0.970 1.00 53.12 C ATOM 1494 C VAL C 223 9.865 -4.337 -2.432 1.00 74.11 C ATOM 1495 O VAL C 223 10.499 -3.527 -3.119 1.00 55.04 O ATOM 1496 CB VAL C 223 9.650 -3.487 -0.051 1.00 22.11 C ATOM 1497 CG1 VAL C 223 8.161 -3.374 -0.189 1.00 72.54 C ATOM 1498 CG2 VAL C 223 10.015 -3.745 1.368 1.00 25.31 C ATOM 0 H VAL C 223 12.119 -3.958 -0.343 1.00 31.33 H new ATOM 0 HA VAL C 223 9.791 -5.552 -0.662 1.00 53.12 H new ATOM 0 HB VAL C 223 10.084 -2.539 -0.369 1.00 22.11 H new ATOM 0 HG11 VAL C 223 7.794 -2.585 0.467 1.00 72.54 H new ATOM 0 HG12 VAL C 223 7.908 -3.134 -1.222 1.00 72.54 H new ATOM 0 HG13 VAL C 223 7.697 -4.321 0.087 1.00 72.54 H new ATOM 0 HG21 VAL C 223 9.601 -2.958 1.999 1.00 25.31 H new ATOM 0 HG22 VAL C 223 9.611 -4.709 1.678 1.00 25.31 H new ATOM 0 HG23 VAL C 223 11.100 -3.757 1.468 1.00 25.31 H new ATOM 1508 N LYS C 224 8.877 -5.059 -2.899 1.00 33.03 N ATOM 1509 CA LYS C 224 8.361 -4.920 -4.247 1.00 24.25 C ATOM 1510 C LYS C 224 7.263 -3.907 -4.248 1.00 61.23 C ATOM 1511 O LYS C 224 7.103 -3.124 -5.178 1.00 53.11 O ATOM 1512 CB LYS C 224 7.716 -6.204 -4.649 1.00 12.13 C ATOM 1513 CG LYS C 224 8.580 -7.403 -4.599 1.00 72.34 C ATOM 1514 CD LYS C 224 7.742 -8.635 -4.841 1.00 0.24 C ATOM 1515 CE LYS C 224 7.069 -8.588 -6.196 1.00 61.02 C ATOM 1516 NZ LYS C 224 8.040 -8.384 -7.305 1.00 33.44 N ATOM 0 H LYS C 224 8.398 -5.772 -2.349 1.00 33.03 H new ATOM 0 HA LYS C 224 9.178 -4.640 -4.911 1.00 24.25 H new ATOM 0 HB2 LYS C 224 6.854 -6.373 -4.003 1.00 12.13 H new ATOM 0 HB3 LYS C 224 7.336 -6.095 -5.665 1.00 12.13 H new ATOM 0 HG2 LYS C 224 9.365 -7.330 -5.351 1.00 72.34 H new ATOM 0 HG3 LYS C 224 9.073 -7.470 -3.629 1.00 72.34 H new ATOM 0 HD2 LYS C 224 8.371 -9.523 -4.776 1.00 0.24 H new ATOM 0 HD3 LYS C 224 6.986 -8.722 -4.060 1.00 0.24 H new ATOM 0 HE2 LYS C 224 6.524 -9.518 -6.360 1.00 61.02 H new ATOM 0 HE3 LYS C 224 6.335 -7.782 -6.206 1.00 61.02 H new ATOM 0 HZ1 LYS C 224 7.574 -8.577 -8.214 1.00 33.44 H new ATOM 0 HZ2 LYS C 224 8.381 -7.401 -7.292 1.00 33.44 H new ATOM 0 HZ3 LYS C 224 8.845 -9.031 -7.185 1.00 33.44 H new ATOM 1530 N HIS C 225 6.464 -3.982 -3.221 1.00 73.21 N ATOM 1531 CA HIS C 225 5.327 -3.128 -3.061 1.00 1.11 C ATOM 1532 C HIS C 225 4.836 -3.194 -1.635 1.00 32.13 C ATOM 1533 O HIS C 225 5.108 -4.176 -0.923 1.00 30.45 O ATOM 1534 CB HIS C 225 4.193 -3.521 -4.059 1.00 1.04 C ATOM 1535 CG HIS C 225 3.737 -4.942 -3.961 1.00 13.43 C ATOM 1536 ND1 HIS C 225 4.184 -5.924 -4.814 1.00 33.04 N ATOM 1537 CD2 HIS C 225 2.887 -5.546 -3.104 1.00 54.31 C ATOM 1538 CE1 HIS C 225 3.639 -7.067 -4.482 1.00 43.30 C ATOM 1539 NE2 HIS C 225 2.846 -6.869 -3.446 1.00 61.51 N ATOM 0 H HIS C 225 6.589 -4.650 -2.461 1.00 73.21 H new ATOM 0 HA HIS C 225 5.623 -2.103 -3.283 1.00 1.11 H new ATOM 0 HB2 HIS C 225 3.337 -2.867 -3.891 1.00 1.04 H new ATOM 0 HB3 HIS C 225 4.542 -3.335 -5.075 1.00 1.04 H new ATOM 0 HD2 HIS C 225 2.342 -5.073 -2.300 1.00 54.31 H new ATOM 0 HE1 HIS C 225 3.810 -8.013 -4.974 1.00 43.30 H new ATOM 0 HE2 HIS C 225 2.293 -7.586 -2.977 1.00 61.51 H new ATOM 1548 N LEU C 226 4.094 -2.201 -1.255 1.00 52.21 N ATOM 1549 CA LEU C 226 3.546 -2.087 0.070 1.00 52.43 C ATOM 1550 C LEU C 226 2.064 -2.238 -0.033 1.00 13.23 C ATOM 1551 O LEU C 226 1.481 -1.868 -1.031 1.00 2.23 O ATOM 1552 CB LEU C 226 3.847 -0.693 0.654 1.00 74.20 C ATOM 1553 CG LEU C 226 5.301 -0.317 0.855 1.00 35.24 C ATOM 1554 CD1 LEU C 226 5.394 1.069 1.409 1.00 45.12 C ATOM 1555 CD2 LEU C 226 5.972 -1.252 1.804 1.00 23.34 C ATOM 0 H LEU C 226 3.844 -1.426 -1.869 1.00 52.21 H new ATOM 0 HA LEU C 226 3.984 -2.850 0.714 1.00 52.43 H new ATOM 0 HB2 LEU C 226 3.395 0.051 -0.002 1.00 74.20 H new ATOM 0 HB3 LEU C 226 3.344 -0.616 1.618 1.00 74.20 H new ATOM 0 HG LEU C 226 5.797 -0.374 -0.114 1.00 35.24 H new ATOM 0 HD11 LEU C 226 6.442 1.334 1.552 1.00 45.12 H new ATOM 0 HD12 LEU C 226 4.933 1.771 0.713 1.00 45.12 H new ATOM 0 HD13 LEU C 226 4.875 1.114 2.366 1.00 45.12 H new ATOM 0 HD21 LEU C 226 7.014 -0.958 1.929 1.00 23.34 H new ATOM 0 HD22 LEU C 226 5.467 -1.216 2.769 1.00 23.34 H new ATOM 0 HD23 LEU C 226 5.926 -2.267 1.408 1.00 23.34 H new ATOM 1567 N LYS C 227 1.469 -2.813 0.948 1.00 64.11 N ATOM 1568 CA LYS C 227 0.066 -2.969 0.973 1.00 73.04 C ATOM 1569 C LYS C 227 -0.471 -2.468 2.305 1.00 71.22 C ATOM 1570 O LYS C 227 -0.131 -2.981 3.349 1.00 42.22 O ATOM 1571 CB LYS C 227 -0.294 -4.436 0.641 1.00 32.44 C ATOM 1572 CG LYS C 227 -1.777 -4.743 0.553 1.00 53.12 C ATOM 1573 CD LYS C 227 -2.367 -5.284 1.852 1.00 12.23 C ATOM 1574 CE LYS C 227 -1.854 -6.696 2.127 1.00 41.00 C ATOM 1575 NZ LYS C 227 -2.472 -7.314 3.323 1.00 44.14 N ATOM 0 H LYS C 227 1.950 -3.192 1.764 1.00 64.11 H new ATOM 0 HA LYS C 227 -0.419 -2.364 0.207 1.00 73.04 H new ATOM 0 HB2 LYS C 227 0.170 -4.699 -0.309 1.00 32.44 H new ATOM 0 HB3 LYS C 227 0.148 -5.081 1.401 1.00 32.44 H new ATOM 0 HG2 LYS C 227 -2.311 -3.836 0.271 1.00 53.12 H new ATOM 0 HG3 LYS C 227 -1.942 -5.470 -0.242 1.00 53.12 H new ATOM 0 HD2 LYS C 227 -2.101 -4.627 2.680 1.00 12.23 H new ATOM 0 HD3 LYS C 227 -3.455 -5.292 1.788 1.00 12.23 H new ATOM 0 HE2 LYS C 227 -2.051 -7.324 1.258 1.00 41.00 H new ATOM 0 HE3 LYS C 227 -0.772 -6.664 2.259 1.00 41.00 H new ATOM 0 HZ1 LYS C 227 -2.669 -8.317 3.133 1.00 44.14 H new ATOM 0 HZ2 LYS C 227 -1.820 -7.236 4.130 1.00 44.14 H new ATOM 0 HZ3 LYS C 227 -3.361 -6.823 3.547 1.00 44.14 H new ATOM 1589 N ILE C 228 -1.307 -1.468 2.234 1.00 42.22 N ATOM 1590 CA ILE C 228 -1.833 -0.782 3.397 1.00 72.43 C ATOM 1591 C ILE C 228 -3.248 -1.279 3.623 1.00 11.12 C ATOM 1592 O ILE C 228 -4.063 -1.206 2.724 1.00 43.55 O ATOM 1593 CB ILE C 228 -1.942 0.733 3.121 1.00 42.44 C ATOM 1594 CG1 ILE C 228 -0.608 1.330 2.648 1.00 52.44 C ATOM 1595 CG2 ILE C 228 -2.370 1.443 4.401 1.00 40.14 C ATOM 1596 CD1 ILE C 228 0.374 1.592 3.741 1.00 15.04 C ATOM 0 H ILE C 228 -1.653 -1.095 1.350 1.00 42.22 H new ATOM 0 HA ILE C 228 -1.178 -0.966 4.248 1.00 72.43 H new ATOM 0 HB ILE C 228 -2.677 0.875 2.328 1.00 42.44 H new ATOM 0 HG12 ILE C 228 -0.156 0.650 1.926 1.00 52.44 H new ATOM 0 HG13 ILE C 228 -0.808 2.265 2.124 1.00 52.44 H new ATOM 0 HG21 ILE C 228 -2.449 2.514 4.214 1.00 40.14 H new ATOM 0 HG22 ILE C 228 -3.337 1.059 4.724 1.00 40.14 H new ATOM 0 HG23 ILE C 228 -1.630 1.265 5.181 1.00 40.14 H new ATOM 0 HD11 ILE C 228 1.286 2.012 3.318 1.00 15.04 H new ATOM 0 HD12 ILE C 228 -0.054 2.297 4.453 1.00 15.04 H new ATOM 0 HD13 ILE C 228 0.608 0.658 4.251 1.00 15.04 H new ATOM 1608 N LEU C 229 -3.535 -1.775 4.786 1.00 14.13 N ATOM 1609 CA LEU C 229 -4.850 -2.326 5.080 1.00 71.54 C ATOM 1610 C LEU C 229 -5.704 -1.271 5.757 1.00 60.21 C ATOM 1611 O LEU C 229 -5.213 -0.537 6.617 1.00 34.11 O ATOM 1612 CB LEU C 229 -4.760 -3.594 5.977 1.00 34.21 C ATOM 1613 CG LEU C 229 -3.941 -4.807 5.449 1.00 55.22 C ATOM 1614 CD1 LEU C 229 -2.453 -4.500 5.351 1.00 32.42 C ATOM 1615 CD2 LEU C 229 -4.167 -6.019 6.320 1.00 24.22 C ATOM 0 H LEU C 229 -2.878 -1.816 5.565 1.00 14.13 H new ATOM 0 HA LEU C 229 -5.308 -2.624 4.137 1.00 71.54 H new ATOM 0 HB2 LEU C 229 -4.334 -3.296 6.935 1.00 34.21 H new ATOM 0 HB3 LEU C 229 -5.776 -3.937 6.173 1.00 34.21 H new ATOM 0 HG LEU C 229 -4.297 -5.018 4.441 1.00 55.22 H new ATOM 0 HD11 LEU C 229 -1.924 -5.377 4.978 1.00 32.42 H new ATOM 0 HD12 LEU C 229 -2.298 -3.665 4.668 1.00 32.42 H new ATOM 0 HD13 LEU C 229 -2.070 -4.238 6.337 1.00 32.42 H new ATOM 0 HD21 LEU C 229 -3.586 -6.857 5.935 1.00 24.22 H new ATOM 0 HD22 LEU C 229 -3.853 -5.798 7.340 1.00 24.22 H new ATOM 0 HD23 LEU C 229 -5.226 -6.279 6.315 1.00 24.22 H new ATOM 1627 N ASN C 230 -6.973 -1.174 5.374 1.00 24.44 N ATOM 1628 CA ASN C 230 -7.842 -0.165 5.966 1.00 53.43 C ATOM 1629 C ASN C 230 -8.465 -0.716 7.219 1.00 4.42 C ATOM 1630 O ASN C 230 -9.337 -1.587 7.170 1.00 62.40 O ATOM 1631 CB ASN C 230 -8.938 0.251 4.965 1.00 75.11 C ATOM 1632 CG ASN C 230 -9.804 1.406 5.430 1.00 4.22 C ATOM 1633 OD1 ASN C 230 -9.376 2.255 6.220 1.00 50.50 O ATOM 1634 ND2 ASN C 230 -10.995 1.492 4.887 1.00 30.44 N ATOM 0 H ASN C 230 -7.415 -1.768 4.672 1.00 24.44 H new ATOM 0 HA ASN C 230 -7.251 0.716 6.215 1.00 53.43 H new ATOM 0 HB2 ASN C 230 -8.466 0.523 4.021 1.00 75.11 H new ATOM 0 HB3 ASN C 230 -9.577 -0.609 4.766 1.00 75.11 H new ATOM 0 HD21 ASN C 230 -11.603 2.280 5.113 1.00 30.44 H new ATOM 0 HD22 ASN C 230 -11.313 0.771 4.239 1.00 30.44 H new ATOM 1641 N THR C 231 -8.014 -0.226 8.322 1.00 73.43 N ATOM 1642 CA THR C 231 -8.501 -0.618 9.596 1.00 3.13 C ATOM 1643 C THR C 231 -9.099 0.580 10.310 1.00 4.02 C ATOM 1644 O THR C 231 -8.496 1.645 10.326 1.00 44.12 O ATOM 1645 CB THR C 231 -7.367 -1.253 10.429 1.00 24.12 C ATOM 1646 OG1 THR C 231 -6.190 -0.427 10.354 1.00 35.51 O ATOM 1647 CG2 THR C 231 -7.039 -2.657 9.933 1.00 54.55 C ATOM 0 H THR C 231 -7.276 0.477 8.362 1.00 73.43 H new ATOM 0 HA THR C 231 -9.283 -1.366 9.467 1.00 3.13 H new ATOM 0 HB THR C 231 -7.703 -1.325 11.463 1.00 24.12 H new ATOM 0 HG1 THR C 231 -6.346 0.410 10.840 1.00 35.51 H new ATOM 0 HG21 THR C 231 -6.237 -3.079 10.539 1.00 54.55 H new ATOM 0 HG22 THR C 231 -7.924 -3.287 10.014 1.00 54.55 H new ATOM 0 HG23 THR C 231 -6.721 -2.610 8.892 1.00 54.55 H new ATOM 1655 N PRO C 232 -10.293 0.445 10.884 1.00 71.31 N ATOM 1656 CA PRO C 232 -10.946 1.551 11.576 1.00 52.31 C ATOM 1657 C PRO C 232 -10.411 1.762 13.005 1.00 73.23 C ATOM 1658 O PRO C 232 -10.432 2.873 13.538 1.00 54.42 O ATOM 1659 CB PRO C 232 -12.414 1.123 11.604 1.00 43.52 C ATOM 1660 CG PRO C 232 -12.381 -0.371 11.607 1.00 62.20 C ATOM 1661 CD PRO C 232 -11.123 -0.782 10.877 1.00 4.34 C ATOM 0 HA PRO C 232 -10.771 2.504 11.077 1.00 52.31 H new ATOM 0 HB2 PRO C 232 -12.921 1.508 12.489 1.00 43.52 H new ATOM 0 HB3 PRO C 232 -12.953 1.504 10.737 1.00 43.52 H new ATOM 0 HG2 PRO C 232 -12.379 -0.755 12.627 1.00 62.20 H new ATOM 0 HG3 PRO C 232 -13.264 -0.778 11.115 1.00 62.20 H new ATOM 0 HD2 PRO C 232 -10.620 -1.608 11.380 1.00 4.34 H new ATOM 0 HD3 PRO C 232 -11.340 -1.112 9.861 1.00 4.34 H new ATOM 1669 N ASN C 233 -9.919 0.707 13.612 1.00 34.31 N ATOM 1670 CA ASN C 233 -9.437 0.757 14.989 1.00 51.21 C ATOM 1671 C ASN C 233 -7.916 0.656 15.071 1.00 51.20 C ATOM 1672 O ASN C 233 -7.341 0.569 16.154 1.00 14.24 O ATOM 1673 CB ASN C 233 -10.119 -0.316 15.849 1.00 61.43 C ATOM 1674 CG ASN C 233 -9.916 -1.736 15.344 1.00 51.54 C ATOM 1675 OD1 ASN C 233 -9.759 -1.980 14.140 1.00 20.01 O ATOM 1676 ND2 ASN C 233 -9.938 -2.671 16.242 1.00 1.31 N ATOM 0 H ASN C 233 -9.838 -0.211 13.174 1.00 