USER MOD reduce.3.24.130724 H: found=0, std=0, add=1137, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 924 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 71 ASN : amide:sc= -0.271 K(o=-0.92,f=-1.9) USER MOD Set 1.2: A 124 GLN : amide:sc= -0.647 X(o=-0.92,f=-0.86) USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.275 X(o=-0.27,f=-0.58) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= -0.223 K(o=-0.22,f=-3!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ -164:sc= 0.368 (180deg=0.298) USER MOD Single : A 40 LYS NZ :NH3+ -173:sc= 1.13 (180deg=1.05) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 156:sc= 2.01 USER MOD Single : A 53 LYS NZ :NH3+ 162:sc= -0.0187 (180deg=-0.211) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.0732 USER MOD Single : A 56 MET CE :methyl 174:sc= -0.108 (180deg=-0.204) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.456 K(o=-0.46,f=-2.7!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 70:sc= 0.237 USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 79 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0175) USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0.838 K(o=0.84,f=-3.3!) USER MOD Single : A 94 SER OG : rot 70:sc= 0.0324 USER MOD Single : A 96 ASN : amide:sc= -0.0569 K(o=-0.057,f=-1.2!) USER MOD Single : A 103 GLN : amide:sc= -0.0486 X(o=-0.049,f=-0.049) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.0557 K(o=-0.056,f=-0.57) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 99:sc= 1.35 USER MOD Single : A 115 ASN : amide:sc= -0.0188 K(o=-0.019,f=-0.54) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ -160:sc= 1.49 (180deg=1.12) USER MOD Single : A 138 MET CE :methyl 157:sc= 0 (180deg=-0.8) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -7.492 12.489 16.634 1.00 0.00 N ATOM 2 CA SER A 1 -8.293 13.597 16.064 1.00 0.00 C ATOM 3 C SER A 1 -8.809 13.227 14.676 1.00 0.00 C ATOM 4 O SER A 1 -8.086 13.356 13.685 1.00 0.00 O ATOM 5 CB SER A 1 -7.492 14.912 16.037 1.00 0.00 C ATOM 6 OG SER A 1 -8.233 15.928 16.685 1.00 0.00 O ATOM 0 H1 SER A 1 -7.149 12.758 17.578 1.00 0.00 H new ATOM 0 H2 SER A 1 -8.083 11.637 16.710 1.00 0.00 H new ATOM 0 H3 SER A 1 -6.680 12.293 16.014 1.00 0.00 H new ATOM 0 HA SER A 1 -9.155 13.760 16.711 1.00 0.00 H new ATOM 0 HB2 SER A 1 -6.531 14.775 16.533 1.00 0.00 H new ATOM 0 HB3 SER A 1 -7.281 15.201 15.007 1.00 0.00 H new ATOM 0 HG SER A 1 -7.723 16.765 16.670 1.00 0.00 H new ATOM 11 N LYS A 2 -10.054 12.733 14.590 1.00 0.00 N ATOM 12 CA LYS A 2 -10.759 12.498 13.314 1.00 0.00 C ATOM 13 C LYS A 2 -10.856 13.803 12.502 1.00 0.00 C ATOM 14 O LYS A 2 -10.919 14.896 13.070 1.00 0.00 O ATOM 15 CB LYS A 2 -12.111 11.788 13.611 1.00 0.00 C ATOM 16 CG LYS A 2 -13.344 12.118 12.738 1.00 0.00 C ATOM 17 CD LYS A 2 -14.073 13.404 13.182 1.00 0.00 C ATOM 18 CE LYS A 2 -15.253 13.781 12.277 1.00 0.00 C ATOM 19 NZ LYS A 2 -16.478 12.993 12.580 1.00 0.00 N ATOM 0 H LYS A 2 -10.607 12.482 15.410 1.00 0.00 H new ATOM 0 HA LYS A 2 -10.201 11.822 12.666 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -11.939 10.714 13.543 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -12.375 12.004 14.646 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -13.029 12.226 11.700 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -14.042 11.281 12.774 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -14.435 13.274 14.202 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -13.361 14.229 13.199 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -15.470 14.843 12.392 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -14.972 13.624 11.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -17.245 13.285 11.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -16.282 11.981 12.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -16.764 13.162 13.566 1.00 0.00 H new ATOM 29 N SER A 3 -10.899 13.681 11.175 1.00 0.00 N ATOM 30 CA SER A 3 -11.041 14.821 10.248 1.00 0.00 C ATOM 31 C SER A 3 -11.811 14.458 8.971 1.00 0.00 C ATOM 32 O SER A 3 -12.662 15.229 8.523 1.00 0.00 O ATOM 33 CB SER A 3 -9.641 15.344 9.891 1.00 0.00 C ATOM 34 OG SER A 3 -9.704 16.615 9.269 1.00 0.00 O ATOM 0 H SER A 3 -10.836 12.780 10.701 1.00 0.00 H new ATOM 0 HA SER A 3 -11.624 15.592 10.751 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.035 15.410 10.795 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.146 14.636 9.226 1.00 0.00 H new ATOM 0 HG SER A 3 -8.797 16.920 9.056 1.00 0.00 H new ATOM 39 N ILE A 4 -11.575 13.257 8.424 1.00 0.00 N ATOM 40 CA ILE A 4 -12.270 12.734 7.229 1.00 0.00 C ATOM 41 C ILE A 4 -12.577 11.230 7.325 1.00 0.00 C ATOM 42 O ILE A 4 -13.702 10.842 7.012 1.00 0.00 O ATOM 43 CB ILE A 4 -11.510 13.026 5.904 1.00 0.00 C ATOM 44 CG1 ILE A 4 -9.985 13.250 6.035 1.00 0.00 C ATOM 45 CG2 ILE A 4 -12.201 14.141 5.102 1.00 0.00 C ATOM 46 CD1 ILE A 4 -9.520 14.699 6.254 1.00 0.00 C ATOM 0 H ILE A 4 -10.885 12.608 8.802 1.00 0.00 H new ATOM 0 HA ILE A 4 -13.215 13.277 7.205 1.00 0.00 H new ATOM 0 HB ILE A 4 -11.575 12.096 5.338 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -9.622 12.646 6.866 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -9.506 12.871 5.132 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -11.647 14.323 4.181 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -13.219 13.837 4.859 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -12.227 15.054 5.697 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -8.433 14.725 6.330 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -9.840 15.315 5.413 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -9.957 15.086 7.174 1.00 0.00 H new ATOM 57 N VAL A 5 -11.628 10.405 7.805 1.00 0.00 N ATOM 58 CA VAL A 5 -11.747 8.935 7.967 1.00 0.00 C ATOM 59 C VAL A 5 -12.111 8.213 6.654 1.00 0.00 C ATOM 60 O VAL A 5 -13.282 8.088 6.291 1.00 0.00 O ATOM 61 CB VAL A 5 -12.690 8.583 9.145 1.00 0.00 C ATOM 62 CG1 VAL A 5 -13.043 7.092 9.230 1.00 0.00 C ATOM 63 CG2 VAL A 5 -12.028 8.978 10.472 1.00 0.00 C ATOM 0 H VAL A 5 -10.718 10.754 8.104 1.00 0.00 H new ATOM 0 HA VAL A 5 -10.759 8.553 8.226 1.00 0.00 H new ATOM 0 HB VAL A 5 -13.611 9.137 8.963 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -13.706 6.923 10.079 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -13.543 6.784 8.312 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -12.131 6.509 9.360 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -12.693 8.729 11.299 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -11.089 8.436 10.586 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -11.830 10.050 10.475 1.00 0.00 H new ATOM 73 N LEU A 6 -11.091 7.717 5.941 1.00 0.00 N ATOM 74 CA LEU A 6 -11.251 6.965 4.688 1.00 0.00 C ATOM 75 C LEU A 6 -10.655 5.551 4.783 1.00 0.00 C ATOM 76 O LEU A 6 -9.873 5.224 5.677 1.00 0.00 O ATOM 77 CB LEU A 6 -10.650 7.755 3.495 1.00 0.00 C ATOM 78 CG LEU A 6 -11.577 8.739 2.747 1.00 0.00 C ATOM 79 CD1 LEU A 6 -12.921 8.121 2.347 1.00 0.00 C ATOM 80 CD2 LEU A 6 -11.842 10.022 3.529 1.00 0.00 C ATOM 0 H LEU A 6 -10.117 7.828 6.222 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.320 6.843 4.512 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -9.791 8.317 3.863 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -10.272 7.033 2.771 1.00 0.00 H new ATOM 0 HG LEU A 6 -11.022 8.984 1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -13.523 8.865 1.826 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -12.748 7.269 1.689 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -13.449 7.788 3.241 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -12.499 10.671 2.951 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -12.318 9.778 4.479 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -10.899 10.535 3.717 1.00 0.00 H new ATOM 91 N GLU A 7 -11.036 4.710 3.827 1.00 0.00 N ATOM 92 CA GLU A 7 -10.737 3.278 3.798 1.00 0.00 C ATOM 93 C GLU A 7 -10.199 2.909 2.406 1.00 0.00 C ATOM 94 O GLU A 7 -10.986 2.542 1.524 1.00 0.00 O ATOM 95 CB GLU A 7 -11.991 2.446 4.141 1.00 0.00 C ATOM 96 CG GLU A 7 -12.667 2.793 5.477 1.00 0.00 C ATOM 97 CD GLU A 7 -14.031 3.485 5.270 1.00 0.00 C ATOM 98 OE1 GLU A 7 -14.092 4.568 4.643 1.00 0.00 O ATOM 99 OE2 GLU A 7 -15.066 2.945 5.740 1.00 0.00 O ATOM 0 H GLU A 7 -11.581 5.016 3.021 1.00 0.00 H new ATOM 0 HA GLU A 7 -9.981 3.052 4.550 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -12.720 2.572 3.341 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -11.714 1.392 4.156 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -12.807 1.883 6.060 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.013 3.445 6.056 1.00 0.00 H new ATOM 104 N PRO A 8 -8.883 3.061 2.143 1.00 0.00 N ATOM 105 CA PRO A 8 -8.340 2.751 0.828 1.00 0.00 C ATOM 106 C PRO A 8 -8.499 1.258 0.535 1.00 0.00 C ATOM 107 O PRO A 8 -9.026 0.918 -0.513 1.00 0.00 O ATOM 108 CB PRO A 8 -6.884 3.213 0.837 1.00 0.00 C ATOM 109 CG PRO A 8 -6.517 3.241 2.316 1.00 0.00 C ATOM 110 CD PRO A 8 -7.839 3.567 3.016 1.00 0.00 C ATOM 0 HA PRO A 8 -8.872 3.265 0.027 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -6.244 2.529 0.280 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -6.774 4.196 0.379 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -6.115 2.283 2.646 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -5.757 3.994 2.525 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -7.888 3.097 3.998 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -7.945 