USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 914 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 396 HIS : no HD1:sc= -4.82! C(o=-5.9!,f=-7.4!) USER MOD Set 1.2: A 399 LYS NZ :NH3+ 154:sc= -1.09 (180deg=-1.7) USER MOD Set 2.1: A 386 THR OG1 : rot -156:sc= -1.95 USER MOD Set 2.2: A 389 LYS NZ :NH3+ -164:sc= 1.29 (180deg=1.04) USER MOD Set 3.1: A 343 GLN : amide:sc= -1.83! K(o=-1.8!,f=-0.17) USER MOD Set 3.2: A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 333 HIS : no HD1:sc= -0.545! C(o=-0.54!,f=-5.5!) USER MOD Single : A 334 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 340 TYR OH : rot 120:sc= 0.398 USER MOD Single : A 342 TYR OH : rot 119:sc= -0.232 USER MOD Single : A 346 SER OG : rot -84:sc= 0.226 USER MOD Single : A 348 SER OG : rot 95:sc= 1.23 USER MOD Single : A 352 ASN : amide:sc= -0.521 K(o=-0.52,f=-0.0087) USER MOD Single : A 359 LYS NZ :NH3+ 177:sc= 0.943 (180deg=0.939) USER MOD Single : A 361 SER OG : rot 81:sc= 0.775 USER MOD Single : A 362 LYS NZ :NH3+ 159:sc= 0.895 (180deg=0.5) USER MOD Single : A 370 ASN : amide:sc= -0.262 K(o=-0.26,f=-1.1) USER MOD Single : A 378 ASN : amide:sc= 1.25 K(o=1.3,f=-0.32) USER MOD Single : A 379 HIS : no HD1:sc= -0.522 K(o=-0.52,f=-0.0022) USER MOD Single : A 380 LYS NZ :NH3+ -165:sc= 1.35 (180deg=1.22) USER MOD Single : A 381 ASN : amide:sc= -0.166 K(o=-0.17,f=-0.98) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= -0.0501 K(o=-0.05,f=-1.9!) USER MOD Single : A 385 MET CE :methyl -161:sc= -2.98! (180deg=-3.92!) USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 390 MET CE :methyl -92:sc= -7.57! (180deg=-7.86!) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 397 TYR OH : rot -15:sc= -0.263 USER MOD Single : A 398 TYR OH : rot -21:sc= 0.506 USER MOD Single : A 401 ASN : amide:sc= -0.0519 K(o=-0.052,f=-1) USER MOD Single : A 405 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00159) USER MOD Single : A 409 GLN : amide:sc= -2.26 K(o=-2.3,f=-5.2!) USER MOD Single : A 416 MET CE :methyl -161:sc= -0.335 (180deg=-1.16) USER MOD Single : A 417 LYS NZ :NH3+ -147:sc= 1.19 (180deg=1.02) USER MOD Single : A 418 THR OG1 : rot 180:sc= 0.0127 USER MOD Single : A 423 MET CE :methyl -177:sc= 0 (180deg=-0.0152) USER MOD Single : A 424 SER OG : rot -104:sc= 2.36 USER MOD Single : A 427 THR OG1 : rot -41:sc= -0.995! USER MOD Single : A 432 HIS : no HD1:sc= -5.1! C(o=-5.1!,f=-1.4!) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= -0.289 X(o=-0.29,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -9.317 -7.191 15.106 1.00 6.78 N ATOM 2 CA GLY A 331 -9.174 -5.796 14.624 1.00 6.11 C ATOM 3 C GLY A 331 -10.132 -5.499 13.491 1.00 5.22 C ATOM 4 O GLY A 331 -9.869 -5.841 12.340 1.00 5.14 O ATOM 0 HA2 GLY A 331 -9.357 -5.105 15.447 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -8.150 -5.629 14.289 1.00 6.11 H new ATOM 10 N SER A 332 -11.238 -4.845 13.810 1.00 4.99 N ATOM 11 CA SER A 332 -12.296 -4.600 12.841 1.00 4.63 C ATOM 12 C SER A 332 -11.987 -3.372 11.986 1.00 3.82 C ATOM 13 O SER A 332 -12.817 -2.478 11.822 1.00 4.13 O ATOM 14 CB SER A 332 -13.626 -4.433 13.576 1.00 5.44 C ATOM 15 OG SER A 332 -13.866 -5.542 14.433 1.00 6.08 O ATOM 0 H SER A 332 -11.427 -4.472 14.740 1.00 4.99 H new ATOM 0 HA SER A 332 -12.364 -5.454 12.168 1.00 4.63 H new ATOM 0 HB2 SER A 332 -13.613 -3.512 14.159 1.00 5.44 H new ATOM 0 HB3 SER A 332 -14.438 -4.342 12.854 1.00 5.44 H new ATOM 0 HG SER A 332 -14.720 -5.418 14.897 1.00 6.08 H new ATOM 21 N HIS A 333 -10.783 -3.345 11.437 1.00 3.28 N ATOM 22 CA HIS A 333 -10.354 -2.266 10.568 1.00 2.94 C ATOM 23 C HIS A 333 -9.771 -2.852 9.294 1.00 2.02 C ATOM 24 O HIS A 333 -8.589 -3.192 9.245 1.00 2.49 O ATOM 25 CB HIS A 333 -9.321 -1.378 11.281 1.00 3.89 C ATOM 26 CG HIS A 333 -8.793 -0.243 10.445 1.00 4.68 C ATOM 27 ND1 HIS A 333 -9.436 0.970 10.325 1.00 5.34 N ATOM 28 CD2 HIS A 333 -7.670 -0.146 9.691 1.00 5.35 C ATOM 29 CE1 HIS A 333 -8.732 1.762 9.534 1.00 6.24 C ATOM 30 NE2 HIS A 333 -7.659 1.108 9.137 1.00 6.26 N ATOM 0 H HIS A 333 -10.079 -4.069 11.582 1.00 3.28 H new ATOM 0 HA HIS A 333 -11.212 -1.643 10.315 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -9.774 -0.968 12.184 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -8.484 -1.999 11.599 1.00 3.89 H new ATOM 0 HD2 HIS A 333 -6.923 -0.914 9.553 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -8.992 2.774 9.260 1.00 6.24 H new ATOM 0 HE2 HIS A 333 -6.937 1.475 8.517 1.00 6.26 H new ATOM 39 N MET A 334 -10.611 -3.001 8.279 1.00 1.20 N ATOM 40 CA MET A 334 -10.164 -3.503 6.989 1.00 0.62 C ATOM 41 C MET A 334 -9.196 -2.515 6.360 1.00 0.57 C ATOM 42 O MET A 334 -9.608 -1.548 5.720 1.00 0.92 O ATOM 43 CB MET A 334 -11.351 -3.749 6.055 1.00 1.35 C ATOM 44 CG MET A 334 -12.261 -4.880 6.506 1.00 2.01 C ATOM 45 SD MET A 334 -13.609 -5.189 5.345 1.00 3.03 S ATOM 46 CE MET A 334 -14.405 -6.586 6.133 1.00 3.71 C ATOM 0 H MET A 334 -11.606 -2.781 8.325 1.00 1.20 H new ATOM 0 HA MET A 334 -9.656 -4.454 7.146 1.00 0.62 H new ATOM 0 HB2 MET A 334 -11.936 -2.833 5.977 1.00 1.35 H new ATOM 0 HB3 MET A 334 -10.976 -3.973 5.057 1.00 1.35 H new ATOM 0 HG2 MET A 334 -11.673 -5.790 6.625 1.00 2.01 H new ATOM 0 HG3 MET A 334 -12.677 -4.639 7.484 1.00 2.01 H new ATOM 0 HE1 MET A 334 -15.262 -6.900 5.537 1.00 3.71 H new ATOM 0 HE2 MET A 334 -13.697 -7.411 6.213 1.00 3.71 H new ATOM 0 HE3 MET A 334 -14.741 -6.299 7.129 1.00 3.71 H new ATOM 56 N ARG A 335 -7.908 -2.745 6.588 1.00 0.40 N ATOM 57 CA ARG A 335 -6.869 -1.873 6.066 1.00 0.32 C ATOM 58 C ARG A 335 -6.935 -1.803 4.555 1.00 0.28 C ATOM 59 O ARG A 335 -7.131 -2.817 3.883 1.00 0.42 O ATOM 60 CB ARG A 335 -5.485 -2.355 6.487 1.00 0.37 C ATOM 61 CG ARG A 335 -5.333 -2.522 7.982 1.00 0.56 C ATOM 62 CD ARG A 335 -3.886 -2.409 8.396 1.00 0.93 C ATOM 63 NE ARG A 335 -3.717 -2.533 9.840 1.00 1.32 N ATOM 64 CZ ARG A 335 -3.394 -1.519 10.642 1.00 2.05 C ATOM 65 NH1 ARG A 335 -3.275 -0.288 10.152 1.00 2.81 N ATOM 66 NH2 ARG A 335 -3.219 -1.728 11.941 1.00 2.51 N ATOM 0 H ARG A 335 -7.560 -3.533 7.134 1.00 0.40 H new ATOM 0 HA ARG A 335 -7.039 -0.879 6.480 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.277 -3.308 6.000 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.738 -1.645 6.131 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -5.922 -1.764 8.498 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -5.727 -3.492 8.285 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -3.305 -3.183 7.896 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -3.489 -1.449 8.066 1.00 0.93 H new ATOM 0 HE ARG A 335 -3.854 -3.452 10.261 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -3.431 -0.117 9.159 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -3.028 0.485 10.770 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -3.332 -2.666 12.326 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -2.972 -0.951 12.554 1.00 2.51 H new ATOM 80 N LEU A 336 -6.782 -0.594 4.037 1.00 0.23 N ATOM 81 CA LEU A 336 -6.693 -0.375 2.603 1.00 0.28 C ATOM 82 C LEU A 336 -5.382 -0.925 2.104 1.00 0.14 C ATOM 83 O LEU A 336 -4.601 -1.439 2.886 1.00 0.20 O ATOM 84 CB LEU A 336 -6.763 1.113 2.258 1.00 0.48 C ATOM 85 CG LEU A 336 -8.075 1.823 2.571 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.557 2.545 1.337 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.124 0.848 3.061 1.00 0.67 C ATOM 0 H LEU A 336 -6.716 0.257 4.595 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.535 -0.880 2.129 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -5.962 1.625 2.792 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.559 1.226 1.193 1.00 0.48 H new ATOM 0 HG LEU A 336 -7.902 2.544 3.370 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.495 3.054 1.557 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.810 3.277 1.029 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.714 1.826 0.533 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.048 1.385 3.276 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.311 0.098 2.293 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -8.770 0.358 3.968 1.00 0.67 H new ATOM 99 N LEU A 337 -5.114 -0.800 0.824 1.00 0.15 N ATOM 100 CA LEU A 337 -3.875 -1.321 0.290 1.00 0.12 C ATOM 101 C LEU A 337 -2.703 -0.562 0.905 1.00 0.11 C ATOM 102 O LEU A 337 -1.750 -1.165 1.387 1.00 0.12 O ATOM 103 CB LEU A 337 -3.887 -1.240 -1.241 1.00 0.14 C ATOM 104 CG LEU A 337 -2.715 -1.892 -1.967 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.592 -0.906 -2.127 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.232 -3.124 -1.223 1.00 0.15 C ATOM 0 H LEU A 337 -5.725 -0.350 0.143 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.764 -2.373 0.551 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.808 -1.699 -1.600 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -3.923 -0.189 -1.527 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.056 -2.204 -2.954 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.761 -1.383 -2.647 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -1.939 -0.050 -2.706 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.261 -0.569 -1.145 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.396 -3.570 -1.762 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.909 -2.841 -0.221 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -3.044 -3.847 -1.151 1.00 0.15 H new ATOM 118 N TRP A 338 -2.811 0.758 0.946 1.00 0.12 N ATOM 119 CA TRP A 338 -1.784 1.581 1.582 1.00 0.14 C ATOM 120 C TRP A 338 -1.805 1.403 3.105 1.00 0.14 C ATOM 121 O TRP A 338 -0.763 1.442 3.755 1.00 0.17 O ATOM 122 CB TRP A 338 -1.949 3.065 1.207 1.00 0.16 C ATOM 123 CG TRP A 338 -3.237 3.682 1.658 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.360 3.861 0.909 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.534 4.209 2.956 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.333 4.462 1.657 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.854 4.679 2.918 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.811 4.323 4.147 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.471 5.251 4.021 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.425 4.888 5.242 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.747 5.346 5.173 1.00 0.21 C ATOM 0 H TRP A 338 -3.592 1.282 0.551 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.815 1.246 1.212 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.121 3.629 1.636 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.874 3.163 0.124 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.466 3.570 -0.126 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.266 4.709 1.327 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.791 3.975 4.207 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.489 5.609 3.969 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.879 4.980 6.169 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.202 5.783 6.050 1.00 0.21 H new ATOM 142 N ASP A 339 -2.998 1.203 3.667 1.00 0.14 N ATOM 143 CA ASP A 339 -3.148 0.991 5.111 1.00 0.17 C ATOM 144 C ASP A 339 -2.468 -0.315 5.486 1.00 0.16 C ATOM 145 O ASP A 339 -1.796 -0.436 6.512 1.00 0.23 O ATOM 146 CB ASP A 339 -4.640 0.930 5.484 1.00 0.23 C ATOM 147 CG ASP A 339 -4.911 1.175 6.959 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.114 0.730 7.809 1.00 0.86 O ATOM 149 OD2 ASP A 339 -5.946 1.804 7.272 1.00 1.15 O ATOM 0 H ASP A 339 -3.875 1.183 3.146 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.688 1.817 5.653 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.183 1.670 4.896 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.035 -0.048 5.209 1.00 0.23 H new ATOM 154 N TYR A 340 -2.639 -1.279 4.603 1.00 0.11 N ATOM 155 CA TYR A 340 -2.082 -2.604 4.750 1.00 0.10 C ATOM 156 C TYR A 340 -0.561 -2.569 4.724 1.00 0.08 C ATOM 157 O TYR A 340 0.086 -3.163 5.584 1.00 0.09 O ATOM 158 CB TYR A 340 -2.597 -3.477 3.618 1.00 0.11 C ATOM 159 CG TYR A 340 -2.370 -4.936 3.848 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.737 -5.521 5.045 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.794 -5.726 2.873 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.537 -6.858 5.269 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.590 -7.070 3.084 1.00 0.14 C ATOM 164 CZ TYR A 340 -1.962 -7.635 4.288 1.00 0.16 C ATOM 165 OH TYR A 340 -1.760 -8.976 4.511 1.00 0.20 O ATOM 0 H TYR A 340 -3.180 -1.158 3.747 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.389 -3.012 5.713 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.664 -3.298 3.487 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.108 -3.182 2.689 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.189 -4.915 5.816 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.500 -5.283 1.933 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -2.829 -7.300 6.210 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.142 -7.679 2.313 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.251 -9.497 3.842 1.00 0.20 H new ATOM 175 N VAL A 341 0.015 -1.863 3.748 1.00 0.08 N ATOM 176 CA VAL A 341 1.470 -1.828 3.613 1.00 0.07 C ATOM 177 C VAL A 341 2.099 -1.245 4.868 1.00 0.08 C ATOM 178 O VAL A 341 3.175 -1.658 5.260 1.00 0.08 O ATOM 179 CB VAL A 341 1.967 -1.034 2.375 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.169 -1.385 1.140 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.959 0.468 2.600 1.00 0.09 C ATOM 0 H VAL A 341 -0.494 -1.318 3.052 1.00 0.08 H new ATOM 0 HA VAL A 341 1.781 -2.863 3.470 1.00 0.07 H new ATOM 0 HB VAL A 341 3.004 -1.332 2.219 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.542 -0.812 0.291 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.270 -2.450 0.932 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.118 -1.146 1.306 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.316 0.972 1.702 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.944 0.797 2.822 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.611 0.714 3.438 1.00 0.09 H new ATOM 191 N TYR A 342 1.414 -0.294 5.494 1.00 0.08 N ATOM 192 CA TYR A 342 1.881 0.275 6.761 1.00 0.10 C ATOM 193 C TYR A 342 2.058 -0.804 7.819 1.00 0.11 C ATOM 194 O TYR A 342 3.043 -0.802 8.557 1.00 0.14 O ATOM 195 CB TYR A 342 0.916 1.329 7.305 1.00 0.11 C ATOM 196 CG TYR A 342 1.213 2.731 6.846 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.380 3.365 7.246 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.331 3.429 6.035 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.666 