USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=27 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= -3.89! X(o=-4.8!,f=-4.9) USER MOD Set 1.2: A 399 LYS NZ :NH3+ 162:sc= -0.94 (180deg=-1.99!) USER MOD Set 2.1: A 380 LYS NZ :NH3+ 140:sc= 1.28 (180deg=0.611) USER MOD Set 2.2: A 385 MET CE :methyl 164:sc= -0.549 (180deg=-2.47) USER MOD Set 3.1: A 384 ASN : amide:sc= 0.286 K(o=1.7,f=-4.6!) USER MOD Set 3.2: A 389 LYS NZ :NH3+ -149:sc= 1.45 (180deg=0.857) USER MOD Set 4.1: A 333 HIS : no HE2:sc= -0.0229 K(o=-0.023,f=-2.8!) USER MOD Set 4.2: A 423 MET CE :methyl -116:sc= 0 (180deg=-1.88) USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 334 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 340 TYR OH : rot 119:sc= 0.302 USER MOD Single : A 342 TYR OH : rot 121:sc= -1.06! USER MOD Single : A 343 GLN : amide:sc= -0.739 X(o=-0.74,f=-0.36) USER MOD Single : A 346 SER OG : rot -32:sc= 0.239 USER MOD Single : A 348 SER OG : rot -13:sc= 0.487 USER MOD Single : A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 352 ASN : amide:sc= -0.494 X(o=-0.49,f=0) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 77:sc= 1.2 USER MOD Single : A 362 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= 1.16 K(o=1.2,f=-0.018) USER MOD Single : A 379 HIS : no HD1:sc= -3.82! C(o=-3.8!,f=-6.9!) USER MOD Single : A 381 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 386 THR OG1 : rot -177:sc= -0.798 USER MOD Single : A 387 TYR OH : rot -89:sc= -0.101 USER MOD Single : A 390 MET CE :methyl -167:sc= -0.455 (180deg=-0.828) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 397 TYR OH : rot 101:sc= -2.31 USER MOD Single : A 398 TYR OH : rot -24:sc= 0.721 USER MOD Single : A 401 ASN : amide:sc= -1.25! K(o=-1.2!,f=-0.0019) USER MOD Single : A 405 LYS NZ :NH3+ -169:sc= -0.0464 (180deg=-0.264) USER MOD Single : A 409 GLN : amide:sc= -6.58! C(o=-6.6!,f=-5.8!) USER MOD Single : A 416 MET CE :methyl 169:sc= -0.827 (180deg=-0.933) USER MOD Single : A 417 LYS NZ :NH3+ -171:sc= 0.952 (180deg=0.769) USER MOD Single : A 418 THR OG1 : rot 180:sc= 0.00226 USER MOD Single : A 424 SER OG : rot 111:sc= 1.19 USER MOD Single : A 427 THR OG1 : rot -49:sc= 0.404 USER MOD Single : A 432 HIS : no HD1:sc= -5.94! K(o=-5.9!,f=-1.6) USER MOD Single : A 435 SER OG : rot -27:sc= 0.136 USER MOD Single : A 436 GLN : amide:sc= -1.95 K(o=-1.9,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -8.874 -4.984 15.132 1.00 6.78 N ATOM 2 CA GLY A 331 -9.964 -4.014 15.402 1.00 6.11 C ATOM 3 C GLY A 331 -10.866 -3.833 14.203 1.00 5.22 C ATOM 4 O GLY A 331 -10.673 -4.486 13.178 1.00 5.14 O ATOM 0 HA2 GLY A 331 -10.554 -4.358 16.252 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -9.533 -3.052 15.681 1.00 6.11 H new ATOM 10 N SER A 332 -11.845 -2.941 14.311 1.00 4.99 N ATOM 11 CA SER A 332 -12.751 -2.671 13.202 1.00 4.63 C ATOM 12 C SER A 332 -12.164 -1.619 12.262 1.00 3.82 C ATOM 13 O SER A 332 -12.837 -0.664 11.872 1.00 4.13 O ATOM 14 CB SER A 332 -14.116 -2.224 13.720 1.00 5.44 C ATOM 15 OG SER A 332 -14.737 -3.259 14.465 1.00 6.08 O ATOM 0 H SER A 332 -12.031 -2.395 15.152 1.00 4.99 H new ATOM 0 HA SER A 332 -12.881 -3.595 12.639 1.00 4.63 H new ATOM 0 HB2 SER A 332 -14.000 -1.339 14.346 1.00 5.44 H new ATOM 0 HB3 SER A 332 -14.753 -1.941 12.882 1.00 5.44 H new ATOM 0 HG SER A 332 -15.609 -2.951 14.789 1.00 6.08 H new ATOM 21 N HIS A 333 -10.902 -1.803 11.912 1.00 3.28 N ATOM 22 CA HIS A 333 -10.234 -0.939 10.956 1.00 2.94 C ATOM 23 C HIS A 333 -9.553 -1.797 9.902 1.00 2.02 C ATOM 24 O HIS A 333 -8.399 -2.199 10.059 1.00 2.49 O ATOM 25 CB HIS A 333 -9.212 -0.023 11.649 1.00 3.89 C ATOM 26 CG HIS A 333 -8.411 0.820 10.697 1.00 4.68 C ATOM 27 ND1 HIS A 333 -8.950 1.853 9.961 1.00 5.34 N ATOM 28 CD2 HIS A 333 -7.103 0.761 10.351 1.00 5.35 C ATOM 29 CE1 HIS A 333 -8.009 2.387 9.201 1.00 6.24 C ATOM 30 NE2 HIS A 333 -6.880 1.744 9.420 1.00 6.26 N ATOM 0 H HIS A 333 -10.315 -2.551 12.281 1.00 3.28 H new ATOM 0 HA HIS A 333 -10.977 -0.297 10.482 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -9.737 0.631 12.345 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -8.530 -0.635 12.239 1.00 3.89 H new ATOM 0 HD1 HIS A 333 -9.923 2.158 9.997 1.00 5.34 H new ATOM 0 HD2 HIS A 333 -6.370 0.068 10.737 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -8.143 3.211 8.516 1.00 6.24 H new ATOM 39 N MET A 334 -10.285 -2.103 8.845 1.00 1.20 N ATOM 40 CA MET A 334 -9.745 -2.891 7.755 1.00 0.62 C ATOM 41 C MET A 334 -8.746 -2.064 6.971 1.00 0.57 C ATOM 42 O MET A 334 -9.063 -0.975 6.491 1.00 0.92 O ATOM 43 CB MET A 334 -10.859 -3.396 6.836 1.00 1.35 C ATOM 44 CG MET A 334 -11.758 -4.430 7.492 1.00 2.01 C ATOM 45 SD MET A 334 -10.835 -5.862 8.091 1.00 3.03 S ATOM 46 CE MET A 334 -12.162 -6.853 8.777 1.00 3.71 C ATOM 0 H MET A 334 -11.256 -1.817 8.720 1.00 1.20 H new ATOM 0 HA MET A 334 -9.239 -3.761 8.174 1.00 0.62 H new ATOM 0 HB2 MET A 334 -11.466 -2.550 6.513 1.00 1.35 H new ATOM 0 HB3 MET A 334 -10.413 -3.828 5.940 1.00 1.35 H new ATOM 0 HG2 MET A 334 -12.290 -3.969 8.325 1.00 2.01 H new ATOM 0 HG3 MET A 334 -12.511 -4.760 6.776 1.00 2.01 H new ATOM 0 HE1 MET A 334 -11.752 -7.775 9.188 1.00 3.71 H new ATOM 0 HE2 MET A 334 -12.662 -6.294 9.568 1.00 3.71 H new ATOM 0 HE3 MET A 334 -12.880 -7.093 7.993 1.00 3.71 H new ATOM 56 N ARG A 335 -7.530 -2.569 6.879 1.00 0.40 N ATOM 57 CA ARG A 335 -6.474 -1.865 6.177 1.00 0.32 C ATOM 58 C ARG A 335 -6.799 -1.761 4.692 1.00 0.28 C ATOM 59 O ARG A 335 -7.182 -2.747 4.062 1.00 0.42 O ATOM 60 CB ARG A 335 -5.114 -2.567 6.340 1.00 0.37 C ATOM 61 CG ARG A 335 -4.570 -2.623 7.763 1.00 0.56 C ATOM 62 CD ARG A 335 -5.193 -3.720 8.612 1.00 0.93 C ATOM 63 NE ARG A 335 -4.910 -5.056 8.091 1.00 1.32 N ATOM 64 CZ ARG A 335 -4.712 -6.129 8.855 1.00 2.05 C ATOM 65 NH1 ARG A 335 -4.682 -6.016 10.177 1.00 2.81 N ATOM 66 NH2 ARG A 335 -4.539 -7.320 8.297 1.00 2.51 N ATOM 0 H ARG A 335 -7.249 -3.463 7.281 1.00 0.40 H new ATOM 0 HA ARG A 335 -6.408 -0.869 6.616 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.204 -3.586 5.964 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.384 -2.058 5.711 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -3.491 -2.774 7.725 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -4.740 -1.661 8.246 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -4.817 -3.644 9.632 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -6.272 -3.572 8.658 1.00 0.93 H new ATOM 0 HE ARG A 335 -4.861 -5.174 7.079 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -4.811 -5.103 10.614 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -4.530 -6.842 10.756 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -4.557 -7.415 7.282 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -4.387 -8.141 8.883 1.00 2.51 H new ATOM 80 N LEU A 336 -6.672 -0.556 4.151 1.00 0.23 N ATOM 81 CA LEU A 336 -6.686 -0.352 2.705 1.00 0.28 C ATOM 82 C LEU A 336 -5.447 -0.987 2.119 1.00 0.14 C ATOM 83 O LEU A 336 -4.674 -1.594 2.843 1.00 0.20 O ATOM 84 CB LEU A 336 -6.677 1.138 2.347 1.00 0.48 C ATOM 85 CG LEU A 336 -7.952 1.928 2.628 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.438 2.570 1.348 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.030 1.043 3.211 1.00 0.67 C ATOM 0 H LEU A 336 -6.557 0.300 4.694 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.595 -0.800 2.304 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -5.859 1.611 2.890 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.450 1.229 1.285 1.00 0.48 H new ATOM 0 HG LEU A 336 -7.725 2.701 3.362 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.349 3.135 1.547 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.671 3.242 0.964 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.645 1.796 0.609 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -9.925 1.636 3.400 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.265 0.245 2.507 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -8.678 0.609 4.147 1.00 0.67 H new ATOM 99 N LEU A 337 -5.218 -0.832 0.833 1.00 0.15 N ATOM 100 CA LEU A 337 -3.999 -1.356 0.257 1.00 0.12 C ATOM 101 C LEU A 337 -2.809 -0.609 0.852 1.00 0.11 C ATOM 102 O LEU A 337 -1.837 -1.219 1.287 1.00 0.12 O ATOM 103 CB LEU A 337 -4.045 -1.251 -1.272 1.00 0.14 C ATOM 104 CG LEU A 337 -2.857 -1.832 -2.033 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.769 -0.800 -2.151 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.323 -3.078 -1.353 1.00 0.15 C ATOM 0 H LEU A 337 -5.843 -0.359 0.180 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.892 -2.414 0.497 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.950 -1.749 -1.621 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -4.138 -0.198 -1.538 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.197 -2.113 -3.030 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.924 -1.222 -2.695 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -2.149 0.069 -2.688 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.444 -0.498 -1.155 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.477 -3.468 -1.920 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.999 -2.830 -0.342 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -3.108 -3.833 -1.308 1.00 0.15 H new ATOM 118 N TRP A 338 -2.916 0.712 0.919 1.00 0.12 N ATOM 119 CA TRP A 338 -1.865 1.524 1.524 1.00 0.14 C ATOM 120 C TRP A 338 -1.851 1.355 3.046 1.00 0.14 C ATOM 121 O TRP A 338 -0.790 1.357 3.667 1.00 0.17 O ATOM 122 CB TRP A 338 -2.018 3.008 1.138 1.00 0.16 C ATOM 123 CG TRP A 338 -3.295 3.653 1.595 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.426 3.837 0.858 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.564 4.212 2.885 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.380 4.472 1.609 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.879 4.706 2.858 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.824 4.336 4.062 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.467 5.315 3.960 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.409 4.936 5.155 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.722 5.418 5.097 1.00 0.21 C ATOM 0 H TRP A 338 -3.713 1.242 0.565 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.908 1.174 1.136 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.178 3.565 1.554 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.952 3.095 0.053 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.552 3.527 -0.169 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.313 4.728 1.287 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.810 3.968 4.115 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.478 5.693 3.917 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.846 5.036 6.071 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.154 5.881 5.972 1.00 0.21 H new ATOM 142 N ASP A 339 -3.034 1.187 3.639 1.00 0.14 N ATOM 143 CA ASP A 339 -3.147 1.003 5.088 1.00 0.17 C ATOM 144 C ASP A 339 -2.554 -0.344 5.462 1.00 0.16 C ATOM 145 O ASP A 339 -2.014 -0.537 6.552 1.00 0.23 O ATOM 146 CB ASP A 339 -4.615 1.080 5.530 1.00 0.23 C ATOM 147 CG ASP A 339 -4.785 1.373 7.012 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.789 0.425 7.817 1.00 0.86 O ATOM 149 OD2 ASP A 339 -4.951 2.554 7.376 1.00 1.15 O ATOM 0 H ASP A 339 -3.924 1.174 3.141 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.601 1.798 5.596 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.120 1.855 4.954 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.107 0.136 5.295 1.00 0.23 H new ATOM 154 N TYR A 340 -2.641 -1.267 4.516 1.00 0.11 N ATOM 155 CA TYR A 340 -2.115 -2.605 4.680 1.00 0.10 C ATOM 156 C TYR A 340 -0.597 -2.594 4.651 1.00 0.08 C ATOM 157 O TYR A 340 0.042 -3.212 5.503 1.00 0.09 O ATOM 158 CB TYR A 340 -2.643 -3.509 3.577 1.00 0.11 C ATOM 159 CG TYR A 340 -2.401 -4.956 3.853 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.803 -5.512 5.052 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.767 -5.760 2.926 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.582 -6.835 5.328 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.542 -7.092 3.188 1.00 0.14 C ATOM 164 CZ TYR A 340 -1.951 -7.629 4.396 1.00 0.16 C ATOM 165 OH TYR A 340 -1.726 -8.957 4.677 1.00 0.20 O ATOM 0 H TYR A 340 -3.081 -1.104 3.611 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.441 -2.986 5.648 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.713 -3.340 3.456 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.169 -3.239 2.633 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.300 -4.893 5.784 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.444 -5.339 1.985 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -2.901 -7.254 6.271 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.049 -7.714 2.456 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.188 -9.514 4.017 1.00 0.20 H new ATOM 175 N VAL A 341 -0.016 -1.889 3.679 1.00 0.08 N ATOM 176 CA VAL A 341 1.438 -1.848 3.559 1.00 0.07 C ATOM 177 C VAL A 341 2.045 -1.254 4.817 1.00 0.08 C ATOM 178 O VAL A 341 3.115 -1.658 5.222 1.00 0.08 O ATOM 179 CB VAL A 341 1.942 -1.060 2.320 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.151 -1.418 1.083 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.945 0.443 2.538 1.00 0.09 C ATOM 0 H VAL A 341 -0.521 -1.349 2.976 1.00 0.08 H new ATOM 0 HA VAL A 341 1.760 -2.881 3.425 1.00 0.07 H new ATOM 0 HB VAL A 341 2.979 -1.360 2.169 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.528 -0.850 0.233 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.254 -2.484 0.881 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.099 -1.179 1.242 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.307 0.940 1.638 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.932 0.781 2.757 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.598 0.688 3.376 1.00 0.09 H new ATOM 191 N TYR A 342 1.344 -0.311 5.435 1.00 0.08 N ATOM 192 CA TYR A 342 1.783 0.264 6.709 1.00 0.10 C ATOM 193 C TYR A 342 1.954 -0.812 7.776 1.00 0.11 C ATOM 194 O TYR A 342 2.920 -0.792 8.539 1.00 0.14 O ATOM 195 CB TYR A 342 0.787 1.299 7.229 1.00 0.11 C ATOM 196 CG TYR A 342 1.041 2.709 6.758 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.189 3.389 7.144 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.128 3.370 5.952 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.420 4.688 6.736 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.357 