USER MOD reduce.3.24.130724 H: found=0, std=0, add=983, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 982 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 CYS SG : rot 32:sc= 0.164 USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-2.6!) USER MOD Single : A 14 ASN : amide:sc= 0.0673 K(o=0.067,f=-6.5!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= -0.277 USER MOD Single : A 26 SER OG : rot -93:sc= 0.196 USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 32 ASN : amide:sc= -0.128 K(o=-0.13,f=-1.9!) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -159:sc= 0.278 USER MOD Single : A 40 SER OG : rot 40:sc= -2.03! USER MOD Single : A 41 GLN : amide:sc= -15.8! C(o=-16!,f=-13!) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 19:sc= 1.1 USER MOD Single : A 58 THR OG1 : rot 48:sc= 0.0184 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.239 X(o=-0.24,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.09) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.024 X(o=-0.024,f=-0.028) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 160:sc= -0.425 USER MOD Single : A 90 ASN : amide:sc= 0.0791 K(o=0.079,f=-1.2) USER MOD Single : A 91 THR OG1 : rot 44:sc= 0.02 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.629 USER MOD Single : A 96 GLN : amide:sc= -1.25 K(o=-1.2,f=-0.045) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot -82:sc= 0.562 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.0757 USER MOD Single : A 109 LYS NZ :NH3+ -143:sc= 0.0988 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.265! USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0.0843 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.299 1.654 21.176 1.00 0.00 N ATOM 2 CA GLY A 1 6.453 2.535 21.509 1.00 0.00 C ATOM 3 C GLY A 1 7.532 2.503 20.445 1.00 0.00 C ATOM 4 O GLY A 1 7.260 2.746 19.268 1.00 0.00 O ATOM 0 H1 GLY A 1 4.589 1.711 21.934 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.874 1.963 20.279 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.628 0.672 21.083 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.100 3.559 21.634 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.879 2.226 22.464 1.00 0.00 H new ATOM 10 N SER A 2 8.759 2.205 20.857 1.00 0.00 N ATOM 11 CA SER A 2 9.884 2.143 19.931 1.00 0.00 C ATOM 12 C SER A 2 10.105 3.490 19.251 1.00 0.00 C ATOM 13 O SER A 2 9.680 3.700 18.115 1.00 0.00 O ATOM 14 CB SER A 2 9.644 1.061 18.877 1.00 0.00 C ATOM 15 OG SER A 2 10.188 -0.182 19.287 1.00 0.00 O ATOM 0 H SER A 2 9.000 2.002 21.827 1.00 0.00 H new ATOM 0 HA SER A 2 10.778 1.894 20.502 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.574 0.952 18.700 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.094 1.364 17.932 1.00 0.00 H new ATOM 0 HG SER A 2 10.019 -0.857 18.596 1.00 0.00 H new ATOM 21 N HIS A 3 10.771 4.400 19.955 1.00 0.00 N ATOM 22 CA HIS A 3 11.048 5.728 19.420 1.00 0.00 C ATOM 23 C HIS A 3 12.347 5.732 18.619 1.00 0.00 C ATOM 24 O HIS A 3 12.352 6.044 17.429 1.00 0.00 O ATOM 25 CB HIS A 3 11.130 6.750 20.554 1.00 0.00 C ATOM 26 CG HIS A 3 10.509 8.070 20.217 1.00 0.00 C ATOM 27 ND1 HIS A 3 10.995 8.900 19.228 1.00 0.00 N ATOM 28 CD2 HIS A 3 9.433 8.704 20.741 1.00 0.00 C ATOM 29 CE1 HIS A 3 10.247 9.986 19.161 1.00 0.00 C ATOM 30 NE2 HIS A 3 9.292 9.891 20.067 1.00 0.00 N ATOM 0 H HIS A 3 11.129 4.242 20.897 1.00 0.00 H new ATOM 0 HA HIS A 3 10.231 6.002 18.753 1.00 0.00 H new ATOM 0 HB2 HIS A 3 10.638 6.341 21.437 1.00 0.00 H new ATOM 0 HB3 HIS A 3 12.176 6.906 20.816 1.00 0.00 H new ATOM 0 HD2 HIS A 3 8.803 8.343 21.540 1.00 0.00 H new ATOM 0 HE1 HIS A 3 10.392 10.812 18.480 1.00 0.00 H new ATOM 0 HE2 HIS A 3 8.567 10.587 20.238 1.00 0.00 H new ATOM 39 N MET A 4 13.445 5.382 19.282 1.00 0.00 N ATOM 40 CA MET A 4 14.750 5.345 18.632 1.00 0.00 C ATOM 41 C MET A 4 15.618 4.239 19.223 1.00 0.00 C ATOM 42 O MET A 4 16.211 4.404 20.290 1.00 0.00 O ATOM 43 CB MET A 4 15.456 6.695 18.778 1.00 0.00 C ATOM 44 CG MET A 4 14.960 7.749 17.802 1.00 0.00 C ATOM 45 SD MET A 4 16.298 8.732 17.098 1.00 0.00 S ATOM 46 CE MET A 4 15.807 10.381 17.597 1.00 0.00 C ATOM 0 H MET A 4 13.457 5.120 20.268 1.00 0.00 H new ATOM 0 HA MET A 4 14.595 5.137 17.573 1.00 0.00 H new ATOM 0 HB2 MET A 4 15.317 7.060 19.796 1.00 0.00 H new ATOM 0 HB3 MET A 4 16.527 6.553 18.633 1.00 0.00 H new ATOM 0 HG2 MET A 4 14.410 7.262 16.997 1.00 0.00 H new ATOM 0 HG3 MET A 4 14.259 8.410 18.312 1.00 0.00 H new ATOM 0 HE1 MET A 4 16.538 11.104 17.235 1.00 0.00 H new ATOM 0 HE2 MET A 4 14.829 10.612 17.176 1.00 0.00 H new ATOM 0 HE3 MET A 4 15.755 10.432 18.685 1.00 0.00 H new ATOM 56 N ASP A 5 15.686 3.111 18.525 1.00 0.00 N ATOM 57 CA ASP A 5 16.480 1.977 18.983 1.00 0.00 C ATOM 58 C ASP A 5 17.293 1.382 17.837 1.00 0.00 C ATOM 59 O ASP A 5 18.499 1.166 17.966 1.00 0.00 O ATOM 60 CB ASP A 5 15.574 0.906 19.591 1.00 0.00 C ATOM 61 CG ASP A 5 16.204 0.231 20.793 1.00 0.00 C ATOM 62 OD1 ASP A 5 17.435 0.017 20.777 1.00 0.00 O ATOM 63 OD2 ASP A 5 15.468 -0.084 21.752 1.00 0.00 O ATOM 0 H ASP A 5 15.201 2.957 17.641 1.00 0.00 H new ATOM 0 HA ASP A 5 17.171 2.335 19.746 1.00 0.00 H new ATOM 0 HB2 ASP A 5 14.628 1.359 19.887 1.00 0.00 H new ATOM 0 HB3 ASP A 5 15.345 0.155 18.835 1.00 0.00 H new ATOM 68 N LYS A 6 16.628 1.120 16.717 1.00 0.00 N ATOM 69 CA LYS A 6 17.293 0.549 15.551 1.00 0.00 C ATOM 70 C LYS A 6 16.616 1.000 14.259 1.00 0.00 C ATOM 71 O LYS A 6 15.452 1.398 14.262 1.00 0.00 O ATOM 72 CB LYS A 6 17.292 -0.979 15.637 1.00 0.00 C ATOM 73 CG LYS A 6 17.989 -1.517 16.876 1.00 0.00 C ATOM 74 CD LYS A 6 18.015 -3.037 16.888 1.00 0.00 C ATOM 75 CE LYS A 6 18.651 -3.576 18.160 1.00 0.00 C ATOM 76 NZ LYS A 6 19.844 -4.419 17.870 1.00 0.00 N ATOM 0 H LYS A 6 15.631 1.293 16.592 1.00 0.00 H new ATOM 0 HA LYS A 6 18.323 0.906 15.540 1.00 0.00 H new ATOM 0 HB2 LYS A 6 16.262 -1.335 15.626 1.00 0.00 H new ATOM 0 HB3 LYS A 6 17.779 -1.385 14.751 1.00 0.00 H new ATOM 0 HG2 LYS A 6 19.009 -1.135 16.915 1.00 0.00 H new ATOM 0 HG3 LYS A 6 17.478 -1.154 17.768 1.00 0.00 H new ATOM 0 HD2 LYS A 6 16.998 -3.420 16.799 1.00 0.00 H new ATOM 0 HD3 LYS A 6 18.569 -3.399 16.022 1.00 0.00 H new ATOM 0 HE2 LYS A 6 18.942 -2.744 18.801 1.00 0.00 H new ATOM 0 HE3 LYS A 6 17.917 -4.163 18.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 20.248 -4.767 18.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 19.563 -5.227 17.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 20.555 -3.852 17.365 1.00 0.00 H new ATOM 90 N THR A 7 17.357 0.934 13.158 1.00 0.00 N ATOM 91 CA THR A 7 16.835 1.334 11.856 1.00 0.00 C ATOM 92 C THR A 7 16.796 0.146 10.900 1.00 0.00 C ATOM 93 O THR A 7 17.712 -0.677 10.884 1.00 0.00 O ATOM 94 CB THR A 7 17.687 2.457 11.265 1.00 0.00 C ATOM 95 OG1 THR A 7 18.820 2.716 12.077 1.00 0.00 O ATOM 96 CG2 THR A 7 16.922 3.750 11.118 1.00 0.00 C ATOM 0 H THR A 7 18.323 0.607 13.141 1.00 0.00 H new ATOM 0 HA THR A 7 15.817 1.698 11.994 1.00 0.00 H new ATOM 0 HB THR A 7 17.991 2.108 10.278 1.00 0.00 H new ATOM 0 HG1 THR A 7 19.351 3.437 11.678 1.00 0.00 H new ATOM 0 HG21 THR A 7 17.575 4.513 10.694 1.00 0.00 H new ATOM 0 HG22 THR A 7 16.069 3.595 10.458 1.00 0.00 H new ATOM 0 HG23 THR A 7 16.569 4.077 12.096 1.00 0.00 H new ATOM 104 N PHE A 8 15.729 0.056 10.112 1.00 0.00 N ATOM 105 CA PHE A 8 15.581 -1.046 9.165 1.00 0.00 C ATOM 106 C PHE A 8 14.886 -0.616 7.877 1.00 0.00 C ATOM 107 O PHE A 8 13.956 0.188 7.888 1.00 0.00 O ATOM 108 CB PHE A 8 14.793 -2.197 9.796 1.00 0.00 C ATOM 109 CG PHE A 8 13.654 -1.765 10.683 1.00 0.00 C ATOM 110 CD1 PHE A 8 13.005 -0.551 10.489 1.00 0.00 C ATOM 111 CD2 PHE A 8 13.233 -2.583 11.717 1.00 0.00 C ATOM 112 CE1 PHE A 8 11.964 -0.169 11.312 1.00 0.00 C ATOM 113 CE2 PHE A 8 12.192 -2.205 12.542 1.00 0.00 C ATOM 114 CZ PHE A 8 11.556 -0.997 12.339 1.00 0.00 C ATOM 0 H PHE A 8 14.960 0.726 10.109 1.00 0.00 H new ATOM 0 HA PHE A 8 16.589 -1.376 8.914 1.00 0.00 H new ATOM 0 HB2 PHE A 8 14.397 -2.828 9.000 1.00 0.00 H new ATOM 0 HB3 PHE A 8 15.478 -2.812 10.380 1.00 0.00 H new ATOM 0 HD1 PHE A 8 13.318 0.100 9.686 1.00 0.00 H new ATOM 0 HD2 PHE A 8 13.725 -3.530 11.881 1.00 0.00 H new ATOM 0 HE1 PHE A 8 11.469 0.777 11.152 1.00 0.00 H new ATOM 0 HE2 PHE A 8 11.876 -2.854 13.345 1.00 0.00 H new ATOM 0 HZ PHE A 8 10.741 -0.700 12.982 1.00 0.00 H new ATOM 124 N CYS A 9 15.320 -1.196 6.768 1.00 0.00 N ATOM 125 CA CYS A 9 14.715 -0.914 5.476 1.00 0.00 C ATOM 126 C CYS A 9 13.662 -1.981 5.186 1.00 0.00 C ATOM 127 O CYS A 9 13.970 -3.172 5.175 1.00 0.00 O ATOM 128 CB CYS A 9 15.779 -0.907 4.375 1.00 0.00 C ATOM 129 SG CYS A 9 16.781 -2.410 4.307 1.00 0.00 S ATOM 0 H CYS A 9 16.089 -1.865 6.737 1.00 0.00 H new ATOM 0 HA CYS A 9 14.248 0.071 5.499 1.00 0.00 H new ATOM 0 HB2 CYS A 9 15.289 -0.766 3.412 1.00 0.00 H new ATOM 0 HB3 CYS A 9 16.437 -0.051 4.526 1.00 0.00 H new ATOM 0 HG CYS A 9 16.065 -3.426 4.687 1.00 0.00 H new ATOM 135 N VAL A 10 12.421 -1.560 4.977 1.00 0.00 N ATOM 136 CA VAL A 10 11.338 -2.507 4.718 1.00 0.00 C ATOM 137 C VAL A 10 10.864 -2.425 3.276 1.00 0.00 C ATOM 138 O VAL A 10 10.953 -1.382 2.641 1.00 0.00 O ATOM 139 CB VAL A 10 10.138 -2.270 5.668 1.00 0.00 C ATOM 140 CG1 VAL A 10 8.955 -1.622 4.953 1.00 0.00 C ATOM 141 CG2 VAL A 10 9.715 -3.575 6.317 1.00 0.00 C ATOM 0 H VAL A 10 12.139 -0.580 4.981 1.00 0.00 H new ATOM 0 HA VAL A 10 11.741 -3.503 4.902 1.00 0.00 H new ATOM 0 HB VAL A 10 10.467 -1.575 6.440 1.00 0.00 H new ATOM 0 HG11 VAL A 10 8.138 -1.476 5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.260 -0.658 4.546 1.00 0.00 H new ATOM 0 HG13 VAL A 10 8.621 -2.269 4.142 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.871 -3.394 6.982 1.00 0.00 H new ATOM 0 HG22 VAL A 10 9.423 -4.287 5.545 1.00 0.00 H new ATOM 0 HG23 VAL A 10 10.547 -3.983 6.890 1.00 0.00 H new ATOM 151 N VAL A 11 10.360 -3.534 2.768 1.00 0.00 N ATOM 152 CA VAL A 11 9.876 -3.581 1.404 1.00 0.00 C ATOM 153 C VAL A 11 8.521 -4.277 1.322 1.00 0.00 C ATOM 154 O VAL A 11 8.365 -5.417 1.759 1.00 0.00 O ATOM 155 CB VAL A 11 10.897 -4.284 0.499 1.00 0.00 C ATOM 156 CG1 VAL A 11 11.305 -5.617 1.099 1.00 0.00 C ATOM 157 CG2 VAL A 11 10.362 -4.452 -0.916 1.00 0.00 C ATOM 0 H VAL A 11 10.276 -4.412 3.280 1.00 0.00 H new ATOM 0 HA VAL A 11 9.747 -2.556 1.057 1.00 0.00 H new ATOM 0 HB VAL A 11 11.784 -3.654 0.433 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.029 -6.104 0.446 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.753 -5.453 2.079 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.426 -6.253 1.204 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.110 -4.953 -1.531 1.00 0.00 H new ATOM 0 HG22 VAL A 11 9.451 -5.051 -0.892 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.141 -3.473 -1.340 1.00 0.00 H new ATOM 167 N VAL A 12 7.541 -3.568 0.769 1.00 0.00 N ATOM 168 CA VAL A 12 6.188 -4.097 0.636 1.00 0.00 C ATOM 169 C VAL A 12 5.954 -4.710 -0.736 1.00 0.00 C ATOM 170 O VAL A 12 5.759 -3.995 -1.717 1.00 0.00 O ATOM 171 CB VAL A 12 5.132 -2.997 0.860 1.00 0.00 C ATOM 172 CG1 VAL A 12 4.908 -2.777 2.341 1.00 0.00 C ATOM 173 CG2 VAL A 12 5.548 -1.699 0.185 1.00 0.00 C ATOM 0 H VAL A 12 7.660 -2.623 0.405 1.00 0.00 H new ATOM 0 HA VAL A 12 6.087 -4.869 1.399 1.00 0.00 H new ATOM 0 HB VAL A 12 4.195 -3.326 0.410 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.160 -1.997 2.484 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.559 -3.703 2.798 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.844 -2.472 2.809 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.786 -0.939 0.358 1.00 0.00 H new ATOM 0 HG22 VAL A 12 6.498 -1.362 0.599 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.658 -1.865 -0.887 1.00 0.00 H new ATOM 183 N GLN A 13 5.948 -6.035 -0.793 1.00 0.00 N ATOM 184 CA GLN A 13 5.711 -6.741 -2.043 1.00 0.00 C ATOM 185 C GLN A 13 4.244 -7.138 -2.144 1.00 0.00 C ATOM 186 O GLN A 13 3.790 -8.043 -1.442 1.00 0.00 O ATOM 187 CB GLN A 13 6.601 -7.983 -2.134 1.00 0.00 C ATOM 188 CG GLN A 13 6.828 -8.466 -3.556 1.00 0.00 C ATOM 189 CD GLN A 13 6.022 -9.706 -3.888 1.00 0.00 C ATOM 190 OE1 GLN A 13 5.006 -9.634 -4.581 1.00 0.00 O ATOM 191 NE2 GLN A 13 6.470 -10.853 -3.391 1.00 0.00 N ATOM 0 H GLN A 13 6.105 -6.642 0.012 1.00 0.00 H new ATOM 0 HA GLN A 13 5.958 -6.078 -2.872 1.00 0.00 H new ATOM 0 HB2 GLN A 13 7.565 -7.763 -1.676 1.00 0.00 H new ATOM 0 HB3 GLN A 13 6.148 -8.787 -1.554 1.00 0.00 H new ATOM 0 HG2 GLN A 13 6.565 -7.670 -4.252 1.00 0.00 H new ATOM 0 HG3 GLN A 13 7.888 -8.677 -3.699 1.00 0.00 H new ATOM 0 HE21 GLN A 13 7.316 -10.866 -2.822 1.00 0.00 H new ATOM 0 HE22 GLN A 13 5.968 -11.721 -3.578 1.00 0.00 H new ATOM 200 N ASN A 14 3.498 -6.452 -3.004 1.00 0.00 N ATOM 201 CA ASN A 14 2.079 -6.741 -3.164 1.00 0.00 C ATOM 202 C ASN A 14 1.826 -7.673 -4.340 1.00 0.00 C ATOM 203 O ASN A 14 2.074 -7.326 -5.494 1.00 0.00 O ATOM 204 CB ASN A 14 1.272 -5.450 -3.353 1.00 0.00 C ATOM 205 CG ASN A 14 1.522 -4.787 -4.693 1.00 0.00 C ATOM 206 OD1 ASN A 14 2.652 -4.418 -5.016 1.00 0.00 O ATOM 207 ND2 ASN A 14 0.464 -4.633 -5.481 1.00 0.00 N ATOM 0 H ASN A 14 3.849 -5.699 -3.596 1.00 0.00 H new ATOM 0 HA ASN A 14 1.752 -7.238 -2.251 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.210 -5.675 -3.257 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.523 -4.751 -2.555 1.00 0.00 H new ATOM 0 HD21 ASN A 14 0.569 -4.194 -6.396 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -0.453 -4.954 -5.172 1.00 0.00 H new ATOM 214 N ARG A 15 1.295 -8.848 -4.034 1.00 0.00 N ATOM 215 CA ARG A 15 0.964 -9.825 -5.062 1.00 0.00 C ATOM 216 C ARG A 15 -0.535 -9.769 -5.343 1.00 0.00 C ATOM 217 O ARG A 15 -1.152 -10.764 -5.722 1.00 0.00 O ATOM 218 CB ARG A 15 1.371 -11.233 -4.617 1.00 0.00 C ATOM 219 CG ARG A 15 2.597 -11.769 -5.338 1.00 0.00 C ATOM 220 CD ARG A 15 2.391 -13.199 -5.814 1.00 0.00 C ATOM 221 NE ARG A 15 3.151 -14.157 -5.014 1.00 0.00 N ATOM 222 CZ ARG A 15 2.748 -14.624 -3.834 1.00 0.00 C ATOM 223 NH1 ARG A 15 1.596 -14.222 -3.311 1.00 0.00 N ATOM 224 NH2 ARG A 15 3.498 -15.495 -3.174 1.00 0.00 N ATOM 0 H ARG A 15 1.084 -9.148 -3.082 1.00 0.00 H new ATOM 0 HA ARG A 15 1.513 -9.588 -5.973 1.00 0.00 H new ATOM 0 HB2 ARG A 15 1.566 -11.224 -3.545 1.00 0.00 H new ATOM 0 HB3 ARG A 15 0.536 -11.913 -4.784 1.00 0.00 H new ATOM 0 HG2 ARG A 15 2.825 -11.131 -6.192 1.00 0.00 H new ATOM 0 HG3 ARG A 15 3.458 -11.728 -4.671 1.00 0.00 H new ATOM 0 HD2 ARG A 15 1.331 -13.448 -5.767 1.00 0.00 H new ATOM 0 HD3 ARG A 15 2.691 -13.280 -6.859 1.00 0.00 H new ATOM 0 HE ARG A 15 4.043 -14.488 -5.381 1.00 0.00 H new ATOM 0 HH11 ARG A 15 1.014 -13.552 -3.813 1.00 0.00 H new ATOM 0 HH12 ARG A 15 1.293 -14.583 -2.407 1.00 0.00 H new ATOM 0 HH21 ARG A 15 4.384 -15.808 -3.570 1.00 0.00 H new ATOM 0 HH22 ARG A 15 3.189 -15.852 -2.270 1.00 0.00 H new ATOM 238 N ILE A 16 -1.108 -8.586 -5.132 1.00 0.00 N ATOM 239 CA ILE A 16 -2.530 -8.356 -5.329 1.00 0.00 C ATOM 240 C ILE A 16 -2.846 -8.056 -6.797 1.00 0.00 C ATOM 241 O ILE A 16 -3.332 -8.923 -7.523 1.00 0.00 O ATOM 242 CB ILE A 16 -3.007 -7.198 -4.418 1.00 0.00 C ATOM 243 CG1 ILE A 16 -3.176 -7.695 -2.984 1.00 0.00 C ATOM 244 CG2 ILE A 16 -4.303 -6.579 -4.916 1.00 0.00 C ATOM 245 CD1 ILE A 16 -2.849 -6.648 -1.945 1.00 0.00 C ATOM 0 H ILE A 16 -0.595 -7.762 -4.819 1.00 0.00 H new ATOM 0 HA ILE A 16 -3.067 -9.265 -5.057 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.243 -6.421 -4.445 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.204 -8.029 -2.842 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -2.534 -8.563 -2.830 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -4.601 -5.771 -4.247 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.154 -6.183 -5.920 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -5.084 -7.339 -4.938 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -2.990 -7.067 -0.949 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -1.813 -6.331 -2.062 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.508 -5.789 -2.074 1.00 0.00 H new ATOM 257 N LYS A 17 -2.570 -6.829 -7.231 1.00 0.00 N ATOM 258 CA LYS A 17 -2.830 -6.429 -8.610 1.00 0.00 C ATOM 259 C LYS A 17 -1.921 -5.274 -9.021 1.00 0.00 C ATOM 260 O LYS A 17 -0.975 -4.935 -8.311 1.00 0.00 O ATOM 261 CB LYS A 17 -4.295 -6.016 -8.780 1.00 0.00 C ATOM 262 CG LYS A 17 -5.286 -7.008 -8.192 1.00 0.00 C ATOM 263 CD LYS A 17 -6.717 -6.515 -8.329 1.00 0.00 C ATOM 264 CE LYS A 17 -6.953 -5.249 -7.519 1.00 0.00 C ATOM 265 NZ LYS A 17 -8.221 -5.316 -6.742 1.00 0.00 N ATOM 0 H LYS A 17 -2.167 -6.096 -6.648 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.622 -7.285 -9.252 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.446 -5.044 -8.309 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -4.507 -5.892 -9.842 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.182 -7.969 -8.695 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -5.056 -7.173 -7.139 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -6.937 -6.322 -9.379 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.404 -7.293 -7.997 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.117 -5.093 -6.837 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -6.983 -4.390 -8.