34.31 H new ATOM 0 HA ASN C 233 -9.708 1.733 15.391 1.00 51.21 H new ATOM 0 HB2 ASN C 233 -9.738 -0.246 16.868 1.00 61.43 H new ATOM 0 HB3 ASN C 233 -11.188 -0.106 15.893 1.00 61.43 H new ATOM 0 HD21 ASN C 233 -9.824 -3.646 15.966 1.00 1.31 H new ATOM 0 HD22 ASN C 233 -10.070 -2.431 17.225 1.00 1.31 H new ATOM 1683 N CYS C 234 -7.286 0.691 13.934 1.00 24.24 N ATOM 1684 CA CYS C 234 -5.844 0.716 13.836 1.00 54.34 C ATOM 1685 C CYS C 234 -5.485 1.768 12.809 1.00 61.41 C ATOM 1686 O CYS C 234 -6.118 1.836 11.759 1.00 63.33 O ATOM 1687 CB CYS C 234 -5.265 -0.671 13.457 1.00 20.23 C ATOM 1688 SG CYS C 234 -5.563 -1.988 14.695 1.00 12.52 S ATOM 0 H CYS C 234 -7.760 0.703 13.031 1.00 24.24 H new ATOM 0 HA CYS C 234 -5.406 0.961 14.804 1.00 54.34 H new ATOM 0 HB2 CYS C 234 -5.696 -0.982 12.505 1.00 20.23 H new ATOM 0 HB3 CYS C 234 -4.190 -0.572 13.304 1.00 20.23 H new ATOM 0 HG CYS C 234 -6.307 -1.522 15.654 1.00 12.52 H new ATOM 1693 N ALA C 235 -4.520 2.607 13.128 1.00 51.04 N ATOM 1694 CA ALA C 235 -4.144 3.725 12.265 1.00 53.35 C ATOM 1695 C ALA C 235 -3.720 3.282 10.871 1.00 24.43 C ATOM 1696 O ALA C 235 -4.360 3.632 9.874 1.00 61.14 O ATOM 1697 CB ALA C 235 -3.053 4.554 12.915 1.00 71.32 C ATOM 0 H ALA C 235 -3.973 2.540 13.986 1.00 51.04 H new ATOM 0 HA ALA C 235 -5.036 4.339 12.140 1.00 53.35 H new ATOM 0 HB1 ALA C 235 -2.785 5.382 12.259 1.00 71.32 H new ATOM 0 HB2 ALA C 235 -3.412 4.947 13.866 1.00 71.32 H new ATOM 0 HB3 ALA C 235 -2.176 3.930 13.088 1.00 71.32 H new ATOM 1703 N CYS C 236 -2.671 2.512 10.794 1.00 22.13 N ATOM 1704 CA CYS C 236 -2.151 2.116 9.516 1.00 23.30 C ATOM 1705 C CYS C 236 -1.457 0.758 9.598 1.00 4.33 C ATOM 1706 O CYS C 236 -0.535 0.557 10.404 1.00 42.10 O ATOM 1707 CB CYS C 236 -1.187 3.200 9.008 1.00 53.45 C ATOM 1708 SG CYS C 236 -0.442 2.868 7.385 1.00 11.03 S ATOM 0 H CYS C 236 -2.161 2.147 11.598 1.00 22.13 H new ATOM 0 HA CYS C 236 -2.976 2.010 8.812 1.00 23.30 H new ATOM 0 HB2 CYS C 236 -1.724 4.147 8.957 1.00 53.45 H new ATOM 0 HB3 CYS C 236 -0.388 3.325 9.739 1.00 53.45 H new ATOM 1713 N GLN C 237 -1.931 -0.175 8.800 1.00 75.24 N ATOM 1714 CA GLN C 237 -1.344 -1.489 8.708 1.00 72.02 C ATOM 1715 C GLN C 237 -0.649 -1.613 7.376 1.00 71.21 C ATOM 1716 O GLN C 237 -1.284 -1.475 6.339 1.00 33.32 O ATOM 1717 CB GLN C 237 -2.421 -2.559 8.827 1.00 45.41 C ATOM 1718 CG GLN C 237 -3.185 -2.529 10.139 1.00 61.55 C ATOM 1719 CD GLN C 237 -2.286 -2.691 11.347 1.00 10.13 C ATOM 1720 OE1 GLN C 237 -2.576 -2.182 12.423 1.00 4.45 O ATOM 1721 NE2 GLN C 237 -1.188 -3.376 11.183 1.00 73.01 N ATOM 0 H GLN C 237 -2.740 -0.039 8.194 1.00 75.24 H new ATOM 0 HA GLN C 237 -0.629 -1.627 9.519 1.00 72.02 H new ATOM 0 HB2 GLN C 237 -3.127 -2.441 8.005 1.00 45.41 H new ATOM 0 HB3 GLN C 237 -1.958 -3.539 8.711 1.00 45.41 H new ATOM 0 HG2 GLN C 237 -3.725 -1.585 10.218 1.00 61.55 H new ATOM 0 HG3 GLN C 237 -3.931 -3.324 10.138 1.00 61.55 H new ATOM 0 HE21 GLN C 237 -0.975 -3.788 10.274 1.00 73.01 H new ATOM 0 HE22 GLN C 237 -0.543 -3.500 11.963 1.00 73.01 H new ATOM 1730 N ILE C 238 0.633 -1.867 7.396 1.00 43.21 N ATOM 1731 CA ILE C 238 1.402 -1.911 6.190 1.00 70.10 C ATOM 1732 C ILE C 238 2.048 -3.272 6.000 1.00 12.03 C ATOM 1733 O ILE C 238 2.607 -3.845 6.919 1.00 34.44 O ATOM 1734 CB ILE C 238 2.503 -0.833 6.208 1.00 0.12 C ATOM 1735 CG1 ILE C 238 1.894 0.499 6.646 1.00 42.45 C ATOM 1736 CG2 ILE C 238 3.162 -0.708 4.827 1.00 73.40 C ATOM 1737 CD1 ILE C 238 2.804 1.669 6.524 1.00 12.44 C ATOM 0 H ILE C 238 1.167 -2.048 8.246 1.00 43.21 H new ATOM 0 HA ILE C 238 0.718 -1.723 5.362 1.00 70.10 H new ATOM 0 HB ILE C 238 3.279 -1.120 6.917 1.00 0.12 H new ATOM 0 HG12 ILE C 238 1.000 0.687 6.051 1.00 42.45 H new ATOM 0 HG13 ILE C 238 1.573 0.412 7.684 1.00 42.45 H new ATOM 0 HG21 ILE C 238 3.936 0.058 4.861 1.00 73.40 H new ATOM 0 HG22 ILE C 238 3.608 -1.663 4.549 1.00 73.40 H new ATOM 0 HG23 ILE C 238 2.410 -0.431 4.089 1.00 73.40 H new ATOM 0 HD11 ILE C 238 2.287 2.569 6.857 1.00 12.44 H new ATOM 0 HD12 ILE C 238 3.688 1.509 7.142 1.00 12.44 H new ATOM 0 HD13 ILE C 238 3.106 1.788 5.483 1.00 12.44 H new ATOM 1749 N VAL C 239 1.943 -3.768 4.823 1.00 62.20 N ATOM 1750 CA VAL C 239 2.539 -5.003 4.418 1.00 51.31 C ATOM 1751 C VAL C 239 3.596 -4.760 3.373 1.00 60.31 C ATOM 1752 O VAL C 239 3.398 -3.973 2.463 1.00 60.23 O ATOM 1753 CB VAL C 239 1.460 -5.995 3.868 1.00 22.03 C ATOM 1754 CG1 VAL C 239 2.065 -7.013 2.924 1.00 34.32 C ATOM 1755 CG2 VAL C 239 0.827 -6.741 5.009 1.00 14.44 C ATOM 0 H VAL C 239 1.418 -3.311 4.077 1.00 62.20 H new ATOM 0 HA VAL C 239 3.004 -5.453 5.295 1.00 51.31 H new ATOM 0 HB VAL C 239 0.721 -5.403 3.329 1.00 22.03 H new ATOM 0 HG11 VAL C 239 1.285 -7.684 2.563 1.00 34.32 H new ATOM 0 HG12 VAL C 239 2.521 -6.499 2.078 1.00 34.32 H new ATOM 0 HG13 VAL C 239 2.825 -7.590 3.450 1.00 34.32 H new ATOM 0 HG21 VAL C 239 0.077 -7.430 4.621 1.00 14.44 H new ATOM 0 HG22 VAL C 239 1.592 -7.302 5.546 1.00 14.44 H new ATOM 0 HG23 VAL C 239 0.353 -6.033 5.688 1.00 14.44 H new ATOM 1765 N ALA C 240 4.703 -5.414 3.522 1.00 70.12 N ATOM 1766 CA ALA C 240 5.723 -5.379 2.542 1.00 34.14 C ATOM 1767 C ALA C 240 5.839 -6.744 1.916 1.00 72.05 C ATOM 1768 O ALA C 240 5.956 -7.747 2.626 1.00 41.43 O ATOM 