4.664 5.538 1.00 0.19 C ATOM 201 CZ TYR A 342 1.503 5.318 5.931 1.00 0.17 C ATOM 202 OH TYR A 342 1.727 6.611 5.522 1.00 0.21 O ATOM 0 H TYR A 342 0.469 0.074 5.078 1.00 0.08 H new ATOM 0 HA TYR A 342 2.742 0.744 6.514 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.217 1.003 6.923 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.805 1.285 8.319 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.913 2.894 7.774 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.775 2.864 5.644 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.316 5.205 7.048 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.362 5.165 4.906 1.00 0.19 H new ATOM 0 HH TYR A 342 1.745 6.646 4.543 1.00 0.21 H new ATOM 212 N GLN A 343 1.020 -1.755 7.822 1.00 0.12 N ATOM 213 CA GLN A 343 1.041 -2.788 8.836 1.00 0.18 C ATOM 214 C GLN A 343 2.146 -3.770 8.510 1.00 0.18 C ATOM 215 O GLN A 343 2.796 -4.323 9.396 1.00 0.25 O ATOM 216 CB GLN A 343 -0.333 -3.472 8.904 1.00 0.28 C ATOM 217 CG GLN A 343 -0.414 -4.832 8.242 1.00 0.55 C ATOM 218 CD GLN A 343 -0.336 -5.968 9.246 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.356 -6.474 9.704 1.00 1.40 O ATOM 220 NE2 GLN A 343 0.869 -6.348 9.625 1.00 1.15 N ATOM 0 H GLN A 343 0.241 -1.821 7.167 1.00 0.12 H new ATOM 0 HA GLN A 343 1.243 -2.360 9.818 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.616 -3.579 9.951 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -1.070 -2.816 8.440 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.347 -4.907 7.684 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.397 -4.931 7.521 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.694 -5.904 9.222 1.00 1.15 H new ATOM 0 HE22 GLN A 343 0.976 -7.086 10.321 1.00 1.15 H new ATOM 229 N LEU A 344 2.354 -3.970 7.221 1.00 0.15 N ATOM 230 CA LEU A 344 3.406 -4.836 6.741 1.00 0.16 C ATOM 231 C LEU A 344 4.766 -4.175 6.961 1.00 0.18 C ATOM 232 O LEU A 344 5.743 -4.817 7.334 1.00 0.27 O ATOM 233 CB LEU A 344 3.178 -5.111 5.258 1.00 0.13 C ATOM 234 CG LEU A 344 1.785 -5.634 4.915 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.585 -5.649 3.419 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.577 -7.022 5.478 1.00 0.18 C ATOM 0 H LEU A 344 1.799 -3.537 6.483 1.00 0.15 H new ATOM 0 HA LEU A 344 3.392 -5.778 7.289 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.354 -4.191 4.700 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.918 -5.836 4.919 1.00 0.13 H new ATOM 0 HG LEU A 344 1.051 -4.965 5.365 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.588 -6.024 3.189 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.691 -4.637 3.028 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.331 -6.296 2.959 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.578 -7.373 5.221 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.319 -7.700 5.057 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.684 -6.995 6.562 1.00 0.18 H new ATOM 248 N LEU A 345 4.779 -2.870 6.749 1.00 0.12 N ATOM 249 CA LEU A 345 5.954 -2.023 6.930 1.00 0.13 C ATOM 250 C LEU A 345 6.376 -1.983 8.397 1.00 0.19 C ATOM 251 O LEU A 345 7.508 -1.625 8.722 1.00 0.29 O ATOM 252 CB LEU A 345 5.619 -0.601 6.452 1.00 0.10 C ATOM 253 CG LEU A 345 6.121 -0.204 5.052 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.428 -1.419 4.203 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.104 0.683 4.340 1.00 0.10 C ATOM 0 H LEU A 345 3.955 -2.354 6.439 1.00 0.12 H new ATOM 0 HA LEU A 345 6.780 -2.433 6.349 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.536 -0.483 6.471 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.030 0.106 7.173 1.00 0.10 H new ATOM 0 HG LEU A 345 7.045 0.357 5.190 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.780 -1.098 3.222 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.200 -2.016 4.688 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.525 -2.019 4.086 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.482 0.950 3.353 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.162 0.144 4.234 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.940 1.589 4.923 1.00 0.10 H new ATOM 267 N SER A 346 5.457 -2.350 9.276 1.00 0.25 N ATOM 268 CA SER A 346 5.684 -2.265 10.706 1.00 0.33 C ATOM 269 C SER A 346 5.978 -3.646 11.299 1.00 0.30 C ATOM 270 O SER A 346 6.217 -3.779 12.499 1.00 0.53 O ATOM 271 CB SER A 346 4.455 -1.643 11.375 1.00 0.51 C ATOM 272 OG SER A 346 4.703 -1.301 12.727 1.00 1.43 O ATOM 0 H SER A 346 4.539 -2.713 9.019 1.00 0.25 H new ATOM 0 HA SER A 346 6.555 -1.636 10.890 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.155 -0.751 10.825 1.00 0.51 H new ATOM 0 HB3 SER A 346 3.622 -2.344 11.325 1.00 0.51 H new ATOM 0 HG SER A 346 5.342 -1.936 13.113 1.00 1.43 H new ATOM 278 N ASP A 347 5.971 -4.675 10.458 1.00 0.32 N ATOM 279 CA ASP A 347 6.189 -6.040 10.930 1.00 0.32 C ATOM 280 C ASP A 347 7.270 -6.714 10.090 1.00 0.30 C ATOM 281 O ASP A 347 7.169 -6.772 8.867 1.00 0.30 O ATOM 282 CB ASP A 347 4.881 -6.829 10.863 1.00 0.35 C ATOM 283 CG ASP A 347 4.892 -8.076 11.723 1.00 0.49 C ATOM 284 OD1 ASP A 347 5.994 -8.599 11.988 1.00 0.58 O ATOM 285 OD2 ASP A 347 3.811 -8.535 12.138 1.00 0.67 O ATOM 0 H ASP A 347 5.818 -4.592 9.453 1.00 0.32 H new ATOM 0 HA ASP A 347 6.524 -6.014 11.967 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.059 -6.186 11.178 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.687 -7.111 9.828 1.00 0.35 H new ATOM 290 N SER A 348 8.296 -7.241 10.751 1.00 0.34 N ATOM 291 CA SER A 348 9.495 -7.690 10.057 1.00 0.35 C ATOM 292 C SER A 348 9.285 -8.992 9.304 1.00 0.31 C ATOM 293 O SER A 348 10.105 -9.378 8.470 1.00 0.32 O ATOM 294 CB SER A 348 10.663 -7.830 11.024 1.00 0.46 C ATOM 295 OG SER A 348 11.825 -8.327 10.375 1.00 1.53 O ATOM 0 H SER A 348 8.320 -7.367 11.763 1.00 0.34 H new ATOM 0 HA SER A 348 9.728 -6.922 9.319 1.00 0.35 H new ATOM 0 HB2 SER A 348 10.883 -6.861 11.472 1.00 0.46 H new ATOM 0 HB3 SER A 348 10.385 -8.501 11.836 1.00 0.46 H new ATOM 0 HG SER A 348 11.583 -8.672 9.490 1.00 1.53 H new ATOM 301 N ARG A 349 8.199 -9.666 9.589 1.00 0.33 N ATOM 302 CA ARG A 349 7.865 -10.880 8.864 1.00 0.35 C ATOM 303 C ARG A 349 7.506 -10.580 7.406 1.00 0.29 C ATOM 304 O ARG A 349 7.438 -11.486 6.575 1.00 0.34 O ATOM 305 CB ARG A 349 6.759 -11.636 9.553 1.00 0.42 C ATOM 306 CG ARG A 349 5.543 -10.816 9.873 1.00 0.55 C ATOM 307 CD ARG A 349 4.475 -11.731 10.406 1.00 0.59 C ATOM 308 NE ARG A 349 3.486 -11.029 11.219 1.00 1.23 N ATOM 309 CZ ARG A 349 2.353 -11.576 11.651 1.00 1.67 C ATOM 310 NH1 ARG A 349 2.057 -12.834 11.350 1.00 1.93 N ATOM 311 NH2 ARG A 349 1.515 -10.861 12.389 1.00 2.56 N ATOM 0 H ARG A 349 7.530 -9.402 10.313 1.00 0.33 H new ATOM 0 HA ARG A 349 8.751 -11.515 8.859 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.460 -12.472 8.921 1.00 0.42 H new ATOM 0 HB3 ARG A 349 7.149 -12.059 10.479 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.786 -10.049 10.609 1.00 0.55 H new ATOM 0 HG3 ARG A 349 5.189 -10.300 8.980 1.00 0.55 H new ATOM 0 HD2 ARG A 349 3.972 -12.221 9.572 1.00 0.59 H new ATOM 0 HD3 ARG A 349 4.939 -12.516 11.003 1.00 0.59 H new ATOM 0 HE ARG A 349 3.676 -10.059 11.471 1.00 1.23 H new ATOM 0 HH11 ARG A 349 2.700 -13.388 10.784 1.00 1.93 H new ATOM 0 HH12 ARG A 349 1.187 -13.247 11.685 1.00 1.93 H new ATOM 0 HH21 ARG A 349 1.740 -9.894 12.624 1.00 2.56 H new ATOM 0 HH22 ARG A 349 0.645 -11.278 12.722 1.00 2.56 H new ATOM 325 N TYR A 350 7.262 -9.308 7.102 1.00 0.22 N ATOM 326 CA TYR A 350 6.867 -8.908 5.760 1.00 0.17 C ATOM 327 C TYR A 350 7.985 -8.140 5.080 1.00 0.16 C ATOM 328 O TYR A 350 7.864 -7.756 3.922 1.00 0.15 O ATOM 329 CB TYR A 350 5.625 -8.032 5.803 1.00 0.17 C ATOM 330 CG TYR A 350 4.494 -8.600 6.611 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.846 -9.761 6.224 1.00 0.24 C ATOM 332 CD2 TYR A 350 4.058 -7.953 7.750 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.795 -10.261 6.951 1.00 0.29 C ATOM 334 CE2 TYR A 350 3.011 -8.446 8.489 1.00 0.28 C ATOM 335 CZ TYR A 350 2.375 -9.602 8.088 1.00 0.31 C ATOM 336 OH TYR A 350 1.316 -10.092 8.821 1.00 0.39 O ATOM 0 H TYR A 350 7.332 -8.539 7.768 1.00 0.22 H new ATOM 0 HA TYR A 350 6.652 -9.815 5.195 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.895 -7.059 6.213 1.00 0.17 H new ATOM 0 HB3 TYR A 350 5.278 -7.863 4.783 1.00 0.17 H new ATOM 0 HD1 TYR A 350 4.173 -10.281 5.336 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.549 -7.044 8.065 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.299 -11.167 6.634 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.687 -7.930 9.381 1.00 0.28 H new ATOM 0 HH TYR A 350 1.153 -9.508 9.591 1.00 0.39 H new ATOM 346 N GLU A 351 9.071 -7.934 5.814 1.00 0.18 N ATOM 347 CA GLU A 351 10.249 -7.205 5.325 1.00 0.21 C ATOM 348 C GLU A 351 10.801 -7.801 4.038 1.00 0.21 C ATOM 349 O GLU A 351 11.509 -7.145 3.274 1.00 0.24 O ATOM 350 CB GLU A 351 11.299 -7.236 6.405 1.00 0.28 C ATOM 351 CG GLU A 351 10.934 -6.392 7.589 1.00 0.48 C ATOM 352 CD GLU A 351 11.119 -4.910 7.347 1.00 0.99 C ATOM 353 OE1 GLU A 351 12.263 -4.483 7.104 1.00 1.05 O ATOM 354 OE2 GLU A 351 10.114 -4.172 7.385 1.00 1.78 O ATOM 0 H GLU A 351 9.166 -8.268 6.773 1.00 0.18 H new ATOM 0 HA GLU A 351 9.958 -6.180 5.095 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.450 -8.265 6.730 1.00 0.28 H new ATOM 0 HB3 GLU A 351 12.247 -6.889 5.995 1.00 0.28 H new ATOM 0 HG2 GLU A 351 9.894 -6.583 7.856 1.00 0.48 H new ATOM 0 HG3 GLU A 351 11.542 -6.693 8.442 1.00 0.48 H new ATOM 361 N ASN A 352 10.473 -9.055 3.823 1.00 0.19 N ATOM 362 CA ASN A 352 10.890 -9.774 2.621 1.00 0.21 C ATOM 363 C ASN A 352 9.975 -9.449 1.434 1.00 0.16 C ATOM 364 O ASN A 352 10.361 -9.610 0.281 1.00 0.18 O ATOM 365 CB ASN A 352 10.888 -11.276 2.896 1.00 0.27 C ATOM 366 CG ASN A 352 11.377 -12.118 1.735 1.00 1.03 C ATOM 367 OD1 ASN A 352 10.864 -13.213 1.497 1.00 1.83 O ATOM 368 ND2 ASN A 352 12.389 -11.648 1.034 1.00 1.62 N ATOM 0 H ASN A 352 9.912 -9.611 4.468 1.00 0.19 H new ATOM 0 HA ASN A 352 11.899 -9.455 2.360 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.514 -11.476 3.765 1.00 0.27 H new ATOM 0 HB3 ASN A 352 9.875 -11.586 3.155 1.00 0.27 H new ATOM 0 HD21 ASN A 352 12.774 -12.195 0.264 1.00 1.62 H new ATOM 0 HD22 ASN A 352 12.787 -10.737 1.261 1.00 1.62 H new ATOM 375 N PHE A 353 8.759 -8.996 1.726 1.00 0.13 N ATOM 376 CA PHE A 353 7.796 -8.630 0.693 1.00 0.10 C ATOM 377 C PHE A 353 7.735 -7.117 0.506 1.00 0.08 C ATOM 378 O PHE A 353 7.421 -6.628 -0.575 1.00 0.07 O ATOM 379 CB PHE A 353 6.400 -9.131 1.060 1.00 0.09 C ATOM 380 CG PHE A 353 6.319 -10.607 1.317 1.00 0.12 C ATOM 381 CD1 PHE A 353 6.997 -11.506 0.517 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.574 -11.090 2.373 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.929 -12.861 0.761 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.504 -12.444 2.629 1.00 0.17 C ATOM 385 CZ PHE A 353 6.183 -13.332 1.821 1.00 0.18 C ATOM 0 H PHE A 353 8.416 -8.873 2.679 1.00 0.13 H new ATOM 0 HA PHE A 353 8.126 -9.095 -0.236 1.00 0.10 H new ATOM 0 HB2 PHE A 353 6.059 -8.600 1.949 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.712 -8.877 0.254 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.588 -11.143 -0.311 1.00 0.17 H new ATOM 0 HD2 PHE A 353 5.039 -10.399 3.008 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.459 -13.553 0.123 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.919 -12.808 3.460 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.131 -14.393 2.018 1.00 0.18 H new ATOM 395 N ILE A 354 8.036 -6.383 1.560 1.00 0.08 N ATOM 396 CA ILE A 354 7.916 -4.934 1.557 1.00 0.07 C ATOM 397 C ILE A 354 8.651 -4.378 2.772 1.00 0.08 C ATOM 398 O ILE A 354 8.787 -5.069 3.777 1.00 0.10 O ATOM 399 CB ILE A 354 6.427 -4.521 1.592 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.229 -3.059 1.191 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.844 -4.779 2.971 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.773 -2.631 1.180 1.00 0.07 C ATOM 0 H ILE A 354 8.370 -6.772 2.442 1.00 0.08 H new ATOM 0 HA ILE A 354 8.358 -4.530 0.646 1.00 0.07 H new ATOM 0 HB ILE A 354 5.898 -5.131 0.860 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.782 -2.422 1.881 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.655 -2.901 0.200 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.795 -4.484 2.983 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.926 -5.840 3.208 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.393 -4.198 3.712 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.704 -1.583 0.887 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.219 -3.244 0.469 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.349 -2.758 2.176 1.00 0.07 H new ATOM 414 N ARG A 355 9.141 -3.159 2.678 1.00 0.09 N ATOM 415 CA ARG A 355 9.895 -2.572 3.779 1.00 0.11 C ATOM 416 C ARG A 355 9.975 -1.066 3.638 1.00 0.10 C ATOM 417 O ARG A 355 9.948 -0.537 2.528 1.00 0.14 O ATOM 418 CB ARG A 355 11.316 -3.138 3.806 1.00 0.16 C ATOM 419 CG ARG A 355 12.205 -2.570 2.711 1.00 0.22 C ATOM 420 CD ARG A 355 13.570 -3.223 2.697 1.00 0.25 C ATOM 421 NE ARG A 355 14.481 -2.557 1.770 1.00 0.98 N ATOM 422 CZ ARG A 355 15.297 -3.194 0.934 1.00 1.40 C ATOM 423 NH1 ARG A 355 15.343 -4.524 0.923 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.077 -2.497 0.118 1.00 2.08 N ATOM 0 H ARG A 355 9.035 -2.557 1.862 1.00 0.09 H new ATOM 0 HA ARG A 355 9.377 -2.819 4.706 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.766 -2.928 4.776 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.271 -4.222 3.703 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.725 -2.712 1.743 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.318 -1.496 2.856 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.993 -3.201 3.701 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.468 -4.271 2.416 1.00 0.25 H new ATOM 0 HE ARG A 355 14.493 -1.537 1.763 1.00 0.98 H new ATOM 0 HH11 ARG A 355 14.751 -5.060 1.557 1.00 1.43 H new ATOM 0 HH12 ARG A 355 15.970 -5.007 0.280 1.00 1.43 H new ATOM 0 HH21 ARG A 355 16.049 -1.477 0.133 1.00 2.08 H new ATOM 0 HH22 ARG A 355 16.704 -2.981 -0.525 1.00 2.08 H new ATOM 438 N TRP A 356 10.065 -0.379 4.765 1.00 0.10 N ATOM 439 CA TRP A 356 10.383 1.037 4.756 1.00 0.09 C ATOM 440 C TRP A 356 11.813 1.238 4.269 1.00 0.09 C ATOM 441 O TRP A 356 12.734 0.573 4.743 1.00 0.14 O ATOM 442 CB TRP A 356 10.280 1.646 6.153 1.00 