4.641 3.171 1.00 0.00 H new ATOM 115 N ILE A 9 -8.152 0.362 1.457 1.00 0.00 N ATOM 116 CA ILE A 9 -8.207 -1.087 1.213 1.00 0.00 C ATOM 117 C ILE A 9 -9.085 -1.725 2.300 1.00 0.00 C ATOM 118 O ILE A 9 -8.690 -1.801 3.459 1.00 0.00 O ATOM 119 CB ILE A 9 -6.794 -1.730 1.117 1.00 0.00 C ATOM 120 CG1 ILE A 9 -5.601 -0.756 0.943 1.00 0.00 C ATOM 121 CG2 ILE A 9 -6.749 -2.812 0.029 1.00 0.00 C ATOM 122 CD1 ILE A 9 -5.410 -0.069 -0.414 1.00 0.00 C ATOM 0 H ILE A 9 -7.826 0.613 2.390 1.00 0.00 H new ATOM 0 HA ILE A 9 -8.656 -1.275 0.238 1.00 0.00 H new ATOM 0 HB ILE A 9 -6.652 -2.168 2.105 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -5.697 0.024 1.699 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.688 -1.307 1.167 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -5.749 -3.243 -0.014 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -7.471 -3.594 0.263 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -6.995 -2.368 -0.936 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -4.534 0.579 -0.374 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.268 -0.824 -1.187 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -6.292 0.527 -0.647 1.00 0.00 H new ATOM 133 N TYR A 10 -10.290 -2.170 1.941 1.00 0.00 N ATOM 134 CA TYR A 10 -11.301 -2.656 2.891 1.00 0.00 C ATOM 135 C TYR A 10 -11.795 -4.061 2.513 1.00 0.00 C ATOM 136 O TYR A 10 -12.993 -4.344 2.523 1.00 0.00 O ATOM 137 CB TYR A 10 -12.417 -1.604 3.008 1.00 0.00 C ATOM 138 CG TYR A 10 -13.377 -1.829 4.166 1.00 0.00 C ATOM 139 CD1 TYR A 10 -12.917 -1.669 5.488 1.00 0.00 C ATOM 140 CD2 TYR A 10 -14.711 -2.219 3.931 1.00 0.00 C ATOM 141 CE1 TYR A 10 -13.773 -1.945 6.574 1.00 0.00 C ATOM 142 CE2 TYR A 10 -15.571 -2.492 5.015 1.00 0.00 C ATOM 143 CZ TYR A 10 -15.098 -2.365 6.339 1.00 0.00 C ATOM 144 OH TYR A 10 -15.919 -2.643 7.385 1.00 0.00 O ATOM 0 H TYR A 10 -10.599 -2.205 0.970 1.00 0.00 H new ATOM 0 HA TYR A 10 -10.865 -2.778 3.882 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -11.961 -0.620 3.116 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -12.986 -1.591 2.078 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -11.906 -1.334 5.670 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -15.075 -2.309 2.918 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -13.413 -1.835 7.586 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -16.591 -2.798 4.832 1.00 0.00 H new ATOM 0 HH TYR A 10 -16.797 -2.917 7.048 1.00 0.00 H new ATOM 153 N TRP A 11 -10.859 -4.910 2.060 1.00 0.00 N ATOM 154 CA TRP A 11 -11.063 -6.208 1.385 1.00 0.00 C ATOM 155 C TRP A 11 -12.178 -6.216 0.309 1.00 0.00 C ATOM 156 O TRP A 11 -12.712 -7.265 -0.048 1.00 0.00 O ATOM 157 CB TRP A 11 -11.160 -7.347 2.421 1.00 0.00 C ATOM 158 CG TRP A 11 -12.447 -7.507 3.177 1.00 0.00 C ATOM 159 CD1 TRP A 11 -12.867 -6.762 4.217 1.00 0.00 C ATOM 160 CD2 TRP A 11 -13.491 -8.509 2.948 1.00 0.00 C ATOM 161 NE1 TRP A 11 -14.133 -7.173 4.602 1.00 0.00 N ATOM 162 CE2 TRP A 11 -14.559 -8.234 3.847 1.00 0.00 C ATOM 163 CE3 TRP A 11 -13.629 -9.605 2.082 1.00 0.00 C ATOM 164 CZ2 TRP A 11 -15.750 -9.002 3.846 1.00 0.00 C ATOM 165 CZ3 TRP A 11 -14.806 -10.390 2.080 1.00 0.00 C ATOM 166 CH2 TRP A 11 -15.863 -10.072 2.954 1.00 0.00 C ATOM 0 H TRP A 11 -9.867 -4.695 2.162 1.00 0.00 H new ATOM 0 HA TRP A 11 -10.172 -6.395 0.785 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -10.958 -8.285 1.905 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -10.361 -7.205 3.149 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -12.303 -5.966 4.680 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -14.677 -6.742 5.350 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -12.824 -9.853 1.406 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -16.557 -8.764 4.523 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -14.894 -11.232 1.409 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -16.769 -10.660 2.935 1.00 0.00 H new ATOM 176 N ASN A 12 -12.527 -5.047 -0.241 1.00 0.00 N ATOM 177 CA ASN A 12 -13.755 -4.807 -1.005 1.00 0.00 C ATOM 178 C ASN A 12 -13.548 -4.979 -2.527 1.00 0.00 C ATOM 179 O ASN A 12 -14.131 -4.252 -3.337 1.00 0.00 O ATOM 180 CB ASN A 12 -14.287 -3.413 -0.600 1.00 0.00 C ATOM 181 CG ASN A 12 -15.799 -3.295 -0.710 1.00 0.00 C ATOM 182 OD1 ASN A 12 -16.351 -2.675 -1.607 1.00 0.00 O ATOM 183 ND2 ASN A 12 -16.516 -3.870 0.230 1.00 0.00 N ATOM 0 H ASN A 12 -11.942 -4.215 -0.163 1.00 0.00 H new ATOM 0 HA ASN A 12 -14.507 -5.558 -0.763 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -13.986 -3.200 0.426 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -13.823 -2.656 -1.232 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -17.533 -3.799 0.211 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -16.055 -4.387 0.978 1.00 0.00 H new ATOM 189 N SER A 13 -12.667 -5.914 -2.912 1.00 0.00 N ATOM 190 CA SER A 13 -12.124 -6.162 -4.265 1.00 0.00 C ATOM 191 C SER A 13 -11.251 -5.032 -4.824 1.00 0.00 C ATOM 192 O SER A 13 -10.109 -5.270 -5.225 1.00 0.00 O ATOM 193 CB SER A 13 -13.235 -6.494 -5.273 1.00 0.00 C ATOM 194 OG SER A 13 -13.203 -7.880 -5.577 1.00 0.00 O ATOM 0 H SER A 13 -12.282 -6.572 -2.234 1.00 0.00 H new ATOM 0 HA SER A 13 -11.471 -7.025 -4.133 1.00 0.00 H new ATOM 0 HB2 SER A 13 -14.207 -6.224 -4.860 1.00 0.00 H new ATOM 0 HB3 SER A 13 -13.101 -5.909 -6.183 1.00 0.00 H new ATOM 0 HG SER A 13 -13.913 -8.091 -6.219 1.00 0.00 H new ATOM 199 N SER A 14 -11.763 -3.802 -4.797 1.00 0.00 N ATOM 200 CA SER A 14 -11.108 -2.570 -5.244 1.00 0.00 C ATOM 201 C SER A 14 -11.271 -1.461 -4.193 1.00 0.00 C ATOM 202 O SER A 14 -11.896 -1.660 -3.146 1.00 0.00 O ATOM 203 CB SER A 14 -11.690 -2.116 -6.595 1.00 0.00 C ATOM 204 OG SER A 14 -11.536 -3.109 -7.598 1.00 0.00 O ATOM 0 H SER A 14 -12.703 -3.627 -4.441 1.00 0.00 H new ATOM 0 HA SER A 14 -10.044 -2.771 -5.371 1.00 0.00 H new ATOM 0 HB2 SER A 14 -12.748 -1.883 -6.475 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.195 -1.198 -6.914 1.00 0.00 H new ATOM 0 HG SER A 14 -11.919 -2.785 -8.440 1.00 0.00 H new ATOM 209 N ASN A 15 -10.721 -0.280 -4.470 1.00 0.00 N ATOM 210 CA ASN A 15 -10.662 0.841 -3.526 1.00 0.00 C ATOM 211 C ASN A 15 -11.580 1.987 -4.001 1.00 0.00 C ATOM 212 O ASN A 15 -11.936 2.037 -5.180 1.00 0.00 O ATOM 213 CB ASN A 15 -9.198 1.301 -3.412 1.00 0.00 C ATOM 214 CG ASN A 15 -8.174 0.171 -3.240 1.00 0.00 C ATOM 215 OD1 ASN A 15 -8.439 -0.926 -2.765 1.00 0.00 O ATOM 216 ND2 ASN A 15 -6.960 0.380 -3.695 1.00 0.00 N ATOM 0 H ASN A 15 -10.295 -0.069 -5.373 1.00 0.00 H new ATOM 0 HA ASN A 15 -11.016 0.530 -2.543 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -8.941 1.870 -4.305 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -9.112 1.981 -2.565 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -6.263 -0.363 -3.648 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -6.714 1.285 -4.095 1.00 0.00 H new ATOM 222 N SER A 16 -11.935 2.953 -3.142 1.00 0.00 N ATOM 223 CA SER A 16 -12.764 4.100 -3.579 1.00 0.00 C ATOM 224 C SER A 16 -12.043 4.996 -4.606 1.00 0.00 C ATOM 225 O SER A 16 -12.645 5.457 -5.580 1.00 0.00 O ATOM 226 CB SER A 16 -13.228 4.932 -2.378 1.00 0.00 C ATOM 227 OG SER A 16 -12.139 5.627 -1.785 1.00 0.00 O ATOM 0 H SER A 16 -11.670 2.970 -2.157 1.00 0.00 H new ATOM 0 HA SER A 16 -13.638 3.679 -4.076 1.00 0.00 H new ATOM 0 HB2 SER A 16 -13.988 5.645 -2.698 1.00 0.00 H new ATOM 0 HB3 SER A 16 -13.694 4.280 -1.638 1.00 0.00 H new ATOM 0 HG SER A 16 -12.462 6.151 -1.023 1.00 0.00 H new ATOM 232 N LYS A 17 -10.730 5.181 -4.410 1.00 0.00 N ATOM 233 CA LYS A 17 -9.802 5.924 -5.277 1.00 0.00 C ATOM 234 C LYS A 17 -9.255 5.106 -6.461 1.00 0.00 C ATOM 235 O LYS A 17 -8.644 5.702 -7.345 1.00 0.00 O ATOM 236 CB LYS A 17 -8.663 6.483 -4.391 1.00 0.00 C ATOM 237 CG LYS A 17 -8.674 8.014 -4.259 1.00 0.00 C ATOM 238 CD LYS A 17 -7.902 8.699 -5.402 1.00 0.00 C ATOM 239 CE LYS A 17 -8.623 9.942 -5.936 1.00 0.00 C ATOM 240 NZ LYS A 17 -8.875 9.830 -7.399 1.00 0.00 N ATOM 0 H LYS A 17 -10.258 4.793 -3.593 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.356 6.736 -5.749 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.738 6.041 -3.397 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.705 6.170 -4.807 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -9.704 8.370 -4.254 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.234 8.298 -3.303 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -6.911 8.982 -5.048 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.759 7.988 -6.216 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.569 10.071 -5.410 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -8.022 10.829 -5.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -9.364 10.685 -7.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.969 9.730 -7.