1769 CB ALA C 240 7.029 -5.022 3.186 1.00 4.34 C ATOM 0 H ALA C 240 4.920 -5.990 4.336 1.00 70.12 H new ATOM 0 HA ALA C 240 5.479 -4.635 1.784 1.00 34.14 H new ATOM 0 HB1 ALA C 240 7.813 -4.996 2.429 1.00 4.34 H new ATOM 0 HB2 ALA C 240 6.947 -4.043 3.657 1.00 4.34 H new ATOM 0 HB3 ALA C 240 7.278 -5.768 3.941 1.00 4.34 H new ATOM 1775 N ARG C 241 5.758 -6.816 0.609 1.00 24.03 N ATOM 1776 CA ARG C 241 6.012 -8.057 -0.030 1.00 73.51 C ATOM 1777 C ARG C 241 7.349 -7.926 -0.646 1.00 4.32 C ATOM 1778 O ARG C 241 7.553 -7.051 -1.495 1.00 34.43 O ATOM 1779 CB ARG C 241 5.011 -8.406 -1.106 1.00 63.03 C ATOM 1780 CG ARG C 241 5.154 -9.864 -1.477 1.00 52.53 C ATOM 1781 CD ARG C 241 4.322 -10.255 -2.642 1.00 50.02 C ATOM 1782 NE ARG C 241 2.872 -10.093 -2.416 1.00 43.10 N ATOM 1783 CZ ARG C 241 1.903 -10.685 -3.155 1.00 23.20 C ATOM 1784 NH1 ARG C 241 2.214 -11.440 -4.198 1.00 42.14 N ATOM 1785 NH2 ARG C 241 0.629 -10.505 -2.844 1.00 4.43 N ATOM 0 H ARG C 241 5.522 -6.041 -0.010 1.00 24.03 H new ATOM 0 HA ARG C 241 5.943 -8.855 0.710 1.00 73.51 H new ATOM 0 HB2 ARG C 241 3.999 -8.208 -0.754 1.00 63.03 H new ATOM 0 HB3 ARG C 241 5.172 -7.780 -1.983 1.00 63.03 H new ATOM 0 HG2 ARG C 241 6.200 -10.075 -1.699 1.00 52.53 H new ATOM 0 HG3 ARG C 241 4.880 -10.479 -0.620 1.00 52.53 H new ATOM 0 HD2 ARG C 241 4.616 -9.656 -3.504 1.00 50.02 H new ATOM 0 HD3 ARG C 241 4.528 -11.296 -2.892 1.00 50.02 H new ATOM 0 HE ARG C 241 2.578 -9.491 -1.647 1.00 43.10 H new ATOM 0 HH11 ARG C 241 3.192 -11.581 -4.452 1.00 42.14 H new ATOM 0 HH12 ARG C 241 1.476 -11.881 -4.747 1.00 42.14 H new ATOM 0 HH21 ARG C 241 0.376 -9.920 -2.047 1.00 4.43 H new ATOM 0 HH22 ARG C 241 -0.100 -10.951 -3.401 1.00 4.43 H new ATOM 1799 N LEU C 242 8.260 -8.727 -0.222 1.00 25.14 N ATOM 1800 CA LEU C 242 9.591 -8.641 -0.690 1.00 32.42 C ATOM 1801 C LEU C 242 9.730 -9.433 -1.958 1.00 43.51 C ATOM 1802 O LEU C 242 8.867 -10.267 -2.277 1.00 50.05 O ATOM 1803 CB LEU C 242 10.576 -9.157 0.354 1.00 64.41 C ATOM 1804 CG LEU C 242 10.595 -8.496 1.738 1.00 12.24 C ATOM 1805 CD1 LEU C 242 10.879 -7.028 1.659 1.00 72.32 C ATOM 1806 CD2 LEU C 242 9.360 -8.759 2.537 1.00 11.21 C ATOM 0 H LEU C 242 8.099 -9.464 0.464 1.00 25.14 H new ATOM 0 HA LEU C 242 9.821 -7.593 -0.883 1.00 32.42 H new ATOM 0 HB2 LEU C 242 10.379 -10.219 0.498 1.00 64.41 H new ATOM 0 HB3 LEU C 242 11.578 -9.073 -0.067 1.00 64.41 H new ATOM 0 HG LEU C 242 11.419 -8.970 2.271 1.00 12.24 H new ATOM 0 HD11 LEU C 242 10.882 -6.604 2.663 1.00 72.32 H new ATOM 0 HD12 LEU C 242 11.853 -6.870 1.195 1.00 72.32 H new ATOM 0 HD13 LEU C 242 10.109 -6.540 1.061 1.00 72.32 H new ATOM 0 HD21 LEU C 242 9.440 -8.263 3.504 1.00 11.21 H new ATOM 0 HD22 LEU C 242 8.492 -8.374 2.002 1.00 11.21 H new ATOM 0 HD23 LEU C 242 9.246 -9.832 2.688 1.00 11.21 H new ATOM 1818 N LYS C 243 10.783 -9.170 -2.686 1.00 61.24 N ATOM 1819 CA LYS C 243 11.060 -9.848 -3.928 1.00 3.32 C ATOM 1820 C LYS C 243 11.444 -11.300 -3.701 1.00 61.42 C ATOM 1821 O LYS C 243 11.449 -11.777 -2.551 1.00 1.12 O ATOM 1822 CB LYS C 243 12.107 -9.071 -4.738 1.00 42.03 C ATOM 1823 CG LYS C 243 13.420 -8.807 -4.027 1.00 63.51 C ATOM 1824 CD LYS C 243 14.299 -7.900 -4.867 1.00 74.14 C ATOM 1825 CE LYS C 243 15.599 -7.556 -4.165 1.00 75.33 C ATOM 1826 NZ LYS C 243 16.398 -6.599 -4.948 1.00 14.50 N ATOM 0 H LYS C 243 11.481 -8.471 -2.432 1.00 61.24 H new ATOM 0 HA LYS C 243 10.147 -9.873 -4.522 1.00 3.32 H new ATOM 0 HB2 LYS C 243 12.315 -9.624 -5.654 1.00 42.03 H new ATOM 0 HB3 LYS C 243 11.675 -8.115 -5.034 1.00 42.03 H new ATOM 0 HG2 LYS C 243 13.230 -8.346 -3.058 1.00 63.51 H new ATOM 0 HG3 LYS C 243 13.934 -9.749 -3.837 1.00 63.51 H new ATOM 0 HD2 LYS C 243 14.518 -8.387 -5.817 1.00 74.14 H new ATOM 0 HD3 LYS C 243 13.758 -6.982 -5.097 1.00 74.14 H new ATOM 0 HE2 LYS C 243 15.383 -7.134 -3.183 1.00 75.33 H new ATOM 0 HE3 LYS C 243 16.177 -8.466 -4.001 1.00 75.33 H new ATOM 0 HZ1 LYS C 243 17.409 -6.767 -4.774 1.00 14.50 H new ATOM 0 HZ2 LYS C 243 16.195 -6.724 -5.960 1.00 14.50 H new ATOM 0 HZ3 LYS C 243 16.155 -5.629 -4.663 1.00 14.50 H new ATOM 1882 N ARG C 247 9.625 -13.190 1.906 1.00 33.12 N ATOM 1883 CA ARG C 247 8.198 -13.521 1.878 1.00 74.41 C ATOM 1884 C ARG C 247 7.347 -12.250 1.863 1.00 64.23 C ATOM 1885 O ARG C 247 7.792 -11.186 1.436 1.00 53.35 O ATOM 1886 CB ARG C 247 7.890 -14.259 3.175 1.00 74.51 C ATOM 1887 CG ARG C 247 8.756 -15.460 3.429 1.00 12.34 C ATOM 1888 CD ARG C 247 8.509 -16.022 4.808 1.00 32.24 C ATOM 1889 NE ARG C 247 8.721 -15.012 5.860 1.00 23.10 N ATOM 1890 CZ ARG C 247 9.817 -14.915 6.629 1.00 20.15 C ATOM 1891 NH1 ARG C 247 10.880 -15.677 6.380 1.00 60.11 N ATOM 1892 NH2 ARG C 247 9.852 -14.031 7.624 1.00 62.04 N ATOM 0 HA ARG C 247 7.976 -14.112 0.990 1.00 74.41 H new ATOM 0 HB2 ARG C 247 8.000 -13.565 4.008 1.00 74.51 H new ATOM 0 HB3 ARG C 247 6.847 -14.576 3.159 1.00 74.51 H new ATOM 0 HG2 ARG C 247 8.553 -16.224 2.679 1.00 12.34 H new ATOM 0 HG3 ARG C 247 9.806 -15.184 3.327 1.00 12.34 H new ATOM 0 HD2 ARG C 247 7.488 -16.400 4.868 1.00 32.24 H new ATOM 0 HD3 ARG C 247 9.173 -16.869 4.979 1.00 32.24 H new ATOM 0 HE ARG C 247 7.976 -14.333 6.016 1.00 23.10 H new ATOM 0 HH11 ARG C 247 10.863 -16.337 5.603 1.00 60.11 H new