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.345 -4.435 -6.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.022 -5.439 -7.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -8.183 -6.121 -6.084 1.00 0.00 H new ATOM 279 N GLU A 18 -2.220 -4.668 -10.167 1.00 0.00 N ATOM 280 CA GLU A 18 -1.433 -3.545 -10.663 1.00 0.00 C ATOM 281 C GLU A 18 -2.158 -2.228 -10.406 1.00 0.00 C ATOM 282 O GLU A 18 -1.980 -1.255 -11.138 1.00 0.00 O ATOM 283 CB GLU A 18 -1.158 -3.709 -12.159 1.00 0.00 C ATOM 284 CG GLU A 18 -2.413 -3.684 -13.017 1.00 0.00 C ATOM 285 CD GLU A 18 -2.175 -3.062 -14.379 1.00 0.00 C ATOM 286 OE1 GLU A 18 -1.111 -3.331 -14.977 1.00 0.00 O ATOM 287 OE2 GLU A 18 -3.052 -2.308 -14.848 1.00 0.00 O ATOM 0 H GLU A 18 -3.000 -4.936 -10.768 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.483 -3.529 -10.129 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.489 -2.913 -12.486 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.636 -4.652 -12.322 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.781 -4.702 -13.146 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.193 -3.126 -12.498 1.00 0.00 H new ATOM 294 N GLY A 19 -2.977 -2.208 -9.359 1.00 0.00 N ATOM 295 CA GLY A 19 -3.722 -1.011 -9.018 1.00 0.00 C ATOM 296 C GLY A 19 -4.648 -1.227 -7.838 1.00 0.00 C ATOM 297 O GLY A 19 -5.860 -1.041 -7.948 1.00 0.00 O ATOM 0 H GLY A 19 -3.138 -3.002 -8.739 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -3.025 -0.205 -8.787 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -4.305 -0.691 -9.881 1.00 0.00 H new ATOM 301 N TYR A 20 -4.075 -1.621 -6.705 1.00 0.00 N ATOM 302 CA TYR A 20 -4.856 -1.861 -5.498 1.00 0.00 C ATOM 303 C TYR A 20 -4.775 -0.670 -4.552 1.00 0.00 C ATOM 304 O TYR A 20 -5.067 -0.788 -3.361 1.00 0.00 O ATOM 305 CB TYR A 20 -4.375 -3.132 -4.793 1.00 0.00 C ATOM 306 CG TYR A 20 -5.294 -3.593 -3.684 1.00 0.00 C ATOM 307 CD1 TYR A 20 -6.673 -3.579 -3.848 1.00 0.00 C ATOM 308 CD2 TYR A 20 -4.781 -4.040 -2.473 1.00 0.00 C ATOM 309 CE1 TYR A 20 -7.517 -3.999 -2.836 1.00 0.00 C ATOM 310 CE2 TYR A 20 -5.618 -4.462 -1.458 1.00 0.00 C ATOM 311 CZ TYR A 20 -6.984 -4.439 -1.644 1.00 0.00 C ATOM 312 OH TYR A 20 -7.821 -4.858 -0.634 1.00 0.00 O ATOM 0 H TYR A 20 -3.073 -1.781 -6.598 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.897 -1.995 -5.790 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.277 -3.931 -5.528 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -3.382 -2.955 -4.381 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -7.093 -3.234 -4.781 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -3.712 -4.058 -2.323 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -8.587 -3.982 -2.979 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.204 -4.809 -0.523 1.00 0.00 H new ATOM 0 HH TYR A 20 -7.287 -5.138 0.139 1.00 0.00 H new ATOM 322 N ARG A 21 -4.396 0.483 -5.093 1.00 0.00 N ATOM 323 CA ARG A 21 -4.300 1.701 -4.304 1.00 0.00 C ATOM 324 C ARG A 21 -3.266 1.576 -3.194 1.00 0.00 C ATOM 325 O ARG A 21 -2.705 0.506 -2.960 1.00 0.00 O ATOM 326 CB ARG A 21 -5.660 2.030 -3.691 1.00 0.00 C ATOM 327 CG ARG A 21 -6.783 2.156 -4.706 1.00 0.00 C ATOM 328 CD ARG A 21 -6.328 2.857 -5.978 1.00 0.00 C ATOM 329 NE ARG A 21 -7.460 3.306 -6.788 1.00 0.00 N ATOM 330 CZ ARG A 21 -7.388 4.286 -7.685 1.00 0.00 C ATOM 331 NH1 ARG A 21 -6.243 4.922 -7.898 1.00 0.00 N ATOM 332 NH2 ARG A 21 -8.467 4.631 -8.374 1.00 0.00 N ATOM 0 H ARG A 21 -4.150 0.597 -6.076 1.00 0.00 H new ATOM 0 HA ARG A 21 -3.985 2.502 -4.973 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -5.920 1.253 -2.972 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.580 2.965 -3.136 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -7.160 1.164 -4.954 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -7.611 2.710 -4.263 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -5.706 3.713 -5.718 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -5.708 2.179 -6.565 1.00 0.00 H new ATOM 0 HE ARG A 21 -8.358 2.840 -6.657 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -5.409 4.661 -7.372 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -6.197 5.672 -8.588 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -9.350 4.145 -8.216 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -8.414 5.382 -9.062 1.00 0.00 H new ATOM 346 N ARG A 22 -3.043 2.686 -2.504 1.00 0.00 N ATOM 347 CA ARG A 22 -2.102 2.735 -1.396 1.00 0.00 C ATOM 348 C ARG A 22 -2.213 4.075 -0.682 1.00 0.00 C ATOM 349 O ARG A 22 -2.877 4.189 0.348 1.00 0.00 O ATOM 350 CB ARG A 22 -0.672 2.502 -1.882 1.00 0.00 C ATOM 351 CG ARG A 22 0.012 1.332 -1.192 1.00 0.00 C ATOM 352 CD ARG A 22 0.982 1.805 -0.120 1.00 0.00 C ATOM 353 NE ARG A 22 1.902 2.821 -0.624 1.00 0.00 N ATOM 354 CZ ARG A 22 2.756 3.494 0.143 1.00 0.00 C ATOM 355 NH1 ARG A 22 2.805 3.270 1.450 1.00 0.00 N ATOM 356 NH2 ARG A 22 3.564 4.396 -0.398 1.00 0.00 N ATOM 0 H ARG A 22 -3.507 3.574 -2.696 1.00 0.00 H new ATOM 0 HA ARG A 22 -2.350 1.938 -0.695 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.685 2.324 -2.957 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.087 3.406 -1.716 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -0.740 0.683 -0.743 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.547 0.735 -1.931 1.00 0.00 H new ATOM 0 HD2 ARG A 22 0.422 2.210 0.723 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.551 0.954 0.255 1.00 0.00 H new ATOM 0 HE ARG A 22 1.889 3.027 -1.623 1.00 0.00 H new ATOM 0 HH11 ARG A 22 2.186 2.578 1.872 1.00 0.00 H new ATOM 0 HH12 ARG A 22 3.462 3.789 2.032 1.00 0.00 H new ATOM 0 HH21 ARG A 22 3.531 4.574 -1.402 1.00 0.00 H new ATOM 0 HH22 ARG A 22 4.219 4.912 0.190 1.00 0.00 H new ATOM 370 N ALA A 23 -1.588 5.092 -1.257 1.00 0.00 N ATOM 371 CA ALA A 23 -1.648 6.432 -0.702 1.00 0.00 C ATOM 372 C ALA A 23 -2.794 7.201 -1.348 1.00 0.00 C ATOM 373 O ALA A 23 -3.089 8.336 -0.973 1.00 0.00 O ATOM 374 CB ALA A 23 -0.328 7.157 -0.915 1.00 0.00 C ATOM 0 H ALA A 23 -1.033 5.012 -2.109 1.00 0.00 H new ATOM 0 HA ALA A 23 -1.826 6.366 0.371 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.391 8.160 -0.493 1.00 0.00 H new ATOM 0 HB2 ALA A 23 0.473 6.606 -0.423 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -0.119 7.225 -1.983 1.00 0.00 H new ATOM 380 N GLY A 24 -3.435 6.565 -2.331 1.00 0.00 N ATOM 381 CA GLY A 24 -4.538 7.190 -3.029 1.00 0.00 C ATOM 382 C GLY A 24 -4.199 7.486 -4.473 1.00 0.00 C ATOM 383 O GLY A 24 -4.482 8.574 -4.973 1.00 0.00 O ATOM 0 H GLY A 24 -3.205 5.625 -2.653 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -5.410 6.537 -2.988 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -4.809 8.116 -2.523 1.00 0.00 H new ATOM 387 N PHE A 25 -3.580 6.518 -5.145 1.00 0.00 N ATOM 388 CA PHE A 25 -3.196 6.700 -6.539 1.00 0.00 C ATOM 389 C PHE A 25 -3.044 5.367 -7.275 1.00 0.00 C ATOM 390 O PHE A 25 -3.686 5.148 -8.302 1.00 0.00 O ATOM 391 CB PHE A 25 -1.900 7.515 -6.625 1.00 0.00 C ATOM 392 CG PHE A 25 -0.690 6.839 -6.034 1.00 0.00 C ATOM 393 CD1 PHE A 25 -0.677 6.404 -4.712 1.00 0.00 C ATOM 394 CD2 PHE A 25 0.445 6.646 -6.807 1.00 0.00 C ATOM 395 CE1 PHE A 25 0.443 5.790 -4.183 1.00 0.00 C ATOM 396 CE2 PHE A 25 1.566 6.035 -6.279 1.00 0.00 C ATOM 397 CZ PHE A 25 1.566 5.607 -4.967 1.00 0.00 C ATOM 0 H PHE A 25 -3.336 5.609 -4.750 1.00 0.00 H new ATOM 0 HA PHE A 25 -3.999 7.247 -7.033 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -1.698 7.741 -7.672 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -2.051 8.467 -6.117 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -1.551 6.548 -4.093 1.00 0.00 H new ATOM 0 HD2 PHE A 25 0.453 6.978 -7.835 1.00 0.00 H new ATOM 0 HE1 PHE A 25 0.440 5.453 -3.157 1.00 0.00 H new ATOM 0 HE2 PHE A 25 2.443 5.892 -6.893 1.00 0.00 H new ATOM 0 HZ PHE A 25 2.442 5.130 -4.554 1.00 0.00 H new ATOM 407 N SER A 26 -2.193 4.486 -6.746 1.00 0.00 N ATOM 408 CA SER A 26 -1.941 3.171 -7.346 1.00 0.00 C ATOM 409 C SER A 26 -0.554 2.672 -6.956 1.00 0.00 C ATOM 410 O SER A 26 0.454 3.282 -7.309 1.00 0.00 O ATOM 411 CB SER A 26 -2.050 3.225 -8.874 1.00 0.00 C ATOM 412 OG SER A 26 -1.525 4.441 -9.380 1.00 0.00 O ATOM 0 H SER A 26 -1.661 4.661 -5.894 1.00 0.00 H new ATOM 0 HA SER A 26 -2.699 2.484 -6.969 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.512 2.383 -9.310 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.094 3.124 -9.171 1.00 0.00 H new ATOM 0 HG SER A 26 -2.249 5.095 -9.477 1.00 0.00 H new ATOM 418 N PHE A 27 -0.505 1.564 -6.225 1.00 0.00 N ATOM 419 CA PHE A 27 0.769 1.000 -5.793 1.00 0.00 C ATOM 420 C PHE A 27 1.339 0.045 -6.840 1.00 0.00 C ATOM 421 O PHE A 27 2.532 -0.260 -6.826 1.00 0.00 O ATOM 422 CB PHE A 27 0.611 0.269 -4.460 1.00 0.00 C ATOM 423 CG PHE A 27 1.926 -0.036 -3.797 1.00 0.00 C ATOM 424 CD1 PHE A 27 2.666 0.974 -3.205 1.00 0.00 C ATOM 425 CD2 PHE A 27 2.428 -1.329 -3.775 1.00 0.00 C ATOM 426 CE1 PHE A 27 3.878 0.703 -2.602 1.00 0.00 C ATOM 427 CE2 PHE A 27 3.641 -1.605 -3.176 1.00 0.00 C ATOM 428 CZ PHE A 27 4.368 -0.588 -2.589 1.00 0.00 C ATOM 0 H PHE A 27 -1.326 1.041 -5.921 1.00 0.00 H new ATOM 0 HA PHE A 27 1.466 1.828 -5.667 1.00 0.00 H new ATOM 0 HB2 PHE A 27 0.004 0.877 -3.789 1.00 0.00 H new ATOM 0 HB3 PHE A 27 0.069 -0.662 -4.625 1.00 0.00 H new ATOM 0 HD1 PHE A 27 2.290 1.986 -3.215 1.00 0.00 H new ATOM 0 HD2 PHE A 27 1.864 -2.129 -4.232 1.00 0.00 H new ATOM 0 HE1 PHE A 27 4.442 1.500 -2.141 1.00 0.00 H new ATOM 0 HE2 PHE A 27 4.021 -2.616 -3.166 1.00 0.00 H new ATOM 0 HZ PHE A 27 5.317 -0.802 -2.121 1.00 0.00 H new ATOM 438 N HIS A 28 0.486 -0.426 -7.745 1.00 0.00 N ATOM 439 CA HIS A 28 0.916 -1.347 -8.793 1.00 0.00 C ATOM 440 C HIS A 28 1.364 -2.677 -8.194 1.00 0.00 C ATOM 441 O HIS A 28 1.508 -2.805 -6.978 1.00 0.00 O ATOM 442 CB HIS A 28 2.057 -0.734 -9.609 1.00 0.00 C ATOM 443 CG HIS A 28 1.620 -0.186 -10.932 1.00 0.00 C ATOM 444 ND1 HIS A 28 2.250 -0.495 -12.119 1.00 0.00 N ATOM 445 CD2 HIS A 28 0.609 0.656 -11.253 1.00 0.00 C ATOM 446 CE1 HIS A 28 1.646 0.134 -13.112 1.00 0.00 C ATOM 447 NE2 HIS A 28 0.646 0.838 -12.612 1.00 0.00 N ATOM 0 H HIS A 28 -0.505 -0.186 -7.774 1.00 0.00 H new ATOM 0 HA HIS A 28 0.067 -1.529 -9.452 1.00 0.00 H new ATOM 0 HB2 HIS A 28 2.519 0.065 -9.029 1.00 0.00 H new ATOM 0 HB3 HIS A 28 2.823 -1.492 -9.774 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -0.096 1.101 -10.566 1.00 0.00 H new ATOM 0 HE1 HIS A 28 1.923 0.082 -14.155 1.00 0.00 H new ATOM 0 HE2 HIS A 28 0.005 1.422 -13.149 1.00 0.00 H new ATOM 456 N LEU A 29 1.586 -3.662 -9.057 1.00 0.00 N ATOM 457 CA LEU A 29 2.022 -4.981 -8.617 1.00 0.00 C ATOM 458 C LEU A 29 3.544 -5.060 -8.589 1.00 0.00 C ATOM 459 O LEU A 29 4.192 -5.140 -9.633 1.00 0.00 O ATOM 460 CB LEU A 29 1.460 -6.063 -9.541 1.00 0.00 C ATOM 461 CG LEU A 29 1.440 -7.472 -8.948 1.00 0.00 C ATOM 462 CD1 LEU A 29 0.431 -7.560 -7.814 1.00 0.00 C ATOM 463 CD2 LEU A 29 1.119 -8.495 -10.026 1.00 0.00 C ATOM 0 H LEU A 29 1.471 -3.571 -10.066 1.00 0.00 H new ATOM 0 HA LEU A 29 1.645 -5.147 -7.608 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.443 -5.788 -9.821 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.050 -6.079 -10.458 1.00 0.00 H new ATOM 0 HG LEU A 29 2.429 -7.691 -8.545 1.00 0.00 H new ATOM 0 HD11 LEU A 29 0.431 -8.570 -7.405 1.00 0.00 H new ATOM 0 HD12 LEU A 29 0.701 -6.851 -7.031 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.563 -7.322 -8.192 1.00 0.00 H new ATOM 0 HD21 LEU A 29 1.108 -9.493 -9.589 1.00 0.00 H new ATOM 0 HD22 LEU A 29 0.141 -8.276 -10.455 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.877 -8.450 -10.808 1.00 0.00 H new ATOM 475 N GLY A 30 4.105 -5.034 -7.388 1.00 0.00 N ATOM 476 CA GLY A 30 5.547 -5.099 -7.240 1.00 0.00 C ATOM 477 C GLY A 30 5.983 -4.984 -5.796 1.00 0.00 C ATOM 478 O GLY A 30 5.336 -5.527 -4.901 1.00 0.00 O ATOM 0 H GLY A 30 3.587 -4.969 -6.512 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.910 -6.040 -7.653 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.006 -4.298 -7.820 1.00 0.00 H new ATOM 482 N ASP A 31 7.082 -4.276 -5.566 1.00 0.00 N ATOM 483 CA ASP A 31 7.601 -4.096 -4.216 1.00 0.00 C ATOM 484 C ASP A 31 8.332 -2.764 -4.079 1.00 0.00 C ATOM 485 O ASP A 31 9.113 -2.383 -4.952 1.00 0.00 O ATOM 486 CB ASP A 31 8.542 -5.247 -3.853 1.00 0.00 C ATOM 487 CG ASP A 31 9.562 -5.525 -4.939 1.00 0.00 C ATOM 488 OD1 ASP A 31 10.262 -4.578 -5.353 1.00 0.00 O ATOM 489 OD2 ASP A 31 9.662 -6.692 -5.375 1.00 0.00 O ATOM 0 H ASP A 31 7.630 -3.818 -6.295 1.00 0.00 H new ATOM 0 HA ASP A 31 6.755 -4.093 -3.529 1.00 0.00 H new ATOM 0 HB2 ASP A 31 9.060 -5.010 -2.924 1.00 0.00 H new ATOM 0 HB3 ASP A 31 7.956 -6.148 -3.670 1.00 0.00 H new ATOM 494 N ASN A 32 8.081 -2.061 -2.976 1.00 0.00 N ATOM 495 CA ASN A 32 8.725 -0.776 -2.728 1.00 0.00 C ATOM 496 C ASN A 32 9.600 -0.855 -1.483 1.00 0.00 C ATOM 497 O ASN A 32 9.163 -1.348 -0.446 1.00 0.00 O ATOM 498 CB ASN A 32 7.674 0.323 -2.562 1.00 0.00 C ATOM 499 CG ASN A 32 8.231 1.705 -2.846 1.00 0.00 C ATOM 500 OD1 ASN