0.10 C ATOM 443 CG TRP A 356 8.896 1.829 6.692 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.411 1.320 7.859 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.830 2.595 6.114 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.118 1.734 8.053 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.737 2.512 6.995 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.691 3.345 4.944 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.529 3.150 6.744 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.490 3.975 4.695 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.423 3.878 5.591 1.00 0.13 C ATOM 0 H TRP A 356 9.923 -0.778 5.693 1.00 0.10 H new ATOM 0 HA TRP A 356 9.667 1.526 4.095 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.836 1.014 6.845 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.775 2.617 6.141 1.00 0.10 H new ATOM 0 HD1 TRP A 356 8.964 0.683 8.533 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.535 1.500 8.856 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.511 3.430 4.246 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.702 3.074 7.435 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.372 4.554 3.791 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.497 4.387 5.369 1.00 0.13 H new ATOM 462 N GLU A 357 11.990 2.136 3.321 1.00 0.10 N ATOM 463 CA GLU A 357 13.321 2.580 2.933 1.00 0.12 C ATOM 464 C GLU A 357 13.620 3.896 3.635 1.00 0.14 C ATOM 465 O GLU A 357 14.771 4.251 3.895 1.00 0.21 O ATOM 466 CB GLU A 357 13.422 2.728 1.423 1.00 0.16 C ATOM 467 CG GLU A 357 13.506 1.396 0.693 1.00 0.25 C ATOM 468 CD GLU A 357 14.784 0.631 0.982 1.00 0.36 C ATOM 469 OE1 GLU A 357 14.897 0.052 2.076 1.00 0.61 O ATOM 470 OE2 GLU A 357 15.671 0.577 0.106 1.00 0.78 O ATOM 0 H GLU A 357 11.230 2.576 2.802 1.00 0.10 H new ATOM 0 HA GLU A 357 14.058 1.836 3.233 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.555 3.279 1.060 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.302 3.323 1.181 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.651 0.781 0.975 1.00 0.25 H new ATOM 0 HG3 GLU A 357 13.432 1.573 -0.380 1.00 0.25 H new ATOM 477 N ASP A 358 12.548 4.615 3.922 1.00 0.14 N ATOM 478 CA ASP A 358 12.591 5.778 4.797 1.00 0.16 C ATOM 479 C ASP A 358 11.263 5.899 5.522 1.00 0.16 C ATOM 480 O ASP A 358 10.351 6.564 5.039 1.00 0.20 O ATOM 481 CB ASP A 358 12.838 7.068 4.021 1.00 0.20 C ATOM 482 CG ASP A 358 13.674 8.051 4.814 1.00 0.92 C ATOM 483 OD1 ASP A 358 13.124 8.703 5.728 1.00 1.46 O ATOM 484 OD2 ASP A 358 14.881 8.185 4.520 1.00 1.33 O ATOM 0 H ASP A 358 11.619 4.409 3.554 1.00 0.14 H new ATOM 0 HA ASP A 358 13.414 5.638 5.498 1.00 0.16 H new ATOM 0 HB2 ASP A 358 13.342 6.837 3.083 1.00 0.20 H new ATOM 0 HB3 ASP A 358 11.883 7.527 3.765 1.00 0.20 H new ATOM 489 N LYS A 359 11.160 5.241 6.664 1.00 0.15 N ATOM 490 CA LYS A 359 9.927 5.206 7.442 1.00 0.17 C ATOM 491 C LYS A 359 9.378 6.599 7.723 1.00 0.19 C ATOM 492 O LYS A 359 8.190 6.856 7.544 1.00 0.23 O ATOM 493 CB LYS A 359 10.168 4.482 8.760 1.00 0.23 C ATOM 494 CG LYS A 359 8.934 4.408 9.641 1.00 0.29 C ATOM 495 CD LYS A 359 9.073 3.350 10.719 1.00 0.38 C ATOM 496 CE LYS A 359 7.769 3.155 11.468 1.00 0.91 C ATOM 497 NZ LYS A 359 7.842 2.031 12.437 1.00 1.50 N ATOM 0 H LYS A 359 11.928 4.715 7.081 1.00 0.15 H new ATOM 0 HA LYS A 359 9.186 4.673 6.847 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.518 3.471 8.552 1.00 0.23 H new ATOM 0 HB3 LYS A 359 10.964 4.989 9.305 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.760 5.379 10.105 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.061 4.188 9.026 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.381 2.406 10.269 1.00 0.38 H new ATOM 0 HD3 LYS A 359 9.857 3.640 11.418 1.00 0.38 H new ATOM 0 HE2 LYS A 359 7.515 4.073 11.998 1.00 0.91 H new ATOM 0 HE3 LYS A 359 6.967 2.966 10.755 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 6.929 1.934 12.926 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 8.058 1.149 11.930 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 8.590 2.222 13.134 1.00 1.50 H new ATOM 511 N GLU A 360 10.244 7.488 8.162 1.00 0.21 N ATOM 512 CA GLU A 360 9.820 8.823 8.548 1.00 0.27 C ATOM 513 C GLU A 360 9.478 9.680 7.332 1.00 0.24 C ATOM 514 O GLU A 360 8.701 10.627 7.430 1.00 0.37 O ATOM 515 CB GLU A 360 10.884 9.474 9.402 1.00 0.41 C ATOM 516 CG GLU A 360 11.148 8.675 10.660 1.00 0.63 C ATOM 517 CD GLU A 360 9.947 8.616 11.581 1.00 1.75 C ATOM 518 OE1 GLU A 360 9.775 9.541 12.403 1.00 1.97 O ATOM 519 OE2 GLU A 360 9.165 7.649 11.486 1.00 2.67 O ATOM 0 H GLU A 360 11.244 7.314 8.261 1.00 0.21 H new ATOM 0 HA GLU A 360 8.907 8.736 9.137 1.00 0.27 H new ATOM 0 HB2 GLU A 360 11.806 9.568 8.828 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.571 10.483 9.669 1.00 0.41 H new ATOM 0 HG2 GLU A 360 11.440 7.661 10.386 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.989 9.116 11.195 1.00 0.63 H new ATOM 526 N SER A 361 10.047 9.337 6.184 1.00 0.19 N ATOM 527 CA SER A 361 9.707 10.000 4.936 1.00 0.21 C ATOM 528 C SER A 361 8.566 9.259 4.242 1.00 0.19 C ATOM 529 O SER A 361 8.144 9.624 3.142 1.00 0.24 O ATOM 530 CB SER A 361 10.941 10.054 4.038 1.00 0.26 C ATOM 531 OG SER A 361 11.968 10.824 4.637 1.00 0.31 O ATOM 0 H SER A 361 10.748 8.601 6.093 1.00 0.19 H new ATOM 0 HA SER A 361 9.376 11.018 5.142 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.302 9.043 3.848 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.675 10.484 3.072 1.00 0.26 H new ATOM 0 HG SER A 361 12.402 10.299 5.341 1.00 0.31 H new ATOM 537 N LYS A 362 8.069 8.224 4.925 1.00 0.15 N ATOM 538 CA LYS A 362 7.028 7.343 4.410 1.00 0.14 C ATOM 539 C LYS A 362 7.399 6.771 3.050 1.00 0.12 C ATOM 540 O LYS A 362 6.571 6.664 2.148 1.00 0.15 O ATOM 541 CB LYS A 362 5.674 8.049 4.373 1.00 0.20 C ATOM 542 CG LYS A 362 4.864 7.834 5.642 1.00 0.48 C ATOM 543 CD LYS A 362 5.570 8.403 6.854 1.00 0.48 C ATOM 544 CE LYS A 362 4.907 7.973 8.154 1.00 0.51 C ATOM 545 NZ LYS A 362 5.667 8.436 9.346 1.00 1.23 N ATOM 0 H LYS A 362 8.385 7.975 5.862 1.00 0.15 H new ATOM 0 HA LYS A 362 6.941 6.502 5.098 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.830 9.117 4.223 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.104 7.687 3.517 1.00 0.20 H new ATOM 0 HG2 LYS A 362 3.887 8.304 5.535 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.691 6.768 5.788 1.00 0.48 H new ATOM 0 HD2 LYS A 362 6.611 8.078 6.853 1.00 0.48 H new ATOM 0 HD3 LYS A 362 5.576 9.491 6.793 1.00 0.48 H new ATOM 0 HE2 LYS A 362 3.893 8.371 8.193 1.00 0.51 H new ATOM 0 HE3 LYS A 362 4.824 6.886 8.177 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.182 8.122 10.211 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 6.627 8.036 9.323 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 5.725 9.474 9.339 1.00 1.23 H new ATOM 559 N ILE A 363 8.656 6.389 2.930 1.00 0.09 N ATOM 560 CA ILE A 363 9.162 5.757 1.732 1.00 0.09 C ATOM 561 C ILE A 363 9.332 4.273 1.973 1.00 0.08 C ATOM 562 O ILE A 363 9.956 3.871 2.952 1.00 0.10 O ATOM 563 CB ILE A 363 10.524 6.344 1.334 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.369 7.798 0.888 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.157 5.492 0.243 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.663 8.582 0.906 1.00 0.46 C ATOM 0 H ILE A 363 9.355 6.510 3.663 1.00 0.09 H new ATOM 0 HA ILE A 363 8.447 5.935 0.929 1.00 0.09 H new ATOM 0 HB ILE A 363 11.186 6.333 2.200 1.00 0.10 H new ATOM 0 HG12 ILE A 363 9.957 7.817 -0.121 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.646 8.292 1.537 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.123 5.914 -0.034 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.298 4.476 0.611 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.504 5.475 -0.630 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.474 9.604 0.577 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.066 8.595 1.919 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.382 8.112 0.235 1.00 0.46 H new ATOM 578 N PHE A 364 8.797 3.461 1.085 1.00 0.09 N ATOM 579 CA PHE A 364 8.904 2.028 1.235 1.00 0.09 C ATOM 580 C PHE A 364 9.238 1.382 -0.105 1.00 0.10 C ATOM 581 O PHE A 364 8.855 1.878 -1.166 1.00 0.13 O ATOM 582 CB PHE A 364 7.606 1.445 1.814 1.00 0.09 C ATOM 583 CG PHE A 364 6.446 1.447 0.871 1.00 0.08 C ATOM 584 CD1 PHE A 364 5.639 2.554 0.767 1.00 0.13 C ATOM 585 CD2 PHE A 364 6.159 0.335 0.105 1.00 0.12 C ATOM 586 CE1 PHE A 364 4.555 2.562 -0.091 1.00 0.14 C ATOM 587 CE2 PHE A 364 5.080 0.327 -0.755 1.00 0.12 C ATOM 588 CZ PHE A 364 4.276 1.442 -0.855 1.00 0.08 C ATOM 0 H PHE A 364 8.287 3.768 0.257 1.00 0.09 H new ATOM 0 HA PHE A 364 9.712 1.810 1.934 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.795 0.420 2.134 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.334 2.012 2.704 1.00 0.09 H new ATOM 0 HD1 PHE A 364 5.854 3.429 1.363 1.00 0.13 H new ATOM 0 HD2 PHE A 364 6.787 -0.540 0.180 1.00 0.12 H new ATOM 0 HE1 PHE A 364 3.928 3.439 -0.165 1.00 0.14 H new ATOM 0 HE2 PHE A 364 4.866 -0.550 -1.348 1.00 0.12 H new ATOM 0 HZ PHE A 364 3.431 1.442 -1.527 1.00 0.08 H new ATOM 598 N ARG A 365 9.976 0.298 -0.043 1.00 0.10 N ATOM 599 CA ARG A 365 10.294 -0.494 -1.210 1.00 0.12 C ATOM 600 C ARG A 365 9.521 -1.796 -1.130 1.00 0.11 C ATOM 601 O ARG A 365 9.604 -2.498 -0.120 1.00 0.18 O ATOM 602 CB ARG A 365 11.792 -0.806 -1.232 1.00 0.17 C ATOM 603 CG ARG A 365 12.236 -1.640 -2.421 1.00 0.17 C ATOM 604 CD ARG A 365 12.658 -0.768 -3.586 1.00 0.31 C ATOM 605 NE ARG A 365 14.020 -1.073 -4.028 1.00 0.77 N ATOM 606 CZ ARG A 365 15.080 -0.305 -3.770 1.00 0.63 C ATOM 607 NH1 ARG A 365 14.955 0.793 -3.034 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.272 -0.647 -4.230 1.00 0.99 N ATOM 0 H ARG A 365 10.375 -0.062 0.824 1.00 0.10 H new ATOM 0 HA ARG A 365 10.028 0.056 -2.113 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.347 0.132 -1.233 1.00 0.17 H new ATOM 0 HB3 ARG A 365 12.056 -1.332 -0.315 1.00 0.17 H new ATOM 0 HG2 ARG A 365 13.066 -2.282 -2.126 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.422 -2.295 -2.732 1.00 0.17 H new ATOM 0 HD2 ARG A 365 11.966 -0.911 -4.416 1.00 0.31 H new ATOM 0 HD3 ARG A 365 12.596 0.281 -3.296 1.00 0.31 H new ATOM 0 HE ARG A 365 14.168 -1.926 -4.567 1.00 0.77 H new ATOM 0 HH11 ARG A 365 14.043 1.056 -2.661 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.771 1.374 -2.842 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.381 -1.498 -4.782 1.00 0.99 H new ATOM 0 HH22 ARG A 365 17.082 -0.060 -4.033 1.00 0.99 H new ATOM 622 N ILE A 366 8.752 -2.118 -2.153 1.00 0.07 N ATOM 623 CA ILE A 366 8.150 -3.418 -2.219 1.00 0.06 C ATOM 624 C ILE A 366 9.224 -4.423 -2.571 1.00 0.07 C ATOM 625 O ILE A 366 9.742 -4.460 -3.684 1.00 0.10 O ATOM 626 CB ILE A 366 6.982 -3.454 -3.212 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.799 -2.690 -2.604 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.606 -4.894 -3.546 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.693 -2.403 -3.578 1.00 0.09 C ATOM 0 H ILE A 366 8.537 -1.500 -2.936 1.00 0.07 H new ATOM 0 HA ILE A 366 7.722 -3.672 -1.249 1.00 0.06 H new ATOM 0 HB ILE A 366 7.272 -2.975 -4.147 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.396 -3.267 -1.772 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.161 -1.748 -2.193 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.775 -4.899 -4.252 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.463 -5.400 -3.991 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.311 -5.414 -2.635 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.894 -1.861 -3.072 1.00 0.09 H new ATOM 0 HD12 ILE A 366 5.079 -1.798 -4.399 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.302 -3.341 -3.971 1.00 0.09 H new ATOM 641 N VAL A 367 9.580 -5.197 -1.580 1.00 0.07 N ATOM 642 CA VAL A 367 10.735 -6.069 -1.655 1.00 0.08 C ATOM 643 C VAL A 367 10.424 -7.314 -2.472 1.00 0.09 C ATOM 644 O VAL A 367 11.213 -7.739 -3.322 1.00 0.12 O ATOM 645 CB VAL A 367 11.193 -6.442 -0.240 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.361 -7.400 -0.281 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.554 -5.185 0.533 1.00 0.10 C ATOM 0 H VAL A 367 9.079 -5.245 -0.693 1.00 0.07 H new ATOM 0 HA VAL A 367 11.544 -5.540 -2.159 1.00 0.08 H new ATOM 0 HB VAL A 367 10.371 -6.946 0.269 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.665 -7.647 0.736 1.00 0.12 H new ATOM 0 HG12 VAL A 367 12.067 -8.310 -0.803 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.195 -6.934 -0.806 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.879 -5.456 1.538 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.361 -4.661 0.020 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.682 -4.534 0.597 1.00 0.10 H new ATOM 657 N ASP A 368 9.268 -7.887 -2.215 1.00 0.08 N ATOM 658 CA ASP A 368 8.763 -8.995 -3.006 1.00 0.09 C ATOM 659 C ASP A 368 7.279 -8.798 -3.233 1.00 0.08 C ATOM 660 O ASP A 368 6.443 -9.203 -2.431 1.00 0.09 O ATOM 661 CB ASP A 368 9.033 -10.335 -2.336 1.00 0.12 C ATOM 662 CG ASP A 368 8.763 -11.515 -3.254 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.591 -11.717 -3.640 1.00 0.45 O ATOM 664 OD2 ASP A 368 9.710 -12.257 -3.588 1.00 0.78 O ATOM 0 H ASP A 368 8.651 -7.601 -1.455 1.00 0.08 H new ATOM 0 HA ASP A 368 9.284 -9.010 -3.963 1.00 0.09 H new ATOM 0 HB2 ASP A 368 10.071 -10.368 -2.004 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.411 -10.423 -1.445 1.00 0.12 H new ATOM 669 N PRO A 369 6.963 -8.133 -4.336 1.00 0.09 N ATOM 670 CA PRO A 369 5.602 -7.748 -4.708 1.00 0.10 C ATOM 671 C PRO A 369 4.660 -8.931 -4.838 1.00 0.12 C ATOM 672 O PRO A 369 3.480 -8.832 -4.516 1.00 0.14 O ATOM 673 CB PRO A 369 5.789 -7.046 -6.058 1.00 0.12 C ATOM 674 CG PRO A 369 7.129 -7.465 -6.540 1.00 0.12 C ATOM 675 CD PRO A 369 7.947 -7.690 -5.318 1.00 0.10 C ATOM 0 HA PRO A 369 5.139 -7.122 -3.945 1.00 0.10 H new ATOM 0 HB2 PRO A 369 5.010 -7.336 -6.763 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.732 -5.963 -5.949 1.00 0.12 H new ATOM 0 HG2 PRO A 369 7.063 -8.373 -7.139 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.574 -6.698 -7.173 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.719 -8.442 -5.483 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.453 -6.779 -4.999 1.00 0.10 H new ATOM 683 N ASN A 370 5.188 -10.052 -5.294 1.00 0.13 N ATOM 684 CA ASN A 370 4.391 -11.258 -5.443 1.00 0.17 C ATOM 685 