ATOM 0 HH12 ARG C 247 11.711 -15.600 6.966 1.00 60.11 H new ATOM 0 HH21 ARG C 247 9.047 -13.430 7.800 1.00 62.04 H new ATOM 0 HH22 ARG C 247 10.684 -13.955 8.210 1.00 62.04 H new ATOM 1906 N GLN C 248 6.103 -12.396 2.288 1.00 22.22 N ATOM 1907 CA GLN C 248 5.231 -11.273 2.522 1.00 44.32 C ATOM 1908 C GLN C 248 5.165 -11.090 4.025 1.00 33.31 C ATOM 1909 O GLN C 248 4.981 -12.066 4.766 1.00 44.55 O ATOM 1910 CB GLN C 248 3.838 -11.523 1.876 1.00 51.24 C ATOM 1911 CG GLN C 248 2.797 -10.392 2.028 1.00 1.21 C ATOM 1912 CD GLN C 248 1.916 -10.472 3.283 1.00 3.12 C ATOM 1913 OE1 GLN C 248 2.309 -10.964 4.329 1.00 42.14 O ATOM 1914 NE2 GLN C 248 0.704 -10.006 3.164 1.00 55.44 N ATOM 0 H GLN C 248 5.675 -13.302 2.479 1.00 22.22 H new ATOM 0 HA GLN C 248 5.603 -10.359 2.060 1.00 44.32 H new ATOM 0 HB2 GLN C 248 3.984 -11.712 0.813 1.00 51.24 H new ATOM 0 HB3 GLN C 248 3.420 -12.432 2.307 1.00 51.24 H new ATOM 0 HG2 GLN C 248 3.322 -9.437 2.033 1.00 1.21 H new ATOM 0 HG3 GLN C 248 2.151 -10.396 1.150 1.00 1.21 H new ATOM 0 HE21 GLN C 248 0.398 -9.599 2.280 1.00 55.44 H new ATOM 0 HE22 GLN C 248 0.062 -10.048 3.955 1.00 55.44 H new ATOM 1923 N VAL C 249 5.324 -9.881 4.476 1.00 71.51 N ATOM 1924 CA VAL C 249 5.430 -9.589 5.890 1.00 21.32 C ATOM 1925 C VAL C 249 4.668 -8.335 6.236 1.00 1.41 C ATOM 1926 O VAL C 249 4.377 -7.518 5.362 1.00 31.31 O ATOM 1927 CB VAL C 249 6.908 -9.429 6.348 1.00 62.32 C ATOM 1928 CG1 VAL C 249 7.690 -10.727 6.187 1.00 45.31 C ATOM 1929 CG2 VAL C 249 7.579 -8.314 5.579 1.00 14.01 C ATOM 0 H VAL C 249 5.385 -9.059 3.876 1.00 71.51 H new ATOM 0 HA VAL C 249 4.998 -10.441 6.416 1.00 21.32 H new ATOM 0 HB VAL C 249 6.900 -9.176 7.408 1.00 62.32 H new ATOM 0 HG11 VAL C 249 8.718 -10.576 6.517 1.00 45.31 H new ATOM 0 HG12 VAL C 249 7.226 -11.508 6.790 1.00 45.31 H new ATOM 0 HG13 VAL C 249 7.686 -11.027 5.139 1.00 45.31 H new ATOM 0 HG21 VAL C 249 8.613 -8.214 5.911 1.00 14.01 H new ATOM 0 HG22 VAL C 249 7.560 -8.544 4.514 1.00 14.01 H new ATOM 0 HG23 VAL C 249 7.049 -7.379 5.757 1.00 14.01 H new ATOM 1939 N CYS C 250 4.346 -8.180 7.479 1.00 51.14 N ATOM 1940 CA CYS C 250 3.674 -6.989 7.913 1.00 12.12 C ATOM 1941 C CYS C 250 4.715 -6.122 8.548 1.00 2.22 C ATOM 1942 O CYS C 250 5.460 -6.573 9.411 1.00 1.45 O ATOM 1943 CB CYS C 250 2.626 -7.291 8.988 1.00 12.02 C ATOM 1944 SG CYS C 250 1.406 -8.584 8.593 1.00 44.25 S ATOM 0 H CYS C 250 4.535 -8.860 8.215 1.00 51.14 H new ATOM 0 HA CYS C 250 3.178 -6.526 7.060 1.00 12.12 H new ATOM 0 HB2 CYS C 250 3.147 -7.581 9.900 1.00 12.02 H new ATOM 0 HB3 CYS C 250 2.087 -6.369 9.208 1.00 12.02 H new ATOM 1949 N ILE C 251 4.801 -4.915 8.112 1.00 3.20 N ATOM 1950 CA ILE C 251 5.739 -3.996 8.643 1.00 43.42 C ATOM 1951 C ILE C 251 5.019 -2.873 9.356 1.00 74.41 C ATOM 1952 O ILE C 251 3.792 -2.908 9.483 1.00 72.23 O ATOM 1953 CB ILE C 251 6.696 -3.473 7.578 1.00 13.32 C ATOM 1954 CG1 ILE C 251 5.965 -2.909 6.387 1.00 75.24 C ATOM 1955 CG2 ILE C 251 7.580 -4.580 7.136 1.00 62.11 C ATOM 1956 CD1 ILE C 251 6.888 -2.316 5.367 1.00 61.30 C ATOM 0 H ILE C 251 4.215 -4.536 7.368 1.00 3.20 H new ATOM 0 HA ILE C 251 6.356 -4.524 9.371 1.00 43.42 H new ATOM 0 HB ILE C 251 7.281 -2.665 8.018 1.00 13.32 H new ATOM 0 HG12 ILE C 251 5.375 -3.698 5.921 1.00 75.24 H new ATOM 0 HG13 ILE C 251 5.265 -2.145 6.725 1.00 75.24 H new ATOM 0 HG21 ILE C 251 8.268 -4.214 6.374 1.00 62.11 H new ATOM 0 HG22 ILE C 251 8.148 -4.954 7.988 1.00 62.11 H new ATOM 0 HG23 ILE C 251 6.974 -5.386 6.721 1.00 62.11 H new ATOM 0 HD11 ILE C 251 6.306 -1.926 4.532 1.00 61.30 H new ATOM 0 HD12 ILE C 251 7.460 -1.506 5.821 1.00 61.30 H new ATOM 0 HD13 ILE C 251 7.572 -3.084 5.005 1.00 61.30 H new ATOM 1968 N ASP C 252 5.741 -1.895 9.821 1.00 32.11 N ATOM 1969 CA ASP C 252 5.120 -0.868 10.633 1.00 75.53 C ATOM 1970 C ASP C 252 5.406 0.495 10.045 1.00 72.21 C ATOM 1971 O ASP C 252 6.510 0.735 9.570 1.00 11.43 O ATOM 1972 CB ASP C 252 5.689 -0.915 12.046 1.00 5.11 C ATOM 1973 CG ASP C 252 4.806 -0.215 13.058 1.00 55.32 C ATOM 1974 OD1 ASP C 252 4.696 1.008 13.015 1.00 3.41 O ATOM 1975 OD2 ASP C 252 4.173 -0.907 13.898 1.00 34.10 O ATOM 0 H ASP C 252 6.742 -1.780 9.661 1.00 32.11 H new ATOM 0 HA ASP C 252 4.045 -1.044 10.657 1.00 75.53 H new ATOM 0 HB2 ASP C 252 5.822 -1.955 12.345 1.00 5.11 H new ATOM 0 HB3 ASP C 252 6.676 -0.453 12.051 1.00 5.11 H new ATOM 1980 N PRO C 253 4.427 1.402 10.046 1.00 11.10 N ATOM 1981 CA PRO C 253 4.623 2.769 9.568 1.00 51.43 C ATOM 1982 C PRO C 253 5.668 3.580 10.368 1.00 45.33 C ATOM 1983 O PRO C 253 6.025 4.685 9.972 1.00 14.12 O ATOM 1984 CB PRO C 253 3.248 3.409 9.672 1.00 34.10 C ATOM 1985 CG PRO C 253 2.444 2.528 10.553 1.00 41.44 C ATOM 1986 CD PRO C 253 3.034 1.157 10.450 1.00 44.45 C ATOM 0 HA PRO C 253 5.025 2.758 8.555 1.00 51.43 H new ATOM 0 HB2 PRO C 253 3.318 4.415 10.087 1.00 34.10 H new ATOM 0 HB3 PRO C 253 2.787 3.501 8.689 1.00 34.10 H new ATOM 0 HG2 PRO C 253 2.470 2.884 11.583 1.00 41.44 H new ATOM 0 HG3 PRO C 253 1.399 2.523 10.244 1.00 41.44 H new ATOM 0 HD2 PRO C 253 2.981 0.627 11.401 1.00 44.45 H new ATOM 0 HD3 PRO C 253 2.506 0.549 9.716 1.00 44.45 H new ATOM 1994 N LYS C 254 6.129 3.041 11.506 1.00 12.45 N ATOM 1995 CA LYS C 254 7.224 3.666 12.269 1.00 