A 32 9.275 1.846 -3.484 1.00 0.00 O ATOM 501 ND2 ASN A 32 7.536 2.732 -2.373 1.00 0.00 N ATOM 0 H ASN A 32 7.438 -2.360 -2.243 1.00 0.00 H new ATOM 0 HA ASN A 32 9.354 -0.533 -3.585 1.00 0.00 H new ATOM 0 HB2 ASN A 32 6.838 0.126 -3.233 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.280 0.295 -1.546 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.862 3.685 -2.533 1.00 0.00 H new ATOM 0 HD22 ASN A 32 6.676 2.568 -1.850 1.00 0.00 H new ATOM 508 N SER A 33 10.836 -0.373 -1.587 1.00 0.00 N ATOM 509 CA SER A 33 11.757 -0.408 -0.457 1.00 0.00 C ATOM 510 C SER A 33 11.598 0.813 0.429 1.00 0.00 C ATOM 511 O SER A 33 11.311 1.915 -0.041 1.00 0.00 O ATOM 512 CB SER A 33 13.208 -0.501 -0.924 1.00 0.00 C ATOM 513 OG SER A 33 13.422 -1.661 -1.710 1.00 0.00 O ATOM 0 H SER A 33 11.220 0.043 -2.436 1.00 0.00 H new ATOM 0 HA SER A 33 11.509 -1.299 0.119 1.00 0.00 H new ATOM 0 HB2 SER A 33 13.463 0.386 -1.504 1.00 0.00 H new ATOM 0 HB3 SER A 33 13.871 -0.518 -0.059 1.00 0.00 H new ATOM 0 HG SER A 33 14.359 -1.694 -1.997 1.00 0.00 H new ATOM 519 N LEU A 34 11.786 0.596 1.719 1.00 0.00 N ATOM 520 CA LEU A 34 11.669 1.654 2.709 1.00 0.00 C ATOM 521 C LEU A 34 13.031 1.933 3.347 1.00 0.00 C ATOM 522 O LEU A 34 13.800 1.012 3.618 1.00 0.00 O ATOM 523 CB LEU A 34 10.626 1.243 3.767 1.00 0.00 C ATOM 524 CG LEU A 34 10.554 2.082 5.035 1.00 0.00 C ATOM 525 CD1 LEU A 34 11.533 1.531 6.051 1.00 0.00 C ATOM 526 CD2 LEU A 34 10.812 3.557 4.758 1.00 0.00 C ATOM 0 H LEU A 34 12.023 -0.316 2.110 1.00 0.00 H new ATOM 0 HA LEU A 34 11.335 2.575 2.230 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.643 1.258 3.296 1.00 0.00 H new ATOM 0 HB3 LEU A 34 10.826 0.211 4.056 1.00 0.00 H new ATOM 0 HG LEU A 34 9.543 2.019 5.438 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.486 2.128 6.962 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.275 0.497 6.281 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.543 1.571 5.642 1.00 0.00 H new ATOM 0 HD21 LEU A 34 10.751 4.118 5.690 1.00 0.00 H new ATOM 0 HD22 LEU A 34 11.805 3.678 4.326 1.00 0.00 H new ATOM 0 HD23 LEU A 34 10.064 3.932 4.059 1.00 0.00 H new ATOM 538 N ALA A 35 13.318 3.207 3.585 1.00 0.00 N ATOM 539 CA ALA A 35 14.567 3.627 4.191 1.00 0.00 C ATOM 540 C ALA A 35 14.604 3.219 5.650 1.00 0.00 C ATOM 541 O ALA A 35 13.570 2.981 6.260 1.00 0.00 O ATOM 542 CB ALA A 35 14.744 5.126 4.059 1.00 0.00 C ATOM 0 H ALA A 35 12.687 3.977 3.361 1.00 0.00 H new ATOM 0 HA ALA A 35 15.388 3.136 3.669 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.686 5.423 4.519 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.753 5.400 3.004 1.00 0.00 H new ATOM 0 HB3 ALA A 35 13.920 5.635 4.559 1.00 0.00 H new ATOM 548 N ALA A 36 15.793 3.111 6.200 1.00 0.00 N ATOM 549 CA ALA A 36 15.934 2.679 7.582 1.00 0.00 C ATOM 550 C ALA A 36 15.420 3.739 8.545 1.00 0.00 C ATOM 551 O ALA A 36 15.980 4.828 8.668 1.00 0.00 O ATOM 552 CB ALA A 36 17.388 2.350 7.883 1.00 0.00 C ATOM 0 H ALA A 36 16.671 3.313 5.722 1.00 0.00 H new ATOM 0 HA ALA A 36 15.332 1.781 7.720 1.00 0.00 H new ATOM 0 HB1 ALA A 36 17.481 2.028 8.920 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.724 1.550 7.223 1.00 0.00 H new ATOM 0 HB3 ALA A 36 18.002 3.236 7.722 1.00 0.00 H new ATOM 558 N VAL A 37 14.322 3.388 9.219 1.00 0.00 N ATOM 559 CA VAL A 37 13.669 4.269 10.180 1.00 0.00 C ATOM 560 C VAL A 37 13.455 3.549 11.509 1.00 0.00 C ATOM 561 O VAL A 37 13.622 2.333 11.599 1.00 0.00 O ATOM 562 CB VAL A 37 12.301 4.753 9.652 1.00 0.00 C ATOM 563 CG1 VAL A 37 11.812 5.962 10.433 1.00 0.00 C ATOM 564 CG2 VAL A 37 12.371 5.061 8.162 1.00 0.00 C ATOM 0 H VAL A 37 13.863 2.483 9.111 1.00 0.00 H new ATOM 0 HA VAL A 37 14.322 5.130 10.327 1.00 0.00 H new ATOM 0 HB VAL A 37 11.582 3.947 9.796 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.847 6.282 10.041 1.00 0.00 H new ATOM 0 HG12 VAL A 37 11.706 5.697 11.485 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.532 6.775 10.334 1.00 0.00 H new ATOM 0 HG21 VAL A 37 11.395 5.400 7.814 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.110 5.842 7.986 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.658 4.161 7.618 1.00 0.00 H new ATOM 574 N SER A 38 13.081 4.304 12.538 1.00 0.00 N ATOM 575 CA SER A 38 12.843 3.734 13.860 1.00 0.00 C ATOM 576 C SER A 38 11.816 2.605 13.800 1.00 0.00 C ATOM 577 O SER A 38 12.118 1.462 14.140 1.00 0.00 O ATOM 578 CB SER A 38 12.364 4.821 14.824 1.00 0.00 C ATOM 579 OG SER A 38 13.134 6.003 14.682 1.00 0.00 O ATOM 0 H SER A 38 12.936 5.312 12.482 1.00 0.00 H new ATOM 0 HA SER A 38 13.784 3.320 14.221 1.00 0.00 H new ATOM 0 HB2 SER A 38 11.314 5.042 14.635 1.00 0.00 H new ATOM 0 HB3 SER A 38 12.434 4.459 15.850 1.00 0.00 H new ATOM 0 HG SER A 38 13.053 6.546 15.494 1.00 0.00 H new ATOM 585 N GLU A 39 10.600 2.933 13.370 1.00 0.00 N ATOM 586 CA GLU A 39 9.532 1.938 13.275 1.00 0.00 C ATOM 587 C GLU A 39 8.354 2.427 12.428 1.00 0.00 C ATOM 588 O GLU A 39 7.519 1.628 12.003 1.00 0.00 O ATOM 589 CB GLU A 39 9.039 1.563 14.673 1.00 0.00 C ATOM 590 CG GLU A 39 8.266 0.255 14.715 1.00 0.00 C ATOM 591 CD GLU A 39 6.936 0.383 15.432 1.00 0.00 C ATOM 592 OE1 GLU A 39 6.908 0.985 16.526 1.00 0.00 O ATOM 593 OE2 GLU A 39 5.924 -0.117 14.899 1.00 0.00 O ATOM 0 H GLU A 39 10.329 3.874 13.083 1.00 0.00 H new ATOM 0 HA GLU A 39 9.952 1.062 12.780 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.895 1.491 15.344 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.403 2.363 15.052 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.093 -0.093 13.697 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.870 -0.504 15.212 1.00 0.00 H new ATOM 600 N SER A 40 8.278 3.735 12.194 1.00 0.00 N ATOM 601 CA SER A 40 7.192 4.320 11.408 1.00 0.00 C ATOM 602 C SER A 40 6.886 3.502 10.152 1.00 0.00 C ATOM 603 O SER A 40 5.738 3.427 9.720 1.00 0.00 O ATOM 604 CB SER A 40 7.539 5.757 11.016 1.00 0.00 C ATOM 605 OG SER A 40 8.907 5.875 10.667 1.00 0.00 O ATOM 0 H SER A 40 8.958 4.413 12.539 1.00 0.00 H new ATOM 0 HA SER A 40 6.300 4.314 12.034 1.00 0.00 H new ATOM 0 HB2 SER A 40 6.918 6.068 10.176 1.00 0.00 H new ATOM 0 HB3 SER A 40 7.313 6.428 11.845 1.00 0.00 H new ATOM 0 HG SER A 40 9.181 5.089 10.149 1.00 0.00 H new ATOM 611 N GLN A 41 7.916 2.898 9.566 1.00 0.00 N ATOM 612 CA GLN A 41 7.738 2.099 8.357 1.00 0.00 C ATOM 613 C GLN A 41 6.898 0.858 8.620 1.00 0.00 C ATOM 614 O GLN A 41 6.105 0.443 7.775 1.00 0.00 O ATOM 615 CB GLN A 41 9.088 1.685 7.773 1.00 0.00 C ATOM 616 CG GLN A 41 9.992 0.919 8.733 1.00 0.00 C ATOM 617 CD GLN A 41 9.512 -0.495 9.022 1.00 0.00 C ATOM 618 OE1 GLN A 41 9.738 -1.025 10.108 1.00 0.00 O ATOM 619 NE2 GLN A 41 8.848 -1.117 8.054 1.00 0.00 N ATOM 0 H GLN A 41 8.877 2.946 9.906 1.00 0.00 H new ATOM 0 HA GLN A 41 7.211 2.726 7.638 1.00 0.00 H new ATOM 0 HB2 GLN A 41 8.913 1.069 6.891 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.613 2.580 7.438 1.00 0.00 H new ATOM 0 HG2 GLN A 41 10.998 0.874 8.315 1.00 0.00 H new ATOM 0 HG3 GLN A 41 10.061 1.469 9.671 1.00 0.00 H new ATOM 0 HE21 GLN A 41 8.680 -0.644 7.166 1.00 0.00 H new ATOM 0 HE22 GLN A 41 8.506 -2.067 8.199 1.00 0.00 H new ATOM 628 N LEU A 42 7.090 0.258 9.785 1.00 0.00 N ATOM 629 CA LEU A 42 6.361 -0.952 10.139 1.00 0.00 C ATOM 630 C LEU A 42 4.882 -0.664 10.346 1.00 0.00 C ATOM 631 O LEU A 42 4.024 -1.461 9.966 1.00 0.00 O ATOM 632 CB LEU A 42 6.952 -1.583 11.402 1.00 0.00 C ATOM 633 CG LEU A 42 6.311 -2.906 11.825 1.00 0.00 C ATOM 634 CD1 LEU A 42 7.060 -4.081 11.215 1.00 0.00 C ATOM 635 CD2 LEU A 42 6.282 -3.021 13.342 1.00 0.00 C ATOM 0 H LEU A 42 7.741 0.586 10.499 1.00 0.00 H new ATOM 0 HA LEU A 42 6.460 -1.653 9.310 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.018 -1.747 11.243 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.858 -0.872 12.223 1.00 0.00 H new ATOM 0 HG LEU A 42 5.285 -2.925 11.458 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.590 -5.014 11.527 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.031 -4.006 10.128 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.096 -4.067 11.552 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.823 -3.968 13.626 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.300 -2.980 13.729 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.702 -2.197 13.758 1.00 0.00 H new ATOM 647 N ALA A 43 4.589 0.475 10.953 1.00 0.00 N ATOM 648 CA ALA A 43 3.213 0.864 11.212 1.00 0.00 C ATOM 649 C ALA A 43 2.614 1.602 10.022 1.00 0.00 C ATOM 650 O ALA A 43 1.406 1.549 9.793 1.00 0.00 O ATOM 651 CB ALA A 43 3.142 1.722 12.460 1.00 0.00 C ATOM 0 H ALA A 43 5.286 1.146 11.275 1.00 0.00 H new ATOM 0 HA ALA A 43 2.627 -0.041 11.370 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.107 2.009 12.646 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.521 1.157 13.312 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.747 2.618 12.321 1.00 0.00 H new ATOM 657 N GLN A 44 3.463 2.288 9.262 1.00 0.00 N ATOM 658 CA GLN A 44 3.004 3.028 8.096 1.00 0.00 C ATOM 659 C GLN A 44 2.410 2.077 7.064 1.00 0.00 C ATOM 660 O GLN A 44 1.322 2.314 6.539 1.00 0.00 O ATOM 661 CB GLN A 44 4.156 3.823 7.477 1.00 0.00 C ATOM 662 CG GLN A 44 3.757 4.606 6.236 1.00 0.00 C ATOM 663 CD GLN A 44 3.756 6.105 6.466 1.00 0.00 C ATOM 664 OE1 GLN A 44 4.786 6.766 6.337 1.00 0.00 O ATOM 665 NE2 GLN A 44 2.594 6.650 6.810 1.00 0.00 N ATOM 0 H GLN A 44 4.467 2.345 9.433 1.00 0.00 H new ATOM 0 HA GLN A 44 2.231 3.727 8.416 1.00 0.00 H new ATOM 0 HB2 GLN A 44 4.551 4.514 8.222 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.963 3.137 7.220 1.00 0.00 H new ATOM 0 HG2 GLN A 44 4.444 4.367 5.424 1.00 0.00 H new ATOM 0 HG3 GLN A 44 2.764 4.291 5.916 1.00 0.00 H new ATOM 0 HE21 GLN A 44 1.764 6.064 6.906 1.00 0.00 H new ATOM 0 HE22 GLN A 44 2.532 7.654 6.978 1.00 0.00 H new ATOM 674 N LEU A 45 3.133 1.000 6.777 1.00 0.00 N ATOM 675 CA LEU A 45 2.676 0.012 5.808 1.00 0.00 C ATOM 676 C LEU A 45 1.636 -0.916 6.427 1.00 0.00 C ATOM 677 O LEU A 45 0.636 -1.254 5.795 1.00 0.00 O ATOM 678 CB LEU A 45 3.857 -0.802 5.276 1.00 0.00 C ATOM 679 CG LEU A 45 4.803 -0.051 4.328 1.00 0.00 C ATOM 680 CD1 LEU A 45 5.057 1.365 4.818 1.00 0.00 C ATOM 681 CD2 LEU A 45 6.116 -0.804 4.173 1.00 0.00 C ATOM 0 H LEU A 45 4.036 0.790 7.201 1.00 0.00 H new ATOM 0 HA LEU A 45 2.212 0.544 4.977 1.00 0.00 H new ATOM 0 HB2 LEU A 45 4.436 -1.167 6.124 1.00 0.00 H new ATOM 0 HB3 LEU A 45 3.468 -1.677 4.755 1.00 0.00 H new ATOM 0 HG LEU A 45 4.321 0.010 3.352 1.00 0.00 H new ATOM 0 HD11 LEU A 45 5.730 1.874 4.128 1.00 0.00 H new ATOM 0 HD12 LEU A 45 4.113 1.907 4.870 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.511 1.331 5.809 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.772 -0.256 3.497 1.00 0.00 H new ATOM 0 HD22 LEU A 45 6.597 -0.901 5.146 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.921 -1.795 3.764 1.00 0.00 H new ATOM 692 N LYS A 46 1.882 -1.322 7.669 1.00 0.00 N ATOM 693 CA LYS A 46 0.968 -2.211 8.379 1.00 0.00 C ATOM 694 C LYS A 46 -0.300 -1.475 8.809 1.00 0.00 C ATOM 695 O LYS A 46 -1.281 -2.100 9.211 1.00 0.00 O ATOM 696 CB LYS A 46 1.660 -2.813 9.603 1.00 0.00 C ATOM 697 CG LYS A 46 0.918 -3.998 10.200 1.00 0.00 C ATOM 698 CD LYS A 46 1.880 -5.030 10.765 1.00 0.00 C ATOM 699 CE LYS A 46 2.035 -4.885 12.272 1.00 0.00 C ATOM 700 NZ LYS A 46 1.773 -6.166 12.984 1.00 0.00 N ATOM 0 H LYS A 46 2.706 -1.050 8.205 1.00 0.00 H new ATOM 0 HA LYS A 46 0.682 -3.011 7.696 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.665 -3.128 9.323 1.00 0.00 H new ATOM 0 HB3 LYS A 46 1.768 -2.041 10.365 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.251 -3.651 10.989 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.294 -4.461 9.435 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.519 -6.031 10.530 1.00 0.00 H new ATOM 0 HD3 LYS A 46 2.853 -4.922 10.286 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.044 -4.542 12.502 1.00 0.00 H new ATOM 0 HE3 LYS A 46 1.348 -4.121 12.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 1.889 -6.024 14.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 0.802 -6.481 12.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 2.445 -6.889 12.656 1.00 0.00 H new ATOM 714 N ALA A 47 -0.275 -0.145 8.725 1.00 0.00 N ATOM 715 CA ALA A 47 -1.426 0.668 9.108 1.00 0.00 C ATOM 716 C ALA A 47 -2.702 0.174 8.434 1.00 0.00 C ATOM 717 O ALA A 47 -3.789 0.254 9.006 1.00 0.00 O ATOM 718 CB ALA A 47 -1.177 2.128 8.762 1.00 0.00 C ATOM 0 H ALA A 47 0.528 0.390 8.396 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.559 0.576 10.186 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.042 2.723 9.053 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.296 2.483 9.296 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.014 2.225 7.689 1.00 0.00 H new ATOM 724 N ASP A 48 -2.560 -0.338 7.217 1.00 0.00 N ATOM 725 CA ASP A 48 -3.701 -0.848 6.464 1.00 0.00 C ATOM 726 C ASP A 48 -3.498 -2.317 6.099 1.00 0.00 C ATOM 727 O ASP A 48 -2.452 -2.692 5.569 1.00 0.00 O ATOM 728 CB ASP A 48 -3.912 -0.020 5.194 1.00 0.00 C ATOM 729 CG ASP A 48 -2.699 -0.038 4.285 1.00 0.00 C ATOM 730 OD1 ASP A 48 -1.592 -0.341 4.777 1.00 0.00 O ATOM 731 OD2 ASP A 48 -2.856 0.252 3.080 1.00 0.00 O ATOM 0 H ASP A 48 -1.667 -0.411 6.730 1.00 0.00 H new ATOM 0 HA ASP A 48 -4.587 -0.767 7.094 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -4.775 -0.405 4.651 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -4.142 1.010 5.469 1.00 0.00 H new ATOM 736 N PRO A 49 -4.497 -3.174 6.380 1.00 0.00 N ATOM 737 CA PRO A 49 -4.415 -4.603 6.078 1.00 0.00 C ATOM 738 C PRO A 49 -4.641 -4.895 4.598 1.00 0.00 C ATOM 739 O PRO A 49 -5.672 -5.448 4.214 1.00 0.00 O ATOM 740 CB PRO A 49 -5.540 -5.198 6.922 1.00 0.00 C ATOM 741 CG PRO A 49 -6.554 -4.111 7.009 1.00 0.00 C ATOM 742 CD PRO A 49 -5.782 -2.817 7.015 1.00 0.00 C ATOM 0 HA PRO A 49 -3.431 -5.017 6.299 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -5.955 -6.092 6.457 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -5.184 -5.489 7.910 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.241 -4.151 6.164 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.155 -4.210 7.913 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -6.302 -2.038 6.457 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.638 -2.441 8.028 1.00 0.00 H new ATOM 750 N ARG A 50 -3.670 -4.521 3.771 1.00 0.00 N ATOM 751 CA ARG A 50 -3.765 -4.743 2.333 1.00 0.00 C ATOM 752 C ARG A 50 -2.484 -5.372 1.794 1.00 0.00 C ATOM 753 O ARG A 50 -2.517 -6.433 1.172 1.00 0.00 O ATOM 754 CB ARG A 50 -4.043 -3.424 1.609 1.00 0.00 C ATOM 755 CG ARG A 50 -5.376 -2.794 1.980 1.00 0.00 C ATOM 756 CD ARG A 50 -6.105 -2.267 0.754 1.00 0.00 C ATOM 757 NE ARG A 50 -6.819 -1.023 1.033 1.00 0.00 N ATOM 758 CZ ARG A 50 -6.235 0.172 1.088 1.00 0.00 C ATOM 759 NH1 ARG A 50 -4.928 0.290 0.885 1.00 0.00 N ATOM 760 NH2 ARG A 50 -6.959 1.253 1.347 1.00 0.00 N ATOM 0 H ARG A 50 -2.809 -4.063 4.072 1.00 0.00 H new ATOM 0 HA ARG A 50 -4.591 -5.430 2.151 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -3.243 -2.720 1.835 