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -9.468 8.996 -7.586 1.00 0.00 H new ATOM 250 N PHE A 18 -9.459 3.783 -6.500 1.00 0.00 N ATOM 251 CA PHE A 18 -9.041 2.900 -7.599 1.00 0.00 C ATOM 252 C PHE A 18 -9.768 3.257 -8.900 1.00 0.00 C ATOM 253 O PHE A 18 -10.921 2.867 -9.106 1.00 0.00 O ATOM 254 CB PHE A 18 -9.266 1.441 -7.185 1.00 0.00 C ATOM 255 CG PHE A 18 -8.723 0.372 -8.105 1.00 0.00 C ATOM 256 CD1 PHE A 18 -9.488 -0.097 -9.189 1.00 0.00 C ATOM 257 CD2 PHE A 18 -7.476 -0.222 -7.824 1.00 0.00 C ATOM 258 CE1 PHE A 18 -9.000 -1.138 -10.001 1.00 0.00 C ATOM 259 CE2 PHE A 18 -6.992 -1.269 -8.631 1.00 0.00 C ATOM 260 CZ PHE A 18 -7.752 -1.724 -9.721 1.00 0.00 C ATOM 0 H PHE A 18 -9.932 3.283 -5.748 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.978 3.039 -7.797 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -8.822 1.297 -6.200 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -10.339 1.282 -7.078 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -10.452 0.343 -9.398 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -6.890 0.127 -6.987 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -9.584 -1.487 -10.840 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -6.036 -1.722 -8.412 1.00 0.00 H new ATOM 0 HZ PHE A 18 -7.379 -2.523 -10.344 1.00 0.00 H new ATOM 269 N LEU A 19 -9.119 4.055 -9.750 1.00 0.00 N ATOM 270 CA LEU A 19 -9.726 4.663 -10.941 1.00 0.00 C ATOM 271 C LEU A 19 -8.675 5.101 -11.978 1.00 0.00 C ATOM 272 O LEU A 19 -8.709 4.571 -13.095 1.00 0.00 O ATOM 273 CB LEU A 19 -10.619 5.853 -10.513 1.00 0.00 C ATOM 274 CG LEU A 19 -12.125 5.581 -10.663 1.00 0.00 C ATOM 275 CD1 LEU A 19 -12.901 6.530 -9.749 1.00 0.00 C ATOM 276 CD2 LEU A 19 -12.580 5.796 -12.108 1.00 0.00 C ATOM 0 H LEU A 19 -8.137 4.303 -9.629 1.00 0.00 H new ATOM 0 HA LEU A 19 -10.340 3.907 -11.431 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -10.405 6.101 -9.473 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -10.355 6.727 -11.109 1.00 0.00 H new ATOM 0 HG LEU A 19 -12.318 4.544 -10.388 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -13.970 6.341 -9.852 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -12.601 6.365 -8.714 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -12.686 7.561 -10.029 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.649 5.597 -12.186 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -12.380 6.826 -12.403 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -12.036 5.118 -12.766 1.00 0.00 H new ATOM 287 N PRO A 20 -7.727 6.015 -11.661 1.00 0.00 N ATOM 288 CA PRO A 20 -6.626 6.318 -12.568 1.00 0.00 C ATOM 289 C PRO A 20 -5.639 5.150 -12.573 1.00 0.00 C ATOM 290 O PRO A 20 -5.456 4.485 -11.548 1.00 0.00 O ATOM 291 CB PRO A 20 -5.975 7.595 -12.039 1.00 0.00 C ATOM 292 CG PRO A 20 -6.337 7.640 -10.552 1.00 0.00 C ATOM 293 CD PRO A 20 -7.546 6.718 -10.392 1.00 0.00 C ATOM 0 HA PRO A 20 -6.963 6.462 -13.595 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -4.895 7.575 -12.181 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -6.349 8.475 -12.563 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -5.503 7.303 -9.936 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -6.575 8.656 -10.238 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.384 6.009 -9.580 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.437 7.293 -10.141 1.00 0.00 H new ATOM 298 N GLY A 21 -4.954 4.935 -13.702 1.00 0.00 N ATOM 299 CA GLY A 21 -3.892 3.933 -13.813 1.00 0.00 C ATOM 300 C GLY A 21 -2.886 4.020 -12.670 1.00 0.00 C ATOM 301 O GLY A 21 -2.601 3.007 -12.057 1.00 0.00 O ATOM 0 H GLY A 21 -5.122 5.453 -14.565 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -4.336 2.938 -13.827 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -3.371 4.063 -14.762 1.00 0.00 H new ATOM 304 N GLN A 22 -2.455 5.230 -12.288 1.00 0.00 N ATOM 305 CA GLN A 22 -1.595 5.490 -11.121 1.00 0.00 C ATOM 306 C GLN A 22 -1.980 4.756 -9.815 1.00 0.00 C ATOM 307 O GLN A 22 -1.124 4.630 -8.944 1.00 0.00 O ATOM 308 CB GLN A 22 -1.548 7.000 -10.847 1.00 0.00 C ATOM 309 CG GLN A 22 -0.472 7.746 -11.667 1.00 0.00 C ATOM 310 CD GLN A 22 0.263 8.838 -10.875 1.00 0.00 C ATOM 311 OE1 GLN A 22 0.137 9.002 -9.671 1.00 0.00 O ATOM 312 NE2 GLN A 22 1.084 9.636 -11.521 1.00 0.00 N ATOM 0 H GLN A 22 -2.701 6.080 -12.795 1.00 0.00 H new ATOM 0 HA GLN A 22 -0.622 5.087 -11.401 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -2.524 7.431 -11.068 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -1.361 7.162 -9.786 1.00 0.00 H new ATOM 0 HG2 GLN A 22 0.257 7.024 -12.035 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -0.942 8.198 -12.541 1.00 0.00 H new ATOM 0 HE21 GLN A 22 1.214 9.528 -12.527 1.00 0.00 H new ATOM 0 HE22 GLN A 22 1.591 10.363 -11.016 1.00 0.00 H new ATOM 319 N GLY A 23 -3.221 4.282 -9.664 1.00 0.00 N ATOM 320 CA GLY A 23 -3.592 3.242 -8.711 1.00 0.00 C ATOM 321 C GLY A 23 -4.560 3.782 -7.675 1.00 0.00 C ATOM 322 O GLY A 23 -5.769 3.796 -7.905 1.00 0.00 O ATOM 0 H GLY A 23 -4.010 4.621 -10.215 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -4.047 2.404 -9.239 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.699 2.860 -8.217 1.00 0.00 H new ATOM 325 N LEU A 24 -4.024 4.292 -6.567 1.00 0.00 N ATOM 326 CA LEU A 24 -4.780 5.018 -5.545 1.00 0.00 C ATOM 327 C LEU A 24 -3.912 6.160 -4.981 1.00 0.00 C ATOM 328 O LEU A 24 -2.732 5.977 -4.701 1.00 0.00 O ATOM 329 CB LEU A 24 -5.283 3.995 -4.492 1.00 0.00 C ATOM 330 CG LEU A 24 -5.881 4.591 -3.199 1.00 0.00 C ATOM 331 CD1 LEU A 24 -7.146 3.854 -2.772 1.00 0.00 C ATOM 332 CD2 LEU A 24 -4.900 4.511 -2.038 1.00 0.00 C ATOM 0 H LEU A 24 -3.031 4.211 -6.349 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.667 5.504 -5.952 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.038 3.364 -4.960 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.451 3.347 -4.218 1.00 0.00 H new ATOM 0 HG LEU A 24 -6.109 5.631 -3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -7.537 4.302 -1.859 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.894 3.927 -3.562 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.912 2.805 -2.590 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.356 4.940 -1.146 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.644 3.468 -1.849 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.996 5.067 -2.286 1.00 0.00 H new ATOM 343 N VAL A 25 -4.483 7.353 -4.817 1.00 0.00 N ATOM 344 CA VAL A 25 -3.771 8.539 -4.302 1.00 0.00 C ATOM 345 C VAL A 25 -4.337 8.898 -2.932 1.00 0.00 C ATOM 346 O VAL A 25 -5.557 8.892 -2.748 1.00 0.00 O ATOM 347 CB VAL A 25 -3.890 9.724 -5.284 1.00 0.00 C ATOM 348 CG1 VAL A 25 -3.249 11.008 -4.743 1.00 0.00 C ATOM 349 CG2 VAL A 25 -3.223 9.403 -6.628 1.00 0.00 C ATOM 0 H VAL A 25 -5.462 7.533 -5.038 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.710 8.311 -4.203 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.960 9.885 -5.414 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -3.363 11.808 -5.475 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.739 11.295 -3.813 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -2.189 10.835 -4.556 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.324 10.257 -7.297 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -2.166 9.190 -6.468 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.705 8.533 -7.075 1.00 0.00 H new ATOM 359 N LEU A 26 -3.469 9.218 -1.968 1.00 0.00 N ATOM 360 CA LEU A 26 -3.887 9.602 -0.618 1.00 0.00 C ATOM 361 C LEU A 26 -3.800 11.114 -0.435 1.00 0.00 C ATOM 362 O LEU A 26 -2.910 11.785 -0.961 1.00 0.00 O ATOM 363 CB LEU A 26 -3.049 8.893 0.463 1.00 0.00 C ATOM 364 CG LEU A 26 -3.341 7.405 0.713 1.00 0.00 C ATOM 365 CD1 LEU A 26 -4.829 7.107 0.910 1.00 0.00 C ATOM 366 CD2 LEU A 26 -2.817 6.534 -0.414 1.00 0.00 C ATOM 0 H LEU A 26 -2.458 9.218 -2.102 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.924 9.288 -0.501 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.997 8.990 0.193 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -3.188 9.427 1.403 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.819 7.167 1.640 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.967 6.039 1.082 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.201 7.664 1.770 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.381 7.405 0.019 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.042 5.489 -0.201 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.294 6.825 -1.350 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.738 6.662 -0.501 1.00 0.00 H new ATOM 377 N TYR A 27 -4.735 11.631 0.355 1.00 0.00 N ATOM 378 CA TYR A 27 -4.787 13.033 0.732 1.00 0.00 C ATOM 379 C TYR A 27 -3.621 13.375 1.683 1.00 0.00 C ATOM 380 O TYR A 27 -3.464 12.723 2.717 1.00 0.00 O ATOM 381 CB TYR A 27 -6.152 13.322 1.368 1.00 0.00 C ATOM 382 CG TYR A 27 -7.219 13.675 0.345 1.00 0.00 C ATOM 383 CD1 TYR A 27 -7.590 12.755 -0.658 1.00 0.00 C ATOM 384 CD2 TYR A 27 -7.809 14.955 0.370 1.00 0.00 C ATOM 385 CE1 TYR A 27 -8.523 13.122 -1.650 1.00 0.00 C ATOM 386 CE2 TYR A 27 -8.749 15.323 -0.615 1.00 0.00 C ATOM 387 CZ TYR A 27 -9.097 14.410 -1.631 1.00 0.00 C ATOM 388 OH TYR A 27 -9.989 14.767 -2.594 1.00 0.00 O ATOM 0 H TYR A 27 -5.490 11.075 0.757 1.00 0.00 H new ATOM 0 HA TYR A 27 -4.674 13.666 -0.148 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -6.475 12.449 1.935 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -6.050 14.143 2.077 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -7.158 11.765 -0.666 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -7.540 15.656 1.146 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -8.797 12.418 -2.422 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -9.202 16.303 -0.591 1.00 0.00 H new ATOM 0 HH TYR A 27 -10.291 15.686 -2.436 1.00 0.00 H new ATOM 397 N PRO A 28 -2.782 14.381 1.369 1.00 0.00 N ATOM 398 CA PRO A 28 -1.683 14.812 2.235 1.00 0.00 C ATOM 399 C PRO A 28 -2.180 15.751 3.353 1.00 0.00 C ATOM 400 O PRO A 28 -1.783 16.913 3.443 1.00 0.00 O ATOM 401 CB PRO A 28 -0.670 15.424 1.270 1.00 0.00 C ATOM 402 CG PRO A 28 -1.516 16.002 