4.650 6.845 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.613 4.714 5.629 1.00 0.19 C ATOM 201 CZ TYR A 342 1.783 5.322 6.036 1.00 0.17 C ATOM 202 OH TYR A 342 2.072 6.604 5.629 1.00 0.21 O ATOM 0 H TYR A 342 0.538 0.100 5.150 1.00 0.08 H new ATOM 0 HA TYR A 342 2.841 0.745 6.546 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.098 1.067 7.004 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.942 1.302 8.394 1.00 0.11 H new ATOM 0 HD1 TYR A 342 3.077 2.841 7.884 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.588 2.959 5.718 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.580 5.128 7.165 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.080 5.245 4.993 1.00 0.19 H new ATOM 0 HH TYR A 342 2.128 6.632 4.651 1.00 0.21 H new ATOM 212 N GLN A 343 1.105 -1.726 7.888 1.00 0.12 N ATOM 213 CA GLN A 343 1.128 -2.773 8.894 1.00 0.18 C ATOM 214 C GLN A 343 2.235 -3.755 8.558 1.00 0.18 C ATOM 215 O GLN A 343 2.875 -4.333 9.437 1.00 0.25 O ATOM 216 CB GLN A 343 -0.240 -3.468 8.945 1.00 0.28 C ATOM 217 CG GLN A 343 -0.323 -4.782 8.198 1.00 0.55 C ATOM 218 CD GLN A 343 -0.259 -5.976 9.128 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.287 -6.493 9.562 1.00 1.40 O ATOM 220 NE2 GLN A 343 0.946 -6.395 9.467 1.00 1.15 N ATOM 0 H GLN A 343 0.306 -1.767 7.256 1.00 0.12 H new ATOM 0 HA GLN A 343 1.326 -2.350 9.879 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.502 -3.644 9.988 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -0.990 -2.789 8.539 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.252 -4.816 7.629 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.493 -4.841 7.478 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.772 -5.937 9.083 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.051 -7.177 10.113 1.00 1.15 H new ATOM 229 N LEU A 344 2.443 -3.933 7.266 1.00 0.15 N ATOM 230 CA LEU A 344 3.474 -4.817 6.770 1.00 0.16 C ATOM 231 C LEU A 344 4.854 -4.187 6.951 1.00 0.18 C ATOM 232 O LEU A 344 5.825 -4.859 7.290 1.00 0.27 O ATOM 233 CB LEU A 344 3.209 -5.097 5.295 1.00 0.13 C ATOM 234 CG LEU A 344 1.802 -5.609 4.990 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.560 -5.633 3.503 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.594 -6.992 5.565 1.00 0.18 C ATOM 0 H LEU A 344 1.902 -3.469 6.536 1.00 0.15 H new ATOM 0 HA LEU A 344 3.456 -5.751 7.332 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.380 -4.182 4.728 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.933 -5.831 4.942 1.00 0.13 H new ATOM 0 HG LEU A 344 1.090 -4.928 5.456 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.553 -6.000 3.304 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.665 -4.625 3.101 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.287 -6.291 3.027 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.585 -7.334 5.334 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.319 -7.680 5.129 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.728 -6.960 6.646 1.00 0.18 H new ATOM 248 N LEU A 345 4.899 -2.882 6.733 1.00 0.12 N ATOM 249 CA LEU A 345 6.112 -2.077 6.846 1.00 0.13 C ATOM 250 C LEU A 345 6.726 -2.174 8.241 1.00 0.19 C ATOM 251 O LEU A 345 7.949 -2.152 8.392 1.00 0.29 O ATOM 252 CB LEU A 345 5.777 -0.615 6.522 1.00 0.10 C ATOM 253 CG LEU A 345 6.192 -0.119 5.125 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.499 -1.277 4.197 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.109 0.768 4.517 1.00 0.10 C ATOM 0 H LEU A 345 4.078 -2.339 6.467 1.00 0.12 H new ATOM 0 HA LEU A 345 6.846 -2.460 6.137 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.701 -0.478 6.629 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.255 0.020 7.268 1.00 0.10 H new ATOM 0 HG LEU A 345 7.100 0.472 5.246 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.789 -0.893 3.219 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.316 -1.868 4.611 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.614 -1.904 4.093 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.426 1.105 3.530 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.183 0.201 4.426 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.943 1.632 5.160 1.00 0.10 H new ATOM 267 N SER A 346 5.876 -2.291 9.254 1.00 0.25 N ATOM 268 CA SER A 346 6.330 -2.295 10.634 1.00 0.33 C ATOM 269 C SER A 346 6.680 -3.697 11.147 1.00 0.30 C ATOM 270 O SER A 346 7.209 -3.831 12.250 1.00 0.53 O ATOM 271 CB SER A 346 5.268 -1.644 11.521 1.00 0.51 C ATOM 272 OG SER A 346 3.970 -2.137 11.226 1.00 1.43 O ATOM 0 H SER A 346 4.866 -2.384 9.142 1.00 0.25 H new ATOM 0 HA SER A 346 7.254 -1.718 10.676 1.00 0.33 H new ATOM 0 HB2 SER A 346 5.501 -1.834 12.569 1.00 0.51 H new ATOM 0 HB3 SER A 346 5.288 -0.563 11.381 1.00 0.51 H new ATOM 0 HG SER A 346 3.597 -1.643 10.466 1.00 1.43 H new ATOM 278 N ASP A 347 6.406 -4.738 10.365 1.00 0.32 N ATOM 279 CA ASP A 347 6.702 -6.100 10.809 1.00 0.32 C ATOM 280 C ASP A 347 7.722 -6.769 9.887 1.00 0.30 C ATOM 281 O ASP A 347 7.628 -6.682 8.664 1.00 0.30 O ATOM 282 CB ASP A 347 5.423 -6.935 10.874 1.00 0.35 C ATOM 283 CG ASP A 347 5.605 -8.215 11.666 1.00 0.49 C ATOM 284 OD1 ASP A 347 6.470 -9.035 11.298 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.875 -8.411 12.660 1.00 0.67 O ATOM 0 H ASP A 347 5.987 -4.670 9.437 1.00 0.32 H new ATOM 0 HA ASP A 347 7.132 -6.039 11.809 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.628 -6.342 11.326 1.00 0.35 H new ATOM 0 HB3 ASP A 347 5.101 -7.180 9.862 1.00 0.35 H new ATOM 290 N SER A 348 8.679 -7.466 10.490 1.00 0.34 N ATOM 291 CA SER A 348 9.801 -8.050 9.763 1.00 0.35 C ATOM 292 C SER A 348 9.391 -9.288 8.970 1.00 0.31 C ATOM 293 O SER A 348 10.068 -9.674 8.018 1.00 0.32 O ATOM 294 CB SER A 348 10.925 -8.397 10.741 1.00 0.46 C ATOM 295 OG SER A 348 11.972 -9.110 10.107 1.00 1.53 O ATOM 0 H SER A 348 8.699 -7.642 11.495 1.00 0.34 H new ATOM 0 HA SER A 348 10.153 -7.309 9.045 1.00 0.35 H new ATOM 0 HB2 SER A 348 11.322 -7.481 11.179 1.00 0.46 H new ATOM 0 HB3 SER A 348 10.523 -8.993 11.560 1.00 0.46 H new ATOM 0 HG SER A 348 12.673 -8.484 9.830 1.00 1.53 H new ATOM 301 N ARG A 349 8.280 -9.910 9.343 1.00 0.33 N ATOM 302 CA ARG A 349 7.831 -11.109 8.645 1.00 0.35 C ATOM 303 C ARG A 349 7.434 -10.766 7.212 1.00 0.29 C ATOM 304 O ARG A 349 7.392 -11.634 6.340 1.00 0.34 O ATOM 305 CB ARG A 349 6.669 -11.758 9.368 1.00 0.42 C ATOM 306 CG ARG A 349 5.393 -10.975 9.266 1.00 0.55 C ATOM 307 CD ARG A 349 4.408 -11.456 10.286 1.00 0.59 C ATOM 308 NE ARG A 349 3.558 -12.539 9.790 1.00 1.23 N ATOM 309 CZ ARG A 349 2.472 -12.977 10.429 1.00 1.67 C ATOM 310 NH1 ARG A 349 2.149 -12.478 11.619 1.00 1.93 N ATOM 311 NH2 ARG A 349 1.716 -13.917 9.878 1.00 2.56 N ATOM 0 H ARG A 349 7.681 -9.611 10.112 1.00 0.33 H new ATOM 0 HA ARG A 349 8.657 -11.819 8.626 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.508 -12.756 8.960 1.00 0.42 H new ATOM 0 HB3 ARG A 349 6.928 -11.882 10.420 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.595 -9.915 9.417 1.00 0.55 H new ATOM 0 HG3 ARG A 349 4.972 -11.080 8.266 1.00 0.55 H new ATOM 0 HD2 ARG A 349 4.946 -11.799 11.170 1.00 0.59 H new ATOM 0 HD3 ARG A 349 3.780 -10.622 10.599 1.00 0.59 H new ATOM 0 HE ARG A 349 3.810 -12.983 8.907 1.00 1.23 H new ATOM 0 HH11 ARG A 349 2.732 -11.758 12.046 1.00 1.93 H new ATOM 0 HH12 ARG A 349 1.318 -12.815 12.105 1.00 1.93 H new ATOM 0 HH21 ARG A 349 1.965 -14.303 8.968 1.00 2.56 H new ATOM 0 HH22 ARG A 349 0.885 -14.254 10.365 1.00 2.56 H new ATOM 325 N TYR A 350 7.151 -9.488 6.977 1.00 0.22 N ATOM 326 CA TYR A 350 6.741 -9.026 5.665 1.00 0.17 C ATOM 327 C TYR A 350 7.850 -8.232 5.001 1.00 0.16 C ATOM 328 O TYR A 350 7.713 -7.833 3.851 1.00 0.15 O ATOM 329 CB TYR A 350 5.517 -8.129 5.761 1.00 0.17 C ATOM 330 CG TYR A 350 4.439 -8.621 6.684 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.700 -9.754 6.387 1.00 0.24 C ATOM 332 CD2 TYR A 350 4.135 -7.922 7.836 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.688 -10.176 7.209 1.00 0.29 C ATOM 334 CE2 TYR A 350 3.132 -8.339 8.673 1.00 0.28 C ATOM 335 CZ TYR A 350 2.402 -9.466 8.358 1.00 0.31 C ATOM 336 OH TYR A 350 1.388 -9.878 9.190 1.00 0.39 O ATOM 0 H TYR A 350 7.200 -8.755 7.685 1.00 0.22 H new ATOM 0 HA TYR A 350 6.508 -9.912 5.074 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.835 -7.141 6.093 1.00 0.17 H new ATOM 0 HB3 TYR A 350 5.094 -8.010 4.764 1.00 0.17 H new ATOM 0 HD1 TYR A 350 3.925 -10.315 5.492 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.696 -7.033 8.081 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.118 -11.059 6.960 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.915 -7.787 9.575 1.00 0.28 H new ATOM 0 HH TYR A 350 1.322 -9.266 9.953 1.00 0.39 H new ATOM 346 N GLU A 351 8.947 -8.007 5.718 1.00 0.18 N ATOM 347 CA GLU A 351 10.022 -7.151 5.209 1.00 0.21 C ATOM 348 C GLU A 351 10.711 -7.793 4.000 1.00 0.21 C ATOM 349 O GLU A 351 11.509 -7.158 3.311 1.00 0.24 O ATOM 350 CB GLU A 351 11.033 -6.810 6.312 1.00 0.28 C ATOM 351 CG GLU A 351 12.039 -7.900 6.594 1.00 0.48 C ATOM 352 CD GLU A 351 13.234 -7.392 7.376 1.00 0.99 C ATOM 353 OE1 GLU A 351 14.211 -6.940 6.750 1.00 1.05 O ATOM 354 OE2 GLU A 351 13.203 -7.440 8.620 1.00 1.78 O ATOM 0 H GLU A 351 9.118 -8.399 6.644 1.00 0.18 H new ATOM 0 HA GLU A 351 9.573 -6.215 4.877 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.568 -5.903 6.030 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.489 -6.587 7.230 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.556 -8.701 7.153 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.380 -8.329 5.652 1.00 0.48 H new ATOM 361 N ASN A 352 10.378 -9.052 3.734 1.00 0.19 N ATOM 362 CA ASN A 352 10.847 -9.731 2.533 1.00 0.21 C ATOM 363 C ASN A 352 9.925 -9.413 1.359 1.00 0.16 C ATOM 364 O ASN A 352 10.295 -9.581 0.201 1.00 0.18 O ATOM 365 CB ASN A 352 10.897 -11.242 2.758 1.00 0.27 C ATOM 366 CG ASN A 352 11.450 -12.013 1.573 1.00 1.03 C ATOM 367 OD1 ASN A 352 10.961 -13.095 1.238 1.00 1.83 O ATOM 368 ND2 ASN A 352 12.494 -11.497 0.960 1.00 1.62 N ATOM 0 H ASN A 352 9.784 -9.623 4.336 1.00 0.19 H new ATOM 0 HA ASN A 352 11.853 -9.377 2.305 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.510 -11.451 3.635 1.00 0.27 H new ATOM 0 HB3 ASN A 352 9.892 -11.602 2.978 1.00 0.27 H new ATOM 0 HD21 ASN A 352 12.925 -11.994 0.181 1.00 1.62 H new ATOM 0 HD22 ASN A 352 12.872 -10.600 1.264 1.00 1.62 H new ATOM 375 N PHE A 353 8.718 -8.958 1.671 1.00 0.13 N ATOM 376 CA PHE A 353 7.738 -8.589 0.661 1.00 0.10 C ATOM 377 C PHE A 353 7.676 -7.075 0.492 1.00 0.08 C ATOM 378 O PHE A 353 7.361 -6.575 -0.582 1.00 0.07 O ATOM 379 CB PHE A 353 6.350 -9.089 1.054 1.00 0.09 C ATOM 380 CG PHE A 353 6.262 -10.564 1.320 1.00 0.12 C ATOM 381 CD1 PHE A 353 6.950 -11.473 0.537 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.499 -11.035 2.369 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.874 -12.825 0.794 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.420 -12.387 2.635 1.00 0.17 C ATOM 385 CZ PHE A 353 6.110 -13.283 1.845 1.00 0.18 C ATOM 0 H PHE A 353 8.393 -8.835 2.630 1.00 0.13 H new ATOM 0 HA PHE A 353 8.046 -9.049 -0.278 1.00 0.10 H new ATOM 0 HB2 PHE A 353 6.026 -8.554 1.946 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.650 -8.836 0.258 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.554 -11.119 -0.286 1.00 0.17 H new ATOM 0 HD2 PHE A 353 4.957 -10.337 2.990 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.413 -13.525 0.172 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.820 -12.742 3.459 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.051 -14.342 2.050 1.00 0.18 H new ATOM 395 N ILE A 354 7.981 -6.354 1.559 1.00 0.08 N ATOM 396 CA ILE A 354 7.873 -4.902 1.576 1.00 0.07 C ATOM 397 C ILE A 354 8.610 -4.361 2.796 1.00 0.08 C ATOM 398 O ILE A 354 8.689 -5.032 3.819 1.00 0.10 O ATOM 399 CB ILE A 354 6.390 -4.471 1.611 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.219 -3.003 1.227 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.795 -4.731 2.986 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.774 -2.549 1.228 1.00 0.07 C ATOM 0 H ILE A 354 8.310 -6.757 2.437 1.00 0.08 H new ATOM 0 HA ILE A 354 8.323 -4.496 0.670 1.00 0.07 H new ATOM 0 HB ILE A 354 5.855 -5.070 0.873 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.788 -2.384 1.921 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.643 -2.842 0.236 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.750 -4.422 2.994 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.861 -5.794 3.216 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.347 -4.163 3.735 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.723 -1.497 0.947 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.205 -3.144 0.513 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.352 -2.679 2.225 1.00 0.07 H new ATOM 414 N ARG A 355 9.162 -3.170 2.691 1.00 0.09 N ATOM 415 CA ARG A 355 9.957 -2.617 3.782 1.00 0.11 C ATOM 416 C ARG A 355 10.057 -1.106 3.660 1.00 0.10 C ATOM 417 O ARG A 355 9.994 -0.561 2.561 1.00 0.14 O ATOM 418 CB ARG A 355 11.368 -3.215 3.762 1.00 0.16 C ATOM 419 CG ARG A 355 12.217 -2.668 2.629 1.00 0.22 C ATOM 420 CD ARG A 355 13.608 -3.266 2.606 1.00 0.25 C ATOM 421 NE ARG A 355 14.457 -2.577 1.637 1.00 0.98 N ATOM 422 CZ ARG A 355 15.432 -3.152 0.940 1.00 1.40 C ATOM 423 NH1 ARG A 355 15.741 -4.429 1.142 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.109 -2.433 0.053 1.00 2.08 N ATOM 0 H ARG A 355 9.080 -2.567 1.873 1.00 0.09 H new ATOM 0 HA ARG A 355 9.464 -2.869 4.721 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.860 -3.008 4.712 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.298 -4.299 3.668 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.723 -2.870 1.679 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.292 -1.585 2.726 1.00 0.22 H new ATOM 0 HD2 ARG A 355 14.054 -3.198 3.598 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.549 -4.325 2.355 1.00 0.25 H new ATOM 0 HE ARG A 355 14.289 -1.583 1.484 1.00 0.98 H new ATOM 0 HH11 ARG A 355 15.229 -4.974 1.835 1.00 1.43 H new ATOM 0 HH12 ARG A 355 16.490 -4.864 0.604 1.00 1.43 H new ATOM 0 HH21 ARG A 355 15.879 -1.449 -0.088 1.00 2.08 H new ATOM 0 HH22 ARG A 355 16.859 -2.864 -0.487 1.00 2.08 H new ATOM 438 N TRP A 356 10.201 -0.436 4.790 1.00 0.10 N ATOM 439 CA TRP A 356 10.496 0.986 4.794 1.00 0.09 C ATOM 440 C TRP A 356 11.893 1.234 4.244 1.00 0.09 C ATOM 441 O TRP A 356 12.860 0.598 4.665 1.00 0.14 