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.020 -3.598 0.533 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.999 -3.531 2.486 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -5.211 -1.979 2.684 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -5.388 -2.101 -0.050 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.811 -3.019 0.401 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.825 -1.073 1.195 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -4.366 -0.538 0.686 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -4.486 1.208 0.928 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -7.963 1.169 1.504 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -6.511 2.169 1.389 1.00 0.00 H new ATOM 774 N LEU A 51 -1.358 -4.709 2.037 1.00 0.00 N ATOM 775 CA LEU A 51 -0.066 -5.203 1.574 1.00 0.00 C ATOM 776 C LEU A 51 0.687 -5.889 2.712 1.00 0.00 C ATOM 777 O LEU A 51 0.273 -5.823 3.869 1.00 0.00 O ATOM 778 CB LEU A 51 0.775 -4.055 1.006 1.00 0.00 C ATOM 779 CG LEU A 51 0.242 -3.415 -0.281 1.00 0.00 C ATOM 780 CD1 LEU A 51 -1.227 -3.046 -0.141 1.00 0.00 C ATOM 781 CD2 LEU A 51 1.065 -2.188 -0.637 1.00 0.00 C ATOM 0 H LEU A 51 -1.314 -3.829 2.551 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.244 -5.932 0.784 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.860 -3.280 1.767 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.782 -4.426 0.815 1.00 0.00 H new ATOM 0 HG LEU A 51 0.330 -4.145 -1.086 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.579 -2.594 -1.068 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.809 -3.943 0.069 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.347 -2.336 0.677 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.677 -1.743 -1.553 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.005 -1.462 0.174 1.00 0.00 H new ATOM 0 HD23 LEU A 51 2.105 -2.478 -0.787 1.00 0.00 H new ATOM 793 N VAL A 52 1.789 -6.553 2.374 1.00 0.00 N ATOM 794 CA VAL A 52 2.592 -7.258 3.369 1.00 0.00 C ATOM 795 C VAL A 52 3.885 -6.510 3.680 1.00 0.00 C ATOM 796 O VAL A 52 4.814 -6.494 2.873 1.00 0.00 O ATOM 797 CB VAL A 52 2.955 -8.675 2.892 1.00 0.00 C ATOM 798 CG1 VAL A 52 3.440 -9.535 4.049 1.00 0.00 C ATOM 799 CG2 VAL A 52 1.774 -9.330 2.189 1.00 0.00 C ATOM 0 H VAL A 52 2.146 -6.618 1.421 1.00 0.00 H new ATOM 0 HA VAL A 52 1.982 -7.318 4.270 1.00 0.00 H new ATOM 0 HB VAL A 52 3.771 -8.587 2.175 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.689 -10.531 3.683 1.00 0.00 H new ATOM 0 HG12 VAL A 52 4.325 -9.080 4.495 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.654 -9.611 4.800 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.055 -10.331 1.861 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.932 -9.397 2.878 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.488 -8.732 1.324 1.00 0.00 H new ATOM 809 N VAL A 53 3.942 -5.909 4.861 1.00 0.00 N ATOM 810 CA VAL A 53 5.127 -5.176 5.296 1.00 0.00 C ATOM 811 C VAL A 53 5.946 -6.022 6.265 1.00 0.00 C ATOM 812 O VAL A 53 5.493 -6.345 7.362 1.00 0.00 O ATOM 813 CB VAL A 53 4.754 -3.826 5.952 1.00 0.00 C ATOM 814 CG1 VAL A 53 3.571 -3.986 6.897 1.00 0.00 C ATOM 815 CG2 VAL A 53 5.940 -3.207 6.684 1.00 0.00 C ATOM 0 H VAL A 53 3.179 -5.914 5.538 1.00 0.00 H new ATOM 0 HA VAL A 53 5.726 -4.962 4.411 1.00 0.00 H new ATOM 0 HB VAL A 53 4.467 -3.147 5.149 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.330 -3.022 7.345 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.709 -4.354 6.341 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.827 -4.697 7.683 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.638 -2.260 7.131 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.279 -3.886 7.466 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.752 -3.032 5.978 1.00 0.00 H new ATOM 825 N GLN A 54 7.148 -6.386 5.838 1.00 0.00 N ATOM 826 CA GLN A 54 8.034 -7.212 6.656 1.00 0.00 C ATOM 827 C GLN A 54 9.412 -6.571 6.809 1.00 0.00 C ATOM 828 O GLN A 54 10.068 -6.246 5.821 1.00 0.00 O ATOM 829 CB GLN A 54 8.172 -8.606 6.038 1.00 0.00 C ATOM 830 CG GLN A 54 7.838 -9.734 6.999 1.00 0.00 C ATOM 831 CD GLN A 54 7.527 -11.034 6.285 1.00 0.00 C ATOM 832 OE1 GLN A 54 8.388 -11.904 6.151 1.00 0.00 O ATOM 833 NE2 GLN A 54 6.291 -11.174 5.821 1.00 0.00 N ATOM 0 H GLN A 54 7.534 -6.124 4.931 1.00 0.00 H new ATOM 0 HA GLN A 54 7.590 -7.297 7.648 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.518 -8.675 5.169 1.00 0.00 H new ATOM 0 HB3 GLN A 54 9.193 -8.736 5.680 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.677 -9.888 7.678 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.982 -9.445 7.609 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.609 -10.428 5.954 1.00 0.00 H new ATOM 0 HE22 GLN A 54 6.024 -12.028 5.331 1.00 0.00 H new ATOM 842 N ILE A 55 9.843 -6.406 8.059 1.00 0.00 N ATOM 843 CA ILE A 55 11.143 -5.811 8.360 1.00 0.00 C ATOM 844 C ILE A 55 12.242 -6.869 8.394 1.00 0.00 C ATOM 845 O ILE A 55 12.012 -8.005 8.806 1.00 0.00 O ATOM 846 CB ILE A 55 11.120 -5.076 9.717 1.00 0.00 C ATOM 847 CG1 ILE A 55 10.838 -6.060 10.856 1.00 0.00 C ATOM 848 CG2 ILE A 55 10.082 -3.965 9.703 1.00 0.00 C ATOM 849 CD1 ILE A 55 12.086 -6.695 11.431 1.00 0.00 C ATOM 0 H ILE A 55 9.307 -6.678 8.883 1.00 0.00 H new ATOM 0 HA ILE A 55 11.354 -5.097 7.564 1.00 0.00 H new ATOM 0 HB ILE A 55 12.100 -4.629 9.883 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.306 -5.539 11.652 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.176 -6.845 10.491 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.079 -3.457 10.668 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.325 -3.250 8.917 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.096 -4.390 9.514 1.00 0.00 H new ATOM 0 HD11 ILE A 55 11.810 -7.380 12.233 1.00 0.00 H new ATOM 0 HD12 ILE A 55 12.608 -7.245 10.648 1.00 0.00 H new ATOM 0 HD13 ILE A 55 12.740 -5.918 11.827 1.00 0.00 H new ATOM 861 N THR A 56 13.439 -6.484 7.961 1.00 0.00 N ATOM 862 CA THR A 56 14.577 -7.392 7.946 1.00 0.00 C ATOM 863 C THR A 56 15.725 -6.829 8.777 1.00 0.00 C ATOM 864 O THR A 56 16.419 -5.905 8.351 1.00 0.00 O ATOM 865 CB THR A 56 15.044 -7.636 6.509 1.00 0.00 C ATOM 866 OG1 THR A 56 15.579 -6.450 5.948 1.00 0.00 O ATOM 867 CG2 THR A 56 13.939 -8.118 5.595 1.00 0.00 C ATOM 0 H THR A 56 13.644 -5.547 7.615 1.00 0.00 H new ATOM 0 HA THR A 56 14.263 -8.340 8.382 1.00 0.00 H new ATOM 0 HB THR A 56 15.802 -8.417 6.579 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.808 -5.823 6.666 1.00 0.00 H new ATOM 0 HG21 THR A 56 14.337 -8.271 4.592 1.00 0.00 H new ATOM 0 HG22 THR A 56 13.538 -9.058 5.974 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.145 -7.372 5.560 1.00 0.00 H new ATOM 875 N GLU A 57 15.915 -7.391 9.964 1.00 0.00 N ATOM 876 CA GLU A 57 16.976 -6.945 10.861 1.00 0.00 C ATOM 877 C GLU A 57 18.346 -7.094 10.205 1.00 0.00 C ATOM 878 O GLU A 57 18.938 -6.114 9.755 1.00 0.00 O ATOM 879 CB GLU A 57 16.932 -7.738 12.168 1.00 0.00 C ATOM 880 CG GLU A 57 15.717 -7.428 13.027 1.00 0.00 C ATOM 881 CD GLU A 57 15.946 -7.737 14.493 1.00 0.00 C ATOM 882 OE1 GLU A 57 16.797 -8.603 14.791 1.00 0.00 O ATOM 883 OE2 GLU A 57 15.274 -7.117 15.343 1.00 0.00 O ATOM 0 H GLU A 57 15.349 -8.157 10.329 1.00 0.00 H new ATOM 0 HA GLU A 57 16.814 -5.889 11.079 1.00 0.00 H new ATOM 0 HB2 GLU A 57 16.941 -8.803 11.937 1.00 0.00 H new ATOM 0 HB3 GLU A 57 17.835 -7.528 12.741 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.458 -6.375 12.918 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.865 -8.005 12.667 1.00 0.00 H new ATOM 890 N THR A 58 18.844 -8.325 10.156 1.00 0.00 N ATOM 891 CA THR A 58 20.144 -8.600 9.557 1.00 0.00 C ATOM 892 C THR A 58 19.989 -9.335 8.229 1.00 0.00 C ATOM 893 O THR A 58 19.584 -10.497 8.197 1.00 0.00 O ATOM 894 CB THR A 58 21.006 -9.425 10.513 1.00 0.00 C ATOM 895 OG1 THR A 58 20.227 -10.410 11.166 1.00 0.00 O ATOM 896 CG2 THR A 58 21.681 -8.591 11.580 1.00 0.00 C ATOM 0 H THR A 58 18.367 -9.148 10.524 1.00 0.00 H new ATOM 0 HA THR A 58 20.636 -7.646 9.367 1.00 0.00 H new ATOM 0 HB THR A 58 21.776 -9.880 9.889 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.683 -10.888 10.505 1.00 0.00 H new ATOM 0 HG21 THR A 58 22.277 -9.237 12.224 1.00 0.00 H new ATOM 0 HG22 THR A 58 22.329 -7.852 11.109 1.00 0.00 H new ATOM 0 HG23 THR A 58 20.924 -8.082 12.177 1.00 0.00 H new ATOM 904 N GLY A 59 20.314 -8.650 7.139 1.00 0.00 N ATOM 905 CA GLY A 59 20.205 -9.254 5.822 1.00 0.00 C ATOM 906 C GLY A 59 21.551 -9.408 5.142 1.00 0.00 C ATOM 907 O GLY A 59 21.636 -9.414 3.914 1.00 0.00 O ATOM 0 H GLY A 59 20.651 -7.687 7.142 1.00 0.00 H new ATOM 0 HA2 GLY A 59 19.733 -10.232 5.912 1.00 0.00 H new ATOM 0 HA3 GLY A 59 19.554 -8.642 5.198 1.00 0.00 H new ATOM 911 N SER A 60 22.605 -9.536 5.941 1.00 0.00 N ATOM 912 CA SER A 60 23.954 -9.692 5.409 1.00 0.00 C ATOM 913 C SER A 60 24.466 -11.110 5.633 1.00 0.00 C ATOM 914 O SER A 60 25.232 -11.639 4.827 1.00 0.00 O ATOM 915 CB SER A 60 24.902 -8.686 6.065 1.00 0.00 C ATOM 916 OG SER A 60 26.232 -8.867 5.609 1.00 0.00 O ATOM 0 H SER A 60 22.551 -9.535 6.960 1.00 0.00 H new ATOM 0 HA SER A 60 23.919 -9.503 4.336 1.00 0.00 H new ATOM 0 HB2 SER A 60 24.572 -7.671 5.841 1.00 0.00 H new ATOM 0 HB3 SER A 60 24.867 -8.801 7.148 1.00 0.00 H new ATOM 0 HG SER A 60 26.818 -8.211 6.042 1.00 0.00 H new ATOM 922 N GLN A 61 24.037 -11.722 6.733 1.00 0.00 N ATOM 923 CA GLN A 61 24.452 -13.081 7.062 1.00 0.00 C ATOM 924 C GLN A 61 23.772 -14.094 6.146 1.00 0.00 C ATOM 925 O GLN A 61 22.626 -14.481 6.375 1.00 0.00 O ATOM 926 CB GLN A 61 24.126 -13.393 8.524 1.00 0.00 C ATOM 927 CG GLN A 61 25.306 -13.955 9.303 1.00 0.00 C ATOM 928 CD GLN A 61 26.318 -12.889 9.675 1.00 0.00 C ATOM 929 OE1 GLN A 61 26.242 -12.295 10.751 1.00 0.00 O ATOM 930 NE2 GLN A 61 27.271 -12.642 8.786 1.00 0.00 N ATOM 0 H GLN A 61 23.403 -11.299 7.411 1.00 0.00 H new ATOM 0 HA GLN A 61 25.529 -13.154 6.914 1.00 0.00 H new ATOM 0 HB2 GLN A 61 23.779 -12.483 9.013 1.00 0.00 H new ATOM 0 HB3 GLN A 61 23.304 -14.108 8.560 1.00 0.00 H new ATOM 0 HG2 GLN A 61 24.942 -14.437 10.210 1.00 0.00 H new ATOM 0 HG3 GLN A 61 25.797 -14.725 8.707 1.00 0.00 H new ATOM 0 HE21 GLN A 61 27.295 -13.159 7.907 1.00 0.00 H new ATOM 0 HE22 GLN A 61 27.980 -11.935 8.981 1.00 0.00 H new ATOM 939 N GLU A 62 24.485 -14.517 5.108 1.00 0.00 N ATOM 940 CA GLU A 62 23.951 -15.485 4.157 1.00 0.00 C ATOM 941 C GLU A 62 22.711 -14.932 3.460 1.00 0.00 C ATOM 942 O GLU A 62 21.593 -15.076 3.955 1.00 0.00 O ATOM 943 CB GLU A 62 23.613 -16.798 4.868 1.00 0.00 C ATOM 944 CG GLU A 62 24.419 -17.985 4.367 1.00 0.00 C ATOM 945 CD GLU A 62 23.748 -18.698 3.208 1.00 0.00 C ATOM 946 OE1 GLU A 62 22.930 -19.606 3.465 1.00 0.00 O ATOM 947 OE2 GLU A 62 24.040 -18.349 2.046 1.00 0.00 O ATOM 0 H GLU A 62 25.434 -14.205 4.904 1.00 0.00 H new ATOM 0 HA GLU A 62 24.714 -15.678 3.403 1.00 0.00 H new ATOM 0 HB2 GLU A 62 23.786 -16.677 5.937 1.00 0.00 H new ATOM 0 HB3 GLU A 62 22.552 -17.009 4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 62 25.407 -17.644 4.056 1.00 0.00 H new ATOM 0 HG3 GLU A 62 24.568 -18.690 5.185 1.00 0.00 H new ATOM 954 N GLY A 63 22.917 -14.299 2.310 1.00 0.00 N ATOM 955 CA GLY A 63 21.807 -13.736 1.565 1.00 0.00 C ATOM 956 C GLY A 63 21.327 -14.651 0.455 1.00 0.00 C ATOM 957 O GLY A 63 21.593 -15.852 0.476 1.00 0.00 O ATOM 0 H GLY A 63 23.833 -14.166 1.881 1.00 0.00 H new ATOM 0 HA2 GLY A 63 20.981 -13.534 2.247 1.00 0.00 H new ATOM 0 HA3 GLY A 63 22.109 -12.780 1.138 1.00 0.00 H new ATOM 961 N GLY A 64 20.620 -14.081 -0.514 1.00 0.00 N ATOM 962 CA GLY A 64 20.113 -14.869 -1.624 1.00 0.00 C ATOM 963 C GLY A 64 20.437 -14.250 -2.969 1.00 0.00 C ATOM 964 O GLY A 64 21.159 -13.256 -3.045 1.00 0.00 O ATOM 0 H GLY A 64 20.388 -13.088 -0.552 1.00 0.00 H new ATOM 0 HA2 GLY A 64 20.537 -15.872 -1.577 1.00 0.00 H new ATOM 0 HA3 GLY A 64 19.033 -14.975 -1.527 1.00 0.00 H new ATOM 968 N GLU A 65 19.902 -14.841 -4.033 1.00 0.00 N ATOM 969 CA GLU A 65 20.138 -14.342 -5.383 1.00 0.00 C ATOM 970 C GLU A 65 18.905 -13.624 -5.921 1.00 0.00 C ATOM 971 O GLU A 65 19.015 -12.685 -6.709 1.00 0.00 O ATOM 972 CB GLU A 65 20.521 -15.492 -6.316 1.00 0.00 C ATOM 973 CG GLU A 65 19.635 -16.718 -6.167 1.00 0.00 C ATOM 974 CD GLU A 65 20.220 -17.749 -5.222 1.00 0.00 C ATOM 975 OE1 GLU A 65 19.997 -17.629 -4.000 1.00 0.00 O ATOM 976 OE2 GLU A 65 20.902 -18.678 -5.706 1.00 0.00 O ATOM 0 H GLU A 65 19.303 -15.665 -3.986 1.00 0.00 H new ATOM 0 HA GLU A 65 20.962 -13.629 -5.340 1.00 0.00 H new ATOM 0 HB2 GLU A 65 20.473 -15.143 -7.348 1.00 0.00 H new ATOM 0 HB3 GLU A 65 21.555 -15.776 -6.123 1.00 0.00 H new ATOM 0 HG2 GLU A 65 18.655 -16.411 -5.802 1.00 0.00 H new ATOM 0 HG3 GLU A 65 19.483 -17.173 -7.146 1.00 0.00 H new ATOM 983 N GLY A 66 17.729 -14.072 -5.490 1.00 0.00 N ATOM 984 CA GLY A 66 16.492 -13.460 -5.938 1.00 0.00 C ATOM 985 C GLY A 66 15.647 -14.400 -6.775 1.00 0.00 C ATOM 986 O GLY A 66 16.165 -15.115 -7.634 1.00 0.00 O ATOM 0 H GLY A 66 17.612 -14.848 -4.838 1.00 0.00 H new ATOM 0 HA2 GLY A 66 15.917 -13.135 -5.071 1.00 0.00 H new ATOM 0 HA3 GLY A 66 16.722 -12.568 -6.521 1.00 0.00 H new ATOM 990 N LEU A 67 14.342 -14.401 -6.523 1.00 0.00 N ATOM 991 CA LEU A 67 13.421 -15.259 -7.259 1.00 0.00 C ATOM 992 C LEU A 67 12.055 -14.596 -7.398 1.00 0.00 C ATOM 993 O LEU A 67 11.020 -15.249 -7.267 1.00 0.00 O ATOM 994 CB LEU A 67 13.277 -16.610 -6.553 1.00 0.00 C ATOM 995 CG LEU A 67 14.354 -17.639 -6.901 1.00 0.00 C ATOM 996 CD1 LEU A 67 14.699 -18.484 -5.684 1.00 0.00 C ATOM 997 CD2 LEU A 67 13.894 -18.523 -8.051 1.00 0.00 C ATOM 0 H LEU A 67 13.898 -13.817 -5.814 1.00 0.00 H new ATOM 0 HA LEU A 67 13.830 -15.420 -8.257 1.00 0.00 H new ATOM 0 HB2 LEU A 67 13.289 -16.443 -5.476 1.00 0.00 H new ATOM 0 HB3 LEU A 67 12.302 -17.030 -6.799 1.00 0.00 H new ATOM 0 HG LEU A 67 15.251 -17.105 -7.214 1.00 0.00 H new ATOM 0 HD11 LEU A 67 15.467 -19.210 -5.951 1.00 0.00 H new ATOM 0 HD12 LEU A 67 15.070 -17.840 -4.887 1.00 0.00 H new ATOM 0 HD13 LEU A 67 13.807 -19.008 -5.341 1.00 0.00 H new ATOM 0 HD21 LEU A 67 14.672 -19.249 -8.285 1.00 0.00 H new ATOM 0 HD22 LEU A 67 12.983 -19.048 -7.765 1.00 0.00 H new ATOM 0 HD23 LEU A 67 13.697 -17.906 -8.928 1.00 0.00 H new ATOM 1009 N SER A 68 12.061 -13.294 -7.664 1.00 0.00 N ATOM 1010 CA SER A 68 10.823 -12.540 -7.820 1.00 0.00 C ATOM 1011 C SER A 68 10.433 -12.430 -9.291 1.00 0.00 C ATOM 1012 O SER A 68 11.286 -12.227 -10.156 1.00 0.00 O ATOM 1013 CB SER A 68 10.972 -11.144 -7.215 1.00 0.00 C ATOM 1014 OG SER A 68 9.752 -10.702 -6.644 1.00 0.00 O ATOM 0 H SER A 68 12.910 -12.739 -7.776 1.00 0.00 H new ATOM 0 HA SER A 68 10.033 -13.075 -7.293 1.00 0.00 H new ATOM 0 HB2 SER A 68 11.751 -11.156 -6.452 1.00 0.00 H new ATOM 0 HB3 SER A 68 11.292 -10.443 -7.986 1.00 0.00 H new ATOM 0 HG SER A 68 9.874 -9.808 -6.262 1.00 0.00 H new ATOM 1020 N LYS A 69 9.140 -12.564 -9.567 1.00 0.00 N ATOM 1021 CA LYS A 69 8.636 -12.479 -10.932 1.00 0.00 C ATOM 1022 C LYS A 69 7.739 -11.258 -11.106 1.00 0.00 C ATOM 1023 O LYS A 69 6.807 -11.045 -10.331 1.00 0.00 O ATOM 1024 CB LYS A 69 7.863 -13.749 -11.293 1.00 0.00 C ATOM 1025 CG LYS A 69 7.839 -14.045 -12.783 1.00 0.00 C ATOM 1026 CD LYS A 69 9.116 -14.739 -13.234 1.00 0.00 C ATOM 1027 CE LYS A 69 8.899 -16.230 -13.434 1.00 0.00 C ATOM 1028 NZ LYS A 69 10.138 -16.914 -13.895 1.00 0.00 N ATOM 0 H LYS A 69 8.422 -12.732 -8.862 1.00 0.00 H new ATOM 0 HA LYS A 69 9.490 -12.379 -11.602 1.00 0.00 H new ATOM 0 HB2 LYS A 69 8.308 -14.596 -10.770 1.00 0.00 H new ATOM 0 HB3 LYS A 69 6.838 -13.655 -10.933 1.00 0.00 H new ATOM 0 HG2 LYS A 69 6.980 -14.674 -13.016 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.713 -13.115 -13.338 1.00 0.00 H new ATOM 0 HD2 LYS A 69 9.464 -14.293 -14.166 1.00 0.00 H new ATOM 0 HD3 LYS A 69 9.899 -14.580 -12.492 1.00 0.00 H new ATOM 0 HE2 LYS A 69 8.564 -16.677 -12.498 1.00 0.00 H new ATOM 0 HE3 LYS A 69 8.105 -16.387 -14.