C ASN A 370 4.007 -11.778 -4.071 1.00 0.17 C ATOM 686 O ASN A 370 2.864 -12.170 -3.827 1.00 0.21 O ATOM 687 CB ASN A 370 5.185 -12.312 -6.198 1.00 0.21 C ATOM 688 CG ASN A 370 4.304 -13.165 -7.091 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.072 -12.828 -8.252 1.00 0.62 O ATOM 690 ND2 ASN A 370 3.817 -14.278 -6.567 1.00 0.59 N ATOM 0 H ASN A 370 6.165 -10.154 -5.568 1.00 0.13 H new ATOM 0 HA ASN A 370 3.487 -11.030 -6.008 1.00 0.17 H new ATOM 0 HB2 ASN A 370 5.949 -11.824 -6.804 1.00 0.21 H new ATOM 0 HB3 ASN A 370 5.705 -12.952 -5.485 1.00 0.21 H new ATOM 0 HD21 ASN A 370 3.227 -14.891 -7.130 1.00 0.59 H new ATOM 0 HD22 ASN A 370 4.032 -14.523 -5.601 1.00 0.59 H new ATOM 697 N GLY A 371 4.979 -11.749 -3.174 1.00 0.16 N ATOM 698 CA GLY A 371 4.748 -12.123 -1.799 1.00 0.19 C ATOM 699 C GLY A 371 3.815 -11.156 -1.109 1.00 0.13 C ATOM 700 O GLY A 371 2.999 -11.542 -0.274 1.00 0.13 O ATOM 0 H GLY A 371 5.938 -11.468 -3.380 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.326 -13.127 -1.760 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.698 -12.156 -1.266 1.00 0.19 H new ATOM 704 N LEU A 372 3.920 -9.895 -1.498 1.00 0.10 N ATOM 705 CA LEU A 372 3.185 -8.826 -0.847 1.00 0.08 C ATOM 706 C LEU A 372 1.730 -8.879 -1.279 1.00 0.11 C ATOM 707 O LEU A 372 0.814 -8.708 -0.480 1.00 0.13 O ATOM 708 CB LEU A 372 3.805 -7.473 -1.221 1.00 0.08 C ATOM 709 CG LEU A 372 3.576 -6.336 -0.220 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.128 -5.873 -0.214 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.969 -6.794 1.170 1.00 0.09 C ATOM 0 H LEU A 372 4.513 -9.587 -2.268 1.00 0.10 H new ATOM 0 HA LEU A 372 3.238 -8.948 0.235 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.879 -7.609 -1.348 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.406 -7.167 -2.188 1.00 0.08 H new ATOM 0 HG LEU A 372 4.196 -5.493 -0.525 1.00 0.08 H new ATOM 0 HD11 LEU A 372 2.007 -5.066 0.509 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.857 -5.515 -1.207 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.481 -6.706 0.061 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.805 -5.983 1.880 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.363 -7.654 1.455 1.00 0.09 H new ATOM 0 HD23 LEU A 372 5.022 -7.075 1.176 1.00 0.09 H new ATOM 723 N ALA A 373 1.536 -9.138 -2.557 1.00 0.12 N ATOM 724 CA ALA A 373 0.211 -9.231 -3.134 1.00 0.15 C ATOM 725 C ALA A 373 -0.545 -10.416 -2.561 1.00 0.14 C ATOM 726 O ALA A 373 -1.766 -10.378 -2.416 1.00 0.16 O ATOM 727 CB ALA A 373 0.325 -9.364 -4.628 1.00 0.20 C ATOM 0 H ALA A 373 2.293 -9.290 -3.224 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.344 -8.325 -2.889 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.671 -9.434 -5.064 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.838 -8.491 -5.033 1.00 0.20 H new ATOM 0 HB3 ALA A 373 0.892 -10.263 -4.871 1.00 0.20 H new ATOM 733 N ARG A 374 0.189 -11.468 -2.230 1.00 0.14 N ATOM 734 CA ARG A 374 -0.403 -12.634 -1.617 1.00 0.17 C ATOM 735 C ARG A 374 -0.885 -12.282 -0.211 1.00 0.14 C ATOM 736 O ARG A 374 -1.862 -12.841 0.280 1.00 0.16 O ATOM 737 CB ARG A 374 0.601 -13.791 -1.613 1.00 0.24 C ATOM 738 CG ARG A 374 0.846 -14.399 -0.254 1.00 0.28 C ATOM 739 CD ARG A 374 1.323 -15.838 -0.377 1.00 0.47 C ATOM 740 NE ARG A 374 0.455 -16.623 -1.263 1.00 1.44 N ATOM 741 CZ ARG A 374 0.385 -17.953 -1.270 1.00 2.04 C ATOM 742 NH1 ARG A 374 1.114 -18.671 -0.422 1.00 2.01 N ATOM 743 NH2 ARG A 374 -0.426 -18.561 -2.131 1.00 3.03 N ATOM 0 H ARG A 374 1.196 -11.532 -2.378 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.269 -12.960 -2.193 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.242 -14.569 -2.287 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.550 -13.434 -2.014 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.590 -13.810 0.283 1.00 0.28 H new ATOM 0 HG3 ARG A 374 -0.071 -14.365 0.334 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.343 -15.852 -0.761 1.00 0.47 H new ATOM 0 HD3 ARG A 374 1.348 -16.299 0.610 1.00 0.47 H new ATOM 0 HE ARG A 374 -0.136 -16.114 -1.920 1.00 1.44 H new ATOM 0 HH11 ARG A 374 1.733 -18.204 0.241 1.00 2.01 H new ATOM 0 HH12 ARG A 374 1.055 -19.689 -0.434 1.00 2.01 H new ATOM 0 HH21 ARG A 374 -0.988 -18.009 -2.779 1.00 3.03 H new ATOM 0 HH22 ARG A 374 -0.486 -19.579 -2.143 1.00 3.03 H new ATOM 757 N LEU A 375 -0.192 -11.343 0.422 1.00 0.13 N ATOM 758 CA LEU A 375 -0.642 -10.764 1.687 1.00 0.15 C ATOM 759 C LEU A 375 -1.938 -10.005 1.461 1.00 0.16 C ATOM 760 O LEU A 375 -2.901 -10.160 2.204 1.00 0.18 O ATOM 761 CB LEU A 375 0.402 -9.787 2.235 1.00 0.17 C ATOM 762 CG LEU A 375 1.504 -10.353 3.125 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.936 -11.734 2.686 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.687 -9.409 3.091 1.00 0.15 C ATOM 0 H LEU A 375 0.690 -10.963 0.079 1.00 0.13 H new ATOM 0 HA LEU A 375 -0.791 -11.573 2.402 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.876 -9.293 1.387 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.123 -9.017 2.800 1.00 0.17 H new ATOM 0 HG LEU A 375 1.114 -10.445 4.139 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.722 -12.097 3.348 1.00 0.29 H new ATOM 0 HD12 LEU A 375 1.084 -12.412 2.728 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.314 -11.689 1.665 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.484 -9.801 3.723 1.00 0.15 H new ATOM 0 HD22 LEU A 375 3.049 -9.316 2.067 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.381 -8.429 3.458 1.00 0.15 H new ATOM 776 N TRP A 376 -1.940 -9.178 0.422 1.00 0.16 N ATOM 777 CA TRP A 376 -3.102 -8.377 0.063 1.00 0.18 C ATOM 778 C TRP A 376 -4.310 -9.277 -0.184 1.00 0.20 C ATOM 779 O TRP A 376 -5.413 -9.003 0.291 1.00 0.25 O ATOM 780 CB TRP A 376 -2.776 -7.535 -1.175 1.00 0.19 C ATOM 781 CG TRP A 376 -3.810 -6.508 -1.531 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.223 -6.180 -2.787 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.544 -5.661 -0.636 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.164 -5.186 -2.732 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.378 -4.851 -1.426 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.579 -5.505 0.752 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.234 -3.903 -0.878 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.424 -4.559 1.293 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.243 -3.772 0.478 1.00 0.24 C ATOM 0 H TRP A 376 -1.138 -9.045 -0.193 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.351 -7.706 0.885 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.824 -7.030 -1.012 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.641 -8.203 -2.026 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.861 -6.638 -3.696 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.629 -4.765 -3.536 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -3.956 -6.114 1.390 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.868 -3.293 -1.504 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.454 -4.424 2.364 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.898 -3.044 0.934 1.00 0.24 H new ATOM 800 N GLY A 377 -4.087 -10.364 -0.911 1.00 0.21 N ATOM 801 CA GLY A 377 -5.133 -11.341 -1.124 1.00 0.27 C ATOM 802 C GLY A 377 -5.514 -12.058 0.155 1.00 0.30 C ATOM 803 O GLY A 377 -6.678 -12.365 0.374 1.00 0.38 O ATOM 0 H GLY A 377 -3.197 -10.586 -1.358 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.012 -10.846 -1.537 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -4.802 -12.071 -1.863 1.00 0.27 H new ATOM 807 N ASN A 378 -4.526 -12.322 1.000 1.00 0.27 N ATOM 808 CA ASN A 378 -4.763 -12.916 2.315 1.00 0.30 C ATOM 809 C ASN A 378 -5.674 -12.022 3.154 1.00 0.30 C ATOM 810 O ASN A 378 -6.611 -12.493 3.801 1.00 0.35 O ATOM 811 CB ASN A 378 -3.437 -13.130 3.044 1.00 0.32 C ATOM 812 CG ASN A 378 -2.975 -14.574 3.040 1.00 0.38 C ATOM 813 OD1 ASN A 378 -3.335 -15.361 3.914 1.00 0.76 O ATOM 814 ND2 ASN A 378 -2.148 -14.916 2.074 1.00 0.42 N ATOM 0 H ASN A 378 -3.544 -12.133 0.798 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.253 -13.879 2.171 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.671 -12.510 2.579 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.539 -12.791 4.075 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.780 -15.866 2.030 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -1.876 -14.231 1.369 1.00 0.42 H new ATOM 821 N HIS A 379 -5.385 -10.729 3.119 1.00 0.28 N ATOM 822 CA HIS A 379 -6.144 -9.726 3.854 1.00 0.30 C ATOM 823 C HIS A 379 -7.577 -9.623 3.328 1.00 0.32 C ATOM 824 O HIS A 379 -8.532 -9.690 4.101 1.00 0.38 O ATOM 825 CB HIS A 379 -5.418 -8.374 3.753 1.00 0.28 C ATOM 826 CG HIS A 379 -6.146 -7.204 4.350 1.00 0.32 C ATOM 827 ND1 HIS A 379 -5.934 -6.804 5.646 1.00 0.43 N ATOM 828 CD2 HIS A 379 -7.019 -6.355 3.766 1.00 0.31 C ATOM 829 CE1 HIS A 379 -6.679 -5.724 5.810 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.355 -5.413 4.699 1.00 0.38 N ATOM 0 H HIS A 379 -4.612 -10.343 2.576 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.209 -10.022 4.901 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.448 -8.465 4.242 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.226 -8.162 2.701 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.384 -6.410 2.751 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -6.735 -5.161 6.730 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -7.995 -4.629 4.572 1.00 0.38 H new ATOM 838 N LYS A 380 -7.729 -9.492 2.014 1.00 0.32 N ATOM 839 CA LYS A 380 -9.050 -9.292 1.423 1.00 0.36 C ATOM 840 C LYS A 380 -9.744 -10.619 1.115 1.00 0.41 C ATOM 841 O LYS A 380 -10.845 -10.639 0.567 1.00 0.45 O ATOM 842 CB LYS A 380 -8.955 -8.465 0.146 1.00 0.36 C ATOM 843 CG LYS A 380 -8.156 -7.183 0.300 1.00 0.38 C ATOM 844 CD LYS A 380 -8.504 -6.181 -0.783 1.00 0.63 C ATOM 845 CE LYS A 380 -8.370 -6.783 -2.167 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.672 -5.787 -3.228 1.00 0.77 N ATOM 0 H LYS A 380 -6.962 -9.520 1.342 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.646 -8.755 2.161 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.500 -9.073 -0.636 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -9.962 -8.216 -0.189 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -8.352 -6.746 1.279 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -7.091 -7.409 0.260 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -9.525 -5.827 -0.637 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -7.851 -5.313 -0.699 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.358 -7.164 -2.302 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.046 -7.633 -2.262 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -8.004 -5.906 -4.016 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.643 -5.930 -3.573 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -8.581 -4.827 -2.839 1.00 0.77 H new ATOM 860 N ASN A 381 -9.085 -11.717 1.477 1.00 0.44 N ATOM 861 CA ASN A 381 -9.588 -13.069 1.230 1.00 0.52 C ATOM 862 C ASN A 381 -9.849 -13.306 -0.258 1.00 0.53 C ATOM 863 O ASN A 381 -10.880 -13.860 -0.641 1.00 0.60 O ATOM 864 CB ASN A 381 -10.852 -13.344 2.050 1.00 0.58 C ATOM 865 CG ASN A 381 -10.582 -13.409 3.544 1.00 1.20 C ATOM 866 OD1 ASN A 381 -10.247 -14.465 4.081 1.00 1.87 O ATOM 867 ND2 ASN A 381 -10.734 -12.285 4.227 1.00 2.01 N ATOM 0 H ASN A 381 -8.183 -11.696 1.952 1.00 0.44 H new ATOM 0 HA ASN A 381 -8.815 -13.768 1.549 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -11.585 -12.562 1.852 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.293 -14.286 1.724 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -10.572 -12.274 5.234 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -11.013 -11.430 3.746 1.00 2.01 H new ATOM 874 N ARG A 382 -8.902 -12.888 -1.092 1.00 0.50 N ATOM 875 CA ARG A 382 -9.005 -13.072 -2.533 1.00 0.55 C ATOM 876 C ARG A 382 -7.829 -13.892 -3.033 1.00 0.68 C ATOM 877 O ARG A 382 -6.675 -13.511 -2.846 1.00 0.78 O ATOM 878 CB ARG A 382 -9.009 -11.732 -3.269 1.00 0.49 C ATOM 879 CG ARG A 382 -10.001 -10.720 -2.725 1.00 0.48 C ATOM 880 CD ARG A 382 -11.432 -11.176 -2.919 1.00 0.57 C ATOM 881 NE ARG A 382 -12.380 -10.197 -2.398 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.702 -10.345 -2.409 1.00 1.11 C ATOM 883 NH1 ARG A 382 -14.258 -11.390 -3.012 1.00 1.69 N ATOM 884 NH2 ARG A 382 -14.468 -9.426 -1.836 1.00 1.27 N ATOM 0 H ARG A 382 -8.049 -12.416 -0.790 1.00 0.50 H new ATOM 0 HA ARG A 382 -9.944 -13.588 -2.732 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -8.008 -11.303 -3.222 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.231 -11.910 -4.321 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -9.811 -10.559 -1.664 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -9.854 -9.762 -3.224 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -11.622 -11.340 -3.980 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -11.582 -12.132 -2.417 1.00 0.57 H new ATOM 0 HE ARG A 382 -12.002 -9.338 -1.997 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -13.670 -12.086 -3.471 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -15.272 -11.496 -3.016 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -14.043 -8.613 -1.391 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -15.482 -9.533 -1.840 1.00 1.27 H new ATOM 898 N THR A 383 -8.125 -15.004 -3.675 1.00 0.76 N ATOM 899 CA THR A 383 -7.091 -15.872 -4.210 1.00 0.95 C ATOM 900 C THR A 383 -6.464 -15.273 -5.471 1.00 0.94 C ATOM 901 O THR A 383 -5.271 -15.430 -5.733 1.00 1.22 O ATOM 902 CB THR A 383 -7.668 -17.262 -4.533 1.00 1.17 C ATOM 903 OG1 THR A 383 -8.260 -17.828 -3.357 1.00 1.24 O ATOM 904 CG2 THR A 383 -6.590 -18.187 -5.068 1.00 1.37 C ATOM 0 H THR A 383 -9.077 -15.330 -3.840 1.00 0.76 H new ATOM 0 HA THR A 383 -6.317 -15.970 -3.449 1.00 0.95 H new ATOM 0 HB THR A 383 -8.431 -17.147 -5.303 1.00 1.17 H new ATOM 0 HG1 THR A 383 -8.627 -18.712 -3.568 1.00 1.24 H new ATOM 0 HG21 THR A 383 -7.024 -19.162 -5.288 1.00 1.37 H new ATOM 0 HG22 THR A 383 -6.167 -17.764 -5.979 1.00 1.37 H new ATOM 0 HG23 THR A 383 -5.804 -18.300 -4.321 1.00 1.37 H new ATOM 912 N ASN A 384 -7.278 -14.573 -6.237 1.00 0.84 N ATOM 913 CA ASN A 384 -6.841 -13.985 -7.501 1.00 0.81 C ATOM 914 C ASN A 384 -6.250 -12.593 -7.300 1.00 0.64 C ATOM 915 O ASN A 384 -6.277 -11.755 -8.203 1.00 0.77 O ATOM 916 CB ASN A 384 -8.023 -13.885 -8.452 1.00 0.89 C ATOM 