35.23 C ATOM 1996 C LYS C 254 8.499 3.752 11.432 1.00 54.24 C ATOM 1997 O LYS C 254 9.362 4.593 11.687 1.00 73.42 O ATOM 1998 CB LYS C 254 7.537 2.887 13.550 1.00 41.31 C ATOM 1999 CG LYS C 254 6.409 2.760 14.575 1.00 12.43 C ATOM 2000 CD LYS C 254 6.073 4.031 15.367 1.00 15.21 C ATOM 2001 CE LYS C 254 5.569 5.183 14.524 1.00 41.20 C ATOM 2002 NZ LYS C 254 5.067 6.286 15.356 1.00 62.15 N ATOM 0 H LYS C 254 5.766 2.181 11.917 1.00 12.45 H new ATOM 0 HA LYS C 254 6.885 4.668 12.531 1.00 35.23 H new ATOM 0 HB2 LYS C 254 7.854 1.883 13.268 1.00 41.31 H new ATOM 0 HB3 LYS C 254 8.387 3.364 14.038 1.00 41.31 H new ATOM 0 HG2 LYS C 254 5.509 2.431 14.056 1.00 12.43 H new ATOM 0 HG3 LYS C 254 6.675 1.975 15.283 1.00 12.43 H new ATOM 0 HD2 LYS C 254 5.319 3.788 16.116 1.00 15.21 H new ATOM 0 HD3 LYS C 254 6.964 4.354 15.905 1.00 15.21 H new ATOM 0 HE2 LYS C 254 6.374 5.546 13.885 1.00 41.20 H new ATOM 0 HE3 LYS C 254 4.774 4.832 13.866 1.00 41.20 H new ATOM 0 HZ1 LYS C 254 4.730 7.057 14.744 1.00 62.15 H new ATOM 0 HZ2 LYS C 254 4.282 5.945 15.947 1.00 62.15 H new ATOM 0 HZ3 LYS C 254 5.833 6.637 15.966 1.00 62.15 H new ATOM 2016 N LEU C 255 8.616 2.873 10.458 1.00 30.10 N ATOM 2017 CA LEU C 255 9.767 2.824 9.581 1.00 2.11 C ATOM 2018 C LEU C 255 9.844 4.105 8.755 1.00 23.11 C ATOM 2019 O LEU C 255 8.890 4.459 8.058 1.00 65.22 O ATOM 2020 CB LEU C 255 9.636 1.612 8.669 1.00 45.32 C ATOM 2021 CG LEU C 255 9.512 0.260 9.381 1.00 24.12 C ATOM 2022 CD1 LEU C 255 9.201 -0.834 8.386 1.00 43.40 C ATOM 2023 CD2 LEU C 255 10.783 -0.062 10.149 1.00 11.25 C ATOM 0 H LEU C 255 7.909 2.167 10.251 1.00 30.10 H new ATOM 0 HA LEU C 255 10.681 2.739 10.169 1.00 2.11 H new ATOM 0 HB2 LEU C 255 8.761 1.750 8.034 1.00 45.32 H new ATOM 0 HB3 LEU C 255 10.505 1.578 8.012 1.00 45.32 H new ATOM 0 HG LEU C 255 8.690 0.322 10.094 1.00 24.12 H new ATOM 0 HD11 LEU C 255 9.116 -1.787 8.908 1.00 43.40 H new ATOM 0 HD12 LEU C 255 8.260 -0.611 7.882 1.00 43.40 H new ATOM 0 HD13 LEU C 255 10.002 -0.894 7.649 1.00 43.40 H new ATOM 0 HD21 LEU C 255 10.673 -1.026 10.647 1.00 11.25 H new ATOM 0 HD22 LEU C 255 11.625 -0.104 9.458 1.00 11.25 H new ATOM 0 HD23 LEU C 255 10.964 0.713 10.894 1.00 11.25 H new ATOM 2035 N LYS C 256 10.973 4.788 8.836 1.00 31.42 N ATOM 2036 CA LYS C 256 11.154 6.050 8.151 1.00 10.11 C ATOM 2037 C LYS C 256 11.032 5.910 6.652 1.00 43.10 C ATOM 2038 O LYS C 256 10.369 6.732 6.007 1.00 3.02 O ATOM 2039 CB LYS C 256 12.486 6.676 8.476 1.00 3.44 C ATOM 2040 CG LYS C 256 12.613 8.057 7.861 1.00 5.31 C ATOM 2041 CD LYS C 256 13.961 8.643 8.069 1.00 72.41 C ATOM 2042 CE LYS C 256 14.290 8.837 9.532 1.00 73.14 C ATOM 2043 NZ LYS C 256 15.620 9.444 9.707 1.00 73.23 N ATOM 0 H LYS C 256 11.783 4.483 9.375 1.00 31.42 H new ATOM 0 HA LYS C 256 10.354 6.698 8.509 1.00 10.11 H new ATOM 0 HB2 LYS C 256 12.603 6.745 9.557 1.00 3.44 H new ATOM 0 HB3 LYS C 256 13.289 6.037 8.109 1.00 3.44 H new ATOM 0 HG2 LYS C 256 12.406 7.997 6.793 1.00 5.31 H new ATOM 0 HG3 LYS C 256 11.861 8.716 8.295 1.00 5.31 H new ATOM 0 HD2 LYS C 256 14.710 7.994 7.615 1.00 72.41 H new ATOM 0 HD3 LYS C 256 14.019 9.603 7.557 1.00 72.41 H new ATOM 0 HE2 LYS C 256 13.535 9.472 9.995 1.00 73.14 H new ATOM 0 HE3 LYS C 256 14.257 7.876 10.045 1.00 73.14 H new ATOM 0 HZ1 LYS C 256 15.816 9.564 10.721 1.00 73.23 H new ATOM 0 HZ2 LYS C 256 16.342 8.825 9.286 1.00 73.23 H new ATOM 0 HZ3 LYS C 256 15.643 10.372 9.238 1.00 73.23 H new ATOM 2057 N TRP C 257 11.641 4.854 6.082 1.00 11.35 N ATOM 2058 CA TRP C 257 11.611 4.693 4.630 1.00 35.53 C ATOM 2059 C TRP C 257 10.175 4.501 4.143 1.00 3.24 C ATOM 2060 O TRP C 257 9.842 4.846 3.015 1.00 12.12 O ATOM 2061 CB TRP C 257 12.574 3.569 4.107 1.00 55.10 C ATOM 2062 CG TRP C 257 12.200 2.128 4.402 1.00 51.04 C ATOM 2063 CD1 TRP C 257 12.770 1.284 5.310 1.00 3.44 C ATOM 2064 CD2 TRP C 257 11.196 1.364 3.733 1.00 54.21 C ATOM 2065 NE1 TRP C 257 12.164 0.052 5.252 1.00 50.41 N ATOM 2066 CE2 TRP C 257 11.195 0.082 4.291 1.00 21.34 C ATOM 2067 CE3 TRP C 257 10.291 1.649 2.715 1.00 21.40 C ATOM 2068 CZ2 TRP C 257 10.325 -0.902 3.861 1.00 73.33 C ATOM 2069 CZ3 TRP C 257 9.441 0.678 2.296 1.00 4.23 C ATOM 2070 CH2 TRP C 257 9.460 -0.577 2.863 1.00 4.03 C ATOM 0 H TRP C 257 12.142 4.126 6.590 1.00 11.35 H new ATOM 0 HA TRP C 257 11.997 5.617 4.198 1.00 35.53 H new ATOM 0 HB2 TRP C 257 12.662 3.678 3.026 1.00 55.10 H new ATOM 0 HB3 TRP C 257 13.563 3.752 4.527 1.00 55.10 H new ATOM 0 HD1 TRP C 257 13.579 1.546 5.976 1.00 3.44 H new ATOM 0 HE1 TRP C 257 12.400 -0.753 5.832 1.00 50.41 H new ATOM 0 HE3 TRP C 257 10.266 2.630 2.264 1.00 21.40 H new ATOM 0 HZ2 TRP C 257 10.332 -1.889 4.300 1.00 73.33 H new ATOM 0 HZ3 TRP C 257 8.738 0.893 1.505 1.00 4.23 H new ATOM 0 HH2 TRP C 257 8.768 -1.325 2.505 1.00 4.03 H new ATOM 2081 N ILE C 258 9.337 3.958 5.022 1.00 55.42 N ATOM 2082 CA ILE C 258 7.921 3.779 4.762 1.00 3.33 C ATOM 2083 C ILE C 258 7.242 5.101 4.565 1.00 52.22 C ATOM 2084 O ILE C 258 6.499 5.292 3.601 1.00 54.34 O ATOM 2085 CB ILE C 258 7.232 3.001 5.912 1.00 62.54 C ATOM 2086 CG1 ILE C 258 7.450 1.511 5.767 1.00 55.44 C ATOM 2087 CG2 ILE C 258 5.749 3.319 6.008 1.00 12.43 C ATOM 2088 CD1 ILE C 258 6.696 0.935 4.606 1.00 54.31 C ATOM 0 H