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 9.948 -17.929 -14.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 10.444 -16.505 -14.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 10.889 -16.787 -13.187 1.00 0.00 H new ATOM 1042 N GLU A 70 8.027 -10.460 -12.129 1.00 0.00 N ATOM 1043 CA GLU A 70 7.245 -9.260 -12.403 1.00 0.00 C ATOM 1044 C GLU A 70 6.051 -9.581 -13.301 1.00 0.00 C ATOM 1045 O GLU A 70 4.910 -9.268 -12.963 1.00 0.00 O ATOM 1046 CB GLU A 70 8.124 -8.190 -13.057 1.00 0.00 C ATOM 1047 CG GLU A 70 8.266 -6.927 -12.224 1.00 0.00 C ATOM 1048 CD GLU A 70 9.614 -6.257 -12.403 1.00 0.00 C ATOM 1049 OE1 GLU A 70 10.568 -6.644 -11.696 1.00 0.00 O ATOM 1050 OE2 GLU A 70 9.716 -5.346 -13.252 1.00 0.00 O ATOM 0 H GLU A 70 8.795 -10.622 -12.781 1.00 0.00 H new ATOM 0 HA GLU A 70 6.868 -8.877 -11.455 1.00 0.00 H new ATOM 0 HB2 GLU A 70 9.114 -8.607 -13.241 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.703 -7.929 -14.028 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.477 -6.226 -12.497 1.00 0.00 H new ATOM 0 HG3 GLU A 70 8.124 -7.173 -11.172 1.00 0.00 H new ATOM 1057 N PRO A 71 6.298 -10.215 -14.461 1.00 0.00 N ATOM 1058 CA PRO A 71 5.234 -10.578 -15.404 1.00 0.00 C ATOM 1059 C PRO A 71 4.099 -11.341 -14.728 1.00 0.00 C ATOM 1060 O PRO A 71 2.925 -11.116 -15.022 1.00 0.00 O ATOM 1061 CB PRO A 71 5.948 -11.472 -16.420 1.00 0.00 C ATOM 1062 CG PRO A 71 7.373 -11.043 -16.368 1.00 0.00 C ATOM 1063 CD PRO A 71 7.629 -10.628 -14.945 1.00 0.00 C ATOM 0 HA PRO A 71 4.764 -9.700 -15.847 1.00 0.00 H new ATOM 0 HB2 PRO A 71 5.842 -12.526 -16.163 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.533 -11.345 -17.420 1.00 0.00 H new ATOM 0 HG2 PRO A 71 8.036 -11.856 -16.663 1.00 0.00 H new ATOM 0 HG3 PRO A 71 7.557 -10.217 -17.055 1.00 0.00 H new ATOM 0 HD2 PRO A 71 8.034 -11.450 -14.354 1.00 0.00 H new ATOM 0 HD3 PRO A 71 8.348 -9.811 -14.889 1.00 0.00 H new ATOM 1071 N ALA A 72 4.459 -12.244 -13.822 1.00 0.00 N ATOM 1072 CA ALA A 72 3.472 -13.041 -13.103 1.00 0.00 C ATOM 1073 C ALA A 72 2.535 -12.151 -12.293 1.00 0.00 C ATOM 1074 O ALA A 72 2.920 -11.072 -11.844 1.00 0.00 O ATOM 1075 CB ALA A 72 4.165 -14.045 -12.195 1.00 0.00 C ATOM 0 H ALA A 72 5.427 -12.442 -13.568 1.00 0.00 H new ATOM 0 HA ALA A 72 2.874 -13.583 -13.836 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.416 -14.633 -11.664 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.789 -14.708 -12.795 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.787 -13.515 -11.474 1.00 0.00 H new ATOM 1081 N GLY A 73 1.302 -12.611 -12.110 1.00 0.00 N ATOM 1082 CA GLY A 73 0.328 -11.845 -11.353 1.00 0.00 C ATOM 1083 C GLY A 73 -1.089 -12.338 -11.565 1.00 0.00 C ATOM 1084 O GLY A 73 -1.610 -13.115 -10.765 1.00 0.00 O ATOM 0 H GLY A 73 0.959 -13.501 -12.472 1.00 0.00 H new ATOM 0 HA2 GLY A 73 0.573 -11.899 -10.292 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.391 -10.796 -11.642 1.00 0.00 H new ATOM 1088 N SER A 74 -1.717 -11.884 -12.645 1.00 0.00 N ATOM 1089 CA SER A 74 -3.084 -12.283 -12.959 1.00 0.00 C ATOM 1090 C SER A 74 -3.513 -11.730 -14.314 1.00 0.00 C ATOM 1091 O SER A 74 -3.385 -10.535 -14.579 1.00 0.00 O ATOM 1092 CB SER A 74 -4.042 -11.796 -11.870 1.00 0.00 C ATOM 1093 OG SER A 74 -3.596 -10.574 -11.306 1.00 0.00 O ATOM 0 H SER A 74 -1.301 -11.240 -13.317 1.00 0.00 H new ATOM 0 HA SER A 74 -3.118 -13.372 -13.003 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.039 -11.663 -12.291 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.124 -12.552 -11.089 1.00 0.00 H new ATOM 0 HG SER A 74 -4.226 -10.284 -10.614 1.00 0.00 H new ATOM 1099 N ASP A 75 -4.024 -12.609 -15.170 1.00 0.00 N ATOM 1100 CA ASP A 75 -4.472 -12.209 -16.500 1.00 0.00 C ATOM 1101 C ASP A 75 -5.578 -13.131 -17.002 1.00 0.00 C ATOM 1102 O ASP A 75 -5.476 -14.353 -16.903 1.00 0.00 O ATOM 1103 CB ASP A 75 -3.299 -12.219 -17.481 1.00 0.00 C ATOM 1104 CG ASP A 75 -3.368 -11.079 -18.477 1.00 0.00 C ATOM 1105 OD1 ASP A 75 -3.953 -10.029 -18.138 1.00 0.00 O ATOM 1106 OD2 ASP A 75 -2.838 -11.236 -19.597 1.00 0.00 O ATOM 0 H ASP A 75 -4.138 -13.602 -14.967 1.00 0.00 H new ATOM 0 HA ASP A 75 -4.871 -11.197 -16.432 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -2.364 -12.156 -16.925 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.287 -13.167 -18.019 1.00 0.00 H new ATOM 1111 N GLU A 76 -6.637 -12.534 -17.543 1.00 0.00 N ATOM 1112 CA GLU A 76 -7.765 -13.297 -18.064 1.00 0.00 C ATOM 1113 C GLU A 76 -8.454 -14.083 -16.950 1.00 0.00 C ATOM 1114 O GLU A 76 -9.475 -13.652 -16.416 1.00 0.00 O ATOM 1115 CB GLU A 76 -7.299 -14.246 -19.172 1.00 0.00 C ATOM 1116 CG GLU A 76 -7.633 -13.757 -20.573 1.00 0.00 C ATOM 1117 CD GLU A 76 -6.870 -14.506 -21.649 1.00 0.00 C ATOM 1118 OE1 GLU A 76 -6.371 -15.614 -21.362 1.00 0.00 O ATOM 1119 OE2 GLU A 76 -6.770 -13.981 -22.778 1.00 0.00 O ATOM 0 H GLU A 76 -6.736 -11.523 -17.631 1.00 0.00 H new ATOM 0 HA GLU A 76 -8.486 -12.594 -18.482 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -6.221 -14.383 -19.092 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -7.757 -15.223 -19.018 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -8.703 -13.868 -20.747 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -7.407 -12.693 -20.646 1.00 0.00 H new ATOM 1126 N GLN A 77 -7.890 -15.237 -16.604 1.00 0.00 N ATOM 1127 CA GLN A 77 -8.452 -16.080 -15.555 1.00 0.00 C ATOM 1128 C GLN A 77 -9.906 -16.431 -15.855 1.00 0.00 C ATOM 1129 O GLN A 77 -10.425 -16.104 -16.923 1.00 0.00 O ATOM 1130 CB GLN A 77 -8.352 -15.377 -14.199 1.00 0.00 C ATOM 1131 CG GLN A 77 -7.962 -16.304 -13.059 1.00 0.00 C ATOM 1132 CD GLN A 77 -6.475 -16.274 -12.766 1.00 0.00 C ATOM 1133 OE1 GLN A 77 -5.650 -16.243 -13.680 1.00 0.00 O ATOM 1134 NE2 GLN A 77 -6.123 -16.283 -11.486 1.00 0.00 N ATOM 0 H GLN A 77 -7.044 -15.609 -17.035 1.00 0.00 H new ATOM 0 HA GLN A 77 -7.876 -17.005 -15.521 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -7.619 -14.573 -14.269 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -9.311 -14.914 -13.968 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -8.511 -16.021 -12.161 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -8.259 -17.323 -13.306 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -6.839 -16.309 -10.760 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -5.136 -16.264 -11.228 1.00 0.00 H new ATOM 1143 N LYS A 78 -10.559 -17.096 -14.907 1.00 0.00 N ATOM 1144 CA LYS A 78 -11.954 -17.488 -15.072 1.00 0.00 C ATOM 1145 C LYS A 78 -12.887 -16.318 -14.779 1.00 0.00 C ATOM 1146 O LYS A 78 -12.916 -15.800 -13.663 1.00 0.00 O ATOM 1147 CB LYS A 78 -12.287 -18.664 -14.152 1.00 0.00 C ATOM 1148 CG LYS A 78 -13.328 -19.609 -14.727 1.00 0.00 C ATOM 1149 CD LYS A 78 -13.111 -21.035 -14.247 1.00 0.00 C ATOM 1150 CE LYS A 78 -14.420 -21.805 -14.175 1.00 0.00 C ATOM 1151 NZ LYS A 78 -14.446 -22.755 -13.029 1.00 0.00 N ATOM 0 H LYS A 78 -10.145 -17.374 -14.017 1.00 0.00 H new ATOM 0 HA LYS A 78 -12.099 -17.794 -16.108 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -11.374 -19.224 -13.946 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -12.646 -18.278 -13.198 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -14.324 -19.274 -14.438 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -13.286 -19.580 -15.816 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -12.424 -21.546 -14.921 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -12.641 -21.021 -13.263 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -15.249 -21.103 -14.083 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -14.569 -22.354 -15.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -15.355 -23.259 -13.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.671 -23.441 -13.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -14.330 -22.229 -12.139 1.00 0.00 H new ATOM 1165 N GLN A 79 -13.647 -15.906 -15.788 1.00 0.00 N ATOM 1166 CA GLN A 79 -14.581 -14.796 -15.637 1.00 0.00 C ATOM 1167 C GLN A 79 -15.692 -14.871 -16.680 1.00 0.00 C ATOM 1168 O GLN A 79 -15.431 -15.061 -17.867 1.00 0.00 O ATOM 1169 CB GLN A 79 -13.841 -13.462 -15.758 1.00 0.00 C ATOM 1170 CG GLN A 79 -14.671 -12.264 -15.324 1.00 0.00 C ATOM 1171 CD GLN A 79 -14.880 -12.213 -13.823 1.00 0.00 C ATOM 1172 OE1 GLN A 79 -15.891 -12.689 -13.309 1.00 0.00 O ATOM 1173 NE2 GLN A 79 -13.920 -11.634 -13.111 1.00 0.00 N ATOM 0 H GLN A 79 -13.635 -16.324 -16.719 1.00 0.00 H new ATOM 0 HA GLN A 79 -15.033 -14.866 -14.648 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -12.934 -13.503 -15.155 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -13.529 -13.322 -16.793 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -14.178 -11.348 -15.650 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -15.640 -12.299 -15.821 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -13.098 -11.252 -13.579 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -14.005 -11.571 -12.096 1.00 0.00 H new ATOM 1182 N LEU A 80 -16.932 -14.722 -16.225 1.00 0.00 N ATOM 1183 CA LEU A 80 -18.085 -14.773 -17.118 1.00 0.00 C ATOM 1184 C LEU A 80 -18.656 -13.377 -17.348 1.00 0.00 C ATOM 1185 O LEU A 80 -18.566 -12.508 -16.480 1.00 0.00 O ATOM 1186 CB LEU A 80 -19.164 -15.691 -16.539 1.00 0.00 C ATOM 1187 CG LEU A 80 -19.086 -17.149 -16.995 1.00 0.00 C ATOM 1188 CD1 LEU A 80 -17.706 -17.722 -16.715 1.00 0.00 C ATOM 1189 CD2 LEU A 80 -20.160 -17.979 -16.307 1.00 0.00 C ATOM 0 H LEU A 80 -17.164 -14.565 -15.244 1.00 0.00 H new ATOM 0 HA LEU A 80 -17.755 -15.173 -18.077 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -19.099 -15.662 -15.451 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -20.142 -15.293 -16.810 1.00 0.00 H new ATOM 0 HG LEU A 80 -19.260 -17.184 -18.070 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -17.669 -18.760 -17.046 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -16.956 -17.143 -17.253 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -17.503 -17.675 -15.645 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -20.091 -19.014 -16.642 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -20.016 -17.937 -15.227 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -21.143 -17.581 -16.558 1.00 0.00 H new ATOM 1201 N ARG A 81 -19.241 -13.168 -18.522 1.00 0.00 N ATOM 1202 CA ARG A 81 -19.826 -11.876 -18.865 1.00 0.00 C ATOM 1203 C ARG A 81 -20.820 -12.014 -20.014 1.00 0.00 C ATOM 1204 O ARG A 81 -22.026 -11.858 -19.825 1.00 0.00 O ATOM 1205 CB ARG A 81 -18.727 -10.880 -19.242 1.00 0.00 C ATOM 1206 CG ARG A 81 -19.246 -9.477 -19.515 1.00 0.00 C ATOM 1207 CD ARG A 81 -19.090 -8.579 -18.299 1.00 0.00 C ATOM 1208 NE ARG A 81 -20.121 -7.544 -18.247 1.00 0.00 N ATOM 1209 CZ ARG A 81 -21.365 -7.759 -17.826 1.00 0.00 C ATOM 1210 NH1 ARG A 81 -21.738 -8.967 -17.420 1.00 0.00 N ATOM 1211 NH2 ARG A 81 -22.240 -6.763 -17.809 1.00 0.00 N ATOM 0 H ARG A 81 -19.323 -13.876 -19.252 1.00 0.00 H new ATOM 0 HA ARG A 81 -20.361 -11.504 -17.991 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -17.995 -10.837 -18.436 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -18.206 -11.244 -20.127 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -18.706 -9.046 -20.358 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -20.297 -9.526 -19.800 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -19.137 -9.184 -17.393 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -18.106 -8.110 -18.318 1.00 0.00 H new ATOM 0 HE ARG A 81 -19.873 -6.603 -18.551 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -21.069 -9.737 -17.430 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -22.693 -9.125 -17.099 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -21.960 -5.832 -18.119 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -23.194 -6.927 -17.486 1.00 0.00 H new ATOM 1225 N ALA A 82 -20.306 -12.307 -21.204 1.00 0.00 N ATOM 1226 CA ALA A 82 -21.147 -12.464 -22.383 1.00 0.00 C ATOM 1227 C ALA A 82 -22.086 -13.656 -22.232 1.00 0.00 C ATOM 1228 O ALA A 82 -21.646 -14.805 -22.190 1.00 0.00 O ATOM 1229 CB ALA A 82 -20.287 -12.623 -23.628 1.00 0.00 C ATOM 0 H ALA A 82 -19.310 -12.440 -21.377 1.00 0.00 H new ATOM 0 HA ALA A 82 -21.755 -11.565 -22.487 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -20.929 -12.739 -24.501 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -19.661 -11.740 -23.753 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -19.654 -13.504 -23.523 1.00 0.00 H new ATOM 1235 N ASP A 83 -23.383 -13.374 -22.148 1.00 0.00 N ATOM 1236 CA ASP A 83 -24.385 -14.424 -22.001 1.00 0.00 C ATOM 1237 C ASP A 83 -24.693 -15.081 -23.345 1.00 0.00 C ATOM 1238 O ASP A 83 -24.477 -16.279 -23.522 1.00 0.00 O ATOM 1239 CB ASP A 83 -25.666 -13.854 -21.388 1.00 0.00 C ATOM 1240 CG ASP A 83 -25.732 -14.061 -19.888 1.00 0.00 C ATOM 1241 OD1 ASP A 83 -25.274 -15.122 -19.415 1.00 0.00 O ATOM 1242 OD2 ASP A 83 -26.241 -13.162 -19.186 1.00 0.00 O ATOM 0 H ASP A 83 -23.764 -12.428 -22.179 1.00 0.00 H new ATOM 0 HA ASP A 83 -23.980 -15.185 -21.334 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -25.727 -12.788 -21.608 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -26.530 -14.326 -21.855 1.00 0.00 H new ATOM 1247 N PRO A 84 -25.206 -14.303 -24.315 1.00 0.00 N ATOM 1248 CA PRO A 84 -25.544 -14.821 -25.644 1.00 0.00 C ATOM 1249 C PRO A 84 -24.306 -15.045 -26.512 1.00 0.00 C ATOM 1250 O PRO A 84 -23.527 -14.120 -26.742 1.00 0.00 O ATOM 1251 CB PRO A 84 -26.416 -13.714 -26.235 1.00 0.00 C ATOM 1252 CG PRO A 84 -25.930 -12.466 -25.583 1.00 0.00 C ATOM 1253 CD PRO A 84 -25.501 -12.860 -24.194 1.00 0.00 C ATOM 0 HA PRO A 84 -26.035 -15.793 -25.594 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -26.311 -13.662 -27.319 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -27.472 -13.886 -26.025 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -25.099 -12.034 -26.140 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -26.717 -11.712 -25.549 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -24.625 -12.298 -23.871 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -26.288 -12.672 -23.463 1.00 0.00 H new ATOM 1261 N PRO A 85 -24.107 -16.280 -27.012 1.00 0.00 N ATOM 1262 CA PRO A 85 -22.955 -16.609 -27.858 1.00 0.00 C