917 CG ASN A 384 -7.603 -13.834 -9.913 1.00 1.40 C ATOM 918 OD1 ASN A 384 -7.478 -12.761 -10.500 1.00 2.21 O ATOM 919 ND2 ASN A 384 -7.383 -14.998 -10.507 1.00 1.70 N ATOM 0 H ASN A 384 -8.256 -14.393 -6.008 1.00 0.84 H new ATOM 0 HA ASN A 384 -6.068 -14.631 -7.918 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -8.681 -14.740 -8.298 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -8.600 -12.992 -8.214 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -7.099 -15.025 -11.486 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -7.498 -15.867 -9.985 1.00 1.70 H new ATOM 926 N MET A 385 -5.727 -12.329 -6.121 1.00 0.55 N ATOM 927 CA MET A 385 -5.143 -11.031 -5.856 1.00 0.42 C ATOM 928 C MET A 385 -3.683 -11.029 -6.262 1.00 0.53 C ATOM 929 O MET A 385 -2.868 -11.750 -5.688 1.00 0.94 O ATOM 930 CB MET A 385 -5.282 -10.650 -4.389 1.00 0.47 C ATOM 931 CG MET A 385 -4.841 -9.230 -4.102 1.00 0.92 C ATOM 932 SD MET A 385 -5.855 -8.024 -4.974 1.00 2.54 S ATOM 933 CE MET A 385 -7.492 -8.707 -4.733 1.00 3.18 C ATOM 0 H MET A 385 -5.694 -12.985 -5.341 1.00 0.55 H new ATOM 0 HA MET A 385 -5.682 -10.289 -6.446 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.322 -10.770 -4.085 1.00 0.47 H new ATOM 0 HB3 MET A 385 -4.692 -11.337 -3.783 1.00 0.47 H new ATOM 0 HG2 MET A 385 -4.895 -9.043 -3.030 1.00 0.92 H new ATOM 0 HG3 MET A 385 -3.798 -9.107 -4.395 1.00 0.92 H new ATOM 0 HE1 MET A 385 -8.240 -7.947 -4.959 1.00 3.18 H new ATOM 0 HE2 MET A 385 -7.631 -9.561 -5.395 1.00 3.18 H new ATOM 0 HE3 MET A 385 -7.603 -9.029 -3.698 1.00 3.18 H new ATOM 943 N THR A 386 -3.363 -10.226 -7.262 1.00 0.23 N ATOM 944 CA THR A 386 -2.021 -10.193 -7.797 1.00 0.24 C ATOM 945 C THR A 386 -1.378 -8.853 -7.498 1.00 0.16 C ATOM 946 O THR A 386 -2.036 -7.952 -6.969 1.00 0.18 O ATOM 947 CB THR A 386 -2.011 -10.439 -9.319 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.565 -9.309 -10.005 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.816 -11.681 -9.661 1.00 0.44 C ATOM 0 H THR A 386 -4.017 -9.590 -7.717 1.00 0.23 H new ATOM 0 HA THR A 386 -1.454 -10.992 -7.319 1.00 0.24 H new ATOM 0 HB THR A 386 -0.978 -10.585 -9.636 1.00 0.33 H new ATOM 0 HG1 THR A 386 -2.597 -9.494 -10.967 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.799 -11.840 -10.739 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.382 -12.546 -9.159 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.846 -11.549 -9.330 1.00 0.44 H new ATOM 957 N TYR A 387 -0.111 -8.705 -7.837 1.00 0.16 N ATOM 958 CA TYR A 387 0.556 -7.431 -7.633 1.00 0.13 C ATOM 959 C TYR A 387 -0.047 -6.378 -8.554 1.00 0.14 C ATOM 960 O TYR A 387 -0.026 -5.190 -8.246 1.00 0.17 O ATOM 961 CB TYR A 387 2.059 -7.524 -7.865 1.00 0.15 C ATOM 962 CG TYR A 387 2.721 -6.206 -7.582 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.670 -5.663 -6.307 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.339 -5.476 -8.589 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.220 -4.441 -6.040 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.889 -4.241 -8.327 1.00 0.14 C ATOM 967 CZ TYR A 387 3.827 -3.727 -7.050 1.00 0.12 C ATOM 968 OH TYR A 387 4.368 -2.495 -6.786 1.00 0.13 O ATOM 0 H TYR A 387 0.469 -9.436 -8.248 1.00 0.16 H new ATOM 0 HA TYR A 387 0.404 -7.145 -6.592 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.484 -8.296 -7.223 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.256 -7.822 -8.895 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.188 -6.214 -5.513 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.389 -5.881 -9.589 1.00 0.14 H new ATOM 0 HE1 TYR A 387 3.179 -4.036 -5.040 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.366 -3.679 -9.117 1.00 0.14 H new ATOM 0 HH TYR A 387 3.685 -1.804 -6.912 1.00 0.13 H new ATOM 978 N GLU A 388 -0.600 -6.822 -9.676 1.00 0.17 N ATOM 979 CA GLU A 388 -1.260 -5.912 -10.598 1.00 0.24 C ATOM 980 C GLU A 388 -2.478 -5.290 -9.929 1.00 0.25 C ATOM 981 O GLU A 388 -2.731 -4.095 -10.065 1.00 0.31 O ATOM 982 CB GLU A 388 -1.669 -6.631 -11.879 1.00 0.30 C ATOM 983 CG GLU A 388 -2.390 -5.736 -12.870 1.00 0.44 C ATOM 984 CD GLU A 388 -2.695 -6.443 -14.169 1.00 1.53 C ATOM 985 OE1 GLU A 388 -3.696 -7.187 -14.224 1.00 2.21 O ATOM 986 OE2 GLU A 388 -1.938 -6.253 -15.142 1.00 1.96 O ATOM 0 H GLU A 388 -0.604 -7.800 -9.966 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.557 -5.123 -10.865 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.779 -7.044 -12.355 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.314 -7.472 -11.624 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -3.320 -5.382 -12.425 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -1.778 -4.857 -13.073 1.00 0.44 H new ATOM 993 N LYS A 389 -3.226 -6.108 -9.191 1.00 0.23 N ATOM 994 CA LYS A 389 -4.353 -5.613 -8.417 1.00 0.28 C ATOM 995 C LYS A 389 -3.886 -4.599 -7.374 1.00 0.28 C ATOM 996 O LYS A 389 -4.550 -3.592 -7.129 1.00 0.40 O ATOM 997 CB LYS A 389 -5.093 -6.760 -7.732 1.00 0.32 C ATOM 998 CG LYS A 389 -6.049 -7.522 -8.639 1.00 0.45 C ATOM 999 CD LYS A 389 -5.328 -8.381 -9.662 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.306 -9.065 -10.607 1.00 0.46 C ATOM 1001 NZ LYS A 389 -7.308 -9.897 -9.885 1.00 1.39 N ATOM 0 H LYS A 389 -3.069 -7.113 -9.115 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.039 -5.121 -9.106 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.361 -7.459 -7.328 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.654 -6.361 -6.887 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.694 -8.155 -8.030 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.695 -6.813 -9.157 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.638 -7.762 -10.236 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.730 -9.134 -9.149 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -6.824 -8.310 -11.198 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -5.753 -9.693 -11.306 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.583 -10.704 -10.481 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -6.894 -10.247 -8.998 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -8.148 -9.322 -9.672 1.00 1.39 H new ATOM 1015 N MET A 390 -2.735 -4.868 -6.775 1.00 0.19 N ATOM 1016 CA MET A 390 -2.150 -3.955 -5.802 1.00 0.17 C ATOM 1017 C MET A 390 -1.689 -2.666 -6.481 1.00 0.16 C ATOM 1018 O MET A 390 -1.962 -1.564 -6.003 1.00 0.17 O ATOM 1019 CB MET A 390 -0.964 -4.608 -5.097 1.00 0.15 C ATOM 1020 CG MET A 390 -0.320 -3.699 -4.066 1.00 0.14 C ATOM 1021 SD MET A 390 1.103 -4.442 -3.258 1.00 0.18 S ATOM 1022 CE MET A 390 1.589 -3.102 -2.173 1.00 1.57 C ATOM 0 H MET A 390 -2.187 -5.711 -6.945 1.00 0.19 H new ATOM 0 HA MET A 390 -2.917 -3.716 -5.065 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.296 -5.525 -4.610 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.218 -4.894 -5.839 1.00 0.15 H new ATOM 0 HG2 MET A 390 -0.012 -2.772 -4.550 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.061 -3.434 -3.312 1.00 0.14 H new ATOM 0 HE1 MET A 390 2.582 -3.302 -1.770 1.00 1.57 H new ATOM 0 HE2 MET A 390 1.606 -2.168 -2.734 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.875 -3.020 -1.354 1.00 1.57 H new ATOM 1032 N SER A 391 -0.991 -2.819 -7.597 1.00 0.15 N ATOM 1033 CA SER A 391 -0.465 -1.689 -8.346 1.00 0.17 C ATOM 1034 C SER A 391 -1.601 -0.803 -8.850 1.00 0.19 C ATOM 1035 O SER A 391 -1.484 0.418 -8.863 1.00 0.21 O ATOM 1036 CB SER A 391 0.391 -2.190 -9.516 1.00 0.23 C ATOM 1037 OG SER A 391 1.054 -1.124 -10.175 1.00 1.02 O ATOM 0 H SER A 391 -0.774 -3.727 -8.007 1.00 0.15 H new ATOM 0 HA SER A 391 0.162 -1.091 -7.685 1.00 0.17 H new ATOM 0 HB2 SER A 391 1.127 -2.905 -9.148 1.00 0.23 H new ATOM 0 HB3 SER A 391 -0.241 -2.721 -10.228 1.00 0.23 H new ATOM 0 HG SER A 391 1.591 -1.480 -10.914 1.00 1.02 H new ATOM 1043 N ARG A 392 -2.708 -1.426 -9.238 1.00 0.21 N ATOM 1044 CA ARG A 392 -3.883 -0.696 -9.689 1.00 0.26 C ATOM 1045 C ARG A 392 -4.445 0.151 -8.550 1.00 0.22 C ATOM 1046 O ARG A 392 -4.912 1.270 -8.766 1.00 0.30 O ATOM 1047 CB ARG A 392 -4.898 -1.677 -10.268 1.00 0.38 C ATOM 1048 CG ARG A 392 -6.023 -2.069 -9.354 1.00 1.12 C ATOM 1049 CD ARG A 392 -7.082 -0.987 -9.287 1.00 2.05 C ATOM 1050 NE ARG A 392 -8.387 -1.515 -8.900 1.00 2.61 N ATOM 1051 CZ ARG A 392 -8.814 -1.621 -7.643 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -8.042 -1.232 -6.631 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -10.022 -2.114 -7.407 1.00 4.06 N ATOM 0 H ARG A 392 -2.815 -2.440 -9.248 1.00 0.21 H new ATOM 0 HA ARG A 392 -3.617 -0.001 -10.486 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.324 -1.239 -11.171 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -4.369 -2.581 -10.571 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -6.472 -2.999 -9.704 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.632 -2.261 -8.355 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -6.774 -0.224 -8.572 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -7.163 -0.500 -10.259 1.00 2.05 H new ATOM 0 HE ARG A 392 -9.014 -1.824 -9.643 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -7.115 -0.849 -6.815 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -8.378 -1.317 -5.672 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -10.614 -2.407 -8.184 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -10.359 -2.200 -6.448 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.387 -0.385 -7.338 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.797 0.358 -6.155 1.00 0.17 C ATOM 1069 C ALA A 393 -3.834 1.512 -5.907 1.00 0.12 C ATOM 1070 O ALA A 393 -4.254 2.642 -5.659 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.868 -0.558 -4.945 1.00 0.20 C ATOM 0 H ALA A 393 -4.060 -1.332 -7.149 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.793 0.767 -6.324 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -5.176 0.016 -4.071 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.592 -1.351 -5.131 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.887 -0.997 -4.763 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.539 1.219 -5.996 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.501 2.240 -5.888 1.00 0.10 C ATOM 1079 C LEU A 394 -1.739 3.353 -6.902 1.00 0.11 C ATOM 1080 O LEU A 394 -1.703 4.531 -6.559 1.00 0.12 O ATOM 1081 CB LEU A 394 -0.121 1.613 -6.120 1.00 0.11 C ATOM 1082 CG LEU A 394 0.319 0.600 -5.066 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.525 -0.189 -5.550 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.649 1.312 -3.773 1.00 0.13 C ATOM 0 H LEU A 394 -2.182 0.275 -6.144 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.538 2.666 -4.885 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.121 1.123 -7.094 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.620 2.411 -6.165 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.501 -0.097 -4.892 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.822 -0.905 -4.784 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.268 -0.722 -6.465 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.351 0.494 -5.748 1.00 0.13 H new ATOM 0 HD21 LEU A 394 0.962 0.583 -3.026 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.456 2.024 -3.945 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.233 1.843 -3.415 1.00 0.13 H new ATOM 1096 N ARG A 395 -2.000 2.966 -8.145 1.00 0.12 N ATOM 1097 CA ARG A 395 -2.271 3.917 -9.222 1.00 0.14 C ATOM 1098 C ARG A 395 -3.407 4.868 -8.862 1.00 0.14 C ATOM 1099 O ARG A 395 -3.392 6.038 -9.241 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.620 3.172 -10.509 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.466 3.021 -11.486 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.241 2.383 -10.858 1.00 0.52 C ATOM 1103 NE ARG A 395 0.756 2.039 -11.867 1.00 1.30 N ATOM 1104 CZ ARG A 395 2.031 1.757 -11.604 1.00 1.72 C ATOM 1105 NH1 ARG A 395 2.494 1.815 -10.360 1.00 1.66 N ATOM 1106 NH2 ARG A 395 2.848 1.419 -12.593 1.00 2.64 N ATOM 0 H ARG A 395 -2.030 1.989 -8.436 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.367 4.507 -9.371 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -2.991 2.181 -10.250 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -3.435 3.697 -11.008 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -1.790 2.417 -12.333 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.198 4.002 -11.878 1.00 0.33 H new ATOM 0 HD2 ARG A 395 0.196 3.068 -10.131 1.00 0.52 H new ATOM 0 HD3 ARG A 395 -0.535 1.486 -10.314 1.00 0.52 H new ATOM 0 HE ARG A 395 0.455 2.013 -12.841 1.00 1.30 H new ATOM 0 HH11 ARG A 395 1.871 2.077 -9.596 1.00 1.66 H new ATOM 0 HH12 ARG A 395 3.472 1.597 -10.169 1.00 1.66 H new ATOM 0 HH21 ARG A 395 2.499 1.376 -13.551 1.00 2.64 H new ATOM 0 HH22 ARG A 395 3.825 1.202 -12.396 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.397 4.368 -8.135 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.519 5.198 -7.723 1.00 0.13 C ATOM 1122 C HIS A 396 -5.094 6.106 -6.574 1.00 0.11 C ATOM 1123 O HIS A 396 -5.496 7.266 -6.501 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.713 4.327 -7.321 1.00 0.14 C ATOM 1125 CG HIS A 396 -8.028 5.044 -7.380 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -8.302 5.959 -8.369 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -9.103 4.944 -6.564 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.531 6.388 -8.133 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -10.056 5.801 -7.048 1.00 0.26 N ATOM 0 H HIS A 396 -4.446 3.399 -7.821 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.828 5.821 -8.562 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.754 3.457 -7.976 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.556 3.956 -6.308 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.193 4.309 -5.695 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -10.046 7.119 -8.738 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.985 5.961 -6.658 1.00 0.26 H new ATOM 1137 N TYR A 397 -4.232 5.577 -5.712 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.737 6.312 -4.551 1.00 0.10 C ATOM 1139 C TYR A 397 -2.945 7.544 -4.962 1.00 0.09 C ATOM 1140 O TYR A 397 -2.970 8.561 -4.274 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.858 5.411 -3.682 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.623 4.290 -3.043 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -5.001 4.358 -2.940 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.978 3.168 -2.555 