O ATOM 442 CB TRP A 356 10.452 1.561 6.205 1.00 0.10 C ATOM 443 CG TRP A 356 9.089 1.757 6.794 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.627 1.224 7.960 1.00 0.12 C ATOM 445 CD2 TRP A 356 8.028 2.569 6.274 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.352 1.663 8.206 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.961 2.488 7.187 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.874 3.358 5.133 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.764 3.169 6.994 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.686 4.032 4.943 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.645 3.938 5.869 1.00 0.13 C ATOM 0 H TRP A 356 10.118 -0.854 5.717 1.00 0.10 H new ATOM 0 HA TRP A 356 9.740 1.470 4.175 1.00 0.09 H new ATOM 0 HB2 TRP A 356 11.018 0.901 6.862 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.965 2.523 6.200 1.00 0.10 H new ATOM 0 HD1 TRP A 356 9.184 0.553 8.597 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.786 1.415 9.018 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.673 3.439 4.410 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.957 3.093 7.707 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.558 4.644 4.062 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.729 4.483 5.694 1.00 0.13 H new ATOM 462 N GLU A 357 11.993 2.158 3.313 1.00 0.10 N ATOM 463 CA GLU A 357 13.282 2.645 2.854 1.00 0.12 C ATOM 464 C GLU A 357 13.625 3.896 3.645 1.00 0.14 C ATOM 465 O GLU A 357 14.773 4.136 4.026 1.00 0.21 O ATOM 466 CB GLU A 357 13.227 2.955 1.371 1.00 0.16 C ATOM 467 CG GLU A 357 12.920 1.739 0.519 1.00 0.25 C ATOM 468 CD GLU A 357 14.116 0.840 0.282 1.00 0.36 C ATOM 469 OE1 GLU A 357 14.493 0.083 1.196 1.00 0.61 O ATOM 470 OE2 GLU A 357 14.663 0.865 -0.842 1.00 0.78 O ATOM 0 H GLU A 357 11.192 2.592 2.854 1.00 0.10 H new ATOM 0 HA GLU A 357 14.048 1.885 3.009 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.468 3.717 1.193 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.182 3.378 1.059 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.132 1.160 1.000 1.00 0.25 H new ATOM 0 HG3 GLU A 357 12.530 2.070 -0.443 1.00 0.25 H new ATOM 477 N ASP A 358 12.589 4.685 3.878 1.00 0.14 N ATOM 478 CA ASP A 358 12.653 5.841 4.757 1.00 0.16 C ATOM 479 C ASP A 358 11.347 5.937 5.524 1.00 0.16 C ATOM 480 O ASP A 358 10.391 6.547 5.053 1.00 0.20 O ATOM 481 CB ASP A 358 12.838 7.137 3.974 1.00 0.20 C ATOM 482 CG ASP A 358 13.545 8.196 4.794 1.00 0.92 C ATOM 483 OD1 ASP A 358 12.976 8.645 5.815 1.00 1.46 O ATOM 484 OD2 ASP A 358 14.661 8.602 4.417 1.00 1.33 O ATOM 0 H ASP A 358 11.671 4.540 3.458 1.00 0.14 H new ATOM 0 HA ASP A 358 13.506 5.713 5.424 1.00 0.16 H new ATOM 0 HB2 ASP A 358 13.411 6.936 3.069 1.00 0.20 H new ATOM 0 HB3 ASP A 358 11.865 7.512 3.658 1.00 0.20 H new ATOM 489 N LYS A 359 11.312 5.325 6.693 1.00 0.15 N ATOM 490 CA LYS A 359 10.101 5.256 7.500 1.00 0.17 C ATOM 491 C LYS A 359 9.509 6.631 7.786 1.00 0.19 C ATOM 492 O LYS A 359 8.302 6.838 7.642 1.00 0.23 O ATOM 493 CB LYS A 359 10.408 4.555 8.814 1.00 0.23 C ATOM 494 CG LYS A 359 9.242 4.552 9.785 1.00 0.29 C ATOM 495 CD LYS A 359 9.524 3.677 10.989 1.00 0.38 C ATOM 496 CE LYS A 359 8.486 3.890 12.070 1.00 0.91 C ATOM 497 NZ LYS A 359 8.635 5.218 12.725 1.00 1.50 N ATOM 0 H LYS A 359 12.118 4.862 7.112 1.00 0.15 H new ATOM 0 HA LYS A 359 9.361 4.695 6.929 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.701 3.526 8.608 1.00 0.23 H new ATOM 0 HB3 LYS A 359 11.262 5.041 9.285 1.00 0.23 H new ATOM 0 HG2 LYS A 359 9.039 5.571 10.114 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.345 4.196 9.277 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.531 2.629 10.688 1.00 0.38 H new ATOM 0 HD3 LYS A 359 10.515 3.902 11.382 1.00 0.38 H new ATOM 0 HE2 LYS A 359 7.489 3.808 11.638 1.00 0.91 H new ATOM 0 HE3 LYS A 359 8.575 3.103 12.819 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 7.876 5.348 13.424 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 9.557 5.268 13.203 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 8.576 5.968 12.007 1.00 1.50 H new ATOM 511 N GLU A 360 10.351 7.561 8.193 1.00 0.21 N ATOM 512 CA GLU A 360 9.887 8.883 8.586 1.00 0.27 C ATOM 513 C GLU A 360 9.585 9.773 7.382 1.00 0.24 C ATOM 514 O GLU A 360 8.950 10.818 7.513 1.00 0.37 O ATOM 515 CB GLU A 360 10.885 9.535 9.518 1.00 0.41 C ATOM 516 CG GLU A 360 11.031 8.762 10.813 1.00 0.63 C ATOM 517 CD GLU A 360 9.725 8.650 11.578 1.00 1.75 C ATOM 518 OE1 GLU A 360 9.377 9.601 12.306 1.00 1.97 O ATOM 519 OE2 GLU A 360 9.041 7.609 11.454 1.00 2.67 O ATOM 0 H GLU A 360 11.360 7.428 8.261 1.00 0.21 H new ATOM 0 HA GLU A 360 8.945 8.756 9.120 1.00 0.27 H new ATOM 0 HB2 GLU A 360 11.854 9.603 9.024 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.567 10.554 9.737 1.00 0.41 H new ATOM 0 HG2 GLU A 360 11.406 7.762 10.594 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.775 9.251 11.442 1.00 0.63 H new ATOM 526 N SER A 361 10.043 9.358 6.209 1.00 0.19 N ATOM 527 CA SER A 361 9.678 10.020 4.969 1.00 0.21 C ATOM 528 C SER A 361 8.525 9.270 4.307 1.00 0.19 C ATOM 529 O SER A 361 8.020 9.665 3.254 1.00 0.24 O ATOM 530 CB SER A 361 10.893 10.068 4.046 1.00 0.26 C ATOM 531 OG SER A 361 11.933 10.840 4.624 1.00 0.31 O ATOM 0 H SER A 361 10.671 8.562 6.092 1.00 0.19 H new ATOM 0 HA SER A 361 9.353 11.040 5.174 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.249 9.056 3.853 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.608 10.495 3.084 1.00 0.26 H new ATOM 0 HG SER A 361 12.427 10.292 5.269 1.00 0.31 H new ATOM 537 N LYS A 362 8.115 8.187 4.972 1.00 0.15 N ATOM 538 CA LYS A 362 7.079 7.283 4.480 1.00 0.14 C ATOM 539 C LYS A 362 7.436 6.753 3.103 1.00 0.12 C ATOM 540 O LYS A 362 6.592 6.614 2.222 1.00 0.15 O ATOM 541 CB LYS A 362 5.696 7.938 4.490 1.00 0.20 C ATOM 542 CG LYS A 362 5.030 7.904 5.858 1.00 0.48 C ATOM 543 CD LYS A 362 5.820 8.709 6.868 1.00 0.48 C ATOM 544 CE LYS A 362 5.338 8.496 8.293 1.00 0.51 C ATOM 545 NZ LYS A 362 5.667 7.138 8.796 1.00 1.23 N ATOM 0 H LYS A 362 8.499 7.913 5.876 1.00 0.15 H new ATOM 0 HA LYS A 362 7.029 6.436 5.164 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.789 8.974 4.163 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.055 7.432 3.768 1.00 0.20 H new ATOM 0 HG2 LYS A 362 4.018 8.301 5.783 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.943 6.872 6.198 1.00 0.48 H new ATOM 0 HD2 LYS A 362 6.873 8.436 6.800 1.00 0.48 H new ATOM 0 HD3 LYS A 362 5.748 9.768 6.619 1.00 0.48 H new ATOM 0 HE2 LYS A 362 5.791 9.243 8.944 1.00 0.51 H new ATOM 0 HE3 LYS A 362 4.259 8.647 8.337 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.656 7.141 9.836 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 4.964 6.458 8.444 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 6.612 6.863 8.461 1.00 1.23 H new ATOM 559 N ILE A 363 8.708 6.459 2.940 1.00 0.09 N ATOM 560 CA ILE A 363 9.211 5.844 1.740 1.00 0.09 C ATOM 561 C ILE A 363 9.403 4.365 1.991 1.00 0.08 C ATOM 562 O ILE A 363 10.049 3.981 2.962 1.00 0.10 O ATOM 563 CB ILE A 363 10.554 6.464 1.332 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.371 7.933 0.963 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.164 5.686 0.183 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.664 8.715 0.943 1.00 0.46 C ATOM 0 H ILE A 363 9.423 6.643 3.643 1.00 0.09 H new ATOM 0 HA ILE A 363 8.495 6.005 0.934 1.00 0.09 H new ATOM 0 HB ILE A 363 11.238 6.411 2.179 1.00 0.10 H new ATOM 0 HG12 ILE A 363 9.902 7.997 -0.019 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.687 8.396 1.674 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.116 6.137 -0.096 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.327 4.653 0.489 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.487 5.708 -0.671 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.459 9.751 0.673 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.125 8.682 1.930 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.343 8.277 0.211 1.00 0.46 H new ATOM 578 N PHE A 364 8.857 3.537 1.128 1.00 0.09 N ATOM 579 CA PHE A 364 8.949 2.105 1.311 1.00 0.09 C ATOM 580 C PHE A 364 9.230 1.431 -0.024 1.00 0.10 C ATOM 581 O PHE A 364 8.874 1.941 -1.085 1.00 0.13 O ATOM 582 CB PHE A 364 7.662 1.538 1.929 1.00 0.09 C ATOM 583 CG PHE A 364 6.489 1.544 1.003 1.00 0.08 C ATOM 584 CD1 PHE A 364 5.731 2.676 0.843 1.00 0.13 C ATOM 585 CD2 PHE A 364 6.161 0.409 0.291 1.00 0.12 C ATOM 586 CE1 PHE A 364 4.647 2.684 -0.018 1.00 0.14 C ATOM 587 CE2 PHE A 364 5.086 0.402 -0.571 1.00 0.12 C ATOM 588 CZ PHE A 364 4.325 1.540 -0.728 1.00 0.08 C ATOM 0 H PHE A 364 8.346 3.829 0.295 1.00 0.09 H new ATOM 0 HA PHE A 364 9.769 1.901 1.999 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.848 0.515 2.256 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.413 2.117 2.818 1.00 0.09 H new ATOM 0 HD1 PHE A 364 5.982 3.570 1.394 1.00 0.13 H new ATOM 0 HD2 PHE A 364 6.754 -0.485 0.411 1.00 0.12 H new ATOM 0 HE1 PHE A 364 4.055 3.579 -0.135 1.00 0.14 H new ATOM 0 HE2 PHE A 364 4.840 -0.494 -1.122 1.00 0.12 H new ATOM 0 HZ PHE A 364 3.481 1.539 -1.402 1.00 0.08 H new ATOM 598 N ARG A 365 9.901 0.309 0.045 1.00 0.10 N ATOM 599 CA ARG A 365 10.159 -0.517 -1.108 1.00 0.12 C ATOM 600 C ARG A 365 9.308 -1.770 -1.033 1.00 0.11 C ATOM 601 O ARG A 365 9.249 -2.412 0.015 1.00 0.18 O ATOM 602 CB ARG A 365 11.626 -0.933 -1.107 1.00 0.17 C ATOM 603 CG ARG A 365 12.034 -1.732 -2.321 1.00 0.17 C ATOM 604 CD ARG A 365 12.501 -0.827 -3.432 1.00 0.31 C ATOM 605 NE ARG A 365 13.856 -0.345 -3.170 1.00 0.77 N ATOM 606 CZ ARG A 365 14.927 -0.756 -3.841 1.00 0.63 C ATOM 607 NH1 ARG A 365 14.798 -1.664 -4.804 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.129 -0.290 -3.523 1.00 0.99 N ATOM 0 H ARG A 365 10.288 -0.061 0.913 1.00 0.10 H new ATOM 0 HA ARG A 365 9.923 0.043 -2.013 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.247 -0.039 -1.046 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.826 -1.522 -0.212 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.831 -2.426 -2.053 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.192 -2.332 -2.666 1.00 0.17 H new ATOM 0 HD2 ARG A 365 12.478 -1.365 -4.380 1.00 0.31 H new ATOM 0 HD3 ARG A 365 11.821 0.019 -3.529 1.00 0.31 H new ATOM 0 HE ARG A 365 13.987 0.345 -2.431 1.00 0.77 H new ATOM 0 HH11 ARG A 365 13.878 -2.044 -5.027 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.619 -1.980 -5.320 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.230 0.383 -2.764 1.00 0.99 H new ATOM 0 HH22 ARG A 365 16.951 -0.606 -4.038 1.00 0.99 H new ATOM 622 N ILE A 366 8.645 -2.123 -2.117 1.00 0.07 N ATOM 623 CA ILE A 366 8.046 -3.421 -2.202 1.00 0.06 C ATOM 624 C ILE A 366 9.133 -4.410 -2.566 1.00 0.07 C ATOM 625 O ILE A 366 9.655 -4.427 -3.680 1.00 0.10 O ATOM 626 CB ILE A 366 6.876 -3.442 -3.198 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.694 -2.682 -2.578 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.496 -4.876 -3.562 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.593 -2.359 -3.549 1.00 0.09 C ATOM 0 H ILE A 366 8.514 -1.531 -2.937 1.00 0.07 H new ATOM 0 HA ILE A 366 7.612 -3.698 -1.241 1.00 0.06 H new ATOM 0 HB ILE A 366 7.169 -2.951 -4.126 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.282 -3.276 -1.763 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.062 -1.754 -2.141 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.666 -4.864 -4.268 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.352 -5.375 -4.017 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.199 -5.413 -2.661 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.797 -1.823 -3.032 1.00 0.09 H new ATOM 0 HD12 ILE A 366 4.987 -1.737 -4.352 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.195 -3.283 -3.968 1.00 0.09 H new ATOM 641 N VAL A 367 9.509 -5.179 -1.578 1.00 0.07 N ATOM 642 CA VAL A 367 10.661 -6.052 -1.664 1.00 0.08 C ATOM 643 C VAL A 367 10.340 -7.291 -2.487 1.00 0.09 C ATOM 644 O VAL A 367 11.124 -7.724 -3.333 1.00 0.12 O ATOM 645 CB VAL A 367 11.123 -6.441 -0.253 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.301 -7.387 -0.306 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.464 -5.191 0.541 1.00 0.10 C ATOM 0 H VAL A 367 9.024 -5.221 -0.682 1.00 0.07 H new ATOM 0 HA VAL A 367 11.469 -5.520 -2.166 1.00 0.08 H new ATOM 0 HB VAL A 367 10.308 -6.963 0.248 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.606 -7.645 0.708 1.00 0.12 H new ATOM 0 HG12 VAL A 367 12.016 -8.293 -0.841 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.131 -6.906 -0.823 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.791 -5.474 1.542 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.263 -4.647 0.038 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.582 -4.554 0.614 1.00 0.10 H new ATOM 657 N ASP A 368 9.175 -7.849 -2.232 1.00 0.08 N ATOM 658 CA ASP A 368 8.667 -8.960 -3.010 1.00 0.09 C ATOM 659 C ASP A 368 7.184 -8.754 -3.251 1.00 0.08 C ATOM 660 O ASP A 368 6.341 -9.140 -2.448 1.00 0.09 O ATOM 661 CB ASP A 368 8.922 -10.282 -2.309 1.00 0.12 C ATOM 662 CG ASP A 368 8.726 -11.477 -3.216 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.590 -11.722 -3.667 1.00 0.45 O ATOM 664 OD2 ASP A 368 9.721 -12.181 -3.487 1.00 0.78 O ATOM 0 H ASP A 368 8.554 -7.546 -1.481 1.00 0.08 H new ATOM 0 HA ASP A 368 9.189 -8.996 -3.966 1.00 0.09 H new ATOM 0 HB2 ASP A 368 9.940 -10.291 -1.920 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.253 -10.368 -1.453 1.00 0.12 H new ATOM 669 N PRO A 369 6.882 -8.098 -4.363 1.00 0.09 N ATOM 670 CA PRO A 369 5.528 -7.711 -4.753 1.00 0.10 C ATOM 671 C PRO A 369 4.587 -8.891 -4.871 1.00 0.12 C ATOM 672 O PRO A 369 3.408 -8.786 -4.543 1.00 0.14 O ATOM 673 CB PRO A 369 5.727 -7.035 -6.115 1.00 0.12 C ATOM 674 CG PRO A 369 7.077 -7.447 -6.569 1.00 0.12 C ATOM 675 CD PRO A 369 7.876 -7.669 -5.333 1.00 0.10 C ATOM 0 HA PRO A 369 5.064 -7.067 -4.006 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.962 -7.349 -6.825 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.656 -5.951 -6.029 1.00 0.12 H new ATOM 0 HG2 PRO A 369 7.026 -8.355 -7.169 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.530 -6.677 -7.194 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.645 -8.427 -5.482 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.383 -6.759 -5.013 1.00 0.10 H new ATOM 683 N ASN A 370 5.109 -10.011 -5.331 1.00 0.13 N ATOM 684 CA ASN A 370 4.318 -11.224 -5.431 1.00 0.17 C