0.137 1.00 0.00 C ATOM 403 CD PRO A 28 -2.723 15.071 0.084 1.00 0.00 C ATOM 0 HA PRO A 28 -1.220 14.003 2.799 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -0.077 16.198 1.757 1.00 0.00 H new ATOM 0 HB3 PRO A 28 0.028 14.673 0.900 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.811 17.031 0.341 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -0.972 16.008 -0.807 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -3.639 15.635 -0.094 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -2.625 14.357 -0.734 1.00 0.00 H new ATOM 408 N GLN A 29 -3.085 15.248 4.199 1.00 0.00 N ATOM 409 CA GLN A 29 -3.778 16.001 5.251 1.00 0.00 C ATOM 410 C GLN A 29 -3.635 15.327 6.627 1.00 0.00 C ATOM 411 O GLN A 29 -4.205 14.266 6.899 1.00 0.00 O ATOM 412 CB GLN A 29 -5.261 16.186 4.873 1.00 0.00 C ATOM 413 CG GLN A 29 -5.524 17.484 4.086 1.00 0.00 C ATOM 414 CD GLN A 29 -6.307 18.504 4.914 1.00 0.00 C ATOM 415 OE1 GLN A 29 -5.765 19.438 5.487 1.00 0.00 O ATOM 416 NE2 GLN A 29 -7.612 18.346 5.023 1.00 0.00 N ATOM 0 H GLN A 29 -3.366 14.268 4.169 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.310 16.982 5.331 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.587 15.334 4.277 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.864 16.190 5.781 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -4.574 17.920 3.777 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.079 17.251 3.177 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -8.073 17.570 4.549 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -8.160 19.000 5.582 1.00 0.00 H new ATOM 423 N ILE A 30 -2.875 15.969 7.520 1.00 0.00 N ATOM 424 CA ILE A 30 -2.700 15.543 8.912 1.00 0.00 C ATOM 425 C ILE A 30 -4.038 15.682 9.663 1.00 0.00 C ATOM 426 O ILE A 30 -4.563 16.784 9.839 1.00 0.00 O ATOM 427 CB ILE A 30 -1.534 16.323 9.562 1.00 0.00 C ATOM 428 CG1 ILE A 30 -0.182 16.086 8.836 1.00 0.00 C ATOM 429 CG2 ILE A 30 -1.378 16.009 11.061 1.00 0.00 C ATOM 430 CD1 ILE A 30 0.441 14.688 8.987 1.00 0.00 C ATOM 0 H ILE A 30 -2.354 16.816 7.291 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.422 14.490 8.961 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.800 17.375 9.457 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.326 16.283 7.774 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.535 16.821 9.202 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.545 16.583 11.468 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -2.295 16.277 11.586 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.183 14.945 11.191 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.381 14.647 8.436 1.00 0.00 H new ATOM 0 HD12 ILE A 30 0.630 14.486 10.041 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -0.245 13.939 8.591 1.00 0.00 H new ATOM 441 N GLY A 31 -4.612 14.541 10.042 1.00 0.00 N ATOM 442 CA GLY A 31 -5.923 14.381 10.677 1.00 0.00 C ATOM 443 C GLY A 31 -6.762 13.268 10.037 1.00 0.00 C ATOM 444 O GLY A 31 -7.728 12.801 10.642 1.00 0.00 O ATOM 0 H GLY A 31 -4.145 13.645 9.906 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -5.784 14.162 11.736 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.469 15.322 10.615 1.00 0.00 H new ATOM 447 N ASP A 32 -6.418 12.821 8.824 1.00 0.00 N ATOM 448 CA ASP A 32 -7.019 11.617 8.249 1.00 0.00 C ATOM 449 C ASP A 32 -6.447 10.308 8.832 1.00 0.00 C ATOM 450 O ASP A 32 -5.527 10.295 9.657 1.00 0.00 O ATOM 451 CB ASP A 32 -7.009 11.668 6.709 1.00 0.00 C ATOM 452 CG ASP A 32 -5.677 11.403 5.989 1.00 0.00 C ATOM 453 OD1 ASP A 32 -4.857 10.593 6.472 1.00 0.00 O ATOM 454 OD2 ASP A 32 -5.518 11.954 4.878 1.00 0.00 O ATOM 0 H ASP A 32 -5.729 13.275 8.225 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.066 11.607 8.553 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.736 10.941 6.346 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.363 12.653 6.405 1.00 0.00 H new ATOM 458 N LYS A 33 -7.024 9.186 8.397 1.00 0.00 N ATOM 459 CA LYS A 33 -6.515 7.832 8.630 1.00 0.00 C ATOM 460 C LYS A 33 -6.926 6.932 7.477 1.00 0.00 C ATOM 461 O LYS A 33 -7.892 7.224 6.767 1.00 0.00 O ATOM 462 CB LYS A 33 -6.997 7.263 9.980 1.00 0.00 C ATOM 463 CG LYS A 33 -8.514 7.378 10.196 1.00 0.00 C ATOM 464 CD LYS A 33 -9.032 6.439 11.304 1.00 0.00 C ATOM 465 CE LYS A 33 -10.004 5.370 10.772 1.00 0.00 C ATOM 466 NZ LYS A 33 -9.330 4.375 9.892 1.00 0.00 N ATOM 0 H LYS A 33 -7.888 9.195 7.854 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.427 7.875 8.680 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.709 6.214 10.045 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.484 7.785 10.788 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.763 8.408 10.453 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.028 7.149 9.262 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -8.185 5.948 11.783 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.533 7.030 12.071 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -10.466 4.853 11.613 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.806 5.857 10.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -10.046 3.850 9.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -8.691 4.868 9.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -8.782 3.711 10.475 1.00 0.00 H new ATOM 476 N LEU A 34 -6.192 5.840 7.320 1.00 0.00 N ATOM 477 CA LEU A 34 -6.361 4.868 6.256 1.00 0.00 C ATOM 478 C LEU A 34 -6.124 3.468 6.821 1.00 0.00 C ATOM 479 O LEU A 34 -5.052 3.153 7.342 1.00 0.00 O ATOM 480 CB LEU A 34 -5.448 5.154 5.042 1.00 0.00 C ATOM 481 CG LEU A 34 -4.185 6.022 5.231 1.00 0.00 C ATOM 482 CD1 LEU A 34 -3.159 5.637 4.170 1.00 0.00 C ATOM 483 CD2 LEU A 34 -4.489 7.512 5.049 1.00 0.00 C ATOM 0 H LEU A 34 -5.433 5.600 7.957 1.00 0.00 H new ATOM 0 HA LEU A 34 -7.382 4.940 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.127 4.193 4.640 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.061 5.631 4.277 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.814 5.851 6.242 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.262 6.244 4.294 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.902 4.583 4.278 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.579 5.808 3.179 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.575 8.090 5.190 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -4.876 7.684 4.045 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -5.232 7.824 5.783 1.00 0.00 H new ATOM 494 N ASP A 35 -7.146 2.629 6.690 1.00 0.00 N ATOM 495 CA ASP A 35 -7.048 1.204 6.975 1.00 0.00 C ATOM 496 C ASP A 35 -6.831 0.388 5.691 1.00 0.00 C ATOM 497 O ASP A 35 -7.347 0.706 4.614 1.00 0.00 O ATOM 498 CB ASP A 35 -8.238 0.723 7.816 1.00 0.00 C ATOM 499 CG ASP A 35 -9.595 1.292 7.381 1.00 0.00 C ATOM 500 OD1 ASP A 35 -10.237 0.688 6.490 1.00 0.00 O ATOM 501 OD2 ASP A 35 -10.013 2.325 7.957 1.00 0.00 O ATOM 0 H ASP A 35 -8.073 2.922 6.380 1.00 0.00 H new ATOM 0 HA ASP A 35 -6.161 1.035 7.586 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -8.283 -0.365 7.770 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.063 0.991 8.858 1.00 0.00 H new ATOM 505 N ILE A 36 -6.020 -0.660 5.829 1.00 0.00 N ATOM 506 CA ILE A 36 -5.618 -1.593 4.788 1.00 0.00 C ATOM 507 C ILE A 36 -5.915 -3.016 5.268 1.00 0.00 C ATOM 508 O ILE A 36 -5.231 -3.563 6.134 1.00 0.00 O ATOM 509 CB ILE A 36 -4.164 -1.371 4.306 1.00 0.00 C ATOM 510 CG1 ILE A 36 -3.712 -2.507 3.361 1.00 0.00 C ATOM 511 CG2 ILE A 36 -3.144 -1.202 5.442 1.00 0.00 C ATOM 512 CD1 ILE A 36 -2.543 -2.118 2.446 1.00 0.00 C ATOM 0 H ILE A 36 -5.602 -0.891 6.730 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.206 -1.412 3.888 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.185 -0.425 3.765 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.422 -3.371 3.959 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.558 -2.814 2.745 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -2.151 -1.051 5.020 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.415 -0.338 6.049 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.141 -2.097 6.065 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.280 -2.964 1.811 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -2.835 -1.273 1.822 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -1.682 -1.840 3.054 1.00 0.00 H new ATOM 523 N ILE A 37 -6.972 -3.600 4.705 1.00 0.00 N ATOM 524 CA ILE A 37 -7.477 -4.936 5.007 1.00 0.00 C ATOM 525 C ILE A 37 -7.529 -5.736 3.705 1.00 0.00 C ATOM 526 O ILE A 37 -8.002 -5.228 2.684 1.00 0.00 O ATOM 527 CB ILE A 37 -8.865 -4.866 5.686 1.00 0.00 C ATOM 528 CG1 ILE A 37 -8.851 -4.056 7.004 1.00 0.00 C ATOM 529 CG2 ILE A 37 -9.416 -6.272 5.990 1.00 0.00 C ATOM 530 CD1 ILE A 37 -9.869 -2.915 6.988 1.00 0.00 C ATOM 0 H ILE A 37 -7.526 -3.129 3.990 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.811 -5.434 5.712 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.509 -4.356 4.970 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -9.066 -4.721 7.840 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -7.853 -3.649 7.168 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.392 -6.185 6.467 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -9.515 -6.833 5.061 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -8.731 -6.794 6.658 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.824 -2.374 7.933 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -9.639 -2.234 6.169 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.870 -3.323 6.851 1.00 0.00 H new ATOM 541 N CYS A 38 -7.082 -6.989 3.749 1.00 0.00 N ATOM 542 CA CYS A 38 -7.126 -7.925 2.631 1.00 0.00 C ATOM 543 C CYS A 38 -7.522 -9.338 3.098 1.00 0.00 C ATOM 544 O CYS A 38 -7.104 -9.760 4.184 1.00 0.00 O ATOM 545 CB CYS A 38 -5.759 -7.989 1.945 1.00 0.00 C ATOM 546 SG CYS A 38 -5.394 -6.620 0.832 1.00 0.00 S ATOM 0 H CYS A 38 -6.667 -7.392 4.589 1.00 0.00 H new ATOM 0 HA CYS A 38 -7.878 -7.566 1.929 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -4.986 -8.028 2.713 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -5.696 -8.920 1.382 1.00 0.00 H new ATOM 550 N PRO A 39 -8.280 -10.089 2.273 1.00 0.00 N ATOM 551 CA PRO A 39 -8.703 -11.448 2.600 1.00 0.00 C ATOM 552 C PRO A 39 -7.541 -12.447 2.466 1.00 0.00 C ATOM 553 O PRO A 39 -6.469 -12.119 1.947 1.00 0.00 O ATOM 554 CB PRO A 39 -9.842 -11.749 1.621 1.00 0.00 C ATOM 555 CG PRO A 39 -9.521 -10.901 0.388 1.00 0.00 C ATOM 556 CD PRO A 39 -8.656 -9.753 0.903 1.00 0.00 C ATOM 0 HA PRO A 39 -9.031 -11.540 3.635 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -9.883 -12.810 1.374 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -10.810 -11.483 2.045 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.992 -11.486 -0.364 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -10.432 -10.528 -0.081 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -7.771 -9.626 0.279 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -9.205 -8.812 0.873 1.00 0.00 H new ATOM 561 N LYS A 40 -7.763 -13.691 2.911 1.00 0.00 N ATOM 562 CA LYS A 40 -6.745 -14.759 2.888 1.00 0.00 C ATOM 563 C LYS A 40 -6.861 -15.677 1.667 1.00 0.00 C ATOM 564 O LYS A 40 -5.844 -15.956 1.033 1.00 0.00 O ATOM 565 CB LYS A 40 -6.818 -15.527 4.218 1.00 0.00 C ATOM 566 CG LYS A 40 -5.831 -16.706 4.300 1.00 0.00 C ATOM 567 CD LYS A 40 -6.499 -18.053 3.961 1.00 0.00 C ATOM 568 CE LYS A 40 -5.498 -19.184 3.686 1.00 0.00 C ATOM 569 NZ LYS A 40 -4.728 -18.974 2.431 1.00 0.00 N ATOM 0 H LYS A 40 -8.657 -13.990 3.300 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.759 -14.305 2.787 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -6.618 -14.838 5.038 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -7.832 -15.902 4.357 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -5.002 -16.531 3.614 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -5.409 -16.755 5.304 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -7.147 -18.346 4.787 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -7.137 -17.923 3.087 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.805 -19.263 4.524 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -6.034 -20.131 3.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -4.155 -19.818 2.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -5.386 -18.807 1.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.104 -18.150 2.541 1.00 0.00 H new ATOM 579 N VAL A 41 -8.089 -16.103 1.339 1.00 0.00 N ATOM 580 CA VAL A 41 -8.456 -16.999 0.221 1.00 0.00 C ATOM 581 C VAL A 41 -7.863 -18.421 0.350 1.00 0.00 C ATOM 582 O VAL A 41 -6.648 -18.601 0.367 1.00 0.00 O ATOM 583 CB VAL A 41 -8.106 -16.356 -1.143 1.00 0.00 C ATOM 584 CG1 VAL A 41 -8.763 -17.147 -2.276 1.00 0.00 C ATOM 585 CG2 VAL A 41 -8.598 -14.902 -1.239 1.00 0.00 C ATOM 0 H VAL A 41 -8.907 -15.816 1.877 1.00 0.00 H new ATOM 0 HA VAL A 41 -9.537 -17.127 0.274 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.020 -16.371 -1.230 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.512 -16.689 -3.233 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.401 -18.175 -2.260 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -9.845 -17.142 -2.144 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.331 -14.491 -2.212 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -9.681 -14.876 -1.119 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.131 -14.307 -0.454 1.00 0.00 H new ATOM 595 N ASP A 42 -8.726 -19.443 0.452 1.00 0.00 N ATOM 596 CA ASP A 42 -8.360 -20.879 0.381 1.00 0.00 C ATOM 597 C ASP A 42 -9.587 -21.812 0.367 1.00 0.00 C ATOM 598 O ASP A 42 -9.746 -22.620 -0.548 1.00 0.00 O ATOM 599 CB ASP A 42 -7.486 -21.280 1.594 1.00 0.00 C ATOM 600 CG ASP A 42 -6.041 -21.700 1.267 1.00 0.00 C ATOM 601 OD1 ASP A 42 -5.543 -21.509 0.134 1.00 0.00 O ATOM 602 OD2 ASP A 42 -5.368 -22.215 2.191 1.00 0.00 O ATOM 0 H ASP A 42 -9.726 -19.297 0.590 1.00 0.00 H new ATOM 0 HA ASP A 42 -7.815 -20.997 -0.556 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -7.452 -20.440 2.288 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -7.975 -22.103 2.114 1.00 0.00 H new ATOM 606 N SER A 43 -10.444 -21.718 1.395 1.00 0.00 N ATOM 607 CA SER A 43 -11.571 -22.648 1.607 1.00 0.00 C ATOM 608 C SER A 43 -12.778 -22.285 0.736 1.00 0.00 C ATOM 609 O SER A 43 -13.422 -23.147 0.129 1.00 0.00 O ATOM 610 CB SER A 43 -11.991 -22.619 3.087 1.00 0.00 C ATOM 611 OG SER A 43 -12.596 -23.845 3.463 1.00 0.00 O ATOM 0 H SER A 43 -10.377 -20.992 2.108 1.00 0.00 H new ATOM 0 HA SER A 43 -11.236 -23.646 1.326 1.00 0.00 H new ATOM 0 HB2 SER A 43 -11.119 -22.431 3.713 1.00 0.00 H new ATOM 0 HB3 SER A 43 -12.687 -21.798 3.256 1.00 0.00 H new ATOM 0 HG SER A 43 -12.854 -23.806 4.408 1.00 0.00 H new ATOM 616 N LYS A 44 -13.057 -20.977 0.653 1.00 0.00 N ATOM 617 CA LYS A 44 -14.116 -20.375 -0.176 1.00 0.00 C ATOM 618 C LYS A 44 -13.627 -20.057 -1.595 1.00 0.00 C ATOM 619 O LYS A 44 -14.421 -20.010 -2.534 1.00 0.00 O ATOM 620 CB LYS A 44 -14.598 -19.068 0.485 1.00 0.00 C ATOM 621 CG LYS A 44 -14.856 -19.151 2.001 1.00 0.00 C ATOM 622 CD LYS A 44 -15.762 -20.309 2.450 1.00 0.00 C ATOM 623 CE LYS A 44 -17.161 -20.207 1.828 1.00 0.00 C ATOM 624 NZ LYS A 44 -18.224 -20.444 2.839 1.00 0.00 N ATOM 0 H LYS A 44 -12.532 -20.280 1.181 1.00 0.00 H new ATOM 0 HA LYS A 44 -14.928 -21.099 -0.250 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -13.854 -18.292 0.302 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -15.518 -18.750 -0.006 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.897 -19.242 2.512 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -15.304 -18.213 2.329 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -15.306 -21.258 2.168 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.845 -20.306 3.537 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -17.292 -19.220 1.385 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -17.256 -20.934 1.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -19.157 -20.368 2.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -18.112 -21.395 3.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -18.148 -19.735 3.596 1.00 0.00 H new ATOM 634 N THR A 45 -12.323 -19.788 -1.718 1.00 0.00 N ATOM 635 CA THR A 45 -11.561 -19.468 -2.942 1.00 0.00 C ATOM 636 C THR A 45 -11.942 -18.161 -3.653 1.00 0.00 C ATOM 637 O THR A 45 -11.154 -17.672 -4.454 1.00 0.00 O ATOM 638 CB THR A 45 -11.517 -20.655 -3.931 1.00 0.00 C ATOM 639 OG1 THR A 45 -11.775 -21.875 -3.269 1.00 0.00 O ATOM 640 CG2 THR A 45 -10.121 -20.834 -4.526 1.00 0.00 C ATOM 0 H THR A 45 -11.717 -19.787 -0.897 1.00 0.00 H new ATOM 0 HA THR A 45 -10.554 -19.285 -2.567 1.00 0.00 H new ATOM 0 HB THR A 45 -12.262 -20.429 -4.694 1.00 0.00 H new ATOM 0 HG1 THR A 45 -11.744 -22.611 -3.915 1.00 0.00 H new ATOM 0 HG21 THR A 45 -10.125 -21.677 -5.217 1.00 0.00 H new ATOM 0 HG22 THR A 45 -9.834 -19.928 -5.060 1.00 0.00 H new ATOM 0 HG23 THR A 45 -9.406 -21.025 -3.726 1.00 0.00 H new ATOM 648 N VAL A 46 -13.090 -17.550 -3.334 1.00 0.00 N ATOM 649 CA VAL A 46 -13.628 -16.261 -3.843 1.00 0.00 C ATOM 650 C VAL A 46 -13.554 -16.068 -5.371 1.00 0.00 C ATOM 651 O VAL A 46 -13.347 -14.961 -5.873 1.00 0.00 O ATOM 652 CB VAL A 46 -13.138 -15.034 -3.034 1.00 0.00 C ATOM 653 CG1 VAL A 46 -13.422 -15.204 -1.532 1.00 0.00 C ATOM 654 CG2 VAL A 46 -11.646 -14.709 -3.190 1.00 0.00 C ATOM 0 H VAL A 46 -13.727 -17.971 -2.658 1.00 0.00 H new ATOM 0 HA VAL A 46 -14.699 -16.335 -3.657 1.00 0.00 H new ATOM 0 HB VAL A 46 -13.704 -14.204 -3.458 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -13.066 -14.326 -0.993 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -14.495 -15.316 -1.375 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -12.907 -16.090 -1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -11.399 -13.836 -2.587 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -11.052 -15.560 -2.857 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -11.427 -14.500 -4.237 1.00 0.00 H new ATOM 664 N GLY A 47 -13.716 -17.157 -6.131 1.00 0.00 N ATOM 665 CA GLY A 47 -13.581 -17.174 -7.602 1.00 0.00 C ATOM 666 C GLY A 47 -12.137 -17.336 -8.112 1.00 0.00 C ATOM 667 O GLY A 47 -11.890 -17.260 -9.314 1.00 0.00 O ATOM 0 H GLY A 47 -13.949 -18.070 -5.740 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -14.186 -17.989 -8.000 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -13.992 -16.247 -8.002 1.00 0.00 H new ATOM 670 N GLN A 48 -11.211 -17.588 -7.186 1.00 0.00 N ATOM 671 CA GLN A 48 -9.774 -17.838 -7.313 1.00 0.00 C ATOM 672 C GLN A 48 -8.982 -16.561 -7.656 1.00 0.00 C ATOM 673 O GLN A 48 -9.017 -16.069 -8.787 1.00 0.00 O ATOM 674 CB GLN A 48 -9.459 -19.033 -8.234 1.00 0.00 C ATOM 675 CG GLN A 48 -10.336 -20.286 -8.000 1.00 0.00 C ATOM 676 CD GLN A 48 -11.263 -20.608 -9.177 1.00 0.00 C ATOM 677 OE1 GLN A 48 -10.848 -20.779 -10.316 1.00 0.00 O ATOM 678 NE2 GLN A 48 -12.560 -20.718 -8.952 1.00 0.00 N ATOM 0 H GLN A 48 -11.487 -17.626 -6.205 1.00 