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.723 3.343 -2.369 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.695 2.139 -1.977 1.00 0.24 C ATOM 1147 CZ TYR A 397 -5.070 2.232 -1.886 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.789 1.216 -1.305 1.00 0.30 O ATOM 0 H TYR A 397 -3.858 4.632 -5.797 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.607 6.637 -3.980 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -2.057 4.995 -4.293 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.387 6.012 -2.904 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.518 5.228 -3.317 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.903 3.096 -2.627 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.798 3.414 -2.298 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -3.183 1.266 -1.598 1.00 0.24 H new ATOM 0 HH TYR A 397 -5.904 0.486 -1.949 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.239 7.446 -6.079 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.394 8.541 -6.539 1.00 0.12 C ATOM 1160 C TYR A 398 -2.223 9.797 -6.775 1.00 0.14 C ATOM 1161 O TYR A 398 -1.874 10.883 -6.315 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.665 8.170 -7.836 1.00 0.14 C ATOM 1163 CG TYR A 398 0.122 6.867 -7.799 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.692 6.381 -6.622 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.297 6.125 -8.960 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.406 5.199 -6.608 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.010 4.945 -8.953 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.560 4.485 -7.778 1.00 0.14 C ATOM 1169 OH TYR A 398 2.268 3.307 -7.775 1.00 0.18 O ATOM 0 H TYR A 398 -2.233 6.624 -6.682 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.656 8.733 -5.760 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.399 8.107 -8.639 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.019 8.979 -8.092 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.573 6.939 -5.705 1.00 0.11 H new ATOM 0 HD2 TYR A 398 -0.133 6.479 -9.885 1.00 0.15 H new ATOM 0 HE1 TYR A 398 1.840 4.837 -5.688 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.137 4.383 -9.867 1.00 0.16 H new ATOM 0 HH TYR A 398 2.897 3.305 -7.023 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.332 9.643 -7.486 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.207 10.772 -7.784 1.00 0.19 C ATOM 1181 C LYS A 399 -4.839 11.325 -6.520 1.00 0.19 C ATOM 1182 O LYS A 399 -5.000 12.534 -6.365 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.307 10.372 -8.753 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.829 10.170 -10.183 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.638 8.700 -10.502 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.958 7.954 -10.405 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.820 6.519 -10.764 1.00 0.71 N ATOM 0 H LYS A 399 -3.647 8.751 -7.867 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.587 11.543 -8.242 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.769 9.449 -8.401 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.081 11.139 -8.745 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.552 10.602 -10.874 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.889 10.701 -10.332 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.226 8.591 -11.505 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.916 8.264 -9.812 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -6.346 8.037 -9.390 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.688 8.423 -11.065 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.639 5.990 -10.402 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -5.775 6.423 -11.799 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.949 6.138 -10.343 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.180 10.431 -5.612 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.890 10.804 -4.406 1.00 0.18 C ATOM 1203 C LEU A 400 -4.924 11.273 -3.328 1.00 0.18 C ATOM 1204 O LEU A 400 -5.259 11.299 -2.146 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.722 9.617 -3.945 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.573 9.008 -5.058 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.248 7.739 -4.593 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.601 10.010 -5.558 1.00 0.21 C ATOM 0 H LEU A 400 -4.975 9.435 -5.689 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.555 11.643 -4.612 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.059 8.851 -3.544 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.374 9.933 -3.130 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.911 8.753 -5.886 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.847 7.327 -5.405 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.492 7.013 -4.295 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.893 7.960 -3.743 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.196 9.556 -6.350 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.254 10.302 -4.736 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.091 10.891 -5.947 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.719 11.642 -3.762 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.718 12.263 -2.890 1.00 0.20 C ATOM 1222 C ASN A 401 -2.283 11.335 -1.765 1.00 0.17 C ATOM 1223 O ASN A 401 -1.965 11.785 -0.662 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.257 13.562 -2.292 1.00 0.27 C ATOM 1225 CG ASN A 401 -3.251 14.731 -3.248 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -2.961 15.863 -2.859 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -3.606 14.484 -4.488 1.00 1.21 N ATOM 0 H ASN A 401 -3.408 11.520 -4.726 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.848 12.476 -3.511 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.277 13.394 -1.947 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -2.662 13.820 -1.416 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -3.649 15.244 -5.167 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -3.839 13.532 -4.772 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.266 10.047 -2.044 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.966 9.053 -1.039 1.00 0.10 C ATOM 1236 C ILE A 402 -0.531 8.556 -1.151 1.00 0.09 C ATOM 1237 O ILE A 402 0.285 8.787 -0.263 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.955 7.891 -1.189 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.363 8.436 -1.019 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.686 6.790 -0.183 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.422 7.487 -1.475 1.00 0.13 C ATOM 0 H ILE A 402 -2.459 9.664 -2.969 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.068 9.504 -0.052 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.837 7.449 -2.178 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.528 8.676 0.031 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.455 9.368 -1.577 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.408 5.985 -0.322 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.678 6.402 -0.329 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.778 7.189 0.827 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.403 7.938 -1.326 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.281 7.266 -2.533 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.356 6.564 -0.899 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.224 7.889 -2.247 1.00 0.07 N ATOM 1254 CA ILE A 403 1.114 7.385 -2.477 1.00 0.07 C ATOM 1255 C ILE A 403 1.634 7.936 -3.797 1.00 0.08 C ATOM 1256 O ILE A 403 0.856 8.425 -4.605 1.00 0.10 O ATOM 1257 CB ILE A 403 1.145 5.835 -2.497 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.532 5.259 -1.225 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.566 5.321 -2.658 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.592 3.751 -1.188 1.00 0.11 C ATOM 0 H ILE A 403 -0.887 7.684 -2.994 1.00 0.07 H new ATOM 0 HA ILE A 403 1.753 7.714 -1.657 1.00 0.07 H new ATOM 0 HB ILE A 403 0.553 5.508 -3.352 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.056 5.662 -0.358 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.507 5.580 -1.148 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.560 4.231 -2.669 1.00 0.14 H new ATOM 0 HG22 ILE A 403 2.983 5.691 -3.595 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.176 5.672 -1.826 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.143 3.392 -0.262 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.045 3.344 -2.039 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.632 3.427 -1.236 1.00 0.11 H new ATOM 1272 N ARG A 404 2.940 7.904 -3.992 1.00 0.10 N ATOM 1273 CA ARG A 404 3.530 8.319 -5.251 1.00 0.13 C ATOM 1274 C ARG A 404 4.559 7.303 -5.707 1.00 0.14 C ATOM 1275 O ARG A 404 4.953 6.413 -4.952 1.00 0.16 O ATOM 1276 CB ARG A 404 4.193 9.687 -5.111 1.00 0.17 C ATOM 1277 CG ARG A 404 5.650 9.613 -4.719 1.00 0.25 C ATOM 1278 CD ARG A 404 6.284 10.985 -4.639 1.00 0.36 C ATOM 1279 NE ARG A 404 7.740 10.908 -4.604 1.00 1.14 N ATOM 1280 CZ ARG A 404 8.551 11.930 -4.855 1.00 1.56 C ATOM 1281 NH1 ARG A 404 8.056 13.109 -5.216 1.00 1.63 N ATOM 1282 NH2 ARG A 404 9.862 11.763 -4.769 1.00 2.39 N ATOM 0 H ARG A 404 3.614 7.594 -3.292 1.00 0.10 H new ATOM 0 HA ARG A 404 2.734 8.387 -5.993 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.106 10.223 -6.056 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.653 10.269 -4.364 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.741 9.114 -3.754 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.191 9.005 -5.445 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.972 11.580 -5.497 1.00 0.36 H new ATOM 0 HD3 ARG A 404 5.926 11.499 -3.747 1.00 0.36 H new ATOM 0 HE ARG A 404 8.164 10.010 -4.371 1.00 1.14 H new ATOM 0 HH11 ARG A 404 7.047 13.234 -5.302 1.00 1.63 H new ATOM 0 HH12 ARG A 404 8.685 13.889 -5.407 1.00 1.63 H new ATOM 0 HH21 ARG A 404 10.244 10.853 -4.511 1.00 2.39 H new ATOM 0 HH22 ARG A 404 10.489 12.544 -4.961 1.00 2.39 H new ATOM 1296 N LYS A 405 4.995 7.457 -6.937 1.00 0.17 N ATOM 1297 CA LYS A 405 5.980 6.581 -7.513 1.00 0.19 C ATOM 1298 C LYS A 405 7.281 7.331 -7.714 1.00 0.22 C ATOM 1299 O LYS A 405 7.285 8.461 -8.200 1.00 0.27 O ATOM 1300 CB LYS A 405 5.471 6.062 -8.847 1.00 0.22 C ATOM 1301 CG LYS A 405 6.306 4.936 -9.407 1.00 0.34 C ATOM 1302 CD LYS A 405 6.167 3.693 -8.571 1.00 0.29 C ATOM 1303 CE LYS A 405 7.139 2.617 -9.007 1.00 0.23 C ATOM 1304 NZ LYS A 405 7.150 2.424 -10.482 1.00 1.08 N ATOM 0 H LYS A 405 4.674 8.195 -7.564 1.00 0.17 H new ATOM 0 HA LYS A 405 6.157 5.741 -6.841 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.444 5.718 -8.727 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.451 6.882 -9.565 1.00 0.22 H new ATOM 0 HG2 LYS A 405 5.999 4.726 -10.431 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.353 5.238 -9.444 1.00 0.34 H new ATOM 0 HD2 LYS A 405 6.340 3.937 -7.523 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.147 3.315 -8.646 1.00 0.29 H new ATOM 0 HE2 LYS A 405 8.142 2.880 -8.671 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.876 1.677 -8.523 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 7.683 1.562 -10.715 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 6.173 2.331 -10.827 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 7.601 3.244 -10.936 1.00 1.08 H new ATOM 1318 N GLU A 406 8.377 6.709 -7.331 1.00 0.23 N ATOM 1319 CA GLU A 406 9.673 7.311 -7.488 1.00 0.28 C ATOM 1320 C GLU A 406 10.164 7.159 -8.917 1.00 0.34 C ATOM 1321 O GLU A 406 10.005 6.108 -9.546 1.00 0.43 O ATOM 1322 CB GLU A 406 10.674 6.676 -6.545 1.00 0.29 C ATOM 1323 CG GLU A 406 10.251 6.690 -5.094 1.00 0.63 C ATOM 1324 CD GLU A 406 10.214 8.092 -4.515 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.281 8.622 -4.152 1.00 2.42 O ATOM 1326 OE2 GLU A 406 9.108 8.667 -4.414 1.00 2.32 O ATOM 0 H GLU A 406 8.389 5.781 -6.907 1.00 0.23 H new ATOM 0 HA GLU A 406 9.580 8.371 -7.252 1.00 0.28 H new ATOM 0 HB2 GLU A 406 10.843 5.644 -6.853 1.00 0.29 H new ATOM 0 HB3 GLU A 406 11.627 7.197 -6.639 1.00 0.29 H new ATOM 0 HG2 GLU A 406 9.264 6.236 -5.002 1.00 0.63 H new ATOM 0 HG3 GLU A 406 10.940 6.078 -4.512 1.00 0.63 H new ATOM 1333 N PRO A 407 10.781 8.215 -9.421 1.00 0.41 N ATOM 1334 CA PRO A 407 11.271 8.284 -10.783 1.00 0.51 C ATOM 1335 C PRO A 407 12.456 7.352 -11.006 1.00 0.52 C ATOM 1336 O PRO A 407 13.537 7.569 -10.458 1.00 0.54 O ATOM 1337 CB PRO A 407 11.674 9.746 -10.968 1.00 0.61 C ATOM 1338 CG PRO A 407 11.713 10.364 -9.610 1.00 0.58 C ATOM 1339 CD PRO A 407 11.105 9.397 -8.634 1.00 0.45 C ATOM 0 HA PRO A 407 10.518 7.965 -11.503 1.00 0.51 H new ATOM 0 HB2 PRO A 407 12.647 9.819 -11.453 1.00 0.61 H new ATOM 0 HB3 PRO A 407 10.960 10.265 -11.607 1.00 0.61 H new ATOM 0 HG2 PRO A 407 12.740 10.594 -9.327 1.00 0.58 H new ATOM 0 HG3 PRO A 407 11.163 11.305 -9.605 1.00 0.58 H new ATOM 0 HD2 PRO A 407 11.802 9.157 -7.831 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.214 9.816 -8.167 1.00 0.45 H new ATOM 1347 N GLY A 408 12.251 6.318 -11.806 1.00 0.54 N ATOM 1348 CA GLY A 408 13.314 5.370 -12.079 1.00 0.58 C ATOM 1349 C GLY A 408 13.298 4.184 -11.135 1.00 0.58 C ATOM 1350 O GLY A 408 13.878 3.140 -11.429 1.00 0.86 O ATOM 0 H GLY A 408 11.367 6.116 -12.273 1.00 0.54 H new ATOM 0 HA2 GLY A 408 13.222 5.014 -13.105 1.00 0.58 H new ATOM 0 HA3 GLY A 408 14.276 5.877 -12.002 1.00 0.58 H new ATOM 1354 N GLN A 409 12.631 4.341 -9.999 1.00 0.47 N ATOM 1355 CA GLN A 409 12.536 3.262 -9.026 1.00 0.51 C ATOM 1356 C GLN A 409 11.515 2.233 -9.456 1.00 0.48 C ATOM 1357 O GLN A 409 10.457 2.565 -9.988 1.00 0.61 O ATOM 1358 CB GLN A 409 12.152 3.784 -7.652 1.00 0.63 C ATOM 1359 CG GLN A 409 13.287 4.460 -6.903 1.00 0.45 C ATOM 1360 CD GLN A 409 14.321 3.456 -6.431 1.00 0.71 C ATOM 1361 OE1 GLN A 409 15.291 3.174 -7.121 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.090 2.882 -5.260 1.00 0.45 N ATOM 0 H GLN A 409 12.151 5.200 -9.730 1.00 0.47 H new ATOM 0 HA GLN A 409 13.522 2.800 -8.971 1.00 0.51 H new ATOM 0 HB2 GLN A 409 11.331 4.493 -7.761 1.00 0.63 H new ATOM 0 HB3 GLN A 409 11.779 2.954 -7.052 1.00 0.63 H new ATOM 0 HG2 GLN A 409 13.763 5.196 -7.550 1.00 0.45 H new ATOM 0 HG3 GLN A 409 12.887 5.001 -6.046 1.00 0.45 H new ATOM 0 HE21 GLN A 409 13.269 3.146 -4.716 1.00 0.45 H new ATOM 0 HE22 GLN A 409 14.733 2.176 -4.902 1.00 0.45 H new ATOM 1371 N ARG A 410 11.841 0.985 -9.185 1.00 0.41 N ATOM 1372 CA ARG