ATOM 685 C ASN A 370 3.955 -11.706 -4.041 1.00 0.17 C ATOM 686 O ASN A 370 2.807 -12.058 -3.762 1.00 0.21 O ATOM 687 CB ASN A 370 5.088 -12.293 -6.160 1.00 0.21 C ATOM 688 CG ASN A 370 4.168 -13.097 -7.046 1.00 0.36 C ATOM 689 OD1 ASN A 370 3.258 -12.557 -7.677 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.359 -14.390 -7.056 1.00 0.59 N ATOM 0 H ASN A 370 6.076 -10.107 -5.641 1.00 0.13 H new ATOM 0 HA ASN A 370 3.408 -11.010 -5.991 1.00 0.17 H new ATOM 0 HB2 ASN A 370 5.874 -11.837 -6.761 1.00 0.21 H new ATOM 0 HB3 ASN A 370 5.577 -12.951 -5.442 1.00 0.21 H new ATOM 0 HD21 ASN A 370 3.742 -14.992 -7.601 1.00 0.59 H new ATOM 0 HD22 ASN A 370 5.125 -14.797 -6.519 1.00 0.59 H new ATOM 697 N GLY A 371 4.945 -11.685 -3.164 1.00 0.16 N ATOM 698 CA GLY A 371 4.734 -12.043 -1.783 1.00 0.19 C ATOM 699 C GLY A 371 3.802 -11.078 -1.084 1.00 0.13 C ATOM 700 O GLY A 371 3.008 -11.464 -0.227 1.00 0.13 O ATOM 0 H GLY A 371 5.904 -11.422 -3.391 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.321 -13.050 -1.729 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.692 -12.063 -1.263 1.00 0.19 H new ATOM 704 N LEU A 372 3.891 -9.820 -1.477 1.00 0.10 N ATOM 705 CA LEU A 372 3.136 -8.760 -0.834 1.00 0.08 C ATOM 706 C LEU A 372 1.687 -8.837 -1.289 1.00 0.11 C ATOM 707 O LEU A 372 0.756 -8.607 -0.523 1.00 0.13 O ATOM 708 CB LEU A 372 3.745 -7.396 -1.187 1.00 0.08 C ATOM 709 CG LEU A 372 3.583 -6.291 -0.132 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.162 -5.764 -0.079 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.975 -6.815 1.236 1.00 0.09 C ATOM 0 H LEU A 372 4.484 -9.506 -2.245 1.00 0.10 H new ATOM 0 HA LEU A 372 3.176 -8.880 0.249 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.809 -7.534 -1.378 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.296 -7.050 -2.118 1.00 0.08 H new ATOM 0 HG LEU A 372 4.239 -5.469 -0.419 1.00 0.08 H new ATOM 0 HD11 LEU A 372 2.091 -4.985 0.680 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.891 -5.351 -1.050 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.481 -6.578 0.172 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.857 -6.024 1.976 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.336 -7.658 1.500 1.00 0.09 H new ATOM 0 HD23 LEU A 372 5.015 -7.141 1.217 1.00 0.09 H new ATOM 723 N ALA A 373 1.514 -9.180 -2.553 1.00 0.12 N ATOM 724 CA ALA A 373 0.197 -9.314 -3.140 1.00 0.15 C ATOM 725 C ALA A 373 -0.536 -10.514 -2.582 1.00 0.14 C ATOM 726 O ALA A 373 -1.757 -10.492 -2.445 1.00 0.16 O ATOM 727 CB ALA A 373 0.314 -9.430 -4.635 1.00 0.20 C ATOM 0 H ALA A 373 2.281 -9.372 -3.198 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.379 -8.423 -2.888 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.680 -9.531 -5.071 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.796 -8.537 -5.033 1.00 0.20 H new ATOM 0 HB3 ALA A 373 0.911 -10.307 -4.886 1.00 0.20 H new ATOM 733 N ARG A 374 0.203 -11.571 -2.268 1.00 0.14 N ATOM 734 CA ARG A 374 -0.397 -12.728 -1.638 1.00 0.17 C ATOM 735 C ARG A 374 -0.888 -12.337 -0.250 1.00 0.14 C ATOM 736 O ARG A 374 -1.874 -12.871 0.231 1.00 0.16 O ATOM 737 CB ARG A 374 0.568 -13.917 -1.595 1.00 0.24 C ATOM 738 CG ARG A 374 1.318 -14.068 -0.299 1.00 0.28 C ATOM 739 CD ARG A 374 2.303 -15.223 -0.364 1.00 0.47 C ATOM 740 NE ARG A 374 3.140 -15.157 -1.562 1.00 1.44 N ATOM 741 CZ ARG A 374 4.457 -15.337 -1.575 1.00 2.04 C ATOM 742 NH1 ARG A 374 5.114 -15.605 -0.453 1.00 2.01 N ATOM 743 NH2 ARG A 374 5.111 -15.254 -2.726 1.00 3.03 N ATOM 0 H ARG A 374 1.206 -11.646 -2.439 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.249 -13.058 -2.233 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.006 -14.832 -1.783 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.288 -13.813 -2.407 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.851 -13.144 -0.075 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.612 -14.234 0.515 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.936 -15.211 0.523 1.00 0.47 H new ATOM 0 HD3 ARG A 374 1.758 -16.167 -0.353 1.00 0.47 H new ATOM 0 HE ARG A 374 2.680 -14.959 -2.451 1.00 1.44 H new ATOM 0 HH11 ARG A 374 4.608 -15.675 0.430 1.00 2.01 H new ATOM 0 HH12 ARG A 374 6.125 -15.741 -0.474 1.00 2.01 H new ATOM 0 HH21 ARG A 374 4.603 -15.054 -3.588 1.00 3.03 H new ATOM 0 HH22 ARG A 374 6.122 -15.390 -2.749 1.00 3.03 H new ATOM 757 N LEU A 375 -0.208 -11.376 0.372 1.00 0.13 N ATOM 758 CA LEU A 375 -0.675 -10.795 1.628 1.00 0.15 C ATOM 759 C LEU A 375 -1.991 -10.069 1.393 1.00 0.16 C ATOM 760 O LEU A 375 -2.947 -10.225 2.146 1.00 0.18 O ATOM 761 CB LEU A 375 0.353 -9.797 2.162 1.00 0.17 C ATOM 762 CG LEU A 375 1.368 -10.309 3.181 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.809 -11.724 2.877 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.567 -9.384 3.179 1.00 0.15 C ATOM 0 H LEU A 375 0.668 -10.984 0.027 1.00 0.13 H new ATOM 0 HA LEU A 375 -0.814 -11.595 2.355 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.904 -9.394 1.312 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.188 -8.966 2.614 1.00 0.17 H new ATOM 0 HG LEU A 375 0.895 -10.321 4.163 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.531 -12.049 3.626 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.944 -12.387 2.895 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.271 -11.757 1.890 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.301 -9.738 3.903 1.00 0.15 H new ATOM 0 HD22 LEU A 375 3.015 -9.371 2.185 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.250 -8.376 3.447 1.00 0.15 H new ATOM 776 N TRP A 376 -2.021 -9.278 0.328 1.00 0.16 N ATOM 777 CA TRP A 376 -3.208 -8.525 -0.049 1.00 0.18 C ATOM 778 C TRP A 376 -4.378 -9.478 -0.294 1.00 0.20 C ATOM 779 O TRP A 376 -5.492 -9.254 0.179 1.00 0.25 O ATOM 780 CB TRP A 376 -2.905 -7.702 -1.304 1.00 0.19 C ATOM 781 CG TRP A 376 -3.870 -6.579 -1.569 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.332 -6.167 -2.788 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.484 -5.719 -0.602 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.186 -5.105 -2.638 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.300 -4.815 -1.310 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.429 -5.622 0.789 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.051 -3.836 -0.675 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.173 -4.642 1.417 1.00 0.22 C ATOM 789 CH2 TRP A 376 -5.976 -3.766 0.683 1.00 0.24 C ATOM 0 H TRP A 376 -1.226 -9.141 -0.296 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.486 -7.849 0.759 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.901 -7.287 -1.216 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.899 -8.369 -2.166 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -4.063 -6.614 -3.734 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.659 -4.612 -3.396 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -3.816 -6.300 1.364 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.672 -3.155 -1.237 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.133 -4.552 2.492 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.551 -3.015 1.205 1.00 0.24 H new ATOM 800 N GLY A 377 -4.104 -10.559 -1.017 1.00 0.21 N ATOM 801 CA GLY A 377 -5.110 -11.573 -1.257 1.00 0.27 C ATOM 802 C GLY A 377 -5.452 -12.354 -0.002 1.00 0.30 C ATOM 803 O GLY A 377 -6.575 -12.809 0.158 1.00 0.38 O ATOM 0 H GLY A 377 -3.197 -10.750 -1.443 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.012 -11.101 -1.646 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -4.754 -12.260 -2.024 1.00 0.27 H new ATOM 807 N ASN A 378 -4.472 -12.520 0.878 1.00 0.27 N ATOM 808 CA ASN A 378 -4.687 -13.150 2.178 1.00 0.30 C ATOM 809 C ASN A 378 -5.620 -12.301 3.037 1.00 0.30 C ATOM 810 O ASN A 378 -6.561 -12.805 3.647 1.00 0.35 O ATOM 811 CB ASN A 378 -3.352 -13.347 2.903 1.00 0.32 C ATOM 812 CG ASN A 378 -2.794 -14.757 2.792 1.00 0.38 C ATOM 813 OD1 ASN A 378 -3.113 -15.638 3.591 1.00 0.76 O ATOM 814 ND2 ASN A 378 -1.937 -14.963 1.810 1.00 0.42 N ATOM 0 H ASN A 378 -3.510 -12.224 0.713 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.149 -14.123 2.013 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.623 -12.645 2.498 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.482 -13.100 3.957 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.510 -15.882 1.690 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -1.702 -14.204 1.171 1.00 0.42 H new ATOM 821 N HIS A 379 -5.348 -11.002 3.061 1.00 0.28 N ATOM 822 CA HIS A 379 -6.122 -10.043 3.843 1.00 0.30 C ATOM 823 C HIS A 379 -7.545 -9.912 3.309 1.00 0.32 C ATOM 824 O HIS A 379 -8.501 -9.839 4.080 1.00 0.38 O ATOM 825 CB HIS A 379 -5.403 -8.684 3.815 1.00 0.28 C ATOM 826 CG HIS A 379 -6.132 -7.555 4.486 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.078 -7.370 5.845 1.00 0.43 N ATOM 828 CD2 HIS A 379 -6.871 -6.563 3.934 1.00 0.31 C ATOM 829 CE1 HIS A 379 -6.779 -6.274 6.088 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.278 -5.749 4.959 1.00 0.38 N ATOM 0 H HIS A 379 -4.581 -10.581 2.537 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.196 -10.398 4.871 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.429 -8.798 4.290 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.221 -8.410 2.776 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.097 -6.437 2.885 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -6.930 -5.855 7.072 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -7.849 -4.908 4.879 1.00 0.38 H new ATOM 838 N LYS A 380 -7.681 -9.901 1.991 1.00 0.32 N ATOM 839 CA LYS A 380 -8.978 -9.684 1.362 1.00 0.36 C ATOM 840 C LYS A 380 -9.658 -10.992 0.970 1.00 0.41 C ATOM 841 O LYS A 380 -10.771 -10.993 0.446 1.00 0.45 O ATOM 842 CB LYS A 380 -8.805 -8.792 0.136 1.00 0.36 C ATOM 843 CG LYS A 380 -8.513 -7.348 0.491 1.00 0.38 C ATOM 844 CD LYS A 380 -7.763 -6.626 -0.612 1.00 0.63 C ATOM 845 CE LYS A 380 -8.373 -6.851 -1.978 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.242 -5.658 -2.856 1.00 0.77 N ATOM 0 H LYS A 380 -6.911 -10.039 1.336 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.624 -9.195 2.091 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -7.993 -9.181 -0.478 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -9.711 -8.836 -0.469 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -9.450 -6.828 0.691 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -7.927 -7.313 1.409 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -7.749 -5.558 -0.397 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -6.726 -6.963 -0.622 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.890 -7.705 -2.453 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.427 -7.103 -1.866 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -8.881 -5.755 -3.671 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -8.493 -4.803 -2.320 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -7.261 -5.581 -3.192 1.00 0.77 H new ATOM 860 N ASN A 381 -8.970 -12.096 1.248 1.00 0.44 N ATOM 861 CA ASN A 381 -9.451 -13.443 0.933 1.00 0.52 C ATOM 862 C ASN A 381 -9.793 -13.578 -0.556 1.00 0.53 C ATOM 863 O ASN A 381 -10.914 -13.928 -0.925 1.00 0.60 O ATOM 864 CB ASN A 381 -10.661 -13.805 1.808 1.00 0.58 C ATOM 865 CG ASN A 381 -11.092 -15.250 1.642 1.00 1.20 C ATOM 866 OD1 ASN A 381 -10.287 -16.121 1.303 1.00 1.87 O ATOM 867 ND2 ASN A 381 -12.358 -15.521 1.910 1.00 2.01 N ATOM 0 H ASN A 381 -8.056 -12.084 1.701 1.00 0.44 H new ATOM 0 HA ASN A 381 -8.647 -14.146 1.153 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -10.416 -13.621 2.854 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.495 -13.150 1.556 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -12.700 -16.479 1.840 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -12.992 -14.772 2.187 1.00 2.01 H new ATOM 874 N ARG A 382 -8.818 -13.295 -1.414 1.00 0.50 N ATOM 875 CA ARG A 382 -9.021 -13.391 -2.855 1.00 0.55 C ATOM 876 C ARG A 382 -8.017 -14.343 -3.476 1.00 0.68 C ATOM 877 O ARG A 382 -6.829 -14.315 -3.156 1.00 0.78 O ATOM 878 CB ARG A 382 -8.889 -12.024 -3.530 1.00 0.49 C ATOM 879 CG ARG A 382 -9.722 -10.934 -2.888 1.00 0.48 C ATOM 880 CD ARG A 382 -11.202 -11.243 -2.987 1.00 0.57 C ATOM 881 NE ARG A 382 -12.014 -10.187 -2.391 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.223 -10.374 -1.868 1.00 1.11 C ATOM 883 NH1 ARG A 382 -13.803 -11.569 -1.926 1.00 1.69 N ATOM 884 NH2 ARG A 382 -13.860 -9.359 -1.293 1.00 1.27 N ATOM 0 H ARG A 382 -7.882 -12.998 -1.137 1.00 0.50 H new ATOM 0 HA ARG A 382 -10.032 -13.768 -3.012 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -7.842 -11.723 -3.514 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.178 -12.118 -4.577 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -9.440 -10.827 -1.841 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -9.514 -9.981 -3.373 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -11.479 -11.368 -4.034 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -11.411 -12.189 -2.487 1.00 0.57 H new ATOM 0 HE ARG A 382 -11.629 -9.243 -2.374 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -13.321 -12.349 -2.373 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -14.730 -11.706 -1.523 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -13.422 -8.439 -1.253 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -14.787 -9.500 -0.891 1.00 1.27 H new ATOM 898 N THR A 383 -8.510 -15.176 -4.377 1.00 0.76 N ATOM 899 CA THR A 383 -7.677 -16.129 -5.087 1.00 0.95 C ATOM 900 C THR A 383 -6.920 -15.448 -6.220 1.00 0.94 C ATOM 901 O THR A 383 -5.743 -15.716 -6.460 1.00 1.22 O ATOM 902 CB THR A 383 -8.541 -17.265 -5.673 1.00 1.17 C ATOM 903 OG1 THR A 383 -9.169 -18.008 -4.618 1.00 1.24 O ATOM 904 CG2 THR A 383 -7.708 -18.193 -6.543 1.00 1.37 C ATOM 0 H THR A 383 -9.496 -15.210 -4.636 1.00 0.76 H new ATOM 0 HA THR A 383 -6.962 -16.541 -4.375 1.00 0.95 H new ATOM 0 HB THR A 383 -9.312 -16.814 -6.298 1.00 1.17 H new ATOM 0 HG1 THR A 383 -9.716 -18.725 -5.003 1.00 1.24 H new ATOM 0 HG21 THR A 383 -8.343 -18.984 -6.943 1.00 1.37 H new ATOM 0 HG22 THR A 383 -7.272 -17.627 -7.366 1.00 1.37 H new ATOM 0 HG23 THR A 383 -6.911 -18.635 -5.945 1.00 1.37 H new ATOM 912 N ASN A 384 -7.602 -14.538 -6.889 1.00 0.84 N ATOM 913 CA ASN A 384 -7.092 -13.935 -8.112 1.00 0.81 C ATOM 914 C ASN A 384 -6.320 -12.659 -7.832 1.00 0.64 C ATOM 915 O ASN A 384 -6.032 -11.887 -8.747 1.00 0.77 O ATOM 916 CB ASN A 384 -8.251 -13.622 -9.046 1.00 0.89 C ATOM 917 