0.00 H new ATOM 0 HA GLN A 48 -9.420 -18.139 -6.327 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -9.575 -18.715 -9.270 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.413 -19.310 -8.101 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.689 -21.143 -7.811 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -10.938 -20.137 -7.103 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -12.928 -20.580 -8.011 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -13.194 -20.941 -9.720 1.00 0.00 H new ATOM 685 N TYR A 49 -8.272 -16.022 -6.659 1.00 0.00 N ATOM 686 CA TYR A 49 -7.538 -14.750 -6.717 1.00 0.00 C ATOM 687 C TYR A 49 -6.025 -14.941 -6.507 1.00 0.00 C ATOM 688 O TYR A 49 -5.572 -16.003 -6.070 1.00 0.00 O ATOM 689 CB TYR A 49 -8.138 -13.773 -5.677 1.00 0.00 C ATOM 690 CG TYR A 49 -8.679 -12.461 -6.232 1.00 0.00 C ATOM 691 CD1 TYR A 49 -9.401 -12.445 -7.443 1.00 0.00 C ATOM 692 CD2 TYR A 49 -8.481 -11.254 -5.526 1.00 0.00 C ATOM 693 CE1 TYR A 49 -9.865 -11.227 -7.981 1.00 0.00 C ATOM 694 CE2 TYR A 49 -8.955 -10.033 -6.056 1.00 0.00 C ATOM 695 CZ TYR A 49 -9.628 -10.017 -7.296 1.00 0.00 C ATOM 696 OH TYR A 49 -10.034 -8.841 -7.845 1.00 0.00 O ATOM 0 H TYR A 49 -8.189 -16.478 -5.751 1.00 0.00 H new ATOM 0 HA TYR A 49 -7.651 -14.328 -7.716 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -8.945 -14.283 -5.151 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -7.371 -13.544 -4.938 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -9.600 -13.371 -7.962 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -7.965 -11.264 -4.577 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -10.402 -11.221 -8.918 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -8.802 -9.112 -5.512 1.00 0.00 H new ATOM 0 HH TYR A 49 -9.797 -8.102 -7.247 1.00 0.00 H new ATOM 705 N GLU A 50 -5.241 -13.900 -6.802 1.00 0.00 N ATOM 706 CA GLU A 50 -3.777 -13.905 -6.665 1.00 0.00 C ATOM 707 C GLU A 50 -3.305 -13.232 -5.361 1.00 0.00 C ATOM 708 O GLU A 50 -4.102 -12.733 -4.560 1.00 0.00 O ATOM 709 CB GLU A 50 -3.127 -13.242 -7.900 1.00 0.00 C ATOM 710 CG GLU A 50 -2.345 -14.237 -8.765 1.00 0.00 C ATOM 711 CD GLU A 50 -3.266 -15.057 -9.689 1.00 0.00 C ATOM 712 OE1 GLU A 50 -3.653 -14.549 -10.772 1.00 0.00 O ATOM 713 OE2 GLU A 50 -3.587 -16.221 -9.358 1.00 0.00 O ATOM 0 H GLU A 50 -5.609 -13.014 -7.149 1.00 0.00 H new ATOM 0 HA GLU A 50 -3.455 -14.945 -6.609 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -3.903 -12.773 -8.505 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -2.456 -12.449 -7.570 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -1.616 -13.696 -9.369 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -1.785 -14.914 -8.120 1.00 0.00 H new ATOM 718 N TYR A 51 -1.987 -13.234 -5.145 1.00 0.00 N ATOM 719 CA TYR A 51 -1.346 -12.701 -3.948 1.00 0.00 C ATOM 720 C TYR A 51 -0.738 -11.328 -4.235 1.00 0.00 C ATOM 721 O TYR A 51 0.061 -11.174 -5.163 1.00 0.00 O ATOM 722 CB TYR A 51 -0.273 -13.699 -3.489 1.00 0.00 C ATOM 723 CG TYR A 51 -0.761 -15.090 -3.095 1.00 0.00 C ATOM 724 CD1 TYR A 51 -2.116 -15.353 -2.779 1.00 0.00 C ATOM 725 CD2 TYR A 51 0.170 -16.145 -3.059 1.00 0.00 C ATOM 726 CE1 TYR A 51 -2.538 -16.662 -2.477 1.00 0.00 C ATOM 727 CE2 TYR A 51 -0.248 -17.457 -2.751 1.00 0.00 C ATOM 728 CZ TYR A 51 -1.606 -17.720 -2.474 1.00 0.00 C ATOM 729 OH TYR A 51 -2.012 -18.989 -2.209 1.00 0.00 O ATOM 0 H TYR A 51 -1.322 -13.617 -5.817 1.00 0.00 H new ATOM 0 HA TYR A 51 -2.081 -12.570 -3.154 1.00 0.00 H new ATOM 0 HB2 TYR A 51 0.457 -13.808 -4.291 1.00 0.00 H new ATOM 0 HB3 TYR A 51 0.252 -13.268 -2.637 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -2.831 -14.544 -2.770 1.00 0.00 H new ATOM 0 HD2 TYR A 51 1.211 -15.949 -3.269 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -3.575 -16.856 -2.248 1.00 0.00 H new ATOM 0 HE2 TYR A 51 0.473 -18.261 -2.727 1.00 0.00 H new ATOM 0 HH TYR A 51 -1.242 -19.594 -2.249 1.00 0.00 H new ATOM 738 N TYR A 52 -1.116 -10.328 -3.436 1.00 0.00 N ATOM 739 CA TYR A 52 -0.724 -8.928 -3.636 1.00 0.00 C ATOM 740 C TYR A 52 0.174 -8.478 -2.481 1.00 0.00 C ATOM 741 O TYR A 52 0.113 -9.033 -1.382 1.00 0.00 O ATOM 742 CB TYR A 52 -1.985 -8.048 -3.766 1.00 0.00 C ATOM 743 CG TYR A 52 -3.080 -8.562 -4.689 1.00 0.00 C ATOM 744 CD1 TYR A 52 -2.750 -9.305 -5.839 1.00 0.00 C ATOM 745 CD2 TYR A 52 -4.437 -8.314 -4.392 1.00 0.00 C ATOM 746 CE1 TYR A 52 -3.759 -9.853 -6.647 1.00 0.00 C ATOM 747 CE2 TYR A 52 -5.454 -8.842 -5.216 1.00 0.00 C ATOM 748 CZ TYR A 52 -5.111 -9.626 -6.340 1.00 0.00 C ATOM 749 OH TYR A 52 -6.067 -10.150 -7.146 1.00 0.00 O ATOM 0 H TYR A 52 -1.711 -10.468 -2.620 1.00 0.00 H new ATOM 0 HA TYR A 52 -0.154 -8.825 -4.560 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -2.412 -7.915 -2.772 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -1.678 -7.062 -4.116 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -1.713 -9.454 -6.101 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.699 -7.718 -3.530 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -3.495 -10.451 -7.507 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -6.492 -8.647 -4.988 1.00 0.00 H new ATOM 0 HH TYR A 52 -6.901 -10.251 -6.641 1.00 0.00 H new ATOM 758 N LYS A 53 1.015 -7.465 -2.701 1.00 0.00 N ATOM 759 CA LYS A 53 1.901 -6.940 -1.656 1.00 0.00 C ATOM 760 C LYS A 53 2.181 -5.455 -1.885 1.00 0.00 C ATOM 761 O LYS A 53 2.340 -5.018 -3.018 1.00 0.00 O ATOM 762 CB LYS A 53 3.173 -7.812 -1.561 1.00 0.00 C ATOM 763 CG LYS A 53 4.149 -7.673 -2.746 1.00 0.00 C ATOM 764 CD LYS A 53 5.515 -7.117 -2.297 1.00 0.00 C ATOM 765 CE LYS A 53 6.415 -8.237 -1.760 1.00 0.00 C ATOM 766 NZ LYS A 53 6.895 -9.109 -2.867 1.00 0.00 N ATOM 0 H LYS A 53 1.102 -6.989 -3.599 1.00 0.00 H new ATOM 0 HA LYS A 53 1.412 -7.000 -0.684 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.702 -7.557 -0.643 1.00 0.00 H new ATOM 0 HB3 LYS A 53 2.874 -8.857 -1.477 1.00 0.00 H new ATOM 0 HG2 LYS A 53 4.289 -8.645 -3.218 1.00 0.00 H new ATOM 0 HG3 LYS A 53 3.717 -7.013 -3.498 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.004 -6.623 -3.137 1.00 0.00 H new ATOM 0 HD3 LYS A 53 5.368 -6.362 -1.525 1.00 0.00 H new ATOM 0 HE2 LYS A 53 7.268 -7.804 -1.237 1.00 0.00 H new ATOM 0 HE3 LYS A 53 5.865 -8.835 -1.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.720 -9.655 -2.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.136 -9.762 -3.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 7.164 -8.520 -3.681 1.00 0.00 H new ATOM 776 N VAL A 54 2.229 -4.681 -0.811 1.00 0.00 N ATOM 777 CA VAL A 54 2.454 -3.236 -0.852 1.00 0.00 C ATOM 778 C VAL A 54 3.854 -2.985 -0.321 1.00 0.00 C ATOM 779 O VAL A 54 4.127 -3.207 0.860 1.00 0.00 O ATOM 780 CB VAL A 54 1.353 -2.503 -0.062 1.00 0.00 C ATOM 781 CG1 VAL A 54 1.767 -1.153 0.538 1.00 0.00 C ATOM 782 CG2 VAL A 54 0.127 -2.298 -0.958 1.00 0.00 C ATOM 0 H VAL A 54 2.111 -5.043 0.135 1.00 0.00 H new ATOM 0 HA VAL A 54 2.393 -2.841 -1.866 1.00 0.00 H new ATOM 0 HB VAL A 54 1.131 -3.150 0.787 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.923 -0.719 1.073 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.597 -1.301 1.229 1.00 0.00 H new ATOM 0 HG13 VAL A 54 2.076 -0.479 -0.261 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.651 -1.779 -0.397 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.407 -1.702 -1.827 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -0.248 -3.267 -1.288 1.00 0.00 H new ATOM 792 N TYR A 55 4.740 -2.537 -1.209 1.00 0.00 N ATOM 793 CA TYR A 55 6.130 -2.223 -0.889 1.00 0.00 C ATOM 794 C TYR A 55 6.488 -0.794 -1.293 1.00 0.00 C ATOM 795 O TYR A 55 5.960 -0.286 -2.278 1.00 0.00 O ATOM 796 CB TYR A 55 7.063 -3.255 -1.545 1.00 0.00 C ATOM 797 CG TYR A 55 8.509 -2.814 -1.589 1.00 0.00 C ATOM 798 CD1 TYR A 55 9.344 -2.985 -0.469 1.00 0.00 C ATOM 799 CD2 TYR A 55 8.991 -2.120 -2.713 1.00 0.00 C ATOM 800 CE1 TYR A 55 10.663 -2.479 -0.481 1.00 0.00 C ATOM 801 CE2 TYR A 55 10.321 -1.672 -2.755 1.00 0.00 C ATOM 802 CZ TYR A 55 11.149 -1.826 -1.630 1.00 0.00 C ATOM 803 OH TYR A 55 12.397 -1.291 -1.644 1.00 0.00 O ATOM 0 H TYR A 55 4.507 -2.379 -2.189 1.00 0.00 H new ATOM 0 HA TYR A 55 6.262 -2.282 0.191 1.00 0.00 H new ATOM 0 HB2 TYR A 55 6.994 -4.195 -0.998 1.00 0.00 H new ATOM 0 HB3 TYR A 55 6.719 -3.451 -2.561 1.00 0.00 H new ATOM 0 HD1 TYR A 55 8.975 -3.505 0.403 1.00 0.00 H new ATOM 0 HD2 TYR A 55 8.334 -1.930 -3.549 1.00 0.00 H new ATOM 0 HE1 TYR A 55 11.296 -2.592 0.387 1.00 0.00 H new ATOM 0 HE2 TYR A 55 10.707 -1.209 -3.651 1.00 0.00 H new ATOM 0 HH TYR A 55 12.567 -0.880 -2.517 1.00 0.00 H new ATOM 812 N MET A 56 7.384 -0.154 -0.539 1.00 0.00 N ATOM 813 CA MET A 56 7.819 1.223 -0.771 1.00 0.00 C ATOM 814 C MET A 56 9.043 1.291 -1.705 1.00 0.00 C ATOM 815 O MET A 56 10.147 0.925 -1.301 1.00 0.00 O ATOM 816 CB MET A 56 8.142 1.878 0.578 1.00 0.00 C ATOM 817 CG MET A 56 8.446 3.374 0.409 1.00 0.00 C ATOM 818 SD MET A 56 9.312 4.141 1.800 1.00 0.00 S ATOM 819 CE MET A 56 9.589 5.772 1.056 1.00 0.00 C ATOM 0 H MET A 56 7.836 -0.588 0.266 1.00 0.00 H new ATOM 0 HA MET A 56 7.010 1.761 -1.265 1.00 0.00 H new ATOM 0 HB2 MET A 56 7.300 1.750 1.259 1.00 0.00 H new ATOM 0 HB3 MET A 56 8.998 1.379 1.032 1.00 0.00 H new ATOM 0 HG2 MET A 56 9.046 3.508 -0.491 1.00 0.00 H new ATOM 0 HG3 MET A 56 7.507 3.904 0.248 1.00 0.00 H new ATOM 0 HE1 MET A 56 10.023 6.442 1.799 1.00 0.00 H new ATOM 0 HE2 MET A 56 10.272 5.676 0.212 1.00 0.00 H new ATOM 0 HE3 MET A 56 8.639 6.180 