A 410 11.012 -0.132 -9.574 1.00 0.39 C ATOM 1373 C ARG A 410 9.835 -0.296 -8.635 1.00 0.31 C ATOM 1374 O ARG A 410 8.687 -0.082 -9.008 1.00 0.42 O ATOM 1375 CB ARG A 410 11.846 -1.413 -9.584 1.00 0.47 C ATOM 1376 CG ARG A 410 13.209 -1.267 -10.248 1.00 0.86 C ATOM 1377 CD ARG A 410 14.348 -1.230 -9.234 1.00 1.11 C ATOM 1378 NE ARG A 410 14.799 0.131 -8.912 1.00 1.27 N ATOM 1379 CZ ARG A 410 15.642 0.827 -9.692 1.00 2.04 C ATOM 1380 NH1 ARG A 410 16.087 0.305 -10.829 1.00 2.65 N ATOM 1381 NH2 ARG A 410 16.054 2.032 -9.332 1.00 2.43 N ATOM 0 H ARG A 410 12.691 0.719 -8.688 1.00 0.41 H new ATOM 0 HA ARG A 410 10.624 0.064 -10.574 1.00 0.39 H new ATOM 0 HB2 ARG A 410 11.989 -1.748 -8.557 1.00 0.47 H new ATOM 0 HB3 ARG A 410 11.286 -2.194 -10.098 1.00 0.47 H new ATOM 0 HG2 ARG A 410 13.366 -2.097 -10.936 1.00 0.86 H new ATOM 0 HG3 ARG A 410 13.225 -0.353 -10.842 1.00 0.86 H new ATOM 0 HD2 ARG A 410 14.025 -1.724 -8.318 1.00 1.11 H new ATOM 0 HD3 ARG A 410 15.190 -1.801 -9.624 1.00 1.11 H new ATOM 0 HE ARG A 410 14.456 0.567 -8.056 1.00 1.27 H new ATOM 0 HH11 ARG A 410 15.789 -0.628 -11.113 1.00 2.65 H new ATOM 0 HH12 ARG A 410 16.727 0.837 -11.418 1.00 2.65 H new ATOM 0 HH21 ARG A 410 15.731 2.440 -8.455 1.00 2.43 H new ATOM 0 HH22 ARG A 410 16.694 2.552 -9.932 1.00 2.43 H new ATOM 1395 N LEU A 411 10.133 -0.663 -7.410 1.00 0.21 N ATOM 1396 CA LEU A 411 9.109 -0.968 -6.439 1.00 0.14 C ATOM 1397 C LEU A 411 9.215 -0.033 -5.264 1.00 0.11 C ATOM 1398 O LEU A 411 8.887 -0.379 -4.136 1.00 0.12 O ATOM 1399 CB LEU A 411 9.232 -2.419 -6.006 1.00 0.11 C ATOM 1400 CG LEU A 411 8.886 -3.414 -7.105 1.00 0.11 C ATOM 1401 CD1 LEU A 411 9.292 -4.813 -6.712 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.404 -3.345 -7.403 1.00 0.16 C ATOM 0 H LEU A 411 11.086 -0.758 -7.060 1.00 0.21 H new ATOM 0 HA LEU A 411 8.126 -0.828 -6.888 1.00 0.14 H new ATOM 0 HB2 LEU A 411 10.252 -2.603 -5.668 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.577 -2.591 -5.152 1.00 0.11 H new ATOM 0 HG LEU A 411 9.440 -3.152 -8.006 1.00 0.11 H new ATOM 0 HD11 LEU A 411 9.034 -5.505 -7.513 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.367 -4.844 -6.537 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.768 -5.102 -5.801 1.00 0.15 H new ATOM 0 HD21 LEU A 411 7.158 -4.058 -8.190 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.840 -3.589 -6.503 1.00 0.16 H new ATOM 0 HD23 LEU A 411 7.145 -2.338 -7.731 1.00 0.16 H new ATOM 1414 N LEU A 412 9.701 1.153 -5.538 1.00 0.13 N ATOM 1415 CA LEU A 412 9.782 2.177 -4.516 1.00 0.11 C ATOM 1416 C LEU A 412 8.548 3.054 -4.601 1.00 0.10 C ATOM 1417 O LEU A 412 8.183 3.518 -5.685 1.00 0.11 O ATOM 1418 CB LEU A 412 11.022 3.032 -4.725 1.00 0.13 C ATOM 1419 CG LEU A 412 11.620 3.721 -3.489 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.572 4.460 -2.687 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.327 2.713 -2.618 1.00 0.16 C ATOM 0 H LEU A 412 10.046 1.436 -6.455 1.00 0.13 H new ATOM 0 HA LEU A 412 9.841 1.704 -3.536 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.795 2.403 -5.167 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.781 3.803 -5.457 1.00 0.13 H new ATOM 0 HG LEU A 412 12.340 4.458 -3.845 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.040 4.931 -1.823 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.109 5.225 -3.311 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.810 3.757 -2.349 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.746 3.216 -1.746 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.617 1.952 -2.292 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.130 2.241 -3.185 1.00 0.16 H new ATOM 1433 N PHE A 413 7.919 3.285 -3.469 1.00 0.10 N ATOM 1434 CA PHE A 413 6.745 4.119 -3.417 1.00 0.11 C ATOM 1435 C PHE A 413 6.826 5.001 -2.192 1.00 0.12 C ATOM 1436 O PHE A 413 7.158 4.535 -1.101 1.00 0.19 O ATOM 1437 CB PHE A 413 5.471 3.278 -3.381 1.00 0.12 C ATOM 1438 CG PHE A 413 5.376 2.282 -4.498 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.955 1.036 -4.368 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.718 2.591 -5.674 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.882 0.112 -5.390 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.642 1.670 -6.697 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.225 0.431 -6.557 1.00 0.11 C ATOM 0 H PHE A 413 8.206 2.902 -2.568 1.00 0.10 H new ATOM 0 HA PHE A 413 6.707 4.734 -4.316 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.422 2.749 -2.429 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.607 3.941 -3.422 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.472 0.781 -3.455 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.260 3.562 -5.792 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.339 -0.860 -5.275 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.124 1.921 -7.611 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.167 -0.289 -7.360 1.00 0.11 H new ATOM 1453 N ARG A 414 6.561 6.271 -2.374 1.00 0.10 N ATOM 1454 CA ARG A 414 6.616 7.205 -1.305 1.00 0.12 C ATOM 1455 C ARG A 414 5.235 7.712 -1.000 1.00 0.11 C ATOM 1456 O ARG A 414 4.509 8.154 -1.887 1.00 0.15 O ATOM 1457 CB ARG A 414 7.541 8.344 -1.674 1.00 0.20 C ATOM 1458 CG ARG A 414 7.425 9.521 -0.750 1.00 0.35 C ATOM 1459 CD ARG A 414 8.586 10.461 -0.912 1.00 0.37 C ATOM 1460 NE ARG A 414 8.590 11.513 0.097 1.00 1.21 N ATOM 1461 CZ ARG A 414 9.350 12.600 0.025 1.00 1.46 C ATOM 1462 NH1 ARG A 414 10.159 12.774 -1.015 1.00 1.06 N ATOM 1463 NH2 ARG A 414 9.305 13.502 0.999 1.00 2.58 N ATOM 0 H ARG A 414 6.302 6.675 -3.274 1.00 0.10 H new ATOM 0 HA ARG A 414 7.006 6.718 -0.412 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.570 7.985 -1.667 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.322 8.666 -2.692 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.494 10.052 -0.950 1.00 0.35 H new ATOM 0 HG3 ARG A 414 7.378 9.172 0.282 1.00 0.35 H new ATOM 0 HD2 ARG A 414 9.518 9.898 -0.851 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.550 10.912 -1.904 1.00 0.37 H new ATOM 0 HE ARG A 414 7.975 11.409 0.904 1.00 1.21 H new ATOM 0 HH11 ARG A 414 10.195 12.074 -1.756 1.00 1.06 H new ATOM 0 HH12 ARG A 414 10.744 13.608 -1.073 1.00 1.06 H new ATOM 0 HH21 ARG A 414 8.688 13.359 1.799 1.00 2.58 H new ATOM 0 HH22 ARG A 414 9.887 14.338 0.947 1.00 2.58 H new ATOM 1477 N PHE A 415 4.874 7.624 0.251 1.00 0.10 N ATOM 1478 CA PHE A 415 3.588 8.103 0.700 1.00 0.09 C ATOM 1479 C PHE A 415 3.535 9.618 0.573 1.00 0.11 C ATOM 1480 O PHE A 415 4.242 10.339 1.279 1.00 0.14 O ATOM 1481 CB PHE A 415 3.328 7.674 2.145 1.00 0.10 C ATOM 1482 CG PHE A 415 2.591 6.378 2.280 1.00 0.10 C ATOM 1483 CD1 PHE A 415 1.204 6.357 2.262 1.00 0.11 C ATOM 1484 CD2 PHE A 415 3.275 5.184 2.434 1.00 0.10 C ATOM 1485 CE1 PHE A 415 0.516 5.169 2.390 1.00 0.13 C ATOM 1486 CE2 PHE A 415 2.599 3.997 2.563 1.00 0.11 C ATOM 1487 CZ PHE A 415 1.218 3.984 2.538 1.00 0.12 C ATOM 0 H PHE A 415 5.456 7.222 0.986 1.00 0.10 H new ATOM 0 HA PHE A 415 2.809 7.667 0.075 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.283 7.591 2.664 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.759 8.456 2.647 1.00 0.10 H new ATOM 0 HD1 PHE A 415 0.657 7.281 2.146 1.00 0.11 H new ATOM 0 HD2 PHE A 415 4.355 5.187 2.453 1.00 0.10 H new ATOM 0 HE1 PHE A 415 -0.564 5.162 2.375 1.00 0.13 H new ATOM 0 HE2 PHE A 415 3.146 3.074 2.684 1.00 0.11 H new ATOM 0 HZ PHE A 415 0.685 3.049 2.634 1.00 0.12 H new ATOM 1497 N MET A 416 2.727 10.079 -0.378 1.00 0.11 N ATOM 1498 CA MET A 416 2.503 11.504 -0.596 1.00 0.15 C ATOM 1499 C MET A 416 2.060 12.169 0.696 1.00 0.17 C ATOM 1500 O MET A 416 2.397 13.322 0.970 1.00 0.23 O ATOM 1501 CB MET A 416 1.416 11.726 -1.648 1.00 0.15 C ATOM 1502 CG MET A 416 1.791 11.339 -3.060 1.00 0.24 C ATOM 1503 SD MET A 416 0.625 12.008 -4.267 1.00 1.41 S ATOM 1504 CE MET A 416 1.305 11.377 -5.797 1.00 1.47 C ATOM 0 H MET A 416 2.210 9.476 -1.018 1.00 0.11 H new ATOM 0 HA MET A 416 3.441 11.939 -0.941 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.531 11.159 -1.357 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.137 12.780 -1.640 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.794 11.702 -3.283 1.00 0.24 H new ATOM 0 HG3 MET A 416 1.819 10.253 -3.144 1.00 0.24 H new ATOM 0 HE1 MET A 416 0.593 11.539 -6.606 1.00 1.47 H new ATOM 0 HE2 MET A 416 2.236 11.897 -6.023 1.00 1.47 H new ATOM 0 HE3 MET A 416 1.501 10.310 -5.695 1.00 1.47 H new ATOM 1514 N LYS A 417 1.273 11.437 1.462 1.00 0.16 N ATOM 1515 CA LYS A 417 0.785 11.901 2.740 1.00 0.21 C ATOM 1516 C LYS A 417 0.798 10.765 3.734 1.00 0.21 C ATOM 1517 O LYS A 417 1.075 9.620 3.383 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.639 12.430 2.612 1.00 0.29 C ATOM 1519 CG LYS A 417 -0.747 13.754 1.896 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.143 14.318 2.033 1.00 0.54 C ATOM 1521 CE LYS A 417 -2.250 15.709 1.430 1.00 0.84 C ATOM 1522 NZ LYS A 417 -1.352 16.683 2.115 1.00 1.36 N ATOM 0 H LYS A 417 0.955 10.501 1.211 1.00 0.16 H new ATOM 0 HA LYS A 417 1.435 12.705 3.083 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.242 11.693 2.081 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.067 12.533 3.609 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.023 14.457 2.308 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.502 13.625 0.842 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -2.854 13.653 1.542 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -2.418 14.356 3.087 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -1.998 15.666 0.370 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -3.281 16.056 1.498 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -1.563 17.645 1.780 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -1.505 16.633 3.143 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -0.361 16.452 1.900 1.00 1.36 H new ATOM 1536 N THR A 418 0.497 11.090 4.968 1.00 0.24 N ATOM 1537 CA THR A 418 0.336 10.092 5.991 1.00 0.24 C ATOM 1538 C THR A 418 -1.144 9.874 6.243 1.00 0.26 C ATOM 1539 O THR A 418 -1.945 10.753 5.933 1.00 0.28 O ATOM 1540 CB THR A 418 1.043 10.521 7.279 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.658 11.859 7.617 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.545 10.443 7.088 1.00 0.22 C ATOM 0 H THR A 418 0.358 12.049 5.288 1.00 0.24 H new ATOM 0 HA THR A 418 0.788 9.158 5.658 1.00 0.24 H new ATOM 0 HB THR A 418 0.754 9.853 8.091 1.00 0.26 H new ATOM 0 HG1 THR A 418 1.110 12.131 8.443 1.00 0.35 H new ATOM 0 HG21 THR A 418 3.045 10.749 8.007 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.828 9.419 6.845 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.843 11.105 6.275 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.536 8.713 6.785 1.00 0.25 N ATOM 1551 CA PRO A 419 -2.949 8.336 6.932 1.00 0.28 C ATOM 1552 C PRO A 419 -3.808 9.451 7.519 1.00 0.31 C ATOM 1553 O PRO A 419 -4.943 9.656 7.097 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.879 7.133 7.866 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.570 6.512 7.532 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.638 7.664 7.303 1.00 0.25 C ATOM 0 HA PRO A 419 -3.423 8.124 5.974 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -2.925 7.434 8.913 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.706 6.444 7.696 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.217 5.875 8.343 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.647 5.884 6.644 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.144 7.973 8.224 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.146 7.414 6.589 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.238 10.191 8.459 1.00 0.35 N ATOM 1565 CA ASP A 420 -3.927 11.315 9.086 1.00 0.42 C ATOM 1566 C ASP A 420 -4.353 12.348 8.046 1.00 0.43 C ATOM 1567 O ASP A 420 -5.502 12.789 8.027 1.00 0.48 O ATOM 1568 CB ASP A 420 -3.012 11.968 10.125 1.00 0.49 C ATOM 1569 CG ASP A 420 -3.657 13.145 10.826 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -4.453 12.919 11.758 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -3.348 14.303 10.471 1.00 0.72 O ATOM 0 H ASP A 420 -2.293 10.033 8.808 1.00 0.35 H new ATOM 0 HA ASP A 420 -4.824 10.937 9.576 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -2.725 11.223 10.867 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -2.096 12.301 9.636 1.00 0.49 H new ATOM 1576 N GLU A 421 -3.427 12.723 7.175 1.00 0.42 N ATOM 1577 CA GLU A 421 -3.719 13.659 6.103 1.00 0.45 C ATOM 1578 C GLU A 421 -4.553 13.001 5.008 1.00 0.42 C ATOM 1579 O GLU A 421 -5.441 13.623 4.429 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.426 14.197 5.498 1.00 0.49 C ATOM 1581 CG GLU A 421 -1.757 15.288 6.315 1.00 0.81 C ATOM 1582 CD GLU A 421 -0.878 16.172 5.456 1.00 1.60 C ATOM 1583 OE1 GLU A 421 -1.424 17.073 4.778 1.00 2.17 O ATOM 1584 OE2 GLU A 421 0.354 15.970 5.430 1.00 2.21 O ATOM 0 H GLU A 421 -2.463 12.390 7.192 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.291 14.482 6.532 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -1.726 13.371 5.375 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -2.639 14.585 4.502 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -2.519 15.896 6.803 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.157 14.835 7.104 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.260 11.741 4.733 1.00 0.34 N ATOM 1592 CA ILE A 422 -4.919 11.008 3.659 1.00 0.33 C ATOM 1593 C ILE A 422 -6.409 10.803 3.945 1.00 0.36 C ATOM 1594 O ILE A 422 -7.251 10.895 3.047 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.245 9.637 3.449 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -2.770 9.822 3.090 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -4.963 8.844 2.378 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.056 8.528 2.762 1.00 0.27 C ATOM 0 H ILE A 422 -3.563 11.198 5.243 1.00 0.34 H new ATOM 0 HA ILE A 422 -4.822 11.606 2.753 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.306 9.075 4.381 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.695 10.495 2.236 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.261 10.307 3.923 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.470 7.881 2.247 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -5.999 8.684 2.677 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -4.937 9.396 1.438 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.015 8.739 2.518 