CG ASN A 384 -8.894 -14.865 -9.642 1.00 1.40 C ATOM 918 OD1 ASN A 384 -8.925 -15.928 -9.022 1.00 2.21 O ATOM 919 ND2 ASN A 384 -9.413 -14.739 -10.854 1.00 1.70 N ATOM 0 H ASN A 384 -8.520 -14.196 -6.605 1.00 0.84 H new ATOM 0 HA ASN A 384 -6.411 -14.649 -8.575 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -9.006 -13.057 -8.500 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -7.896 -12.982 -9.854 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -9.857 -15.539 -11.304 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -9.368 -13.842 -11.337 1.00 1.70 H new ATOM 926 N MET A 385 -5.984 -12.434 -6.577 1.00 0.55 N ATOM 927 CA MET A 385 -5.285 -11.220 -6.204 1.00 0.42 C ATOM 928 C MET A 385 -3.817 -11.313 -6.577 1.00 0.53 C ATOM 929 O MET A 385 -3.115 -12.235 -6.161 1.00 0.94 O ATOM 930 CB MET A 385 -5.431 -10.950 -4.710 1.00 0.47 C ATOM 931 CG MET A 385 -4.851 -9.613 -4.283 1.00 0.92 C ATOM 932 SD MET A 385 -6.140 -8.406 -3.900 1.00 2.54 S ATOM 933 CE MET A 385 -7.172 -8.482 -5.363 1.00 3.18 C ATOM 0 H MET A 385 -6.182 -13.070 -5.804 1.00 0.55 H new ATOM 0 HA MET A 385 -5.733 -10.391 -6.752 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.487 -10.982 -4.443 1.00 0.47 H new ATOM 0 HB3 MET A 385 -4.938 -11.747 -4.154 1.00 0.47 H new ATOM 0 HG2 MET A 385 -4.217 -9.756 -3.408 1.00 0.92 H new ATOM 0 HG3 MET A 385 -4.215 -9.224 -5.078 1.00 0.92 H new ATOM 0 HE1 MET A 385 -7.787 -7.584 -5.422 1.00 3.18 H new ATOM 0 HE2 MET A 385 -6.542 -8.549 -6.250 1.00 3.18 H new ATOM 0 HE3 MET A 385 -7.816 -9.360 -5.309 1.00 3.18 H new ATOM 943 N THR A 386 -3.368 -10.365 -7.381 1.00 0.23 N ATOM 944 CA THR A 386 -1.989 -10.328 -7.816 1.00 0.24 C ATOM 945 C THR A 386 -1.374 -8.980 -7.484 1.00 0.16 C ATOM 946 O THR A 386 -2.058 -8.107 -6.938 1.00 0.18 O ATOM 947 CB THR A 386 -1.865 -10.582 -9.330 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.452 -9.504 -10.065 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.558 -11.873 -9.713 1.00 0.44 C ATOM 0 H THR A 386 -3.945 -9.607 -7.746 1.00 0.23 H new ATOM 0 HA THR A 386 -1.457 -11.120 -7.289 1.00 0.24 H new ATOM 0 HB THR A 386 -0.805 -10.656 -9.572 1.00 0.33 H new ATOM 0 HG1 THR A 386 -2.715 -9.820 -10.955 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.459 -12.034 -10.786 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.100 -12.705 -9.177 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.614 -11.810 -9.451 1.00 0.44 H new ATOM 957 N TYR A 387 -0.102 -8.793 -7.809 1.00 0.16 N ATOM 958 CA TYR A 387 0.531 -7.502 -7.604 1.00 0.13 C ATOM 959 C TYR A 387 -0.068 -6.494 -8.568 1.00 0.14 C ATOM 960 O TYR A 387 -0.141 -5.303 -8.271 1.00 0.17 O ATOM 961 CB TYR A 387 2.045 -7.562 -7.788 1.00 0.15 C ATOM 962 CG TYR A 387 2.669 -6.220 -7.526 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.579 -5.649 -6.267 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.292 -5.496 -8.536 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.093 -4.406 -6.015 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.807 -4.240 -8.292 1.00 0.14 C ATOM 967 CZ TYR A 387 3.706 -3.698 -7.030 1.00 0.12 C ATOM 968 OH TYR A 387 4.216 -2.445 -6.783 1.00 0.13 O ATOM 0 H TYR A 387 0.503 -9.509 -8.210 1.00 0.16 H new ATOM 0 HA TYR A 387 0.345 -7.199 -6.574 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.469 -8.303 -7.111 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.280 -7.885 -8.802 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.095 -6.194 -5.470 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.374 -5.923 -9.525 1.00 0.14 H new ATOM 0 HE1 TYR A 387 3.019 -3.980 -5.025 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.286 -3.685 -9.085 1.00 0.14 H new ATOM 0 HH TYR A 387 4.614 -2.086 -7.604 1.00 0.13 H new ATOM 978 N GLU A 388 -0.511 -6.982 -9.720 1.00 0.17 N ATOM 979 CA GLU A 388 -1.218 -6.147 -10.676 1.00 0.24 C ATOM 980 C GLU A 388 -2.416 -5.485 -10.004 1.00 0.25 C ATOM 981 O GLU A 388 -2.616 -4.278 -10.123 1.00 0.31 O ATOM 982 CB GLU A 388 -1.659 -6.979 -11.881 1.00 0.30 C ATOM 983 CG GLU A 388 -2.633 -6.274 -12.798 1.00 0.44 C ATOM 984 CD GLU A 388 -4.028 -6.856 -12.727 1.00 1.53 C ATOM 985 OE1 GLU A 388 -4.208 -8.031 -13.114 1.00 1.96 O ATOM 986 OE2 GLU A 388 -4.949 -6.146 -12.276 1.00 2.21 O ATOM 0 H GLU A 388 -0.392 -7.952 -10.013 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.547 -5.365 -11.031 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.777 -7.262 -12.455 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.117 -7.902 -11.524 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -2.671 -5.216 -12.537 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -2.270 -6.336 -13.824 1.00 0.44 H new ATOM 993 N LYS A 389 -3.192 -6.285 -9.275 1.00 0.23 N ATOM 994 CA LYS A 389 -4.337 -5.775 -8.524 1.00 0.28 C ATOM 995 C LYS A 389 -3.905 -4.722 -7.501 1.00 0.28 C ATOM 996 O LYS A 389 -4.591 -3.722 -7.296 1.00 0.40 O ATOM 997 CB LYS A 389 -5.071 -6.914 -7.807 1.00 0.32 C ATOM 998 CG LYS A 389 -6.011 -7.721 -8.694 1.00 0.45 C ATOM 999 CD LYS A 389 -5.273 -8.510 -9.759 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.239 -9.274 -10.649 1.00 0.46 C ATOM 1001 NZ LYS A 389 -5.544 -9.947 -11.775 1.00 1.39 N ATOM 0 H LYS A 389 -3.048 -7.291 -9.189 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.013 -5.310 -9.241 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.332 -7.589 -7.374 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.644 -6.495 -6.979 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.590 -8.406 -8.075 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.721 -7.047 -9.173 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.674 -7.832 -10.367 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.583 -9.208 -9.285 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -6.769 -10.017 -10.054 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -6.988 -8.588 -11.044 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -6.240 -10.222 -12.497 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -4.850 -9.296 -12.193 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -5.055 -10.795 -11.424 1.00 1.39 H new ATOM 1015 N MET A 390 -2.769 -4.963 -6.860 1.00 0.19 N ATOM 1016 CA MET A 390 -2.213 -4.026 -5.887 1.00 0.17 C ATOM 1017 C MET A 390 -1.769 -2.740 -6.568 1.00 0.16 C ATOM 1018 O MET A 390 -2.018 -1.642 -6.070 1.00 0.17 O ATOM 1019 CB MET A 390 -1.029 -4.670 -5.174 1.00 0.15 C ATOM 1020 CG MET A 390 -0.365 -3.760 -4.160 1.00 0.14 C ATOM 1021 SD MET A 390 0.885 -4.619 -3.196 1.00 0.18 S ATOM 1022 CE MET A 390 -0.119 -5.913 -2.478 1.00 1.57 C ATOM 0 H MET A 390 -2.210 -5.805 -6.996 1.00 0.19 H new ATOM 0 HA MET A 390 -2.987 -3.780 -5.160 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.367 -5.576 -4.671 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.290 -4.974 -5.916 1.00 0.15 H new ATOM 0 HG2 MET A 390 0.093 -2.916 -4.676 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.122 -3.352 -3.490 1.00 0.14 H new ATOM 0 HE1 MET A 390 -0.499 -5.584 -1.511 1.00 1.57 H new ATOM 0 HE2 MET A 390 -0.956 -6.134 -3.141 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.485 -6.810 -2.344 1.00 1.57 H new ATOM 1032 N SER A 391 -1.110 -2.889 -7.709 1.00 0.15 N ATOM 1033 CA SER A 391 -0.661 -1.752 -8.492 1.00 0.17 C ATOM 1034 C SER A 391 -1.849 -0.863 -8.859 1.00 0.19 C ATOM 1035 O SER A 391 -1.747 0.357 -8.805 1.00 0.21 O ATOM 1036 CB SER A 391 0.066 -2.233 -9.754 1.00 0.23 C ATOM 1037 OG SER A 391 0.637 -1.153 -10.473 1.00 1.02 O ATOM 0 H SER A 391 -0.874 -3.795 -8.113 1.00 0.15 H new ATOM 0 HA SER A 391 0.037 -1.165 -7.895 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.848 -2.940 -9.477 1.00 0.23 H new ATOM 0 HB3 SER A 391 -0.634 -2.768 -10.396 1.00 0.23 H new ATOM 0 HG SER A 391 1.093 -1.495 -11.270 1.00 1.02 H new ATOM 1043 N ARG A 392 -2.983 -1.483 -9.202 1.00 0.21 N ATOM 1044 CA ARG A 392 -4.216 -0.743 -9.495 1.00 0.26 C ATOM 1045 C ARG A 392 -4.515 0.241 -8.382 1.00 0.22 C ATOM 1046 O ARG A 392 -4.688 1.442 -8.616 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.407 -1.680 -9.606 1.00 0.38 C ATOM 1048 CG ARG A 392 -5.202 -2.845 -10.540 1.00 1.12 C ATOM 1049 CD ARG A 392 -5.148 -2.409 -11.991 1.00 2.05 C ATOM 1050 NE ARG A 392 -5.298 -3.547 -12.892 1.00 2.61 N ATOM 1051 CZ ARG A 392 -5.863 -3.475 -14.091 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -6.237 -2.302 -14.588 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -6.043 -4.579 -14.799 1.00 4.06 N ATOM 0 H ARG A 392 -3.073 -2.496 -9.284 1.00 0.21 H new ATOM 0 HA ARG A 392 -4.061 -0.225 -10.441 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.645 -2.064 -8.614 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -6.272 -1.109 -9.943 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -4.276 -3.358 -10.281 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -6.012 -3.563 -10.407 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -5.937 -1.683 -12.184 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -4.200 -1.909 -12.188 1.00 2.05 H new ATOM 0 HE ARG A 392 -4.947 -4.453 -12.582 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -6.091 -1.449 -14.048 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -6.671 -2.254 -15.510 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -5.748 -5.480 -14.423 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -6.477 -4.529 -15.721 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.587 -0.299 -7.172 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.824 0.490 -5.976 1.00 0.17 C ATOM 1069 C ALA A 393 -3.788 1.600 -5.841 1.00 0.12 C ATOM 1070 O ALA A 393 -4.139 2.744 -5.573 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.808 -0.403 -4.747 1.00 0.20 C ATOM 0 H ALA A 393 -4.482 -1.298 -6.995 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.807 0.954 -6.061 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.987 0.200 -3.857 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.588 -1.159 -4.836 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.837 -0.892 -4.665 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.518 1.265 -6.061 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.438 2.240 -5.951 1.00 0.10 C ATOM 1079 C LEU A 394 -1.650 3.369 -6.942 1.00 0.11 C ATOM 1080 O LEU A 394 -1.572 4.541 -6.592 1.00 0.12 O ATOM 1081 CB LEU A 394 -0.085 1.567 -6.204 1.00 0.11 C ATOM 1082 CG LEU A 394 0.316 0.524 -5.170 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.499 -0.290 -5.664 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.651 1.208 -3.859 1.00 0.13 C ATOM 0 H LEU A 394 -2.213 0.326 -6.316 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.442 2.650 -4.941 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.109 1.094 -7.186 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.686 2.337 -6.240 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.520 -0.157 -5.011 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.771 -1.030 -4.911 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.230 -0.797 -6.591 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.346 0.372 -5.845 1.00 0.13 H new ATOM 0 HD21 LEU A 394 0.938 0.459 -3.121 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.477 1.902 -4.012 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.221 1.755 -3.501 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.955 2.997 -8.173 1.00 0.12 N ATOM 1097 CA ARG A 395 -2.193 3.956 -9.238 1.00 0.14 C ATOM 1098 C ARG A 395 -3.347 4.887 -8.890 1.00 0.14 C ATOM 1099 O ARG A 395 -3.342 6.059 -9.256 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.496 3.212 -10.532 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.373 2.297 -10.976 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.577 2.906 -12.113 1.00 0.52 C ATOM 1103 NE ARG A 395 -1.410 3.157 -13.291 1.00 1.30 N ATOM 1104 CZ ARG A 395 -0.982 3.788 -14.382 1.00 1.72 C ATOM 1105 NH1 ARG A 395 0.276 4.205 -14.457 1.00 1.66 N ATOM 1106 NH2 ARG A 395 -1.805 3.988 -15.404 1.00 2.64 N ATOM 0 H ARG A 395 -2.045 2.023 -8.462 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.297 4.563 -9.365 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.404 2.623 -10.400 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.698 3.937 -11.321 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -0.711 2.096 -10.134 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.786 1.339 -11.292 1.00 0.33 H new ATOM 0 HD2 ARG A 395 -0.127 3.842 -11.781 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.241 2.237 -12.382 1.00 0.52 H new ATOM 0 HE ARG A 395 -2.376 2.829 -13.274 1.00 1.30 H new ATOM 0 HH11 ARG A 395 0.915 4.042 -13.679 1.00 1.66 H new ATOM 0 HH12 ARG A 395 0.604 4.689 -15.293 1.00 1.66 H new ATOM 0 HH21 ARG A 395 -2.769 3.658 -15.355 1.00 2.64 H new ATOM 0 HH22 ARG A 395 -1.474 4.472 -16.238 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.337 4.362 -8.178 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.473 5.167 -7.760 1.00 0.13 C ATOM 1122 C HIS A 396 -5.064 6.063 -6.599 1.00 0.11 C ATOM 1123 O HIS A 396 -5.494 7.210 -6.500 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.659 4.279 -7.374 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.981 4.965 -7.518 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -8.250 5.768 -8.600 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -9.059 4.945 -6.705 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.480 6.214 -8.422 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -10.012 5.743 -7.286 1.00 0.26 N ATOM 0 H HIS A 396 -4.374 3.387 -7.880 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.789 5.793 -8.595 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.652 3.384 -7.996 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.538 3.951 -6.342 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.153 4.404 -5.775 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.992 6.875 -9.106 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.945 5.940 -6.923 1.00 0.26 H new ATOM 1137 N TYR A 397 -4.185 5.539 -5.752 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.678 6.280 -4.604 1.00 0.10 C ATOM 1139 C TYR A 397 -2.878 7.490 -5.046 1.00 0.09 C ATOM 1140 O TYR A 397 -2.840 8.504 -4.353 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.800 5.384 -3.726 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.566 4.284 -3.059 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.943 4.349 -2.970 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.922 