0.710 1.00 0.00 H new ATOM 827 N VAL A 57 8.875 1.828 -2.915 1.00 0.00 N ATOM 828 CA VAL A 57 9.926 1.938 -3.944 1.00 0.00 C ATOM 829 C VAL A 57 10.125 3.401 -4.391 1.00 0.00 C ATOM 830 O VAL A 57 9.344 4.277 -4.026 1.00 0.00 O ATOM 831 CB VAL A 57 9.589 0.971 -5.096 1.00 0.00 C ATOM 832 CG1 VAL A 57 8.573 1.530 -6.088 1.00 0.00 C ATOM 833 CG2 VAL A 57 10.841 0.498 -5.834 1.00 0.00 C ATOM 0 H VAL A 57 7.980 2.211 -3.221 1.00 0.00 H new ATOM 0 HA VAL A 57 10.892 1.641 -3.535 1.00 0.00 H new ATOM 0 HB VAL A 57 9.122 0.113 -4.612 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.385 0.794 -6.870 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.641 1.752 -5.568 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.966 2.443 -6.535 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.555 -0.181 -6.637 1.00 0.00 H new ATOM 0 HG22 VAL A 57 11.362 1.358 -6.254 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.500 -0.021 -5.137 1.00 0.00 H new ATOM 843 N ASP A 58 11.174 3.710 -5.160 1.00 0.00 N ATOM 844 CA ASP A 58 11.405 5.038 -5.767 1.00 0.00 C ATOM 845 C ASP A 58 10.458 5.322 -6.949 1.00 0.00 C ATOM 846 O ASP A 58 10.007 4.392 -7.612 1.00 0.00 O ATOM 847 CB ASP A 58 12.849 5.134 -6.290 1.00 0.00 C ATOM 848 CG ASP A 58 13.909 4.737 -5.249 1.00 0.00 C ATOM 849 OD1 ASP A 58 14.337 5.603 -4.454 1.00 0.00 O ATOM 850 OD2 ASP A 58 14.335 3.554 -5.244 1.00 0.00 O ATOM 0 H ASP A 58 11.905 3.035 -5.386 1.00 0.00 H new ATOM 0 HA ASP A 58 11.216 5.772 -4.983 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.953 4.492 -7.165 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.040 6.155 -6.619 1.00 0.00 H new ATOM 854 N LYS A 59 10.218 6.594 -7.301 1.00 0.00 N ATOM 855 CA LYS A 59 9.349 6.977 -8.434 1.00 0.00 C ATOM 856 C LYS A 59 9.726 6.323 -9.774 1.00 0.00 C ATOM 857 O LYS A 59 8.855 5.888 -10.524 1.00 0.00 O ATOM 858 CB LYS A 59 9.292 8.508 -8.572 1.00 0.00 C ATOM 859 CG LYS A 59 10.578 9.173 -9.078 1.00 0.00 C ATOM 860 CD LYS A 59 10.417 10.694 -9.133 1.00 0.00 C ATOM 861 CE LYS A 59 11.783 11.324 -9.427 1.00 0.00 C ATOM 862 NZ LYS A 59 11.647 12.671 -10.035 1.00 0.00 N ATOM 0 H LYS A 59 10.620 7.392 -6.809 1.00 0.00 H new ATOM 0 HA LYS A 59 8.359 6.590 -8.192 1.00 0.00 H new ATOM 0 HB2 LYS A 59 8.479 8.764 -9.252 1.00 0.00 H new ATOM 0 HB3 LYS A 59 9.041 8.934 -7.601 1.00 0.00 H new ATOM 0 HG2 LYS A 59 11.409 8.914 -8.422 1.00 0.00 H new ATOM 0 HG3 LYS A 59 10.824 8.793 -10.069 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.700 10.970 -9.906 1.00 0.00 H new ATOM 0 HD3 LYS A 59 10.025 11.067 -8.187 1.00 0.00 H new ATOM 0 HE2 LYS A 59 12.356 11.398 -8.503 1.00 0.00 H new ATOM 0 HE3 LYS A 59 12.345 10.676 -10.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 12.591 13.065 -10.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 11.122 12.597 -10.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 11.132 13.296 -9.382 1.00 0.00 H new ATOM 872 N ASP A 60 11.027 6.228 -10.053 1.00 0.00 N ATOM 873 CA ASP A 60 11.575 5.614 -11.266 1.00 0.00 C ATOM 874 C ASP A 60 11.360 4.092 -11.273 1.00 0.00 C ATOM 875 O ASP A 60 10.930 3.506 -12.266 1.00 0.00 O ATOM 876 CB ASP A 60 13.071 5.961 -11.314 1.00 0.00 C ATOM 877 CG ASP A 60 13.862 5.142 -12.350 1.00 0.00 C ATOM 878 OD1 ASP A 60 13.831 5.491 -13.553 1.00 0.00 O ATOM 879 OD2 ASP A 60 14.537 4.165 -11.951 1.00 0.00 O ATOM 0 H ASP A 60 11.748 6.585 -9.426 1.00 0.00 H new ATOM 0 HA ASP A 60 11.063 5.999 -12.148 1.00 0.00 H new ATOM 0 HB2 ASP A 60 13.182 7.021 -11.540 1.00 0.00 H new ATOM 0 HB3 ASP A 60 13.505 5.799 -10.327 1.00 0.00 H new ATOM 883 N GLN A 61 11.602 3.454 -10.128 1.00 0.00 N ATOM 884 CA GLN A 61 11.413 2.018 -9.934 1.00 0.00 C ATOM 885 C GLN A 61 9.926 1.618 -9.871 1.00 0.00 C ATOM 886 O GLN A 61 9.546 0.557 -10.373 1.00 0.00 O ATOM 887 CB GLN A 61 12.158 1.602 -8.672 1.00 0.00 C ATOM 888 CG GLN A 61 13.684 1.790 -8.764 1.00 0.00 C ATOM 889 CD GLN A 61 14.458 0.650 -8.098 1.00 0.00 C ATOM 890 OE1 GLN A 61 14.231 0.275 -6.957 1.00 0.00 O ATOM 891 NE2 GLN A 61 15.396 0.040 -8.795 1.00 0.00 N ATOM 0 H GLN A 61 11.942 3.931 -9.293 1.00 0.00 H new ATOM 0 HA GLN A 61 11.819 1.491 -10.797 1.00 0.00 H new ATOM 0 HB2 GLN A 61 11.780 2.181 -7.830 1.00 0.00 H new ATOM 0 HB3 GLN A 61 11.942 0.555 -8.462 1.00 0.00 H new ATOM 0 HG2 GLN A 61 13.975 1.859 -9.812 1.00 0.00 H new ATOM 0 HG3 GLN A 61 13.959 2.734 -8.294 1.00 0.00 H new ATOM 0 HE21 GLN A 61 15.599 0.340 -9.749 1.00 0.00 H new ATOM 0 HE22 GLN A 61 15.919 -0.732 -8.381 1.00 0.00 H new ATOM 898 N ALA A 62 9.057 2.507 -9.378 1.00 0.00 N ATOM 899 CA ALA A 62 7.604 2.423 -9.505 1.00 0.00 C ATOM 900 C ALA A 62 7.132 2.526 -10.969 1.00 0.00 C ATOM 901 O ALA A 62 5.968 2.263 -11.256 1.00 0.00 O ATOM 902 CB ALA A 62 6.975 3.516 -8.624 1.00 0.00 C ATOM 0 H ALA A 62 9.360 3.333 -8.862 1.00 0.00 H new ATOM 0 HA ALA A 62 7.275 1.441 -9.164 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.889 3.469 -8.706 1.00 0.00 H new ATOM 0 HB2 ALA A 62 7.268 3.360 -7.586 1.00 0.00 H new ATOM 0 HB3 ALA A 62 7.322 4.495 -8.955 1.00 0.00 H new ATOM 908 N ASP A 63 8.005 2.904 -11.905 1.00 0.00 N ATOM 909 CA ASP A 63 7.713 2.959 -13.339 1.00 0.00 C ATOM 910 C ASP A 63 8.384 1.806 -14.114 1.00 0.00 C ATOM 911 O ASP A 63 7.820 1.302 -15.090 1.00 0.00 O ATOM 912 CB ASP A 63 8.141 4.335 -13.885 1.00 0.00 C ATOM 913 CG ASP A 63 7.040 5.007 -14.722 1.00 0.00 C ATOM 914 OD1 ASP A 63 5.894 5.134 -14.224 1.00 0.00 O ATOM 915 OD2 ASP A 63 7.331 5.440 -15.864 1.00 0.00 O ATOM 0 H ASP A 63 8.959 3.188 -11.681 1.00 0.00 H new ATOM 0 HA ASP A 63 6.640 2.832 -13.483 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.407 4.986 -13.052 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.036 4.217 -14.496 1.00 0.00 H new ATOM 919 N ARG A 64 9.552 1.335 -13.644 1.00 0.00 N ATOM 920 CA ARG A 64 10.228 0.112 -14.123 1.00 0.00 C ATOM 921 C ARG A 64 9.550 -1.184 -13.693 1.00 0.00 C ATOM 922 O ARG A 64 9.730 -2.199 -14.362 1.00 0.00 O ATOM 923 CB ARG A 64 11.671 0.076 -13.600 1.00 0.00 C ATOM 924 CG ARG A 64 12.562 1.034 -14.390 1.00 0.00 C ATOM 925 CD ARG A 64 14.039 0.831 -14.028 1.00 0.00 C ATOM 926 NE ARG A 64 14.904 1.180 -15.170 1.00 0.00 N ATOM 927 CZ ARG A 64 15.129 0.436 -16.240 1.00 0.00 C ATOM 928 NH1 ARG A 64 14.646 -0.770 -16.365 1.00 0.00 N ATOM 929 NH2 ARG A 64 15.843 0.902 -17.223 1.00 0.00 N ATOM 0 H ARG A 64 10.068 1.806 -12.900 1.00 0.00 H new ATOM 0 HA ARG A 64 10.185 0.164 -15.211 1.00 0.00 H new ATOM 0 HB2 ARG A 64 11.686 0.346 -12.544 1.00 0.00 H new ATOM 0 HB3 ARG A 64 12.064 -0.938 -13.675 1.00 0.00 H new ATOM 0 HG2 ARG A 64 12.420 0.872 -15.458 1.00 0.00 H new ATOM 0 HG3 ARG A 64 12.270 2.063 -14.182 1.00 0.00 H new ATOM 0 HD2 ARG A 64 14.297 1.448 -13.167 1.00 0.00 H new ATOM 0 HD3 ARG A 64 14.209 -0.206 -13.739 1.00 0.00 H new ATOM 0 HE ARG A 64 15.375 2.084 -15.131 1.00 0.00 H new ATOM 0 HH11 ARG A 64 14.073 -1.169 -15.622 1.00 0.00 H new ATOM 0 HH12 ARG A 64 14.842 -1.313 -17.206 1.00 0.00 H new ATOM 0 HH21 ARG A 64 16.231 1.844 -17.170 1.00 0.00 H new ATOM 0 HH22 ARG A 64 16.015 0.325 -18.047 1.00 0.00 H new ATOM 940 N CYS A 65 8.801 -1.147 -12.594 1.00 0.00 N ATOM 941 CA CYS A 65 8.133 -2.298 -12.001 1.00 0.00 C ATOM 942 C CYS A 65 9.137 -3.310 -11.441 1.00 0.00 C ATOM 943 O CYS A 65 9.323 -4.413 -11.954 1.00 0.00 O ATOM 944 CB CYS A 65 7.072 -2.858 -12.952 1.00 0.00 C ATOM 945 SG CYS A 65 6.077 -1.526 -13.650 1.00 0.00 S ATOM 0 H CYS A 65 8.638 -0.284 -12.075 1.00 0.00 H new ATOM 0 HA CYS A 65 7.573 -1.984 -11.120 1.00 0.00 H new ATOM 0 HB2 CYS A 65 7.554 -3.418 -13.754 1.00 0.00 H new ATOM 0 HB3 CYS A 65 6.429 -3.557 -12.417 1.00 0.00 H new ATOM 949 N THR A 66 9.836 -2.875 -10.401 1.00 0.00 N ATOM 950 CA THR A 66 10.886 -3.626 -9.721 1.00 0.00 C ATOM 951 C THR A 66 10.784 -3.362 -8.216 1.00 0.00 C ATOM 952 O THR A 66 10.504 -2.243 -7.784 1.00 0.00 O ATOM 953 CB THR A 66 12.276 -3.239 -10.263 1.00 0.00 C ATOM 954 OG1 THR A 66 12.474 -1.837 -10.227 1.00 0.00 O ATOM 955 CG2 THR A 66 12.463 -3.669 -11.723 1.00 0.00 C ATOM 0 H THR A 66 9.682 -1.954 -9.991 1.00 0.00 H new ATOM 0 HA THR A 66 10.755 -4.692 -9.909 1.00 0.00 H new ATOM 0 HB THR A 66 12.992 -3.751 -9.620 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.365 -1.623 -10.575 1.00 0.00 H new ATOM 0 HG21 THR A 66 13.456 -3.376 -12.064 1.00 0.00 H new ATOM 0 HG22 THR A 66 12.357 -4.751 -11.800 1.00 0.00 H new ATOM 0 HG23 THR A 66 11.709 -3.185 -12.344 1.00 0.00 H new ATOM 963 N ILE A 67 10.963 -4.409 -7.411 1.00 0.00 N ATOM 964 CA ILE A 67 10.862 -4.384 -5.943 1.00 0.00 C ATOM 965 C ILE A 67 12.220 -4.864 -5.399 1.00 0.00 C ATOM 966 O ILE A 67 12.892 -5.695 -6.018 1.00 0.00 O ATOM 967 CB ILE A 67 9.713 -5.298 -5.438 1.00 0.00 C ATOM 968 CG1 ILE A 67 8.519 -5.539 -6.402 1.00 0.00 C ATOM 969 CG2 ILE A 67 9.168 -4.902 -4.067 1.00 0.00 C ATOM 970 CD1 ILE A 67 7.654 -4.313 -6.685 1.00 0.00 C ATOM 0 H ILE A 67 11.191 -5.335 -7.772 1.00 0.00 H new ATOM 0 HA ILE A 67 10.631 -3.378 -5.593 1.00 0.00 H new ATOM 0 HB ILE A 67 10.242 -6.249 -5.372 1.00 0.00 H new ATOM 0 HG12 ILE A 67 8.907 -5.916 -7.348 1.00 0.00 H new ATOM 0 HG13 ILE A 67 7.886 -6.321 -5.983 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.369 -5.586 -3.782 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.969 -4.951 -3.329 1.00 0.00 H new ATOM 0 HG23 ILE A 67 8.777 -3.885 -4.111 1.00 0.00 H new ATOM 0 HD11 ILE A 67 6.849 -4.585 -7.368 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.229 -3.944 -5.751 1.00 0.00 H new ATOM 0 HD13 ILE A 67 8.266 -3.533 -7.138 1.00 0.00 H new ATOM 981 N LYS A 68 12.655 -4.350 -4.249 1.00 0.00 N ATOM 982 CA LYS A 68 13.965 -4.695 -3.681 1.00 0.00 C ATOM 983 C LYS A 68 13.867 -5.905 -2.746 1.00 0.00 C ATOM 984 O LYS A 68 13.045 -5.907 -1.834 1.00 0.00 O ATOM 985 CB LYS A 68 14.522 -3.500 -2.905 1.00 0.00 C ATOM 986 CG LYS A 68 14.769 -2.221 -3.720 1.00 0.00 C ATOM 987 CD LYS A 68 15.992 -2.336 -4.645 1.00 0.00 C ATOM 988 CE LYS A 68 16.612 -0.949 -4.868 1.00 0.00 C ATOM 989 NZ LYS A 68 18.014 -1.052 -5.347 1.00 0.00 N ATOM 0 H LYS A 68 12.118 -3.689 -3.687 1.00 0.00 H new ATOM 0 HA LYS A 68 14.632 -4.950 -4.505 1.00 0.00 H new ATOM 0 HB2 LYS A 68 13.830 -3.263 -2.096 1.00 0.00 H new ATOM 0 HB3 LYS A 68 15.463 -3.799 -2.443 1.00 0.00 H new ATOM 0 HG2 LYS A 68 13.885 -2.000 -4.318 1.00 0.00 H new ATOM 0 HG3 LYS A 68 14.911 -1.382 -3.039 1.00 0.00 H new ATOM 0 HD2 LYS A 68 16.730 -3.007 -4.205 1.00 0.00 H new ATOM 0 HD3 LYS A 68 15.697 -2.770 -5.600 1.00 0.00 H new ATOM 0 HE2 LYS A 68 16.017 -0.396 -5.595 1.00 0.00 H new ATOM 0 HE3 LYS A 68 16.585 -0.383 -3.