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.099 7.861 3.623 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.540 8.052 1.909 1.00 0.27 H new ATOM 1610 N MET A 423 -6.728 10.542 5.202 1.00 0.42 N ATOM 1611 CA MET A 423 -8.090 10.269 5.618 1.00 0.51 C ATOM 1612 C MET A 423 -8.974 11.512 5.635 1.00 0.58 C ATOM 1613 O MET A 423 -10.108 11.467 6.105 1.00 0.71 O ATOM 1614 CB MET A 423 -8.070 9.592 6.972 1.00 0.58 C ATOM 1615 CG MET A 423 -7.644 8.148 6.851 1.00 0.58 C ATOM 1616 SD MET A 423 -9.000 7.066 6.360 1.00 0.90 S ATOM 1617 CE MET A 423 -8.177 5.475 6.353 1.00 2.01 C ATOM 0 H MET A 423 -6.048 10.514 5.962 1.00 0.42 H new ATOM 0 HA MET A 423 -8.536 9.604 4.878 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.387 10.121 7.637 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.061 9.646 7.424 1.00 0.58 H new ATOM 0 HG2 MET A 423 -6.839 8.070 6.120 1.00 0.58 H new ATOM 0 HG3 MET A 423 -7.242 7.810 7.806 1.00 0.58 H new ATOM 0 HE1 MET A 423 -8.169 5.074 5.340 1.00 2.01 H new ATOM 0 HE2 MET A 423 -7.152 5.594 6.704 1.00 2.01 H new ATOM 0 HE3 MET A 423 -8.708 4.788 7.011 1.00 2.01 H new ATOM 1627 N SER A 424 -8.462 12.616 5.110 1.00 0.59 N ATOM 1628 CA SER A 424 -9.208 13.847 5.015 1.00 0.72 C ATOM 1629 C SER A 424 -10.157 13.837 3.809 1.00 0.67 C ATOM 1630 O SER A 424 -10.426 14.877 3.206 1.00 1.09 O ATOM 1631 CB SER A 424 -8.216 14.988 4.890 1.00 0.92 C ATOM 1632 OG SER A 424 -7.240 14.925 5.918 1.00 1.57 O ATOM 0 H SER A 424 -7.514 12.676 4.739 1.00 0.59 H new ATOM 0 HA SER A 424 -9.823 13.967 5.907 1.00 0.72 H new ATOM 0 HB2 SER A 424 -7.728 14.946 3.916 1.00 0.92 H new ATOM 0 HB3 SER A 424 -8.743 15.941 4.941 1.00 0.92 H new ATOM 0 HG SER A 424 -6.372 14.685 5.531 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.654 12.658 3.454 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.591 12.547 2.352 1.00 0.42 C ATOM 1640 C GLY A 425 -10.978 11.929 1.112 1.00 0.37 C ATOM 1641 O GLY A 425 -11.695 11.440 0.242 1.00 0.50 O ATOM 0 H GLY A 425 -10.424 11.775 3.911 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.444 11.946 2.667 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -11.973 13.538 2.106 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.652 11.930 1.039 1.00 0.38 N ATOM 1646 CA ARG A 426 -8.944 11.432 -0.138 1.00 0.36 C ATOM 1647 C ARG A 426 -9.195 9.939 -0.362 1.00 0.33 C ATOM 1648 O ARG A 426 -9.469 9.511 -1.480 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.450 11.715 0.010 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.132 13.184 0.060 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.196 13.783 -1.324 1.00 0.92 C ATOM 1652 NE ARG A 426 -6.886 15.211 -1.325 1.00 1.37 N ATOM 1653 CZ ARG A 426 -6.999 16.001 -2.392 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -7.450 15.517 -3.543 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -6.675 17.281 -2.302 1.00 2.67 N ATOM 0 H ARG A 426 -9.043 12.271 1.782 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.326 11.954 -1.015 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.084 11.239 0.919 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -6.916 11.261 -0.825 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -7.837 13.693 0.717 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.138 13.333 0.482 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.496 13.261 -1.976 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -8.192 13.629 -1.738 1.00 0.92 H new ATOM 0 HE ARG A 426 -6.562 15.630 -0.453 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -7.713 14.534 -3.615 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -7.534 16.128 -4.355 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -6.339 17.661 -1.417 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -6.761 17.887 -3.118 1.00 2.67 H new ATOM 1669 N THR A 427 -9.107 9.160 0.705 1.00 0.33 N ATOM 1670 CA THR A 427 -9.376 7.723 0.642 1.00 0.37 C ATOM 1671 C THR A 427 -10.664 7.386 1.392 1.00 0.43 C ATOM 1672 O THR A 427 -10.870 6.260 1.849 1.00 0.58 O ATOM 1673 CB THR A 427 -8.188 6.921 1.216 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.453 5.522 1.206 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.881 7.354 2.624 1.00 0.41 C ATOM 0 H THR A 427 -8.850 9.497 1.633 1.00 0.33 H new ATOM 0 HA THR A 427 -9.503 7.443 -0.404 1.00 0.37 H new ATOM 0 HB THR A 427 -7.327 7.122 0.578 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.334 5.353 1.600 1.00 1.24 H new ATOM 0 HG21 THR A 427 -7.041 6.775 3.008 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.625 8.414 2.631 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.754 7.187 3.255 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.533 8.377 1.491 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.817 8.223 2.167 1.00 0.62 C ATOM 1685 C ASP A 428 -13.695 7.231 1.418 1.00 0.61 C ATOM 1686 O ASP A 428 -14.289 6.333 2.009 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.521 9.579 2.249 1.00 0.74 C ATOM 1688 CG ASP A 428 -14.842 9.527 2.990 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -15.856 9.110 2.392 1.00 1.75 O ATOM 1690 OD2 ASP A 428 -14.879 9.938 4.164 1.00 1.63 O ATOM 0 H ASP A 428 -11.373 9.309 1.108 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.642 7.844 3.174 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -12.863 10.293 2.745 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.693 9.952 1.240 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.751 7.391 0.109 1.00 0.54 N ATOM 1696 CA ARG A 429 -14.562 6.528 -0.733 1.00 0.65 C ATOM 1697 C ARG A 429 -13.823 5.242 -1.000 1.00 0.55 C ATOM 1698 O ARG A 429 -14.416 4.172 -1.089 1.00 0.66 O ATOM 1699 CB ARG A 429 -14.862 7.216 -2.053 1.00 0.81 C ATOM 1700 CG ARG A 429 -15.179 8.682 -1.900 1.00 0.98 C ATOM 1701 CD ARG A 429 -15.623 9.290 -3.217 1.00 1.12 C ATOM 1702 NE ARG A 429 -16.553 10.398 -3.015 1.00 1.64 N ATOM 1703 CZ ARG A 429 -16.486 11.561 -3.656 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -15.506 11.797 -4.522 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -17.401 12.493 -3.430 1.00 3.05 N ATOM 0 H ARG A 429 -13.242 8.115 -0.398 1.00 0.54 H new ATOM 0 HA ARG A 429 -15.499 6.315 -0.219 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -14.005 7.104 -2.717 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -15.704 6.717 -2.532 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -15.964 8.811 -1.155 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -14.300 9.210 -1.531 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -14.751 9.643 -3.767 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -16.098 8.524 -3.830 1.00 1.12 H new ATOM 0 HE ARG A 429 -17.304 10.271 -2.337 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -14.799 11.084 -4.699 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -15.461 12.692 -5.010 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -18.155 12.317 -2.765 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -17.351 13.386 -3.921 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.512 5.369 -1.064 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.612 4.277 -1.421 1.00 0.36 C ATOM 1721 C LEU A 430 -11.881 3.014 -0.627 1.00 0.39 C ATOM 1722 O LEU A 430 -11.720 1.901 -1.131 1.00 0.45 O ATOM 1723 CB LEU A 430 -10.192 4.712 -1.158 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.432 5.222 -2.357 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -8.126 5.768 -1.876 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -9.196 4.111 -3.358 1.00 0.56 C ATOM 0 H LEU A 430 -12.029 6.246 -0.867 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.777 4.050 -2.474 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -10.206 5.495 -0.400 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.645 3.869 -0.736 1.00 0.31 H new ATOM 0 HG LEU A 430 -10.010 5.999 -2.858 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.554 6.145 -2.724 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.308 6.580 -1.172 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.562 4.978 -1.380 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.646 4.503 -4.214 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.618 3.315 -2.889 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -10.154 3.714 -3.693 1.00 0.56 H new ATOM 1738 N GLU A 431 -12.277 3.202 0.612 1.00 0.42 N ATOM 1739 CA GLU A 431 -12.595 2.087 1.502 1.00 0.53 C ATOM 1740 C GLU A 431 -13.529 1.053 0.859 1.00 0.59 C ATOM 1741 O GLU A 431 -13.443 -0.131 1.174 1.00 0.72 O ATOM 1742 CB GLU A 431 -13.232 2.570 2.808 1.00 0.61 C ATOM 1743 CG GLU A 431 -12.423 3.594 3.573 1.00 0.73 C ATOM 1744 CD GLU A 431 -12.965 3.809 4.972 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -14.167 4.127 5.109 1.00 1.25 O ATOM 1746 OE2 GLU A 431 -12.207 3.622 5.947 1.00 1.31 O ATOM 0 H GLU A 431 -12.390 4.122 1.037 1.00 0.42 H new ATOM 0 HA GLU A 431 -11.638 1.608 1.709 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -14.209 2.996 2.582 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -13.402 1.708 3.453 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -11.385 3.267 3.632 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -12.429 4.540 3.032 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.416 1.487 -0.038 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.412 0.576 -0.602 1.00 0.66 C ATOM 1755 C HIS A 432 -14.778 -0.431 -1.569 1.00 0.60 C ATOM 1756 O HIS A 432 -15.052 -1.627 -1.495 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.569 1.345 -1.278 1.00 0.76 C ATOM 1758 CG HIS A 432 -16.309 1.869 -2.663 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -17.171 1.664 -3.718 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -15.294 2.595 -3.152 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -16.691 2.247 -4.798 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -15.550 2.822 -4.481 1.00 3.38 N ATOM 0 H HIS A 432 -14.466 2.445 -0.384 1.00 0.58 H new ATOM 0 HA HIS A 432 -15.833 0.011 0.230 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -17.437 0.687 -1.320 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -16.838 2.187 -0.640 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -14.431 2.939 -2.600 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -17.154 2.252 -5.774 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -14.954 3.350 -5.119 1.00 3.38 H new ATOM 1771 N LEU A 433 -13.902 0.047 -2.444 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.336 -0.800 -3.489 1.00 0.53 C ATOM 1773 C LEU A 433 -12.227 -1.674 -2.931 1.00 0.54 C ATOM 1774 O LEU A 433 -12.082 -2.835 -3.313 1.00 0.67 O ATOM 1775 CB LEU A 433 -12.806 0.028 -4.667 1.00 0.60 C ATOM 1776 CG LEU A 433 -11.677 0.999 -4.344 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -10.658 1.027 -5.474 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.231 2.387 -4.115 1.00 0.88 C ATOM 0 H LEU A 433 -13.569 1.011 -2.452 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.140 -1.436 -3.858 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -12.460 -0.657 -5.441 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -13.636 0.594 -5.091 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.181 0.660 -3.434 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -9.859 1.726 -5.226 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.239 0.030 -5.611 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -11.145 1.345 -6.396 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.414 3.071 -3.885 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -12.746 2.726 -5.014 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -12.932 2.366 -3.281 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.456 -1.117 -2.015 1.00 0.49 N ATOM 1791 CA GLU A 434 -10.362 -1.847 -1.400 1.00 0.60 C ATOM 1792 C GLU A 434 -10.865 -2.794 -0.315 1.00 0.76 C ATOM 1793 O GLU A 434 -10.084 -3.485 0.334 1.00 1.02 O ATOM 1794 CB GLU A 434 -9.329 -0.875 -0.846 1.00 0.54 C ATOM 1795 CG GLU A 434 -8.647 -0.074 -1.939 1.00 0.63 C ATOM 1796 CD GLU A 434 -8.036 -0.955 -3.011 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -6.917 -1.471 -2.804 1.00 1.36 O ATOM 1798 OE2 GLU A 434 -8.669 -1.134 -4.065 1.00 1.90 O ATOM 0 H GLU A 434 -11.567 -0.160 -1.680 1.00 0.49 H new ATOM 0 HA GLU A 434 -9.886 -2.459 -2.166 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -9.813 -0.193 -0.147 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -8.578 -1.429 -0.282 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -9.371 0.600 -2.397 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -7.868 0.548 -1.497 1.00 0.63 H new ATOM 1805 N SER A 435 -12.179 -2.820 -0.126 1.00 0.72 N ATOM 1806 CA SER A 435 -12.799 -3.784 0.766 1.00 0.89 C ATOM 1807 C SER A 435 -13.135 -5.050 -0.008 1.00 1.03 C ATOM 1808 O SER A 435 -13.418 -6.097 0.575 1.00 1.20 O ATOM 1809 CB SER A 435 -14.063 -3.202 1.399 1.00 0.97 C ATOM 1810 OG SER A 435 -14.652 -4.123 2.304 1.00 1.47 O ATOM 0 H SER A 435 -12.833 -2.183 -0.580 1.00 0.72 H new ATOM 0 HA SER A 435 -12.098 -4.024 1.566 1.00 0.89 H new ATOM 0 HB2 SER A 435 -13.819 -2.278 1.923 1.00 0.97 H new ATOM 0 HB3 SER A 435 -14.779 -2.946 0.618 1.00 0.97 H new ATOM 0 HG SER A 435 -14.424 -5.037 2.035 1.00 1.47 H new ATOM 1816 N GLN A 436 -13.124 -4.934 -1.328 1.00 1.04 N ATOM 1817 CA GLN A 436 -13.373 -6.066 -2.194 1.00 1.24 C ATOM 1818 C GLN A 436 -12.046 -6.729 -2.544 1.00 1.47 C ATOM 1819 O GLN A 436 -11.362 -6.243 -3.472 1.00 1.78 O ATOM 1820 CB GLN A 436 -14.086 -5.624 -3.477 1.00 1.17 C ATOM 1821 CG GLN A 436 -14.967 -4.390 -3.337 1.00 1.30 C ATOM 1822 CD GLN A 436 -16.328 -4.620 -2.679 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -17.313 -3.977 -3.047 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -16.397 -5.485 -1.682 1.00 2.60 N ATOM 1825 OXT GLN A 436 -11.688 -7.723 -1.887 1.00 2.10 O ATOM 0 H GLN A 436 -12.944 -4.059 -1.821 1.00 1.04 H new ATOM 0 HA GLN A 436 -14.017 -6.774 -1.672 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -13.335 -5.429 -4.242 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -14.700 -6.450 -3.836 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -14.425 -3.643 -2.757 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -15.130 -3.968 -4.329 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -15.566 -6.004 -1.398 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -17.281 -5.634 -1.196 1.00 2.60 H new TER 1834 GLN A 436