3.179 -2.534 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.668 3.350 -2.377 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.640 2.163 -1.934 1.00 0.24 C ATOM 1147 CZ TYR A 397 -5.018 2.253 -1.858 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.743 1.249 -1.258 1.00 0.30 O ATOM 0 H TYR A 397 -3.807 4.596 -5.841 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.538 6.618 -4.026 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -2.009 4.949 -4.337 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.315 5.995 -2.964 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.459 5.206 -3.377 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.846 3.109 -2.594 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.744 3.422 -2.317 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -3.128 1.303 -1.527 1.00 0.24 H new ATOM 0 HH TYR A 397 -6.650 1.569 -1.069 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.228 7.377 -6.195 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.416 8.469 -6.704 1.00 0.12 C ATOM 1160 C TYR A 398 -2.287 9.690 -6.973 1.00 0.14 C ATOM 1161 O TYR A 398 -1.971 10.800 -6.546 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.691 8.081 -7.997 1.00 0.14 C ATOM 1163 CG TYR A 398 0.187 6.847 -7.914 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.717 6.400 -6.704 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.491 6.128 -9.064 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.517 5.276 -6.649 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.289 5.009 -9.015 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.798 4.587 -7.810 1.00 0.14 C ATOM 1169 OH TYR A 398 2.593 3.471 -7.765 1.00 0.18 O ATOM 0 H TYR A 398 -2.247 6.547 -6.787 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.670 8.700 -5.944 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.436 7.922 -8.776 1.00 0.14 H new ATOM 0 HB3 TYR A 398 -0.074 8.923 -8.313 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.498 6.942 -5.796 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.093 6.454 -10.014 1.00 0.15 H new ATOM 0 HE1 TYR A 398 1.919 4.939 -5.705 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.515 4.464 -9.920 1.00 0.16 H new ATOM 0 HH TYR A 398 3.138 3.490 -6.951 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.393 9.468 -7.677 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.327 10.540 -7.998 1.00 0.19 C ATOM 1181 C LYS A 399 -4.945 11.127 -6.743 1.00 0.19 C ATOM 1182 O LYS A 399 -5.071 12.345 -6.609 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.438 10.041 -8.909 1.00 0.20 C ATOM 1184 CG LYS A 399 -5.015 9.856 -10.356 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.794 8.394 -10.694 1.00 0.27 C ATOM 1186 CE LYS A 399 -6.071 7.595 -10.504 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.919 6.170 -10.911 1.00 0.71 N ATOM 0 H LYS A 399 -3.664 8.553 -8.036 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.758 11.315 -8.512 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.809 9.091 -8.525 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.269 10.746 -8.871 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.779 10.270 -11.014 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -4.098 10.415 -10.541 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.453 8.303 -11.725 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -4.007 7.985 -10.061 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -6.372 7.640 -9.457 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.872 8.052 -11.086 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.601 5.585 -10.387 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -6.097 6.080 -11.932 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.953 5.850 -10.699 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.311 10.256 -5.819 1.00 0.17 N ATOM 1202 CA LEU A 400 -6.010 10.662 -4.614 1.00 0.18 C ATOM 1203 C LEU A 400 -5.041 11.170 -3.552 1.00 0.18 C ATOM 1204 O LEU A 400 -5.379 11.244 -2.370 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.844 9.488 -4.116 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.744 8.890 -5.198 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.442 7.649 -4.696 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.753 9.916 -5.683 1.00 0.21 C ATOM 0 H LEU A 400 -5.133 9.254 -5.882 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.674 11.497 -4.839 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.179 8.713 -3.736 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.461 9.817 -3.280 1.00 0.18 H new ATOM 0 HG LEU A 400 -7.115 8.604 -6.041 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -9.076 7.244 -5.485 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.699 6.905 -4.409 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -9.056 7.901 -3.831 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.384 9.471 -6.452 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.374 10.239 -4.847 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.227 10.776 -6.098 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.837 11.524 -3.999 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.840 12.189 -3.155 1.00 0.20 C ATOM 1222 C ASN A 401 -2.450 11.344 -1.950 1.00 0.17 C ATOM 1223 O ASN A 401 -2.276 11.853 -0.842 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.366 13.549 -2.709 1.00 0.27 C ATOM 1225 CG ASN A 401 -3.259 14.596 -3.803 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -2.312 14.593 -4.594 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -4.240 15.482 -3.873 1.00 1.21 N ATOM 0 H ASN A 401 -3.523 11.359 -4.955 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.938 12.326 -3.751 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.408 13.451 -2.404 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -2.808 13.883 -1.834 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -4.231 16.197 -4.601 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -5.005 15.450 -3.199 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.309 10.054 -2.185 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.994 9.107 -1.140 1.00 0.10 C ATOM 1236 C ILE A 402 -0.545 8.640 -1.227 1.00 0.09 C ATOM 1237 O ILE A 402 0.261 8.915 -0.342 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.952 7.917 -1.267 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.375 8.414 -1.057 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.618 6.816 -0.280 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.417 7.447 -1.524 1.00 0.13 C ATOM 0 H ILE A 402 -2.410 9.635 -3.109 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.115 9.588 -0.169 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.849 7.487 -2.263 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.528 8.618 0.003 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.504 9.359 -1.585 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.320 5.992 -0.403 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.604 6.459 -0.462 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.689 7.204 0.736 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.408 7.865 -1.344 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.289 7.262 -2.590 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.314 6.509 -0.978 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.217 7.942 -2.303 1.00 0.07 N ATOM 1254 CA ILE A 403 1.134 7.451 -2.514 1.00 0.07 C ATOM 1255 C ILE A 403 1.681 8.043 -3.811 1.00 0.08 C ATOM 1256 O ILE A 403 0.912 8.501 -4.655 1.00 0.10 O ATOM 1257 CB ILE A 403 1.170 5.900 -2.562 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.623 5.305 -1.265 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.585 5.385 -2.803 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.674 3.795 -1.248 1.00 0.11 C ATOM 0 H ILE A 403 -0.872 7.702 -3.047 1.00 0.07 H new ATOM 0 HA ILE A 403 1.759 7.763 -1.677 1.00 0.07 H new ATOM 0 HB ILE A 403 0.540 5.586 -3.394 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.195 5.693 -0.422 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.408 5.631 -1.127 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.576 4.295 -2.831 1.00 0.14 H new ATOM 0 HG22 ILE A 403 2.955 5.769 -3.753 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.237 5.722 -1.997 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.273 3.428 -0.303 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.079 3.402 -2.072 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.707 3.465 -1.356 1.00 0.11 H new ATOM 1272 N ARG A 404 2.997 8.086 -3.950 1.00 0.10 N ATOM 1273 CA ARG A 404 3.611 8.559 -5.178 1.00 0.13 C ATOM 1274 C ARG A 404 4.694 7.595 -5.624 1.00 0.14 C ATOM 1275 O ARG A 404 5.192 6.789 -4.833 1.00 0.16 O ATOM 1276 CB ARG A 404 4.202 9.959 -4.991 1.00 0.17 C ATOM 1277 CG ARG A 404 5.694 9.971 -4.736 1.00 0.25 C ATOM 1278 CD ARG A 404 6.238 11.386 -4.699 1.00 0.36 C ATOM 1279 NE ARG A 404 7.698 11.417 -4.804 1.00 1.14 N ATOM 1280 CZ ARG A 404 8.397 12.494 -5.170 1.00 1.56 C ATOM 1281 NH1 ARG A 404 7.788 13.654 -5.374 1.00 1.63 N ATOM 1282 NH2 ARG A 404 9.711 12.417 -5.305 1.00 2.39 N ATOM 0 H ARG A 404 3.658 7.799 -3.228 1.00 0.10 H new ATOM 0 HA ARG A 404 2.839 8.612 -5.946 1.00 0.13 H new ATOM 0 HB2 ARG A 404 3.992 10.552 -5.881 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.698 10.446 -4.156 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.907 9.473 -3.790 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.202 9.404 -5.516 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.804 11.962 -5.516 1.00 0.36 H new ATOM 0 HD3 ARG A 404 5.931 11.868 -3.771 1.00 0.36 H new ATOM 0 HE ARG A 404 8.212 10.564 -4.584 1.00 1.14 H new ATOM 0 HH11 ARG A 404 6.778 13.728 -5.251 1.00 1.63 H new ATOM 0 HH12 ARG A 404 8.329 14.472 -5.653 1.00 1.63 H new ATOM 0 HH21 ARG A 404 10.191 11.534 -5.129 1.00 2.39 H new ATOM 0 HH22 ARG A 404 10.244 13.240 -5.585 1.00 2.39 H new ATOM 1296 N LYS A 405 5.060 7.696 -6.886 1.00 0.17 N ATOM 1297 CA LYS A 405 6.051 6.816 -7.465 1.00 0.19 C ATOM 1298 C LYS A 405 7.357 7.577 -7.690 1.00 0.22 C ATOM 1299 O LYS A 405 7.350 8.738 -8.102 1.00 0.27 O ATOM 1300 CB LYS A 405 5.518 6.247 -8.780 1.00 0.22 C ATOM 1301 CG LYS A 405 6.304 5.052 -9.291 1.00 0.34 C ATOM 1302 CD LYS A 405 6.228 3.894 -8.321 1.00 0.29 C ATOM 1303 CE LYS A 405 7.151 2.758 -8.723 1.00 0.23 C ATOM 1304 NZ LYS A 405 6.758 2.128 -10.009 1.00 1.08 N ATOM 0 H LYS A 405 4.681 8.386 -7.534 1.00 0.17 H new ATOM 0 HA LYS A 405 6.253 5.990 -6.782 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.477 5.955 -8.644 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.532 7.031 -9.537 1.00 0.22 H new ATOM 0 HG2 LYS A 405 5.913 4.744 -10.261 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.345 5.336 -9.442 1.00 0.34 H new ATOM 0 HD2 LYS A 405 6.492 4.240 -7.321 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.202 3.528 -8.272 1.00 0.29 H new ATOM 0 HE2 LYS A 405 8.170 3.135 -8.804 1.00 0.23 H new ATOM 0 HE3 LYS A 405 7.153 2.002 -7.938 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 7.411 1.348 -10.227 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 5.789 1.757 -9.932 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 6.798 2.836 -10.769 1.00 1.08 H new ATOM 1318 N GLU A 406 8.458 6.916 -7.381 1.00 0.23 N ATOM 1319 CA GLU A 406 9.794 7.489 -7.479 1.00 0.28 C ATOM 1320 C GLU A 406 10.302 7.677 -8.909 1.00 0.34 C ATOM 1321 O GLU A 406 9.773 7.130 -9.878 1.00 0.43 O ATOM 1322 CB GLU A 406 10.779 6.602 -6.731 1.00 0.29 C ATOM 1323 CG GLU A 406 10.267 5.200 -6.437 1.00 0.63 C ATOM 1324 CD GLU A 406 10.009 4.304 -7.658 1.00 1.77 C ATOM 1325 OE1 GLU A 406 9.678 4.815 -8.733 1.00 2.32 O ATOM 1326 OE2 GLU A 406 10.132 3.065 -7.523 1.00 2.42 O ATOM 0 H GLU A 406 8.452 5.951 -7.050 1.00 0.23 H new ATOM 0 HA GLU A 406 9.721 8.484 -7.040 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.696 6.525 -7.315 1.00 0.29 H new ATOM 0 HB3 GLU A 406 11.041 7.085 -5.789 1.00 0.29 H new ATOM 0 HG2 GLU A 406 10.989 4.700 -5.791 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.339 5.285 -5.872 1.00 0.63 H new ATOM 1333 N PRO A 407 11.303 8.550 -9.037 1.00 0.41 N ATOM 1334 CA PRO A 407 12.099 8.687 -10.239 1.00 0.51 C ATOM 1335 C PRO A 407 13.112 7.547 -10.406 1.00 0.52 C ATOM 1336 O PRO A 407 14.066 7.446 -9.632 1.00 0.54 O ATOM 1337 CB PRO A 407 12.804 10.029 -10.069 1.00 0.61 C ATOM 1338 CG PRO A 407 12.727 10.377 -8.623 1.00 0.58 C ATOM 1339 CD PRO A 407 11.764 9.428 -7.964 1.00 0.45 C ATOM 0 HA PRO A 407 11.482 8.642 -11.136 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.842 9.964 -10.396 1.00 0.61 H new ATOM 0 HB3 PRO A 407 12.325 10.797 -10.677 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.711 10.302 -8.161 1.00 0.58 H new ATOM 0 HG3 PRO A 407 12.393 11.407 -8.497 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.250 8.860 -7.171 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.932 9.964 -7.508 1.00 0.45 H new ATOM 1347 N GLY A 408 12.909 6.696 -11.403 1.00 0.54 N ATOM 1348 CA GLY A 408 13.930 5.727 -11.781 1.00 0.58 C ATOM 1349 C GLY A 408 14.168 4.609 -10.773 1.00 0.58 C ATOM 1350 O GLY A 408 15.265 4.051 -10.714 1.00 0.86 O ATOM 0 H GLY A 408 12.056 6.656 -11.960 1.00 0.54 H new ATOM 0 HA2 GLY A 408 13.649 5.281 -12.735 1.00 0.58 H new ATOM 0 HA3 GLY A 408 14.869 6.256 -11.941 1.00 0.58 H new ATOM 1354 N GLN A 409 13.169 4.280 -9.977 1.00 0.47 N ATOM 1355 CA GLN A 409 13.243 3.108 -9.112 1.00 0.51 C ATOM 1356 C GLN A 409 12.283 2.043 -9.630 1.00 0.48 C ATOM 1357 O GLN A 409 11.714 2.194 -10.713 1.00 0.61 O ATOM 1358 CB GLN A 409 12.933 3.461 -7.661 1.00 0.63 C ATOM 1359 CG GLN A 409 14.070 4.121 -6.911 1.00 0.45 C ATOM 1360 CD GLN A 409 14.926 3.101 -6.189 1.00 0.71 C ATOM 1361 OE1 GLN A 409 15.882 2.560 -6.742 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.570 2.822 -4.945 1.00 0.45 N ATOM 0 H GLN A 409 12.296 4.804 -9.908 1.00 0.47 H new ATOM 0 HA GLN A 409 14.261 2.720 -9.133 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.069 4.125 -7.640 1.00 0.63 H new ATOM 0 HB3 GLN A 409 12.648 2.551 -7.133 1.00 0.63 H new ATOM 0 HG2 GLN A 409 14.687 4.687 -7.609 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.667 4.834 -6.192 1.00 0.45 H new ATOM 0 HE21 GLN A 409 13.770 3.295 -4.525 1.00 0.45 H new ATOM 0 HE22 GLN A 409 15.096 2.134 -4.406 1.00 0.45 H new ATOM 1371 N ARG A 410 12.106 0.968 -8.883 1.00 0.41 N ATOM 1372 CA