ILE C 258 9.630 3.628 5.942 1.00 55.42 H new ATOM 0 HA ILE C 258 7.830 3.195 3.846 1.00 3.33 H new ATOM 0 HB ILE C 258 7.697 3.330 6.842 1.00 62.54 H new ATOM 0 HG12 ILE C 258 8.514 1.313 5.640 1.00 55.44 H new ATOM 0 HG13 ILE C 258 7.139 1.010 6.684 1.00 55.44 H new ATOM 0 HG21 ILE C 258 5.307 2.752 6.827 1.00 12.43 H new ATOM 0 HG22 ILE C 258 5.617 4.385 6.192 1.00 12.43 H new ATOM 0 HG23 ILE C 258 5.258 3.049 5.073 1.00 12.43 H new ATOM 0 HD11 ILE C 258 6.885 -0.137 4.545 1.00 54.31 H new ATOM 0 HD12 ILE C 258 5.629 1.108 4.744 1.00 54.31 H new ATOM 0 HD13 ILE C 258 7.025 1.415 3.684 1.00 54.31 H new ATOM 2100 N GLN C 259 7.494 6.007 5.463 1.00 3.12 N ATOM 2101 CA GLN C 259 6.892 7.284 5.388 1.00 21.00 C ATOM 2102 C GLN C 259 7.351 8.022 4.169 1.00 24.43 C ATOM 2103 O GLN C 259 6.571 8.634 3.508 1.00 23.44 O ATOM 2104 CB GLN C 259 7.101 8.052 6.664 1.00 41.44 C ATOM 2105 CG GLN C 259 6.526 7.288 7.822 1.00 11.14 C ATOM 2106 CD GLN C 259 6.445 8.037 9.092 1.00 21.11 C ATOM 2107 OE1 GLN C 259 5.492 7.660 9.876 1.00 40.41 O flip ATOM 2108 NE2 GLN C 259 7.226 8.930 9.376 1.00 20.45 N flip ATOM 0 H GLN C 259 8.119 5.873 6.258 1.00 3.12 H new ATOM 0 HA GLN C 259 5.814 7.160 5.280 1.00 21.00 H new ATOM 0 HB2 GLN C 259 8.165 8.225 6.824 1.00 41.44 H new ATOM 0 HB3 GLN C 259 6.626 9.031 6.591 1.00 41.44 H new ATOM 0 HG2 GLN C 259 5.525 6.951 7.553 1.00 11.14 H new ATOM 0 HG3 GLN C 259 7.130 6.395 7.983 1.00 11.14 H new ATOM 0 HE21 GLN C 259 7.963 9.191 8.721 1.00 20.45 H new ATOM 0 HE22 GLN C 259 7.142 9.416 10.269 1.00 20.45 H new ATOM 2117 N GLU C 260 8.603 7.886 3.840 1.00 52.13 N ATOM 2118 CA GLU C 260 9.142 8.523 2.652 1.00 43.32 C ATOM 2119 C GLU C 260 8.564 7.896 1.379 1.00 63.33 C ATOM 2120 O GLU C 260 8.428 8.570 0.362 1.00 25.14 O ATOM 2121 CB GLU C 260 10.656 8.447 2.647 1.00 25.23 C ATOM 2122 CG GLU C 260 11.290 9.079 3.860 1.00 74.10 C ATOM 2123 CD GLU C 260 12.796 9.076 3.804 1.00 73.33 C ATOM 2124 OE1 GLU C 260 13.381 10.031 3.233 1.00 21.24 O ATOM 2125 OE2 GLU C 260 13.428 8.136 4.321 1.00 35.31 O ATOM 0 H GLU C 260 9.279 7.340 4.373 1.00 52.13 H new ATOM 0 HA GLU C 260 8.849 9.573 2.670 1.00 43.32 H new ATOM 0 HB2 GLU C 260 10.960 7.402 2.590 1.00 25.23 H new ATOM 0 HB3 GLU C 260 11.034 8.938 1.751 1.00 25.23 H new ATOM 0 HG2 GLU C 260 10.937 10.106 3.955 1.00 74.10 H new ATOM 0 HG3 GLU C 260 10.964 8.546 4.753 1.00 74.10 H new ATOM 2132 N TYR C 261 8.221 6.611 1.459 1.00 54.24 N ATOM 2133 CA TYR C 261 7.630 5.864 0.329 1.00 72.04 C ATOM 2134 C TYR C 261 6.319 6.554 -0.029 1.00 51.25 C ATOM 2135 O TYR C 261 6.095 6.970 -1.166 1.00 45.21 O ATOM 2136 CB TYR C 261 7.301 4.432 0.789 1.00 52.13 C ATOM 2137 CG TYR C 261 7.406 3.347 -0.237 1.00 43.22 C ATOM 2138 CD1 TYR C 261 6.335 3.021 -1.013 1.00 63.55 C ATOM 2139 CD2 TYR C 261 8.561 2.594 -0.363 1.00 2.32 C ATOM 2140 CE1 TYR C 261 6.393 1.972 -1.892 1.00 24.03 C ATOM 2141 CE2 TYR C 261 8.629 1.554 -1.256 1.00 51.02 C ATOM 2142 CZ TYR C 261 7.528 1.251 -2.010 1.00 5.25 C ATOM 2143 OH TYR C 261 7.556 0.209 -2.868 1.00 70.23 O ATOM 0 H TYR C 261 8.341 6.052 2.303 1.00 54.24 H new ATOM 0 HA TYR C 261 8.318 5.835 -0.516 1.00 72.04 H new ATOM 0 HB2 TYR C 261 7.965 4.181 1.616 1.00 52.13 H new ATOM 0 HB3 TYR C 261 6.285 4.428 1.183 1.00 52.13 H new ATOM 0 HD1 TYR C 261 5.426 3.599 -0.934 1.00 63.55 H new ATOM 0 HD2 TYR C 261 9.419 2.828 0.249 1.00 2.32 H new ATOM 0 HE1 TYR C 261 5.530 1.722 -2.491 1.00 24.03 H new ATOM 0 HE2 TYR C 261 9.539 0.982 -1.362 1.00 51.02 H new ATOM 0 HH TYR C 261 7.034 0.429 -3.667 1.00 70.23 H new ATOM 2153 N LEU C 262 5.484 6.708 0.988 1.00 1.21 N ATOM 2154 CA LEU C 262 4.203 7.310 0.860 1.00 23.41 C ATOM 2155 C LEU C 262 4.293 8.827 0.693 1.00 52.44 C ATOM 2156 O LEU C 262 3.431 9.443 0.069 1.00 72.45 O ATOM 2157 CB LEU C 262 3.233 6.808 1.961 1.00 34.30 C ATOM 2158 CG LEU C 262 3.670 6.912 3.417 1.00 43.12 C ATOM 2159 CD1 LEU C 262 3.510 8.295 3.915 1.00 13.21 C ATOM 2160 CD2 LEU C 262 2.936 5.907 4.305 1.00 24.10 C ATOM 0 H LEU C 262 5.701 6.405 1.938 1.00 1.21 H new ATOM 0 HA LEU C 262 3.750 6.979 -0.074 1.00 23.41 H new ATOM 0 HB2 LEU C 262 2.298 7.358 1.855 1.00 34.30 H new ATOM 0 HB3 LEU C 262 3.011 5.761 1.755 1.00 34.30 H new ATOM 0 HG LEU C 262 4.729 6.658 3.463 1.00 43.12 H new ATOM 0 HD11 LEU C 262 3.828 8.346 4.956 1.00 13.21 H new ATOM 0 HD12 LEU C 262 4.121 8.970 3.316 1.00 13.21 H new ATOM 0 HD13 LEU C 262 2.463 8.590 3.840 1.00 13.21 H new ATOM 0 HD21 LEU C 262 3.277 6.014 5.335 1.00 24.10 H new ATOM 0 HD22 LEU C 262 1.863 6.094 4.256 1.00 24.10 H new ATOM 0 HD23 LEU C 262 3.144 4.895 3.958 1.00 24.10 H new ATOM 2172 N GLU C 263 5.349 9.432 1.247 1.00 44.03 N ATOM 2173 CA GLU C 263 5.592 10.852 1.055 1.00 3.34 C ATOM 2174 C GLU C 263 5.799 11.225 -0.397 1.00 44.14 C ATOM 2175 O GLU C 263 5.553 12.365 -0.787 1.00 53.23 O ATOM 2176 CB GLU C 263 6.655 11.480 1.981 1.00 4.51 C ATOM 2177 CG GLU C 263 6.226 11.559 3.445 1.00 11.24 C ATOM 2178 CD GLU C 263 7.202 12.311 4.317 1.00 2.35 C ATOM 2179 OE1 GLU C 263 7.085 13.559 4.410 1.00 72.12 O ATOM 2180 OE2 GLU C 263 8.091 11.688 4.935 1.00 30.11 O ATOM 0 H GLU C 263 6.041 8.958 1.827 1.00 44.03 H new ATOM 0 HA GLU C 263 4.658 11.311 1.378 1.00 3.34 H new ATOM 0 HB2 