ATOM 1263 C PRO A 85 -22.855 -15.698 -29.076 1.00 0.00 C ATOM 1264 O PRO A 85 -21.880 -14.964 -29.237 1.00 0.00 O ATOM 1265 CB PRO A 85 -23.227 -18.053 -28.292 1.00 0.00 C ATOM 1266 CG PRO A 85 -24.138 -18.601 -27.249 1.00 0.00 C ATOM 1267 CD PRO A 85 -24.982 -17.446 -26.792 1.00 0.00 C ATOM 0 HA PRO A 85 -22.012 -16.482 -27.327 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -23.689 -18.089 -29.279 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -22.303 -18.628 -28.352 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -24.757 -19.402 -27.653 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -23.572 -19.024 -26.419 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -25.905 -17.370 -27.366 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -25.265 -17.544 -25.744 1.00 0.00 H new ATOM 1275 N SER A 86 -23.871 -15.750 -29.932 1.00 0.00 N ATOM 1276 CA SER A 86 -23.898 -14.929 -31.137 1.00 0.00 C ATOM 1277 C SER A 86 -25.259 -14.260 -31.306 1.00 0.00 C ATOM 1278 O SER A 86 -26.226 -14.895 -31.727 1.00 0.00 O ATOM 1279 CB SER A 86 -23.579 -15.780 -32.367 1.00 0.00 C ATOM 1280 OG SER A 86 -22.389 -16.524 -32.178 1.00 0.00 O ATOM 0 H SER A 86 -24.686 -16.352 -29.813 1.00 0.00 H new ATOM 0 HA SER A 86 -23.140 -14.152 -31.036 1.00 0.00 H new ATOM 0 HB2 SER A 86 -24.408 -16.459 -32.568 1.00 0.00 H new ATOM 0 HB3 SER A 86 -23.474 -15.137 -33.241 1.00 0.00 H new ATOM 0 HG SER A 86 -22.208 -17.061 -32.978 1.00 0.00 H new ATOM 1286 N THR A 87 -25.326 -12.976 -30.975 1.00 0.00 N ATOM 1287 CA THR A 87 -26.567 -12.220 -31.090 1.00 0.00 C ATOM 1288 C THR A 87 -26.306 -10.828 -31.659 1.00 0.00 C ATOM 1289 O THR A 87 -26.585 -9.818 -31.012 1.00 0.00 O ATOM 1290 CB THR A 87 -27.249 -12.110 -29.725 1.00 0.00 C ATOM 1291 OG1 THR A 87 -26.308 -11.774 -28.721 1.00 0.00 O ATOM 1292 CG2 THR A 87 -27.941 -13.386 -29.297 1.00 0.00 C ATOM 0 H THR A 87 -24.535 -12.436 -30.625 1.00 0.00 H new ATOM 0 HA THR A 87 -27.227 -12.753 -31.775 1.00 0.00 H new ATOM 0 HB THR A 87 -28.001 -11.329 -29.839 1.00 0.00 H new ATOM 0 HG1 THR A 87 -26.776 -11.399 -27.946 1.00 0.00 H new ATOM 0 HG21 THR A 87 -28.404 -13.239 -28.321 1.00 0.00 H new ATOM 0 HG22 THR A 87 -28.708 -13.646 -30.027 1.00 0.00 H new ATOM 0 HG23 THR A 87 -27.211 -14.193 -29.235 1.00 0.00 H new ATOM 1300 N ASP A 88 -25.767 -10.782 -32.873 1.00 0.00 N ATOM 1301 CA ASP A 88 -25.467 -9.515 -33.528 1.00 0.00 C ATOM 1302 C ASP A 88 -24.480 -8.698 -32.701 1.00 0.00 C ATOM 1303 O ASP A 88 -24.280 -8.964 -31.516 1.00 0.00 O ATOM 1304 CB ASP A 88 -26.752 -8.714 -33.749 1.00 0.00 C ATOM 1305 CG ASP A 88 -27.385 -8.996 -35.097 1.00 0.00 C ATOM 1306 OD1 ASP A 88 -26.636 -9.259 -36.061 1.00 0.00 O ATOM 1307 OD2 ASP A 88 -28.630 -8.953 -35.188 1.00 0.00 O ATOM 0 H ASP A 88 -25.529 -11.608 -33.423 1.00 0.00 H new ATOM 0 HA ASP A 88 -25.012 -9.732 -34.495 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -27.465 -8.951 -32.959 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -26.531 -7.650 -33.670 1.00 0.00 H new ATOM 1312 N LEU A 89 -23.866 -7.700 -33.333 1.00 0.00 N ATOM 1313 CA LEU A 89 -22.897 -6.836 -32.661 1.00 0.00 C ATOM 1314 C LEU A 89 -21.561 -7.549 -32.469 1.00 0.00 C ATOM 1315 O LEU A 89 -20.520 -7.060 -32.908 1.00 0.00 O ATOM 1316 CB LEU A 89 -23.439 -6.368 -31.306 1.00 0.00 C ATOM 1317 CG LEU A 89 -22.785 -5.101 -30.748 1.00 0.00 C ATOM 1318 CD1 LEU A 89 -22.811 -3.986 -31.782 1.00 0.00 C ATOM 1319 CD2 LEU A 89 -23.482 -4.663 -29.469 1.00 0.00 C ATOM 0 H LEU A 89 -24.023 -7.469 -34.314 1.00 0.00 H new ATOM 0 HA LEU A 89 -22.734 -5.966 -33.297 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -24.511 -6.193 -31.401 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -23.310 -7.173 -30.583 1.00 0.00 H new ATOM 0 HG LEU A 89 -21.744 -5.324 -30.513 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -22.342 -3.094 -31.367 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -22.266 -4.302 -32.672 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -23.844 -3.762 -32.049 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -23.005 -3.761 -29.085 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -24.532 -4.457 -29.679 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -23.409 -5.456 -28.725 1.00 0.00 H new ATOM 1331 N ASN A 90 -21.592 -8.704 -31.808 1.00 0.00 N ATOM 1332 CA ASN A 90 -20.379 -9.479 -31.557 1.00 0.00 C ATOM 1333 C ASN A 90 -19.552 -9.650 -32.831 1.00 0.00 C ATOM 1334 O ASN A 90 -18.332 -9.479 -32.814 1.00 0.00 O ATOM 1335 CB ASN A 90 -20.738 -10.850 -30.980 1.00 0.00 C ATOM 1336 CG ASN A 90 -21.208 -10.766 -29.542 1.00 0.00 C ATOM 1337 OD1 ASN A 90 -21.357 -9.676 -28.988 1.00 0.00 O ATOM 1338 ND2 ASN A 90 -21.445 -11.919 -28.928 1.00 0.00 N ATOM 0 H ASN A 90 -22.444 -9.124 -31.436 1.00 0.00 H new ATOM 0 HA ASN A 90 -19.776 -8.929 -30.834 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -21.520 -11.304 -31.589 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -19.868 -11.505 -31.038 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -21.764 -11.925 -27.959 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -21.308 -12.799 -29.425 1.00 0.00 H new ATOM 1345 N THR A 91 -20.216 -9.996 -33.930 1.00 0.00 N ATOM 1346 CA THR A 91 -19.528 -10.197 -35.204 1.00 0.00 C ATOM 1347 C THR A 91 -18.842 -8.917 -35.699 1.00 0.00 C ATOM 1348 O THR A 91 -18.002 -8.973 -36.597 1.00 0.00 O ATOM 1349 CB THR A 91 -20.515 -10.694 -36.261 1.00 0.00 C ATOM 1350 OG1 THR A 91 -21.738 -9.987 -36.176 1.00 0.00 O ATOM 1351 CG2 THR A 91 -20.829 -12.170 -36.141 1.00 0.00 C ATOM 0 H THR A 91 -21.225 -10.143 -33.966 1.00 0.00 H new ATOM 0 HA THR A 91 -18.753 -10.946 -35.039 1.00 0.00 H new ATOM 0 HB THR A 91 -20.024 -10.521 -37.218 1.00 0.00 H new ATOM 0 HG1 THR A 91 -21.556 -9.031 -36.057 1.00 0.00 H new ATOM 0 HG21 THR A 91 -21.535 -12.456 -36.921 1.00 0.00 H new ATOM 0 HG22 THR A 91 -19.911 -12.747 -36.252 1.00 0.00 H new ATOM 0 HG23 THR A 91 -21.267 -12.370 -35.163 1.00 0.00 H new ATOM 1359 N PHE A 92 -19.190 -7.769 -35.114 1.00 0.00 N ATOM 1360 CA PHE A 92 -18.590 -6.500 -35.512 1.00 0.00 C ATOM 1361 C PHE A 92 -17.262 -6.285 -34.792 1.00 0.00 C ATOM 1362 O PHE A 92 -17.108 -6.665 -33.631 1.00 0.00 O ATOM 1363 CB PHE A 92 -19.547 -5.347 -35.211 1.00 0.00 C ATOM 1364 CG PHE A 92 -20.805 -5.382 -36.032 1.00 0.00 C ATOM 1365 CD1 PHE A 92 -21.781 -6.333 -35.785 1.00 0.00 C ATOM 1366 CD2 PHE A 92 -21.009 -4.465 -37.051 1.00 0.00 C ATOM 1367 CE1 PHE A 92 -22.939 -6.369 -36.537 1.00 0.00 C ATOM 1368 CE2 PHE A 92 -22.165 -4.496 -37.807 1.00 0.00 C ATOM 1369 CZ PHE A 92 -23.131 -5.448 -37.551 1.00 0.00 C ATOM 0 H PHE A 92 -19.881 -7.695 -34.367 1.00 0.00 H new ATOM 0 HA PHE A 92 -18.400 -6.529 -36.585 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -19.812 -5.372 -34.154 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -19.033 -4.403 -35.389 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -21.635 -7.055 -34.995 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -20.256 -3.718 -37.256 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -23.693 -7.115 -36.334 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -22.313 -3.776 -38.598 1.00 0.00 H new ATOM 0 HZ PHE A 92 -24.035 -5.474 -38.141 1.00 0.00 H new ATOM 1379 N THR A 93 -16.302 -5.684 -35.487 1.00 0.00 N ATOM 1380 CA THR A 93 -14.986 -5.433 -34.907 1.00 0.00 C ATOM 1381 C THR A 93 -14.751 -3.941 -34.670 1.00 0.00 C ATOM 1382 O THR A 93 -15.032 -3.426 -33.588 1.00 0.00 O ATOM 1383 CB THR A 93 -13.892 -6.009 -35.810 1.00 0.00 C ATOM 1384 OG1 THR A 93 -13.950 -5.426 -37.100 1.00 0.00 O ATOM 1385 CG2 THR A 93 -13.985 -7.510 -35.980 1.00 0.00 C ATOM 0 H THR A 93 -16.409 -5.362 -36.449 1.00 0.00 H new ATOM 0 HA THR A 93 -14.947 -5.931 -33.938 1.00 0.00 H new ATOM 0 HB THR A 93 -12.952 -5.774 -35.312 1.00 0.00 H new ATOM 0 HG1 THR A 93 -13.243 -5.805 -37.662 1.00 0.00 H new ATOM 0 HG21 THR A 93 -13.181 -7.853 -36.631 1.00 0.00 H new ATOM 0 HG22 THR A 93 -13.895 -7.993 -35.007 1.00 0.00 H new ATOM 0 HG23 THR A 93 -14.946 -7.767 -36.425 1.00 0.00 H new ATOM 1393 N VAL A 94 -14.231 -3.252 -35.683 1.00 0.00 N ATOM 1394 CA VAL A 94 -13.955 -1.822 -35.576 1.00 0.00 C ATOM 1395 C VAL A 94 -13.974 -1.156 -36.949 1.00 0.00 C ATOM 1396 O VAL A 94 -14.533 -0.073 -37.118 1.00 0.00 O ATOM 1397 CB VAL A 94 -12.588 -1.563 -34.913 1.00 0.00 C ATOM 1398 CG1 VAL A 94 -12.368 -0.072 -34.703 1.00 0.00 C ATOM 1399 CG2 VAL A 94 -12.482 -2.316 -33.595 1.00 0.00 C ATOM 0 H VAL A 94 -13.992 -3.661 -36.587 1.00 0.00 H new ATOM 0 HA VAL A 94 -14.740 -1.393 -34.954 1.00 0.00 H new ATOM 0 HB VAL A 94 -11.807 -1.931 -35.579 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -11.398 0.090 -34.234 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.396 0.439 -35.665 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.153 0.324 -34.059 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.510 -2.121 -33.142 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -13.271 -1.982 -32.921 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -12.589 -3.385 -33.777 1.00 0.00 H new ATOM 1409 N GLU A 95 -13.356 -1.813 -37.923 1.00 0.00 N ATOM 1410 CA GLU A 95 -13.296 -1.293 -39.283 1.00 0.00 C ATOM 1411 C GLU A 95 -14.594 -1.572 -40.035 1.00 0.00 C ATOM 1412 O GLU A 95 -14.900 -0.910 -41.028 1.00 0.00 O ATOM 1413 CB GLU A 95 -12.115 -1.908 -40.036 1.00 0.00 C ATOM 1414 CG GLU A 95 -12.100 -3.428 -40.009 1.00 0.00 C ATOM 1415 CD GLU A 95 -11.074 -3.985 -39.041 1.00 0.00 C ATOM 1416 OE1 GLU A 95 -10.663 -3.246 -38.122 1.00 0.00 O ATOM 1417 OE2 GLU A 95 -10.681 -5.159 -39.203 1.00 0.00 O ATOM 0 H GLU A 95 -12.888 -2.710 -37.795 1.00 0.00 H new ATOM 0 HA GLU A 95 -13.159 -0.213 -39.224 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -12.141 -1.572 -41.073 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -11.186 -1.536 -39.604 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -13.090 -3.792 -39.733 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -11.890 -3.803 -41.011 1.00 0.00 H new ATOM 1424 N GLN A 96 -15.355 -2.553 -39.561 1.00 0.00 N ATOM 1425 CA GLN A 96 -16.615 -2.913 -40.192 1.00 0.00 C ATOM 1426 C GLN A 96 -17.651 -1.831 -39.948 1.00 0.00 C ATOM 1427 O GLN A 96 -18.306 -1.360 -40.873 1.00 0.00 O ATOM 1428 CB GLN A 96 -17.115 -4.257 -39.653 1.00 0.00 C ATOM 1429 CG GLN A 96 -17.098 -5.373 -40.686 1.00 0.00 C ATOM 1430 CD GLN A 96 -18.363 -5.411 -41.523 1.00 0.00 C ATOM 1431 OE1 GLN A 96 -19.203 -6.295 -41.359 1.00 0.00 O ATOM 1432 NE2 GLN A 96 -18.502 -4.450 -42.428 1.00 0.00 N ATOM 0 H GLN A 96 -15.119 -3.112 -38.741 1.00 0.00 H new ATOM 0 HA GLN A 96 -16.453 -3.007 -41.266 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -16.498 -4.550 -38.804 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -18.132 -4.134 -39.281 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -16.237 -5.244 -41.341 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -16.973 -6.330 -40.180 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -17.780 -3.737 -42.530 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -19.331 -4.425 -43.022 1.00 0.00 H new ATOM 1441 N LEU A 97 -17.781 -1.439 -38.691 1.00 0.00 N ATOM 1442 CA LEU A 97 -18.731 -0.399 -38.304 1.00 0.00 C ATOM 1443 C LEU A 97 -18.476 0.876 -39.092 1.00 0.00 C ATOM 1444 O LEU A 97 -19.353 1.377 -39.796 1.00 0.00 O ATOM 1445 CB LEU A 97 -18.626 -0.091 -36.806 1.00 0.00 C ATOM 1446 CG LEU A 97 -17.361 -0.604 -36.112 1.00 0.00 C ATOM 1447 CD1 LEU A 97 -16.833 0.419 -35.127 1.00 0.00 C ATOM 1448 CD2 LEU A 97 -17.645 -1.918 -35.411 1.00 0.00 C ATOM 0 H LEU A 97 -17.241 -1.824 -37.916 1.00 0.00 H new ATOM 0 HA LEU A 97 -19.733 -0.769 -38.523 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -18.680 0.989 -36.671 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -19.493 -0.519 -36.304 1.00 0.00 H new ATOM 0 HG LEU A 97 -16.596 -0.769 -36.871 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -15.934 0.032 -34.647 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -16.593 1.342 -35.655 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -17.591 0.620 -34.370 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -16.738 -2.273 -34.921 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -18.426 -1.771 -34.665 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -17.975 -2.656 -36.142 1.00 0.00 H new ATOM 1460 N LYS A 98 -17.264 1.392 -38.959 1.00 0.00 N ATOM 1461 CA LYS A 98 -16.867 2.611 -39.647 1.00 0.00 C ATOM 1462 C LYS A 98 -17.076 2.484 -41.155 1.00 0.00 C ATOM 1463 O LYS A 98 -17.427 3.456 -41.823 1.00 0.00 O ATOM 1464 CB LYS A 98 -15.402 2.920 -39.330 1.00 0.00 C ATOM 1465 CG LYS A 98 -15.161 4.337 -38.839 1.00 0.00 C ATOM 1466 CD LYS A 98 -13.771 4.488 -38.238 1.00 0.00 C ATOM 1467 CE LYS A 98 -13.630 3.703 -36.940 1.00 0.00 C ATOM 1468 NZ LYS A 98 -12.211 3.613 -36.499 1.00 0.00 N ATOM 0 H LYS A 98 -16.534 0.982 -38.377 1.00 0.00 H new ATOM 0 HA LYS A 98 -17.492 3.432 -39.296 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -15.049 2.219 -38.573 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -14.804 2.750 -40.225 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -15.279 5.036 -39.667 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -15.912 4.598 -38.093 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -13.025 4.143 -38.954 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -13.569 5.542 -38.049 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -14.223 4.181 -36.160 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -14.032 2.699 -37.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -12.157 3.072 -35.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -11.649 3.135 -37.