ARG A 410 11.276 -0.134 -9.349 1.00 0.39 C ATOM 1373 C ARG A 410 10.032 -0.312 -8.496 1.00 0.31 C ATOM 1374 O ARG A 410 8.912 -0.072 -8.949 1.00 0.42 O ATOM 1375 CB ARG A 410 12.094 -1.435 -9.418 1.00 0.47 C ATOM 1376 CG ARG A 410 12.897 -1.758 -8.163 1.00 0.86 C ATOM 1377 CD ARG A 410 14.398 -1.705 -8.424 1.00 1.11 C ATOM 1378 NE ARG A 410 14.936 -0.340 -8.402 1.00 1.27 N ATOM 1379 CZ ARG A 410 15.594 0.220 -9.423 1.00 2.04 C ATOM 1380 NH1 ARG A 410 15.732 -0.433 -10.570 1.00 2.65 N ATOM 1381 NH2 ARG A 410 16.120 1.433 -9.291 1.00 2.43 N ATOM 0 H ARG A 410 12.520 0.832 -7.961 1.00 0.41 H new ATOM 0 HA ARG A 410 10.936 0.114 -10.355 1.00 0.39 H new ATOM 0 HB2 ARG A 410 11.415 -2.263 -9.620 1.00 0.47 H new ATOM 0 HB3 ARG A 410 12.779 -1.371 -10.263 1.00 0.47 H new ATOM 0 HG2 ARG A 410 12.640 -1.051 -7.374 1.00 0.86 H new ATOM 0 HG3 ARG A 410 12.625 -2.750 -7.803 1.00 0.86 H new ATOM 0 HD2 ARG A 410 14.913 -2.305 -7.674 1.00 1.11 H new ATOM 0 HD3 ARG A 410 14.609 -2.157 -9.393 1.00 1.11 H new ATOM 0 HE ARG A 410 14.800 0.215 -7.557 1.00 1.27 H new ATOM 0 HH11 ARG A 410 15.335 -1.367 -10.676 1.00 2.65 H new ATOM 0 HH12 ARG A 410 16.235 -0.001 -11.345 1.00 2.65 H new ATOM 0 HH21 ARG A 410 16.022 1.938 -8.410 1.00 2.43 H new ATOM 0 HH22 ARG A 410 16.622 1.859 -10.070 1.00 2.43 H new ATOM 1395 N LEU A 411 10.230 -0.740 -7.275 1.00 0.21 N ATOM 1396 CA LEU A 411 9.132 -1.004 -6.370 1.00 0.14 C ATOM 1397 C LEU A 411 9.206 -0.089 -5.180 1.00 0.11 C ATOM 1398 O LEU A 411 8.803 -0.432 -4.077 1.00 0.12 O ATOM 1399 CB LEU A 411 9.163 -2.458 -5.951 1.00 0.11 C ATOM 1400 CG LEU A 411 8.839 -3.413 -7.085 1.00 0.11 C ATOM 1401 CD1 LEU A 411 9.190 -4.830 -6.710 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.374 -3.281 -7.439 1.00 0.16 C ATOM 0 H LEU A 411 11.153 -0.916 -6.878 1.00 0.21 H new ATOM 0 HA LEU A 411 8.186 -0.811 -6.876 1.00 0.14 H new ATOM 0 HB2 LEU A 411 10.151 -2.695 -5.556 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.451 -2.611 -5.140 1.00 0.11 H new ATOM 0 HG LEU A 411 9.438 -3.157 -7.959 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.949 -5.496 -7.538 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.256 -4.895 -6.491 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.620 -5.125 -5.829 1.00 0.15 H new ATOM 0 HD21 LEU A 411 7.133 -3.964 -8.253 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.766 -3.526 -6.568 1.00 0.16 H new ATOM 0 HD23 LEU A 411 7.166 -2.257 -7.751 1.00 0.16 H new ATOM 1414 N LEU A 412 9.752 1.072 -5.416 1.00 0.13 N ATOM 1415 CA LEU A 412 9.858 2.078 -4.393 1.00 0.11 C ATOM 1416 C LEU A 412 8.612 2.957 -4.470 1.00 0.10 C ATOM 1417 O LEU A 412 8.143 3.286 -5.555 1.00 0.11 O ATOM 1418 CB LEU A 412 11.125 2.887 -4.653 1.00 0.13 C ATOM 1419 CG LEU A 412 11.712 3.704 -3.504 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.664 4.506 -2.763 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.452 2.789 -2.568 1.00 0.16 C ATOM 0 H LEU A 412 10.135 1.348 -6.320 1.00 0.13 H new ATOM 0 HA LEU A 412 9.921 1.643 -3.396 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.895 2.197 -4.997 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.919 3.571 -5.476 1.00 0.13 H new ATOM 0 HG LEU A 412 12.404 4.430 -3.930 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.138 5.067 -1.957 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.181 5.199 -3.452 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.917 3.831 -2.345 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.872 3.370 -1.747 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.765 2.043 -2.170 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.257 2.290 -3.108 1.00 0.16 H new ATOM 1433 N PHE A 413 8.051 3.305 -3.333 1.00 0.10 N ATOM 1434 CA PHE A 413 6.908 4.189 -3.307 1.00 0.11 C ATOM 1435 C PHE A 413 7.024 5.123 -2.117 1.00 0.12 C ATOM 1436 O PHE A 413 7.501 4.729 -1.052 1.00 0.19 O ATOM 1437 CB PHE A 413 5.606 3.392 -3.234 1.00 0.12 C ATOM 1438 CG PHE A 413 5.459 2.388 -4.338 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.969 1.113 -4.191 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.831 2.719 -5.523 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.857 0.183 -5.204 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.715 1.792 -6.539 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.229 0.524 -6.381 1.00 0.11 C ATOM 0 H PHE A 413 8.367 2.990 -2.416 1.00 0.10 H new ATOM 0 HA PHE A 413 6.891 4.774 -4.227 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.558 2.876 -2.275 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.764 4.083 -3.267 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.463 0.840 -3.270 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.427 3.712 -5.656 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.261 -0.810 -5.074 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.220 2.062 -7.460 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.140 -0.200 -7.177 1.00 0.11 H new ATOM 1453 N ARG A 414 6.614 6.359 -2.297 1.00 0.10 N ATOM 1454 CA ARG A 414 6.642 7.315 -1.219 1.00 0.12 C ATOM 1455 C ARG A 414 5.238 7.759 -0.898 1.00 0.11 C ATOM 1456 O ARG A 414 4.491 8.173 -1.781 1.00 0.15 O ATOM 1457 CB ARG A 414 7.524 8.519 -1.564 1.00 0.20 C ATOM 1458 CG ARG A 414 7.085 9.802 -0.882 1.00 0.35 C ATOM 1459 CD ARG A 414 8.229 10.516 -0.184 1.00 0.37 C ATOM 1460 NE ARG A 414 9.233 11.018 -1.125 1.00 1.21 N ATOM 1461 CZ ARG A 414 9.441 12.315 -1.371 1.00 1.46 C ATOM 1462 NH1 ARG A 414 8.692 13.240 -0.779 1.00 1.06 N ATOM 1463 NH2 ARG A 414 10.398 12.690 -2.209 1.00 2.58 N ATOM 0 H ARG A 414 6.258 6.723 -3.181 1.00 0.10 H new ATOM 0 HA ARG A 414 7.075 6.834 -0.342 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.553 8.299 -1.281 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.516 8.669 -2.644 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.643 10.469 -1.622 1.00 0.35 H new ATOM 0 HG3 ARG A 414 6.307 9.574 -0.154 1.00 0.35 H new ATOM 0 HD2 ARG A 414 7.833 11.348 0.398 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.704 9.833 0.520 1.00 0.37 H new ATOM 0 HE ARG A 414 9.807 10.337 -1.622 1.00 1.21 H new ATOM 0 HH11 ARG A 414 7.954 12.961 -0.133 1.00 1.06 H new ATOM 0 HH12 ARG A 414 8.856 14.228 -0.971 1.00 1.06 H new ATOM 0 HH21 ARG A 414 10.978 11.988 -2.668 1.00 2.58 H new ATOM 0 HH22 ARG A 414 10.554 13.681 -2.395 1.00 2.58 H new ATOM 1477 N PHE A 415 4.882 7.646 0.357 1.00 0.10 N ATOM 1478 CA PHE A 415 3.596 8.117 0.820 1.00 0.09 C ATOM 1479 C PHE A 415 3.551 9.635 0.736 1.00 0.11 C ATOM 1480 O PHE A 415 4.252 10.332 1.473 1.00 0.14 O ATOM 1481 CB PHE A 415 3.344 7.652 2.259 1.00 0.10 C ATOM 1482 CG PHE A 415 2.636 6.340 2.381 1.00 0.10 C ATOM 1483 CD1 PHE A 415 1.250 6.288 2.378 1.00 0.11 C ATOM 1484 CD2 PHE A 415 3.349 5.166 2.524 1.00 0.10 C ATOM 1485 CE1 PHE A 415 0.590 5.085 2.506 1.00 0.13 C ATOM 1486 CE2 PHE A 415 2.703 3.962 2.651 1.00 0.11 C ATOM 1487 CZ PHE A 415 1.321 3.916 2.639 1.00 0.12 C ATOM 0 H PHE A 415 5.467 7.230 1.082 1.00 0.10 H new ATOM 0 HA PHE A 415 2.813 7.702 0.186 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.301 7.581 2.776 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.759 8.414 2.775 1.00 0.10 H new ATOM 0 HD1 PHE A 415 0.682 7.200 2.274 1.00 0.11 H new ATOM 0 HD2 PHE A 415 4.429 5.196 2.536 1.00 0.10 H new ATOM 0 HE1 PHE A 415 -0.490 5.054 2.503 1.00 0.13 H new ATOM 0 HE2 PHE A 415 3.273 3.051 2.760 1.00 0.11 H new ATOM 0 HZ PHE A 415 0.812 2.968 2.733 1.00 0.12 H new ATOM 1497 N MET A 416 2.759 10.131 -0.209 1.00 0.11 N ATOM 1498 CA MET A 416 2.540 11.565 -0.375 1.00 0.15 C ATOM 1499 C MET A 416 2.038 12.178 0.918 1.00 0.17 C ATOM 1500 O MET A 416 2.350 13.323 1.247 1.00 0.23 O ATOM 1501 CB MET A 416 1.515 11.824 -1.477 1.00 0.15 C ATOM 1502 CG MET A 416 2.053 11.646 -2.879 1.00 0.24 C ATOM 1503 SD MET A 416 3.344 12.844 -3.273 1.00 1.41 S ATOM 1504 CE MET A 416 2.487 14.382 -2.940 1.00 1.47 C ATOM 0 H MET A 416 2.252 9.553 -0.880 1.00 0.11 H new ATOM 0 HA MET A 416 3.492 12.021 -0.648 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.669 11.151 -1.336 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.135 12.840 -1.372 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.451 10.637 -2.988 1.00 0.24 H new ATOM 0 HG3 MET A 416 1.237 11.746 -3.595 1.00 0.24 H new ATOM 0 HE1 MET A 416 3.003 15.202 -3.440 1.00 1.47 H new ATOM 0 HE2 MET A 416 1.464 14.317 -3.312 1.00 1.47 H new ATOM 0 HE3 MET A 416 2.472 14.565 -1.866 1.00 1.47 H new ATOM 1514 N LYS A 417 1.249 11.400 1.629 1.00 0.16 N ATOM 1515 CA LYS A 417 0.693 11.808 2.898 1.00 0.21 C ATOM 1516 C LYS A 417 0.780 10.666 3.884 1.00 0.21 C ATOM 1517 O LYS A 417 1.023 9.520 3.508 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.776 12.191 2.746 1.00 0.29 C ATOM 1519 CG LYS A 417 -1.035 13.432 1.921 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.501 13.808 1.993 1.00 0.54 C ATOM 1521 CE LYS A 417 -2.816 15.038 1.163 1.00 0.84 C ATOM 1522 NZ LYS A 417 -2.055 16.227 1.626 1.00 1.36 N ATOM 0 H LYS A 417 0.975 10.461 1.339 1.00 0.16 H new ATOM 0 HA LYS A 417 1.261 12.667 3.254 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.308 11.355 2.292 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.201 12.339 3.739 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.422 14.256 2.287 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.747 13.256 0.885 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -3.107 12.971 1.645 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -2.777 13.991 3.031 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -2.581 14.841 0.117 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -3.884 15.248 1.215 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -2.627 17.083 1.481 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -1.833 16.125 2.637 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -1.171 16.306 1.084 1.00 1.36 H new ATOM 1536 N THR A 418 0.574 10.980 5.140 1.00 0.24 N ATOM 1537 CA THR A 418 0.429 9.964 6.147 1.00 0.24 C ATOM 1538 C THR A 418 -1.043 9.662 6.352 1.00 0.26 C ATOM 1539 O THR A 418 -1.888 10.469 5.969 1.00 0.28 O ATOM 1540 CB THR A 418 1.079 10.406 7.457 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.689 11.752 7.771 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.583 10.312 7.326 1.00 0.22 C ATOM 0 H THR A 418 0.503 11.936 5.488 1.00 0.24 H new ATOM 0 HA THR A 418 0.935 9.057 5.814 1.00 0.24 H new ATOM 0 HB THR A 418 0.748 9.754 8.265 1.00 0.26 H new ATOM 0 HG1 THR A 418 1.109 12.026 8.613 1.00 0.35 H new ATOM 0 HG21 THR A 418 3.050 10.627 8.259 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.866 9.282 7.108 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.919 10.959 6.516 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.377 8.500 6.931 1.00 0.25 N ATOM 1551 CA PRO A 419 -2.765 8.041 7.061 1.00 0.28 C ATOM 1552 C PRO A 419 -3.719 9.122 7.562 1.00 0.31 C ATOM 1553 O PRO A 419 -4.832 9.241 7.061 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.644 6.889 8.053 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.298 6.330 7.760 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.431 7.526 7.506 1.00 0.25 C ATOM 0 HA PRO A 419 -3.196 7.755 6.102 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -2.721 7.235 9.084 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.429 6.147 7.907 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -0.924 5.741 8.598 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.324 5.670 6.893 1.00 0.27 H new ATOM 0 HD2 PRO A 419 0.024 7.898 8.424 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.382 7.297 6.817 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.268 9.931 8.511 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.086 11.031 9.027 1.00 0.42 C ATOM 1566 C ASP A 420 -4.473 11.989 7.904 1.00 0.43 C ATOM 1567 O ASP A 420 -5.643 12.333 7.740 1.00 0.48 O ATOM 1568 CB ASP A 420 -3.334 11.800 10.111 1.00 0.49 C ATOM 1569 CG ASP A 420 -4.137 12.969 10.648 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -4.933 12.761 11.583 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -3.969 14.102 10.145 1.00 0.72 O ATOM 0 H ASP A 420 -2.346 9.851 8.940 1.00 0.35 H new ATOM 0 HA ASP A 420 -4.990 10.600 9.456 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.089 11.124 10.930 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -2.390 12.165 9.706 1.00 0.49 H new ATOM 1576 N GLU A 421 -3.481 12.384 7.120 1.00 0.42 N ATOM 1577 CA GLU A 421 -3.686 13.276 5.988 1.00 0.45 C ATOM 1578 C GLU A 421 -4.511 12.607 4.899 1.00 0.42 C ATOM 1579 O GLU A 421 -5.238 13.265 4.160 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.334 13.690 5.417 1.00 0.49 C ATOM 1581 CG GLU A 421 -1.782 14.969 6.006 1.00 0.81 C ATOM 1582 CD GLU A 421 -2.449 16.191 5.416 1.00 1.60 C ATOM 1583 OE1 GLU A 421 -2.057 16.606 4.300 1.00 2.21 O ATOM 1584 OE2 GLU A 421 -3.371 16.736 6.052 1.00 2.17 O ATOM 0 H GLU A 421 -2.511 12.095 7.250 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.230 14.153 6.339 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -1.618 12.886 5.586 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -2.429 13.810 4.338 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -1.924 14.963 7.087 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -0.708 15.018 5.826 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.384 11.299 4.801 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.041 10.540 3.752 1.00 0.33 C ATOM 1593 C ILE A 422 -6.507 10.252 4.091 1.00 0.36 C ATOM 1594 O ILE A 422 -7.368 10.195 3.211 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.298 9.215 3.511 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -2.830 9.472 3.177 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -4.960 8.437 2.402 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.049 8.208 2.895 1.00 0.27 C ATOM 0 H ILE A 422 -3.826 10.734 5.441 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.016 11.146 2.846 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.343 8.625 4.427 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.772 10.128 2.308 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.363 10.001 4.008 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.423 7.502 2.243 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -5.993 8.221 2.676 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -4.943 9.025 1.485 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.015 8.463 2.665 