GLU C 263 7.574 10.897 1.912 1.00 4.51 H new ATOM 0 HB3 GLU C 263 6.887 12.484 1.625 1.00 4.51 H new ATOM 0 HG2 GLU C 263 5.251 12.042 3.504 1.00 11.24 H new ATOM 0 HG3 GLU C 263 6.106 10.548 3.835 1.00 11.24 H new ATOM 2187 N LYS C 264 6.247 10.277 -1.201 1.00 10.21 N ATOM 2188 CA LYS C 264 6.429 10.532 -2.619 1.00 62.24 C ATOM 2189 C LYS C 264 5.093 10.477 -3.372 1.00 72.23 C ATOM 2190 O LYS C 264 5.012 10.840 -4.550 1.00 35.12 O ATOM 2191 CB LYS C 264 7.458 9.591 -3.240 1.00 33.14 C ATOM 2192 CG LYS C 264 8.811 9.646 -2.569 1.00 42.32 C ATOM 2193 CD LYS C 264 9.328 11.069 -2.486 1.00 60.53 C ATOM 2194 CE LYS C 264 10.699 11.120 -1.865 1.00 22.01 C ATOM 2195 NZ LYS C 264 11.719 10.462 -2.708 1.00 51.51 N ATOM 0 H LYS C 264 6.489 9.333 -0.901 1.00 10.21 H new ATOM 0 HA LYS C 264 6.822 11.544 -2.715 1.00 62.24 H new ATOM 0 HB2 LYS C 264 7.079 8.570 -3.192 1.00 33.14 H new ATOM 0 HB3 LYS C 264 7.575 9.839 -4.295 1.00 33.14 H new ATOM 0 HG2 LYS C 264 8.739 9.224 -1.567 1.00 42.32 H new ATOM 0 HG3 LYS C 264 9.520 9.031 -3.124 1.00 42.32 H new ATOM 0 HD2 LYS C 264 9.363 11.504 -3.485 1.00 60.53 H new ATOM 0 HD3 LYS C 264 8.638 11.675 -1.899 1.00 60.53 H new ATOM 0 HE2 LYS C 264 10.982 12.159 -1.700 1.00 22.01 H new ATOM 0 HE3 LYS C 264 10.672 10.638 -0.888 1.00 22.01 H new ATOM 0 HZ1 LYS C 264 12.668 10.721 -2.371 1.00 51.51 H new ATOM 0 HZ2 LYS C 264 11.602 9.430 -2.653 1.00 51.51 H new ATOM 0 HZ3 LYS C 264 11.606 10.771 -3.695 1.00 51.51 H new ATOM 2209 N CYS C 265 4.053 10.031 -2.687 1.00 70.21 N ATOM 2210 CA CYS C 265 2.707 10.029 -3.242 1.00 51.33 C ATOM 2211 C CYS C 265 2.058 11.351 -2.878 1.00 44.35 C ATOM 2212 O CYS C 265 0.984 11.707 -3.364 1.00 3.23 O ATOM 2213 CB CYS C 265 1.884 8.922 -2.607 1.00 1.01 C ATOM 2214 SG CYS C 265 2.723 7.289 -2.549 1.00 52.13 S ATOM 0 H CYS C 265 4.115 9.663 -1.738 1.00 70.21 H new ATOM 0 HA CYS C 265 2.754 9.880 -4.321 1.00 51.33 H new ATOM 0 HB2 CYS C 265 1.622 9.218 -1.591 1.00 1.01 H new ATOM 0 HB3 CYS C 265 0.950 8.818 -3.160 1.00 1.01 H new ATOM 2219 N LEU C 266 2.739 12.079 -2.017 1.00 1.33 N ATOM 2220 CA LEU C 266 2.257 13.294 -1.473 1.00 72.15 C ATOM 2221 C LEU C 266 2.731 14.487 -2.227 1.00 34.25 C ATOM 2222 O LEU C 266 3.934 14.727 -2.379 1.00 11.40 O ATOM 2223 CB LEU C 266 2.636 13.408 -0.001 1.00 53.31 C ATOM 2224 CG LEU C 266 1.963 12.403 0.918 1.00 54.24 C ATOM 2225 CD1 LEU C 266 2.564 12.428 2.305 1.00 13.22 C ATOM 2226 CD2 LEU C 266 0.487 12.731 1.003 1.00 55.13 C ATOM 0 H LEU C 266 3.666 11.819 -1.679 1.00 1.33 H new ATOM 0 HA LEU C 266 1.171 13.273 -1.563 1.00 72.15 H new ATOM 0 HB2 LEU C 266 3.716 13.293 0.090 1.00 53.31 H new ATOM 0 HB3 LEU C 266 2.392 14.413 0.344 1.00 53.31 H new ATOM 0 HG LEU C 266 2.113 11.405 0.507 1.00 54.24 H new ATOM 0 HD11 LEU C 266 2.057 11.696 2.934 1.00 13.22 H new ATOM 0 HD12 LEU C 266 3.625 12.184 2.246 1.00 13.22 H new ATOM 0 HD13 LEU C 266 2.444 13.422 2.736 1.00 13.22 H new ATOM 0 HD21 LEU C 266 -0.007 12.016 1.660 1.00 55.13 H new ATOM 0 HD22 LEU C 266 0.360 13.738 1.401 1.00 55.13 H new ATOM 0 HD23 LEU C 266 0.044 12.676 0.009 1.00 55.13 H new ATOM 2238 N ASN C 267 1.760 15.199 -2.729 1.00 71.10 N ATOM 2239 CA ASN C 267 1.893 16.493 -3.362 1.00 32.30 C ATOM 2240 C ASN C 267 2.568 16.438 -4.724 1.00 42.24 C ATOM 2241 O ASN C 267 2.811 17.469 -5.353 1.00 41.13 O ATOM 2242 CB ASN C 267 2.560 17.491 -2.422 1.00 55.30 C ATOM 2243 CG ASN C 267 1.908 17.535 -1.027 1.00 34.12 C ATOM 2244 OD1 ASN C 267 0.621 17.220 -0.935 1.00 4.52 O flip ATOM 2245 ND2 ASN C 267 2.570 17.829 -0.036 1.00 2.52 N flip ATOM 0 H ASN C 267 0.793 14.876 -2.708 1.00 71.10 H new ATOM 0 HA ASN C 267 0.882 16.847 -3.565 1.00 32.30 H new ATOM 0 HB2 ASN C 267 3.614 17.233 -2.316 1.00 55.30 H new ATOM 0 HB3 ASN C 267 2.518 18.485 -2.868 1.00 55.30 H new ATOM 0 HD21 ASN C 267 3.557 18.067 -0.134 1.00 2.52 H new ATOM 0 HD22 ASN C 267 2.133 17.835 0.886 1.00 2.52 H new ATOM 2252 N LYS C 268 2.848 15.242 -5.188 1.00 35.55 N ATOM 2253 CA LYS C 268 3.398 15.063 -6.500 1.00 14.12 C ATOM 2254 C LYS C 268 2.320 14.580 -7.436 1.00 21.23 C ATOM 2255 O LYS C 268 2.153 13.361 -7.592 1.00 38.20 O ATOM 2256 CB LYS C 268 4.591 14.107 -6.508 1.00 64.02 C ATOM 2257 CG LYS C 268 5.796 14.608 -5.750 1.00 71.41 C ATOM 2258 CD LYS C 268 6.985 13.701 -5.967 1.00 13.31 C ATOM 2259 CE LYS C 268 8.228 14.265 -5.315 1.00 15.44 C ATOM 2260 NZ LYS C 268 9.429 13.465 -5.620 1.00 41.53 N ATOM 2261 OXT LYS C 268 1.601 15.430 -7.995 1.00 38.20 O ATOM 0 H LYS C 268 2.701 14.377 -4.668 1.00 35.55 H new ATOM 0 HA LYS C 268 3.773 16.029 -6.840 1.00 14.12 H new ATOM 0 HB2 LYS C 268 4.280 13.153 -6.082 1.00 64.02 H new ATOM 0 HB3 LYS C 268 4.881 13.915 -7.541 1.00 64.02 H new ATOM 0 HG2 LYS C 268 6.041 15.619 -6.075 1.00 71.41 H new ATOM 0 HG3 LYS C 268 5.565 14.663 -4.686 1.00 71.41 H new ATOM 0 HD2 LYS C 268 6.772 12.714 -5.557 1.00 13.31 H new ATOM 0 HD3 LYS C 268 7.158 13.572 -7.036 1.00 13.31 H new ATOM 0 HE2 LYS C 268 8.381 15.290 -5.653 1.00 15.44 H new ATOM 0 HE3 LYS C 268 8.084 14.304 -4.235 1.00 15.44 H new ATOM 0 HZ1 LYS C 268 10.223 13.795 -5.035 1.00 41.53 H new ATOM 0 HZ2 LYS C 268 9.240 12.463 -5.415 1.00 41.53 H new ATOM 0 HZ3 LYS C 268 9.672 13.572 -6.626 1.00 41.53 H new