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.834 4.570 -36.344 1.00 0.00 H new ATOM 1482 N ALA A 99 -16.867 1.282 -41.687 1.00 0.00 N ATOM 1483 CA ALA A 99 -17.045 1.043 -43.116 1.00 0.00 C ATOM 1484 C ALA A 99 -18.495 0.735 -43.455 1.00 0.00 C ATOM 1485 O ALA A 99 -18.925 0.884 -44.598 1.00 0.00 O ATOM 1486 CB ALA A 99 -16.133 -0.077 -43.588 1.00 0.00 C ATOM 0 H ALA A 99 -16.576 0.463 -41.153 1.00 0.00 H new ATOM 0 HA ALA A 99 -16.772 1.958 -43.641 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -16.280 -0.240 -44.656 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.094 0.197 -43.403 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -16.369 -0.992 -43.045 1.00 0.00 H new ATOM 1492 N GLN A 100 -19.235 0.298 -42.454 1.00 0.00 N ATOM 1493 CA GLN A 100 -20.641 -0.048 -42.629 1.00 0.00 C ATOM 1494 C GLN A 100 -21.535 1.173 -42.468 1.00 0.00 C ATOM 1495 O GLN A 100 -22.493 1.353 -43.220 1.00 0.00 O ATOM 1496 CB GLN A 100 -21.056 -1.132 -41.634 1.00 0.00 C ATOM 1497 CG GLN A 100 -20.853 -2.546 -42.154 1.00 0.00 C ATOM 1498 CD GLN A 100 -22.138 -3.168 -42.667 1.00 0.00 C ATOM 1499 OE1 GLN A 100 -22.803 -2.614 -43.542 1.00 0.00 O ATOM 1500 NE2 GLN A 100 -22.495 -4.325 -42.122 1.00 0.00 N ATOM 0 H GLN A 100 -18.887 0.172 -41.503 1.00 0.00 H new ATOM 0 HA GLN A 100 -20.763 -0.430 -43.643 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -20.485 -1.007 -40.714 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -22.107 -0.995 -41.378 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -20.115 -2.532 -42.956 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -20.446 -3.168 -41.357 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -21.914 -4.749 -41.399 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -23.351 -4.790 -42.426 1.00 0.00 H new ATOM 1509 N LEU A 101 -21.223 2.015 -41.487 1.00 0.00 N ATOM 1510 CA LEU A 101 -22.016 3.213 -41.247 1.00 0.00 C ATOM 1511 C LEU A 101 -22.078 4.049 -42.512 1.00 0.00 C ATOM 1512 O LEU A 101 -23.150 4.462 -42.954 1.00 0.00 O ATOM 1513 CB LEU A 101 -21.413 4.060 -40.122 1.00 0.00 C ATOM 1514 CG LEU A 101 -21.778 3.647 -38.691 1.00 0.00 C ATOM 1515 CD1 LEU A 101 -21.270 4.682 -37.700 1.00 0.00 C ATOM 1516 CD2 LEU A 101 -23.283 3.452 -38.530 1.00 0.00 C ATOM 0 H LEU A 101 -20.435 1.891 -40.852 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.017 2.899 -40.952 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -20.328 4.035 -40.219 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -21.723 5.095 -40.269 1.00 0.00 H new ATOM 0 HG LEU A 101 -21.297 2.691 -38.487 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -21.535 4.377 -36.688 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -20.186 4.763 -37.782 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -21.724 5.649 -37.919 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -23.504 3.160 -37.503 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -23.797 4.385 -38.761 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -23.624 2.672 -39.211 1.00 0.00 H new ATOM 1528 N THR A 102 -20.909 4.288 -43.091 1.00 0.00 N ATOM 1529 CA THR A 102 -20.814 5.069 -44.312 1.00 0.00 C ATOM 1530 C THR A 102 -21.521 4.357 -45.449 1.00 0.00 C ATOM 1531 O THR A 102 -22.188 4.985 -46.271 1.00 0.00 O ATOM 1532 CB THR A 102 -19.354 5.320 -44.672 1.00 0.00 C ATOM 1533 OG1 THR A 102 -18.508 4.371 -44.046 1.00 0.00 O ATOM 1534 CG2 THR A 102 -18.886 6.695 -44.266 1.00 0.00 C ATOM 0 H THR A 102 -20.015 3.951 -42.733 1.00 0.00 H new ATOM 0 HA THR A 102 -21.300 6.030 -44.146 1.00 0.00 H new ATOM 0 HB THR A 102 -19.296 5.231 -45.757 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.329 4.651 -43.124 1.00 0.00 H new ATOM 0 HG21 THR A 102 -17.840 6.821 -44.546 1.00 0.00 H new ATOM 0 HG22 THR A 102 -19.490 7.449 -44.771 1.00 0.00 H new ATOM 0 HG23 THR A 102 -18.989 6.811 -43.187 1.00 0.00 H new ATOM 1542 N GLU A 103 -21.379 3.039 -45.487 1.00 0.00 N ATOM 1543 CA GLU A 103 -22.018 2.249 -46.525 1.00 0.00 C ATOM 1544 C GLU A 103 -23.509 2.082 -46.244 1.00 0.00 C ATOM 1545 O GLU A 103 -24.254 1.558 -47.071 1.00 0.00 O ATOM 1546 CB GLU A 103 -21.346 0.880 -46.659 1.00 0.00 C ATOM 1547 CG GLU A 103 -20.368 0.795 -47.819 1.00 0.00 C ATOM 1548 CD GLU A 103 -20.934 0.035 -49.004 1.00 0.00 C ATOM 1549 OE1 GLU A 103 -21.559 -1.024 -48.785 1.00 0.00 O ATOM 1550 OE2 GLU A 103 -20.752 0.499 -50.148 1.00 0.00 O ATOM 0 H GLU A 103 -20.831 2.500 -44.816 1.00 0.00 H new ATOM 0 HA GLU A 103 -21.904 2.784 -47.468 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -20.819 0.651 -45.733 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -22.115 0.118 -46.786 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -20.096 1.802 -48.134 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -19.453 0.308 -47.483 1.00 0.00 H new ATOM 1557 N ARG A 104 -23.934 2.540 -45.074 1.00 0.00 N ATOM 1558 CA ARG A 104 -25.336 2.453 -44.678 1.00 0.00 C ATOM 1559 C ARG A 104 -26.045 3.792 -44.887 1.00 0.00 C ATOM 1560 O ARG A 104 -27.275 3.857 -44.886 1.00 0.00 O ATOM 1561 CB ARG A 104 -25.447 2.027 -43.212 1.00 0.00 C ATOM 1562 CG ARG A 104 -25.596 0.526 -43.027 1.00 0.00 C ATOM 1563 CD ARG A 104 -26.440 0.197 -41.806 1.00 0.00 C ATOM 1564 NE ARG A 104 -26.983 -1.159 -41.863 1.00 0.00 N ATOM 1565 CZ ARG A 104 -27.743 -1.694 -40.911 1.00 0.00 C ATOM 1566 NH1 ARG A 104 -28.051 -0.994 -39.826 1.00 0.00 N ATOM 1567 NH2 ARG A 104 -28.195 -2.934 -41.042 1.00 0.00 N ATOM 0 H ARG A 104 -23.327 2.977 -44.380 1.00 0.00 H new ATOM 0 HA ARG A 104 -25.820 1.704 -45.305 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -24.560 2.365 -42.675 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -26.303 2.528 -42.760 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -26.055 0.092 -43.916 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -24.611 0.071 -42.923 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -25.834 0.307 -40.907 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -27.259 0.912 -41.728 1.00 0.00 H new ATOM 0 HE ARG A 104 -26.766 -1.729 -42.681 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -27.705 -0.041 -39.719 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -28.634 -1.409 -39.100 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -27.960 -3.477 -41.873 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -28.778 -3.344 -40.312 1.00 0.00 H new ATOM 1581 N GLY A 105 -25.265 4.855 -45.069 1.00 0.00 N ATOM 1582 CA GLY A 105 -25.841 6.171 -45.281 1.00 0.00 C ATOM 1583 C GLY A 105 -26.153 6.893 -43.984 1.00 0.00 C ATOM 1584 O GLY A 105 -27.244 7.439 -43.820 1.00 0.00 O ATOM 0 H GLY A 105 -24.245 4.828 -45.073 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -25.150 6.774 -45.870 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -26.756 6.072 -45.865 1.00 0.00 H new ATOM 1588 N ILE A 106 -25.195 6.900 -43.061 1.00 0.00 N ATOM 1589 CA ILE A 106 -25.382 7.565 -41.777 1.00 0.00 C ATOM 1590 C ILE A 106 -24.107 8.286 -41.341 1.00 0.00 C ATOM 1591 O ILE A 106 -23.211 7.682 -40.753 1.00 0.00 O ATOM 1592 CB ILE A 106 -25.803 6.562 -40.683 1.00 0.00 C ATOM 1593 CG1 ILE A 106 -26.046 7.286 -39.356 1.00 0.00 C ATOM 1594 CG2 ILE A 106 -24.748 5.476 -40.518 1.00 0.00 C ATOM 1595 CD1 ILE A 106 -27.004 6.558 -38.437 1.00 0.00 C ATOM 0 H ILE A 106 -24.285 6.454 -43.178 1.00 0.00 H new ATOM 0 HA ILE A 106 -26.178 8.298 -41.908 1.00 0.00 H new ATOM 0 HB ILE A 106 -26.735 6.088 -40.990 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -25.093 7.418 -38.844 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -26.438 8.282 -39.561 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -25.063 4.778 -39.742 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -24.626 4.941 -41.460 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -23.799 5.931 -40.234 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -27.129 7.128 -37.516 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -27.970 6.449 -38.930 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -26.604 5.572 -38.202 1.00 0.00 H new ATOM 1607 N THR A 107 -24.032 9.586 -41.631 1.00 0.00 N ATOM 1608 CA THR A 107 -22.866 10.383 -41.264 1.00 0.00 C ATOM 1609 C THR A 107 -22.538 10.220 -39.783 1.00 0.00 C ATOM 1610 O THR A 107 -23.378 10.475 -38.919 1.00 0.00 O ATOM 1611 CB THR A 107 -23.108 11.860 -41.588 1.00 0.00 C ATOM 1612 OG1 THR A 107 -24.496 12.135 -41.660 1.00 0.00 O ATOM 1613 CG2 THR A 107 -22.485 12.297 -42.895 1.00 0.00 C ATOM 0 H THR A 107 -24.763 10.105 -42.117 1.00 0.00 H new ATOM 0 HA THR A 107 -22.016 10.026 -41.846 1.00 0.00 H new ATOM 0 HB THR A 107 -22.636 12.415 -40.777 1.00 0.00 H new ATOM 0 HG1 THR A 107 -24.631 13.083 -41.866 1.00 0.00 H new ATOM 0 HG21 THR A 107 -22.695 13.353 -43.063 1.00 0.00 H new ATOM 0 HG22 THR A 107 -21.407 12.143 -42.853 1.00 0.00 H new ATOM 0 HG23 THR A 107 -22.904 11.710 -43.712 1.00 0.00 H new ATOM 1621 N PHE A 108 -21.314 9.790 -39.496 1.00 0.00 N ATOM 1622 CA PHE A 108 -20.879 9.588 -38.118 1.00 0.00 C ATOM 1623 C PHE A 108 -19.655 10.438 -37.798 1.00 0.00 C ATOM 1624 O PHE A 108 -18.847 10.079 -36.940 1.00 0.00 O ATOM 1625 CB PHE A 108 -20.570 8.109 -37.874 1.00 0.00 C ATOM 1626 CG PHE A 108 -19.392 7.603 -38.656 1.00 0.00 C ATOM 1627 CD1 PHE A 108 -19.478 7.427 -40.027 1.00 0.00 C ATOM 1628 CD2 PHE A 108 -18.198 7.302 -38.019 1.00 0.00 C ATOM 1629 CE1 PHE A 108 -18.397 6.960 -40.749 1.00 0.00 C ATOM 1630 CE2 PHE A 108 -17.113 6.835 -38.736 1.00 0.00 C ATOM 1631 CZ PHE A 108 -17.213 6.665 -40.103 1.00 0.00 C ATOM 0 H PHE A 108 -20.606 9.575 -40.198 1.00 0.00 H new ATOM 0 HA PHE A 108 -21.690 9.898 -37.458 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -20.382 7.956 -36.811 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -21.448 7.516 -38.131 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -20.401 7.658 -40.538 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -18.115 7.434 -36.950 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -18.478 6.826 -41.818 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -16.188 6.603 -38.228 1.00 0.00 H new ATOM 0 HZ PHE A 108 -16.366 6.302 -40.666 1.00 0.00 H new ATOM 1641 N LYS A 109 -19.522 11.568 -38.486 1.00 0.00 N ATOM 1642 CA LYS A 109 -18.395 12.467 -38.267 1.00 0.00 C ATOM 1643 C LYS A 109 -18.368 12.959 -36.823 1.00 0.00 C ATOM 1644 O LYS A 109 -17.306 13.251 -36.276 1.00 0.00 O ATOM 1645 CB LYS A 109 -18.471 13.657 -39.226 1.00 0.00 C ATOM 1646 CG LYS A 109 -17.546 13.529 -40.426 1.00 0.00 C ATOM 1647 CD LYS A 109 -17.989 12.411 -41.355 1.00 0.00 C ATOM 1648 CE LYS A 109 -17.561 11.049 -40.833 1.00 0.00 C ATOM 1649 NZ LYS A 109 -17.148 10.136 -41.934 1.00 0.00 N ATOM 0 H LYS A 109 -20.180 11.882 -39.199 1.00 0.00 H new ATOM 0 HA LYS A 109 -17.476 11.915 -38.461 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -19.497 13.765 -39.578 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -18.223 14.568 -38.682 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -17.526 14.471 -40.973 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -16.529 13.337 -40.084 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -19.073 12.436 -41.464 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -17.565 12.571 -42.346 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -16.734 11.172 -40.134 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -18.383 10.599 -40.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -17.457 9.167 -41.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -17.585 10.447 -42.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -16.113 10.155 -42.031 1.00 0.00 H new ATOM 1663 N GLN A 110 -19.545 13.045 -36.211 1.00 0.00 N ATOM 1664 CA GLN A 110 -19.658 13.498 -34.830 1.00 0.00 C ATOM 1665 C GLN A 110 -20.399 12.470 -33.980 1.00 0.00 C ATOM 1666 O GLN A 110 -21.246 11.731 -34.482 1.00 0.00 O ATOM 1667 CB GLN A 110 -20.384 14.844 -34.769 1.00 0.00 C ATOM 1668 CG GLN A 110 -19.822 15.883 -35.725 1.00 0.00 C ATOM 1669 CD GLN A 110 -20.550 17.209 -35.640 1.00 0.00 C ATOM 1670 OE1 GLN A 110 -20.356 17.978 -34.698 1.00 0.00 O ATOM 1671 NE2 GLN A 110 -21.396 17.485 -36.626 1.00 0.00 N ATOM 0 H GLN A 110 -20.434 12.807 -36.650 1.00 0.00 H new ATOM 0 HA GLN A 110 -18.651 13.618 -34.430 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -21.439 14.689 -34.994 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -20.329 15.231 -33.752 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -18.766 16.038 -35.506 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -19.884 15.504 -36.745 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -21.526 16.819 -37.387 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -21.915 18.363 -36.622 1.00 0.00 H new ATOM 1680 N SER A 111 -20.075 12.431 -32.692 1.00 0.00 N ATOM 1681 CA SER A 111 -20.709 11.494 -31.771 1.00 0.00 C ATOM 1682 C SER A 111 -20.383 10.050 -32.144 1.00 0.00 C ATOM 1683 O SER A 111 -21.148 9.135 -31.841 1.00 0.00 O ATOM 1684 CB SER A 111 -22.225 11.700 -31.761 1.00 0.00 C ATOM 1685 OG SER A 111 -22.750 11.565 -30.453 1.00 0.00 O ATOM 0 H SER A 111 -19.377 13.038 -32.262 1.00 0.00 H new ATOM 0 HA SER A 111 -20.316 11.688 -30.773 1.00 0.00 H new ATOM 0 HB2 SER A 111 -22.463 12.690 -32.151 1.00 0.00 H new ATOM 0 HB3 SER A 111 -22.698 10.974 -32.423 1.00 0.00 H new ATOM 0 HG SER A 111 -23.720 11.703 -30.474 1.00 0.00 H new ATOM 1691 N ALA A 112 -19.244 9.852 -32.801 1.00 0.00 N ATOM 1692 CA ALA A 112 -18.822 8.517 -33.209 1.00 0.00 C ATOM 1693 C ALA A 112 -17.303 8.397 -33.213 1.00 0.00 C ATOM 1694 O ALA A 112 -16.633 8.894 -34.118 1.00 0.00 O ATOM 1695 CB ALA A 112 -19.383 8.176 -34.581 1.00 0.00 C ATOM 0 H ALA A 112 -18.598 10.597 -33.062 1.00 0.00 H new ATOM 0 HA ALA A 112 -19.215 7.805 -32.483 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -19.058 7.176 -34.869 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -20.472 8.207 -34.547 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -19.022 8.900 -35.312 1.00 0.00 H new ATOM 1701 N THR A 113 -16.763 7.731 -32.196 1.00 0.00 N ATOM 1702 CA THR A 113 -15.322 7.542 -32.084 1.00 0.00 C ATOM 1703 C THR A 113 -14.918 6.159 -32.587 1.00 0.00 C ATOM 1704 O THR A 113 -14.450 6.014 -33.716 1.00 0.00 O ATOM 1705 CB THR A 113 -14.875 7.732 -30.633 1.00 0.00 C ATOM 1706 OG1 THR A 113 -15.449 6.746 -29.794 1.00 0.00 O ATOM 1707 CG2 THR A 113 -15.250 9.084 -30.070 1.00 0.00 C ATOM 0 H THR A 113 -17.303 7.313 -31.438 1.00 0.00 H new ATOM 0 HA THR A 113 -14.828 8.289 -32.705 1.00 0.00 H new ATOM 0 HB THR A 113 -13.788 7.647 -30.652 1.00 0.00 H new ATOM 0 HG1 THR A 113 -15.148 6.886 -28.872 1.00 0.00 H new ATOM 0 HG21 THR A 113 -14.906 9.157 -29.038 1.00 0.00 H new ATOM 0 HG22 THR A 113 -14.782 9.868 -30.665 1.00 0.00 H new ATOM 0 HG23 THR A 113 -16.333 9.203 -30.100 1.00 0.00 H new ATOM 1715 N LYS A 114 -15.112 5.144 -31.749 1.00 0.00 N ATOM 1716 CA LYS A 114 -14.774 3.776 -32.125 1.00 0.00 C ATOM 1717 C LYS A 114 -15.541 2.769 -31.277 1.00 0.00 C ATOM 1718 O LYS A 114 -16.012 1.751 -31.783 1.00 0.00 O ATOM 1719 CB LYS A 114 -13.264 3.539 -32.013 1.00 0.00 C ATOM 1720 CG LYS A 114 -12.844 2.110 -32.322 1.00 0.00 C ATOM 1721 CD LYS A 114 -11.360 1.898 -32.071 1.00 0.00 C ATOM 1722 CE LYS A 114 -11.090 0.547 -31.428 1.00 0.00 C ATOM 1723 NZ LYS A 114 -9.750 0.013 -31.799 1.00 0.00 N ATOM 0 H LYS A 114 -15.499 5.243 -30.811 1.00 0.00 H new ATOM 0 HA LYS A 114 -15.067 3.633 -33.165 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -12.748 4.215 -32.694 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -12.939 3.794 -31.004 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -13.420 1.419 -31.706 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -13.075 1.879 -33.362 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -10.817 1.968 -33.014 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -10.982 2.691 -31.426 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -11.156 0.641 -30.344 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -11.860 -0.161 -31.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -9.605 -0.909 -31.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -9.695 -0.101 -32.