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.077 7.560 3.771 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.492 7.689 2.045 1.00 0.27 H new ATOM 1610 N MET A 423 -6.792 10.086 5.369 1.00 0.42 N ATOM 1611 CA MET A 423 -8.135 9.759 5.821 1.00 0.51 C ATOM 1612 C MET A 423 -9.046 10.976 5.843 1.00 0.58 C ATOM 1613 O MET A 423 -10.183 10.909 6.302 1.00 0.71 O ATOM 1614 CB MET A 423 -8.069 9.134 7.200 1.00 0.58 C ATOM 1615 CG MET A 423 -7.415 7.778 7.179 1.00 0.58 C ATOM 1616 SD MET A 423 -7.601 6.884 8.735 1.00 0.90 S ATOM 1617 CE MET A 423 -6.748 5.355 8.354 1.00 2.01 C ATOM 0 H MET A 423 -6.106 10.173 6.119 1.00 0.42 H new ATOM 0 HA MET A 423 -8.561 9.050 5.111 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.515 9.792 7.869 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.077 9.043 7.605 1.00 0.58 H new ATOM 0 HG2 MET A 423 -7.845 7.185 6.372 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.354 7.895 6.958 1.00 0.58 H new ATOM 0 HE1 MET A 423 -6.823 4.675 9.203 1.00 2.01 H new ATOM 0 HE2 MET A 423 -7.203 4.893 7.478 1.00 2.01 H new ATOM 0 HE3 MET A 423 -5.698 5.565 8.150 1.00 2.01 H new ATOM 1627 N SER A 424 -8.546 12.072 5.319 1.00 0.59 N ATOM 1628 CA SER A 424 -9.296 13.329 5.297 1.00 0.72 C ATOM 1629 C SER A 424 -10.219 13.407 4.075 1.00 0.67 C ATOM 1630 O SER A 424 -10.392 14.464 3.471 1.00 1.09 O ATOM 1631 CB SER A 424 -8.335 14.522 5.314 1.00 0.92 C ATOM 1632 OG SER A 424 -7.465 14.499 4.195 1.00 1.57 O ATOM 0 H SER A 424 -7.619 12.129 4.898 1.00 0.59 H new ATOM 0 HA SER A 424 -9.919 13.363 6.191 1.00 0.72 H new ATOM 0 HB2 SER A 424 -8.905 15.451 5.315 1.00 0.92 H new ATOM 0 HB3 SER A 424 -7.749 14.507 6.233 1.00 0.92 H new ATOM 0 HG SER A 424 -6.577 14.196 4.477 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.804 12.274 3.708 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.738 12.250 2.600 1.00 0.42 C ATOM 1640 C GLY A 425 -11.097 11.797 1.303 1.00 0.37 C ATOM 1641 O GLY A 425 -11.791 11.521 0.327 1.00 0.50 O ATOM 0 H GLY A 425 -10.648 11.372 4.158 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.566 11.584 2.843 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -12.159 13.246 2.464 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.773 11.705 1.301 1.00 0.38 N ATOM 1646 CA ARG A 426 -9.029 11.332 0.104 1.00 0.36 C ATOM 1647 C ARG A 426 -9.352 9.890 -0.273 1.00 0.33 C ATOM 1648 O ARG A 426 -9.840 9.601 -1.365 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.529 11.471 0.358 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.188 12.599 1.286 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.236 13.933 0.594 1.00 0.92 C ATOM 1652 NE ARG A 426 -6.927 15.010 1.533 1.00 1.37 N ATOM 1653 CZ ARG A 426 -6.397 16.181 1.203 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -6.131 16.470 -0.064 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -6.129 17.066 2.155 1.00 2.67 N ATOM 0 H ARG A 426 -9.190 11.884 2.119 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.316 11.993 -0.714 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.150 10.538 0.776 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -7.019 11.625 -0.593 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -7.884 12.601 2.125 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.192 12.440 1.698 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.524 13.947 -0.231 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -8.225 14.091 0.164 1.00 0.92 H new ATOM 0 HE ARG A 426 -7.135 14.849 2.518 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -6.334 15.789 -0.796 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -5.724 17.373 -0.306 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -6.330 16.843 3.130 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -5.722 17.969 1.912 1.00 2.67 H new ATOM 1669 N THR A 427 -9.083 9.000 0.671 1.00 0.33 N ATOM 1670 CA THR A 427 -9.347 7.575 0.517 1.00 0.37 C ATOM 1671 C THR A 427 -10.581 7.163 1.313 1.00 0.43 C ATOM 1672 O THR A 427 -10.790 5.984 1.599 1.00 0.58 O ATOM 1673 CB THR A 427 -8.129 6.757 0.993 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.358 5.360 0.864 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.804 7.066 2.433 1.00 0.41 C ATOM 0 H THR A 427 -8.673 9.247 1.572 1.00 0.33 H new ATOM 0 HA THR A 427 -9.529 7.375 -0.539 1.00 0.37 H new ATOM 0 HB THR A 427 -7.289 7.040 0.358 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.277 5.153 1.133 1.00 1.24 H new ATOM 0 HG21 THR A 427 -6.942 6.477 2.746 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.575 8.127 2.535 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.660 6.818 3.061 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.402 8.144 1.654 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.595 7.899 2.458 1.00 0.62 C ATOM 1685 C ASP A 428 -13.551 6.978 1.711 1.00 0.61 C ATOM 1686 O ASP A 428 -14.082 6.021 2.269 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.282 9.229 2.779 1.00 0.74 C ATOM 1688 CG ASP A 428 -14.495 9.071 3.670 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -14.334 9.091 4.908 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -15.616 8.946 3.137 1.00 1.75 O ATOM 0 H ASP A 428 -11.266 9.119 1.388 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.305 7.415 3.390 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -12.566 9.893 3.264 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.583 9.710 1.848 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.739 7.272 0.435 1.00 0.54 N ATOM 1696 CA ARG A 429 -14.622 6.495 -0.421 1.00 0.65 C ATOM 1697 C ARG A 429 -13.910 5.251 -0.918 1.00 0.55 C ATOM 1698 O ARG A 429 -14.522 4.213 -1.143 1.00 0.66 O ATOM 1699 CB ARG A 429 -15.057 7.353 -1.596 1.00 0.81 C ATOM 1700 CG ARG A 429 -15.280 8.790 -1.194 1.00 0.98 C ATOM 1701 CD ARG A 429 -15.700 9.652 -2.366 1.00 1.12 C ATOM 1702 NE ARG A 429 -16.068 10.997 -1.939 1.00 1.64 N ATOM 1703 CZ ARG A 429 -15.376 12.092 -2.240 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -14.261 12.008 -2.954 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -15.790 13.275 -1.813 1.00 3.05 N ATOM 0 H ARG A 429 -13.285 8.054 -0.036 1.00 0.54 H new ATOM 0 HA ARG A 429 -15.498 6.185 0.148 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -14.299 7.309 -2.378 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -15.976 6.948 -2.020 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -16.046 8.834 -0.419 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -14.364 9.191 -0.760 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -14.885 9.709 -3.087 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -16.544 9.188 -2.876 1.00 1.12 H new ATOM 0 HE ARG A 429 -16.910 11.105 -1.373 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -13.929 11.099 -3.276 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -13.736 12.852 -3.181 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -16.640 13.346 -1.253 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -15.259 14.115 -2.044 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.602 5.380 -1.045 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.731 4.321 -1.563 1.00 0.36 C ATOM 1721 C LEU A 430 -11.950 2.992 -0.860 1.00 0.39 C ATOM 1722 O LEU A 430 -11.883 1.925 -1.471 1.00 0.45 O ATOM 1723 CB LEU A 430 -10.288 4.714 -1.343 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.508 5.123 -2.570 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -8.176 5.645 -2.120 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -9.314 3.947 -3.501 1.00 0.56 C ATOM 0 H LEU A 430 -12.101 6.231 -0.790 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.969 4.203 -2.620 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -10.264 5.540 -0.632 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.773 3.875 -0.875 1.00 0.31 H new ATOM 0 HG LEU A 430 -10.056 5.891 -3.115 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.592 5.948 -2.989 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.324 6.504 -1.465 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.643 4.863 -1.579 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.750 4.266 -4.377 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.766 3.160 -2.983 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -10.286 3.567 -3.814 1.00 0.56 H new ATOM 1738 N GLU A 431 -12.180 3.076 0.427 1.00 0.42 N ATOM 1739 CA GLU A 431 -12.319 1.897 1.280 1.00 0.53 C ATOM 1740 C GLU A 431 -13.349 0.884 0.765 1.00 0.59 C ATOM 1741 O GLU A 431 -13.295 -0.292 1.124 1.00 0.72 O ATOM 1742 CB GLU A 431 -12.676 2.305 2.711 1.00 0.61 C ATOM 1743 CG GLU A 431 -11.762 3.363 3.293 1.00 0.73 C ATOM 1744 CD GLU A 431 -11.934 3.522 4.788 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -11.237 2.813 5.545 1.00 1.31 O ATOM 1746 OE2 GLU A 431 -12.768 4.348 5.220 1.00 1.25 O ATOM 0 H GLU A 431 -12.278 3.961 0.924 1.00 0.42 H new ATOM 0 HA GLU A 431 -11.348 1.402 1.261 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -13.701 2.675 2.728 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -12.645 1.422 3.349 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -10.726 3.102 3.076 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -11.960 4.317 2.805 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.276 1.316 -0.078 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.326 0.417 -0.544 1.00 0.66 C ATOM 1755 C HIS A 432 -14.828 -0.526 -1.648 1.00 0.60 C ATOM 1756 O HIS A 432 -15.211 -1.693 -1.698 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.556 1.204 -1.020 1.00 0.76 C ATOM 1758 CG HIS A 432 -16.506 1.708 -2.425 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -17.463 1.396 -3.364 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -15.620 2.503 -3.042 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -17.162 1.982 -4.503 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -16.047 2.664 -4.337 1.00 3.38 N ATOM 0 H HIS A 432 -14.325 2.265 -0.449 1.00 0.58 H new ATOM 0 HA HIS A 432 -15.618 -0.199 0.306 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -17.434 0.567 -0.914 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -16.698 2.055 -0.354 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -14.734 2.937 -2.602 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -17.732 1.915 -5.418 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -15.578 3.220 -5.052 1.00 3.38 H new ATOM 1771 N LEU A 433 -13.971 -0.018 -2.522 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.533 -0.780 -3.694 1.00 0.53 C ATOM 1773 C LEU A 433 -12.419 -1.764 -3.355 1.00 0.54 C ATOM 1774 O LEU A 433 -12.409 -2.889 -3.854 1.00 0.67 O ATOM 1775 CB LEU A 433 -13.094 0.146 -4.836 1.00 0.60 C ATOM 1776 CG LEU A 433 -11.991 1.140 -4.501 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -10.938 1.165 -5.600 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.589 2.519 -4.312 1.00 0.88 C ATOM 0 H LEU A 433 -13.564 0.914 -2.447 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.396 -1.355 -4.029 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -12.759 -0.471 -5.670 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -13.965 0.703 -5.181 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.507 0.830 -3.575 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -10.159 1.882 -5.341 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.498 0.173 -5.705 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -11.402 1.458 -6.542 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.798 3.229 -4.072 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -13.088 2.828 -5.230 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -13.312 2.493 -3.497 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.487 -1.356 -2.506 1.00 0.49 N ATOM 1791 CA GLU A 434 -10.395 -2.234 -2.110 1.00 0.60 C ATOM 1792 C GLU A 434 -10.851 -3.359 -1.192 1.00 0.76 C ATOM 1793 O GLU A 434 -10.048 -4.202 -0.793 1.00 1.02 O ATOM 1794 CB GLU A 434 -9.273 -1.438 -1.468 1.00 0.54 C ATOM 1795 CG GLU A 434 -8.418 -0.738 -2.499 1.00 0.63 C ATOM 1796 CD GLU A 434 -7.952 -1.696 -3.585 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -7.273 -2.694 -3.257 1.00 1.36 O ATOM 1798 OE2 GLU A 434 -8.284 -1.464 -4.764 1.00 1.90 O ATOM 0 H GLU A 434 -11.464 -0.429 -2.080 1.00 0.49 H new ATOM 0 HA GLU A 434 -10.020 -2.702 -3.020 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -9.695 -0.701 -0.785 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -8.650 -2.105 -0.872 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -8.985 0.076 -2.950 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -7.552 -0.291 -2.011 1.00 0.63 H new ATOM 1805 N SER A 435 -12.135 -3.382 -0.875 1.00 0.72 N ATOM 1806 CA SER A 435 -12.713 -4.493 -0.142 1.00 0.89 C ATOM 1807 C SER A 435 -12.790 -5.717 -1.056 1.00 1.03 C ATOM 1808 O SER A 435 -12.904 -6.855 -0.598 1.00 1.20 O ATOM 1809 CB SER A 435 -14.100 -4.113 0.381 1.00 0.97 C ATOM 1810 OG SER A 435 -14.662 -5.148 1.170 1.00 1.47 O ATOM 0 H SER A 435 -12.796 -2.643 -1.114 1.00 0.72 H new ATOM 0 HA SER A 435 -12.084 -4.734 0.715 1.00 0.89 H new ATOM 0 HB2 SER A 435 -14.029 -3.201 0.974 1.00 0.97 H new ATOM 0 HB3 SER A 435 -14.760 -3.896 -0.459 1.00 0.97 H new ATOM 0 HG SER A 435 -15.547 -4.872 1.489 1.00 1.47 H new ATOM 1816 N GLN A 436 -12.728 -5.470 -2.359 1.00 1.04 N ATOM 1817 CA GLN A 436 -12.714 -6.532 -3.342 1.00 1.24 C ATOM 1818 C GLN A 436 -11.279 -6.923 -3.657 1.00 1.47 C ATOM 1819 O GLN A 436 -10.839 -7.978 -3.174 1.00 1.78 O ATOM 1820 CB GLN A 436 -13.440 -6.095 -4.613 1.00 1.17 C ATOM 1821 CG GLN A 436 -14.925 -5.830 -4.409 1.00 1.30 C ATOM 1822 CD GLN A 436 -15.656 -7.016 -3.803 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -16.117 -7.906 -4.516 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -15.787 -7.023 -2.486 1.00 2.60 N ATOM 1825 OXT GLN A 436 -10.585 -6.153 -4.357 1.00 2.10 O ATOM 0 H GLN A 436 -12.686 -4.532 -2.756 1.00 1.04 H new ATOM 0 HA GLN A 436 -13.235 -7.398 -2.933 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -12.968 -5.191 -4.998 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -13.319 -6.866 -5.374 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -15.049 -4.963 -3.761 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -15.380 -5.579 -5.367 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -15.390 -6.266 -1.930 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -16.285 -7.786 -2.027 1.00 2.60 H new TER 1834 GLN A 436