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -9.013 0.676 -31.485 1.00 0.00 H new ATOM 1737 N ALA A 115 -15.686 3.060 -29.994 1.00 0.00 N ATOM 1738 CA ALA A 115 -16.425 2.178 -29.108 1.00 0.00 C ATOM 1739 C ALA A 115 -17.917 2.467 -29.202 1.00 0.00 C ATOM 1740 O ALA A 115 -18.749 1.633 -28.843 1.00 0.00 O ATOM 1741 CB ALA A 115 -15.936 2.325 -27.674 1.00 0.00 C ATOM 0 H ALA A 115 -15.305 3.894 -29.547 1.00 0.00 H new ATOM 0 HA ALA A 115 -16.252 1.148 -29.420 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -16.502 1.656 -27.026 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -14.877 2.070 -27.623 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -16.078 3.354 -27.345 1.00 0.00 H new ATOM 1747 N GLU A 116 -18.247 3.663 -29.685 1.00 0.00 N ATOM 1748 CA GLU A 116 -19.634 4.076 -29.826 1.00 0.00 C ATOM 1749 C GLU A 116 -20.233 3.605 -31.149 1.00 0.00 C ATOM 1750 O GLU A 116 -21.396 3.203 -31.193 1.00 0.00 O ATOM 1751 CB GLU A 116 -19.743 5.597 -29.704 1.00 0.00 C ATOM 1752 CG GLU A 116 -21.145 6.136 -29.946 1.00 0.00 C ATOM 1753 CD GLU A 116 -22.099 5.809 -28.814 1.00 0.00 C ATOM 1754 OE1 GLU A 116 -21.716 6.002 -27.641 1.00 0.00 O ATOM 1755 OE2 GLU A 116 -23.227 5.358 -29.101 1.00 0.00 O ATOM 0 H GLU A 116 -17.568 4.362 -29.985 1.00 0.00 H new ATOM 0 HA GLU A 116 -20.204 3.609 -29.023 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -19.416 5.896 -28.708 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -19.059 6.059 -30.416 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -21.097 7.217 -30.075 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -21.534 5.721 -30.876 1.00 0.00 H new ATOM 1762 N LEU A 117 -19.452 3.655 -32.229 1.00 0.00 N ATOM 1763 CA LEU A 117 -19.967 3.223 -33.528 1.00 0.00 C ATOM 1764 C LEU A 117 -19.976 1.705 -33.638 1.00 0.00 C ATOM 1765 O LEU A 117 -20.710 1.145 -34.450 1.00 0.00 O ATOM 1766 CB LEU A 117 -19.235 3.886 -34.716 1.00 0.00 C ATOM 1767 CG LEU A 117 -17.822 3.422 -35.063 1.00 0.00 C ATOM 1768 CD1 LEU A 117 -17.083 4.528 -35.794 1.00 0.00 C ATOM 1769 CD2 LEU A 117 -17.054 3.014 -33.836 1.00 0.00 C ATOM 0 H LEU A 117 -18.486 3.981 -32.233 1.00 0.00 H new ATOM 0 HA LEU A 117 -21.000 3.567 -33.587 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -19.854 3.749 -35.603 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -19.191 4.957 -34.520 1.00 0.00 H new ATOM 0 HG LEU A 117 -17.905 2.547 -35.708 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -16.076 4.192 -36.039 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -17.616 4.777 -36.712 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -17.026 5.410 -35.157 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -16.054 2.690 -34.124 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -16.979 3.862 -33.155 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -17.572 2.194 -33.339 1.00 0.00 H new ATOM 1781 N ILE A 118 -19.192 1.034 -32.797 1.00 0.00 N ATOM 1782 CA ILE A 118 -19.170 -0.421 -32.807 1.00 0.00 C ATOM 1783 C ILE A 118 -20.362 -0.966 -32.024 1.00 0.00 C ATOM 1784 O ILE A 118 -20.863 -2.052 -32.314 1.00 0.00 O ATOM 1785 CB ILE A 118 -17.845 -1.000 -32.246 1.00 0.00 C ATOM 1786 CG1 ILE A 118 -17.868 -2.535 -32.287 1.00 0.00 C ATOM 1787 CG2 ILE A 118 -17.553 -0.500 -30.834 1.00 0.00 C ATOM 1788 CD1 ILE A 118 -18.618 -3.180 -31.137 1.00 0.00 C ATOM 0 H ILE A 118 -18.574 1.469 -32.112 1.00 0.00 H new ATOM 0 HA ILE A 118 -19.239 -0.739 -33.847 1.00 0.00 H new ATOM 0 HB ILE A 118 -17.037 -0.644 -32.886 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -18.321 -2.855 -33.225 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -16.842 -2.902 -32.287 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -16.616 -0.931 -30.482 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -17.472 0.587 -30.842 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -18.363 -0.798 -30.168 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -18.585 -4.264 -31.244 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -18.153 -2.894 -30.193 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -19.656 -2.846 -31.146 1.00 0.00 H new ATOM 1800 N ALA A 119 -20.825 -0.192 -31.043 1.00 0.00 N ATOM 1801 CA ALA A 119 -21.972 -0.582 -30.235 1.00 0.00 C ATOM 1802 C ALA A 119 -23.280 -0.143 -30.889 1.00 0.00 C ATOM 1803 O ALA A 119 -24.311 -0.801 -30.754 1.00 0.00 O ATOM 1804 CB ALA A 119 -21.854 0.002 -28.834 1.00 0.00 C ATOM 0 H ALA A 119 -20.420 0.710 -30.791 1.00 0.00 H new ATOM 0 HA ALA A 119 -21.982 -1.670 -30.162 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -22.718 -0.298 -28.241 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -20.944 -0.367 -28.361 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -21.815 1.090 -28.895 1.00 0.00 H new ATOM 1810 N LEU A 120 -23.225 0.994 -31.579 1.00 0.00 N ATOM 1811 CA LEU A 120 -24.399 1.558 -32.243 1.00 0.00 C ATOM 1812 C LEU A 120 -25.066 0.560 -33.184 1.00 0.00 C ATOM 1813 O LEU A 120 -26.293 0.467 -33.222 1.00 0.00 O ATOM 1814 CB LEU A 120 -24.011 2.818 -33.021 1.00 0.00 C ATOM 1815 CG LEU A 120 -25.108 3.880 -33.118 1.00 0.00 C ATOM 1816 CD1 LEU A 120 -24.921 4.939 -32.043 1.00 0.00 C ATOM 1817 CD2 LEU A 120 -25.114 4.517 -34.500 1.00 0.00 C ATOM 0 H LEU A 120 -22.375 1.546 -31.693 1.00 0.00 H new ATOM 0 HA LEU A 120 -25.118 1.810 -31.464 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -23.135 3.263 -32.549 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -23.716 2.528 -34.030 1.00 0.00 H new ATOM 0 HG LEU A 120 -26.071 3.395 -32.959 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -25.710 5.686 -32.127 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -24.967 4.471 -31.060 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -23.951 5.420 -32.171 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -25.901 5.270 -34.550 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -24.149 4.988 -34.688 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -25.297 3.751 -35.253 1.00 0.00 H new ATOM 1829 N PHE A 121 -24.266 -0.172 -33.952 1.00 0.00 N ATOM 1830 CA PHE A 121 -24.807 -1.144 -34.898 1.00 0.00 C ATOM 1831 C PHE A 121 -25.646 -2.200 -34.188 1.00 0.00 C ATOM 1832 O PHE A 121 -25.161 -3.286 -33.873 1.00 0.00 O ATOM 1833 CB PHE A 121 -23.681 -1.815 -35.679 1.00 0.00 C ATOM 1834 CG PHE A 121 -23.208 -0.997 -36.840 1.00 0.00 C ATOM 1835 CD1 PHE A 121 -23.951 -0.924 -38.008 1.00 0.00 C ATOM 1836 CD2 PHE A 121 -22.022 -0.292 -36.762 1.00 0.00 C ATOM 1837 CE1 PHE A 121 -23.515 -0.165 -39.074 1.00 0.00 C ATOM 1838 CE2 PHE A 121 -21.584 0.467 -37.821 1.00 0.00 C ATOM 1839 CZ PHE A 121 -22.330 0.531 -38.979 1.00 0.00 C ATOM 0 H PHE A 121 -23.248 -0.113 -33.939 1.00 0.00 H new ATOM 0 HA PHE A 121 -25.451 -0.605 -35.593 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -22.843 -2.003 -35.008 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -24.024 -2.785 -36.040 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -24.881 -1.467 -38.084 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -21.432 -0.338 -35.858 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -24.101 -0.117 -39.980 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -20.655 1.013 -37.746 1.00 0.00 H new ATOM 0 HZ PHE A 121 -21.985 1.127 -39.811 1.00 0.00 H new ATOM 1849 N ALA A 122 -26.909 -1.873 -33.941 1.00 0.00 N ATOM 1850 CA ALA A 122 -27.821 -2.791 -33.270 1.00 0.00 C ATOM 1851 C ALA A 122 -29.272 -2.355 -33.451 1.00 0.00 C ATOM 1852 O ALA A 122 -29.818 -1.628 -32.620 1.00 0.00 O ATOM 1853 CB ALA A 122 -27.477 -2.891 -31.791 1.00 0.00 C ATOM 0 H ALA A 122 -27.325 -0.977 -34.196 1.00 0.00 H new ATOM 0 HA ALA A 122 -27.706 -3.775 -33.725 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -28.166 -3.580 -31.303 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -26.457 -3.258 -31.679 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -27.561 -1.907 -31.331 1.00 0.00 H new ATOM 1859 N PRO A 123 -29.919 -2.795 -34.544 1.00 0.00 N ATOM 1860 CA PRO A 123 -31.315 -2.446 -34.830 1.00 0.00 C ATOM 1861 C PRO A 123 -32.231 -2.691 -33.636 1.00 0.00 C ATOM 1862 O PRO A 123 -33.050 -1.840 -33.284 1.00 0.00 O ATOM 1863 CB PRO A 123 -31.682 -3.378 -35.986 1.00 0.00 C ATOM 1864 CG PRO A 123 -30.388 -3.662 -36.667 1.00 0.00 C ATOM 1865 CD PRO A 123 -29.341 -3.666 -35.586 1.00 0.00 C ATOM 0 HA PRO A 123 -31.431 -1.388 -35.063 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -32.148 -4.294 -35.624 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -32.392 -2.906 -36.665 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -30.421 -4.622 -37.182 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -30.169 -2.904 -37.419 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -29.155 -4.672 -35.211 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -28.388 -3.280 -35.949 1.00 0.00 H new ATOM 1873 N ALA A 124 -32.089 -3.857 -33.015 1.00 0.00 N ATOM 1874 CA ALA A 124 -32.905 -4.213 -31.860 1.00 0.00 C ATOM 1875 C ALA A 124 -34.390 -4.182 -32.204 1.00 0.00 C ATOM 1876 O ALA A 124 -34.984 -3.113 -32.342 1.00 0.00 O ATOM 1877 CB ALA A 124 -32.611 -3.275 -30.699 1.00 0.00 C ATOM 0 H ALA A 124 -31.416 -4.572 -33.292 1.00 0.00 H new ATOM 0 HA ALA A 124 -32.649 -5.231 -31.566 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -33.227 -3.551 -29.843 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -31.558 -3.350 -30.428 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -32.838 -2.250 -30.993 1.00 0.00 H new ATOM 1883 N ASP A 125 -34.984 -5.363 -32.343 1.00 0.00 N ATOM 1884 CA ASP A 125 -36.400 -5.471 -32.671 1.00 0.00 C ATOM 1885 C ASP A 125 -37.232 -5.727 -31.417 1.00 0.00 C ATOM 1886 O ASP A 125 -38.279 -6.371 -31.474 1.00 0.00 O ATOM 1887 CB ASP A 125 -36.624 -6.593 -33.688 1.00 0.00 C ATOM 1888 CG ASP A 125 -36.874 -6.062 -35.087 1.00 0.00 C ATOM 1889 OD1 ASP A 125 -36.117 -5.173 -35.528 1.00 0.00 O ATOM 1890 OD2 ASP A 125 -37.827 -6.536 -35.741 1.00 0.00 O ATOM 0 H ASP A 125 -34.507 -6.258 -32.234 1.00 0.00 H new ATOM 0 HA ASP A 125 -36.721 -4.525 -33.108 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -35.753 -7.248 -33.701 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -37.474 -7.200 -33.375 1.00 0.00 H new ATOM 1895 N GLY A 126 -36.758 -5.216 -30.285 1.00 0.00 N ATOM 1896 CA GLY A 126 -37.470 -5.401 -29.034 1.00 0.00 C ATOM 1897 C GLY A 126 -36.967 -6.598 -28.251 1.00 0.00 C ATOM 1898 O GLY A 126 -37.619 -7.642 -28.213 1.00 0.00 O ATOM 0 H GLY A 126 -35.895 -4.678 -30.212 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -37.367 -4.503 -28.425 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -38.533 -5.526 -29.240 1.00 0.00 H new ATOM 1902 N GLU A 127 -35.804 -6.447 -27.622 1.00 0.00 N ATOM 1903 CA GLU A 127 -35.216 -7.524 -26.836 1.00 0.00 C ATOM 1904 C GLU A 127 -34.754 -7.015 -25.475 1.00 0.00 C ATOM 1905 O GLU A 127 -34.928 -5.841 -25.149 1.00 0.00 O ATOM 1906 CB GLU A 127 -34.037 -8.148 -27.587 1.00 0.00 C ATOM 1907 CG GLU A 127 -34.457 -9.040 -28.744 1.00 0.00 C ATOM 1908 CD GLU A 127 -33.329 -9.926 -29.236 1.00 0.00 C ATOM 1909 OE1 GLU A 127 -32.172 -9.455 -29.263 1.00 0.00 O ATOM 1910 OE2 GLU A 127 -33.602 -11.092 -29.591 1.00 0.00 O ATOM 0 H GLU A 127 -35.252 -5.590 -27.642 1.00 0.00 H new ATOM 0 HA GLU A 127 -35.981 -8.284 -26.679 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -33.396 -7.352 -27.967 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -33.439 -8.732 -26.887 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -35.294 -9.664 -28.432 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -34.812 -8.419 -29.567 1.00 0.00 H new ATOM 1917 N LYS A 128 -34.164 -7.905 -24.684 1.00 0.00 N ATOM 1918 CA LYS A 128 -33.677 -7.546 -23.357 1.00 0.00 C ATOM 1919 C LYS A 128 -32.618 -6.451 -23.444 1.00 0.00 C ATOM 1920 O LYS A 128 -31.834 -6.407 -24.392 1.00 0.00 O ATOM 1921 CB LYS A 128 -33.101 -8.776 -22.652 1.00 0.00 C ATOM 1922 CG LYS A 128 -34.087 -9.460 -21.719 1.00 0.00 C ATOM 1923 CD LYS A 128 -33.873 -9.037 -20.274 1.00 0.00 C ATOM 1924 CE LYS A 128 -35.013 -9.501 -19.383 1.00 0.00 C ATOM 1925 NZ LYS A 128 -34.607 -9.565 -17.951 1.00 0.00 N ATOM 0 H LYS A 128 -34.011 -8.881 -24.939 1.00 0.00 H new ATOM 0 HA LYS A 128 -34.519 -7.166 -22.778 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -32.768 -9.492 -23.403 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -32.221 -8.479 -22.082 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -35.105 -9.218 -22.023 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -33.978 -10.541 -21.803 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -32.933 -9.450 -19.908 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -33.787 -7.952 -20.221 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -35.858 -8.821 -19.491 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -35.352 -10.485 -19.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -35.412 -9.886 -17.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -33.817 -10.233 -17.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -34.308 -8.621 -17.632 1.00 0.00 H new ATOM 1939 N SER A 129 -32.599 -5.572 -22.448 1.00 0.00 N ATOM 1940 CA SER A 129 -31.635 -4.479 -22.412 1.00 0.00 C ATOM 1941 C SER A 129 -30.310 -4.944 -21.814 1.00 0.00 C ATOM 1942 O SER A 129 -30.268 -5.909 -21.051 1.00 0.00 O ATOM 1943 CB SER A 129 -32.191 -3.308 -21.601 1.00 0.00 C ATOM 1944 OG SER A 129 -33.114 -3.756 -20.623 1.00 0.00 O ATOM 0 H SER A 129 -33.240 -5.595 -21.655 1.00 0.00 H new ATOM 0 HA SER A 129 -31.456 -4.150 -23.436 1.00 0.00 H new ATOM 0 HB2 SER A 129 -31.372 -2.776 -21.116 1.00 0.00 H new ATOM 0 HB3 SER A 129 -32.680 -2.599 -22.269 1.00 0.00 H new ATOM 0 HG SER A 129 -33.453 -2.988 -20.117 1.00 0.00 H new ATOM 1950 N GLU A 130 -29.232 -4.253 -22.168 1.00 0.00 N ATOM 1951 CA GLU A 130 -27.907 -4.595 -21.666 1.00 0.00 C ATOM 1952 C GLU A 130 -27.289 -3.421 -20.912 1.00 0.00 C ATOM 1953 O GLU A 130 -26.096 -3.145 -21.040 1.00 0.00 O ATOM 1954 CB GLU A 130 -26.993 -5.013 -22.822 1.00 0.00 C ATOM 1955 CG GLU A 130 -27.612 -6.053 -23.741 1.00 0.00 C ATOM 1956 CD GLU A 130 -26.854 -6.203 -25.045 1.00 0.00 C ATOM 1957 OE1 GLU A 130 -26.160 -5.244 -25.441 1.00 0.00 O ATOM 1958 OE2 GLU A 130 -26.953 -7.280 -25.669 1.00 0.00 O ATOM 0 H GLU A 130 -29.250 -3.453 -22.800 1.00 0.00 H new ATOM 0 HA GLU A 130 -28.013 -5.431 -20.974 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -26.735 -4.131 -23.407 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -26.063 -5.408 -22.414 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -27.640 -7.015 -23.229 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -28.644 -5.775 -23.955 1.00 0.00 H new ATOM 1965 N ALA A 131 -28.110 -2.733 -20.126 1.00 0.00 N ATOM 1966 CA ALA A 131 -27.645 -1.589 -19.351 1.00 0.00 C ATOM 1967 C ALA A 131 -27.119 -0.486 -20.263 1.00 0.00 C ATOM 1968 O ALA A 131 -26.393 0.398 -19.763 1.00 0.00 O ATOM 1969 CB ALA A 131 -26.570 -2.021 -18.366 1.00 0.00 C ATOM 1970 OXT ALA A 131 -27.437 -0.516 -21.471 1.00 0.00 O ATOM 0 H ALA A 131 -29.100 -2.948 -20.009 1.00 0.00 H new ATOM 0 HA ALA A 131 -28.492 -1.190 -18.794 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -26.232 -1.157 -17.794 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -26.979 -2.769 -17.686 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -25.728 -2.448 -18.911 1.00 0.00 H new TER 1976 ALA A 131