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.404 -0.098 -5.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 18.586 -1.559 -4.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 18.036 -1.571 -6.248 1.00 0.00 H new ATOM 999 N LYS A 69 14.736 -6.911 -2.907 1.00 0.00 N ATOM 1000 CA LYS A 69 14.791 -8.095 -2.018 1.00 0.00 C ATOM 1001 C LYS A 69 15.194 -7.788 -0.565 1.00 0.00 C ATOM 1002 O LYS A 69 14.957 -8.601 0.324 1.00 0.00 O ATOM 1003 CB LYS A 69 15.680 -9.174 -2.656 1.00 0.00 C ATOM 1004 CG LYS A 69 17.179 -8.821 -2.642 1.00 0.00 C ATOM 1005 CD LYS A 69 17.989 -9.839 -1.828 1.00 0.00 C ATOM 1006 CE LYS A 69 19.454 -9.394 -1.735 1.00 0.00 C ATOM 1007 NZ LYS A 69 20.387 -10.519 -2.006 1.00 0.00 N ATOM 0 H LYS A 69 15.426 -6.934 -3.658 1.00 0.00 H new ATOM 0 HA LYS A 69 13.772 -8.471 -1.928 1.00 0.00 H new ATOM 0 HB2 LYS A 69 15.531 -10.115 -2.127 1.00 0.00 H new ATOM 0 HB3 LYS A 69 15.362 -9.333 -3.686 1.00 0.00 H new ATOM 0 HG2 LYS A 69 17.556 -8.789 -3.664 1.00 0.00 H new ATOM 0 HG3 LYS A 69 17.315 -7.825 -2.220 1.00 0.00 H new ATOM 0 HD2 LYS A 69 17.566 -9.936 -0.828 1.00 0.00 H new ATOM 0 HD3 LYS A 69 17.928 -10.821 -2.296 1.00 0.00 H new ATOM 0 HE2 LYS A 69 19.636 -8.590 -2.448 1.00 0.00 H new ATOM 0 HE3 LYS A 69 19.650 -8.990 -0.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 21.368 -10.181 -1.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 20.230 -11.276 -1.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 20.217 -10.888 -2.963 1.00 0.00 H new ATOM 1017 N GLU A 70 15.772 -6.611 -0.314 1.00 0.00 N ATOM 1018 CA GLU A 70 16.004 -6.067 1.033 1.00 0.00 C ATOM 1019 C GLU A 70 14.719 -5.602 1.755 1.00 0.00 C ATOM 1020 O GLU A 70 14.778 -5.184 2.916 1.00 0.00 O ATOM 1021 CB GLU A 70 17.050 -4.943 0.951 1.00 0.00 C ATOM 1022 CG GLU A 70 16.555 -3.696 0.190 1.00 0.00 C ATOM 1023 CD GLU A 70 17.570 -3.202 -0.864 1.00 0.00 C ATOM 1024 OE1 GLU A 70 18.051 -4.020 -1.687 1.00 0.00 O ATOM 1025 OE2 GLU A 70 17.864 -1.984 -0.903 1.00 0.00 O ATOM 0 H GLU A 70 16.100 -5.993 -1.056 1.00 0.00 H new ATOM 0 HA GLU A 70 16.384 -6.881 1.650 1.00 0.00 H new ATOM 0 HB2 GLU A 70 17.339 -4.652 1.961 1.00 0.00 H new ATOM 0 HB3 GLU A 70 17.945 -5.326 0.462 1.00 0.00 H new ATOM 0 HG2 GLU A 70 15.610 -3.926 -0.301 1.00 0.00 H new ATOM 0 HG3 GLU A 70 16.357 -2.895 0.902 1.00 0.00 H new ATOM 1030 N ASN A 71 13.553 -5.681 1.095 1.00 0.00 N ATOM 1031 CA ASN A 71 12.238 -5.572 1.729 1.00 0.00 C ATOM 1032 C ASN A 71 12.006 -6.609 2.854 1.00 0.00 C ATOM 1033 O ASN A 71 12.746 -7.588 2.975 1.00 0.00 O ATOM 1034 CB ASN A 71 11.137 -5.625 0.648 1.00 0.00 C ATOM 1035 CG ASN A 71 10.900 -6.959 -0.052 1.00 0.00 C ATOM 1036 OD1 ASN A 71 11.438 -8.004 0.269 1.00 0.00 O ATOM 1037 ND2 ASN A 71 10.042 -6.961 -1.048 1.00 0.00 N ATOM 0 H ASN A 71 13.501 -5.825 0.087 1.00 0.00 H new ATOM 0 HA ASN A 71 12.194 -4.606 2.233 1.00 0.00 H new ATOM 0 HB2 ASN A 71 10.199 -5.316 1.108 1.00 0.00 H new ATOM 0 HB3 ASN A 71 11.378 -4.884 -0.114 1.00 0.00 H new ATOM 0 HD21 ASN A 71 9.835 -7.830 -1.541 1.00 0.00 H new ATOM 0 HD22 ASN A 71 9.584 -6.094 -1.328 1.00 0.00 H new ATOM 1043 N THR A 72 10.958 -6.366 3.657 1.00 0.00 N ATOM 1044 CA THR A 72 10.502 -7.127 4.847 1.00 0.00 C ATOM 1045 C THR A 72 9.540 -6.313 5.729 1.00 0.00 C ATOM 1046 O THR A 72 8.459 -6.827 6.028 1.00 0.00 O ATOM 1047 CB THR A 72 11.658 -7.739 5.674 1.00 0.00 C ATOM 1048 OG1 THR A 72 11.804 -9.085 5.260 1.00 0.00 O ATOM 1049 CG2 THR A 72 11.441 -7.825 7.188 1.00 0.00 C ATOM 0 H THR A 72 10.351 -5.565 3.481 1.00 0.00 H new ATOM 0 HA THR A 72 9.942 -7.972 4.447 1.00 0.00 H new ATOM 0 HB THR A 72 12.507 -7.078 5.499 1.00 0.00 H new ATOM 0 HG1 THR A 72 12.168 -9.110 4.350 1.00 0.00 H new ATOM 0 HG21 THR A 72 12.319 -8.270 7.657 1.00 0.00 H new ATOM 0 HG22 THR A 72 11.283 -6.824 7.590 1.00 0.00 H new ATOM 0 HG23 THR A 72 10.566 -8.442 7.396 1.00 0.00 H new ATOM 1057 N PRO A 73 9.850 -5.057 6.132 1.00 0.00 N ATOM 1058 CA PRO A 73 9.011 -4.269 7.051 1.00 0.00 C ATOM 1059 C PRO A 73 7.801 -3.599 6.364 1.00 0.00 C ATOM 1060 O PRO A 73 7.398 -2.482 6.699 1.00 0.00 O ATOM 1061 CB PRO A 73 9.980 -3.288 7.718 1.00 0.00 C ATOM 1062 CG PRO A 73 11.103 -3.079 6.702 1.00 0.00 C ATOM 1063 CD PRO A 73 11.098 -4.344 5.851 1.00 0.00 C ATOM 0 HA PRO A 73 8.521 -4.900 7.792 1.00 0.00 H new ATOM 0 HB2 PRO A 73 9.485 -2.347 7.957 1.00 0.00 H new ATOM 0 HB3 PRO A 73 10.366 -3.691 8.654 1.00 0.00 H new ATOM 0 HG2 PRO A 73 10.926 -2.192 6.094 1.00 0.00 H new ATOM 0 HG3 PRO A 73 12.064 -2.939 7.197 1.00 0.00 H new ATOM 0 HD2 PRO A 73 11.167 -4.094 4.792 1.00 0.00 H new ATOM 0 HD3 PRO A 73 11.959 -4.969 6.088 1.00 0.00 H new ATOM 1068 N LEU A 74 7.219 -4.289 5.384 1.00 0.00 N ATOM 1069 CA LEU A 74 6.148 -3.846 4.489 1.00 0.00 C ATOM 1070 C LEU A 74 4.963 -4.839 4.518 1.00 0.00 C ATOM 1071 O LEU A 74 4.993 -5.839 5.245 1.00 0.00 O ATOM 1072 CB LEU A 74 6.750 -3.711 3.071 1.00 0.00 C ATOM 1073 CG LEU A 74 7.349 -2.352 2.668 1.00 0.00 C ATOM 1074 CD1 LEU A 74 6.331 -1.210 2.745 1.00 0.00 C ATOM 1075 CD2 LEU A 74 8.598 -1.966 3.449 1.00 0.00 C ATOM 0 H LEU A 74 7.505 -5.246 5.178 1.00 0.00 H new ATOM 0 HA LEU A 74 5.750 -2.884 4.811 1.00 0.00 H new ATOM 0 HB2 LEU A 74 7.531 -4.464 2.966 1.00 0.00 H new ATOM 0 HB3 LEU A 74 5.969 -3.959 2.352 1.00 0.00 H new ATOM 0 HG LEU A 74 7.643 -2.498 1.629 1.00 0.00 H new ATOM 0 HD11 LEU A 74 6.809 -0.276 2.450 1.00 0.00 H new ATOM 0 HD12 LEU A 74 5.498 -1.419 2.074 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.960 -1.121 3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 74 8.957 -0.996 3.105 1.00 0.00 H new ATOM 0 HD22 LEU A 74 8.360 -1.909 4.511 1.00 0.00 H new ATOM 0 HD23 LEU A 74 9.372 -2.717 3.291 1.00 0.00 H new ATOM 1086 N LEU A 75 3.909 -4.570 3.741 1.00 0.00 N ATOM 1087 CA LEU A 75 2.653 -5.326 3.784 1.00 0.00 C ATOM 1088 C LEU A 75 2.538 -6.379 2.674 1.00 0.00 C ATOM 1089 O LEU A 75 2.957 -6.183 1.536 1.00 0.00 O ATOM 1090 CB LEU A 75 1.487 -4.322 3.774 1.00 0.00 C ATOM 1091 CG LEU A 75 0.078 -4.967 3.815 1.00 0.00 C ATOM 1092 CD1 LEU A 75 -0.806 -4.277 4.844 1.00 0.00 C ATOM 1093 CD2 LEU A 75 -0.579 -4.944 2.432 1.00 0.00 C ATOM 0 H LEU A 75 3.904 -3.813 3.057 1.00 0.00 H new ATOM 0 HA LEU A 75 2.624 -5.910 4.704 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.592 -3.655 4.630 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.564 -3.705 2.878 1.00 0.00 H new ATOM 0 HG LEU A 75 0.197 -6.009 4.114 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.789 -4.748 4.853 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -0.352 -4.365 5.831 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -0.911 -3.223 4.585 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.566 -5.403 2.490 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.678 -3.913 2.093 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.038 -5.500 1.727 1.00 0.00 H new ATOM 1104 N ASN A 76 1.879 -7.491 3.004 1.00 0.00 N ATOM 1105 CA ASN A 76 1.645 -8.634 2.126 1.00 0.00 C ATOM 1106 C ASN A 76 0.159 -9.025 2.177 1.00 0.00 C ATOM 1107 O ASN A 76 -0.242 -9.861 2.987 1.00 0.00 O ATOM 1108 CB ASN A 76 2.583 -9.774 2.555 1.00 0.00 C ATOM 1109 CG ASN A 76 4.022 -9.564 2.110 1.00 0.00 C ATOM 1110 OD1 ASN A 76 4.380 -9.780 0.961 1.00 0.00 O ATOM 1111 ND2 ASN A 76 4.898 -9.161 3.006 1.00 0.00 N ATOM 0 H ASN A 76 1.477 -7.623 3.932 1.00 0.00 H new ATOM 0 HA ASN A 76 1.868 -8.392 1.087 1.00 0.00 H new ATOM 0 HB2 ASN A 76 2.555 -9.870 3.640 1.00 0.00 H new ATOM 0 HB3 ASN A 76 2.215 -10.713 2.143 1.00 0.00 H new ATOM 0 HD21 ASN A 76 5.874 -9.029 2.741 1.00 0.00 H new ATOM 0 HD22 ASN A 76 4.601 -8.980 3.965 1.00 0.00 H new ATOM 1117 N CYS A 77 -0.651 -8.381 1.334 1.00 0.00 N ATOM 1118 CA CYS A 77 -2.068 -8.652 1.025 1.00 0.00 C ATOM 1119 C CYS A 77 -2.294 -10.068 0.417 1.00 0.00 C ATOM 1120 O CYS A 77 -2.780 -10.246 -0.704 1.00 0.00 O ATOM 1121 CB CYS A 77 -2.550 -7.487 0.140 1.00 0.00 C ATOM 1122 SG CYS A 77 -4.229 -7.533 -0.557 1.00 0.00 S ATOM 0 H CYS A 77 -0.307 -7.584 0.799 1.00 0.00 H new ATOM 0 HA CYS A 77 -2.671 -8.689 1.932 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -2.464 -6.573 0.727 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -1.852 -7.398 -0.693 1.00 0.00 H new ATOM 1126 N ALA A 78 -1.876 -11.089 1.169 1.00 0.00 N ATOM 1127 CA ALA A 78 -1.973 -12.509 0.850 1.00 0.00 C ATOM 1128 C ALA A 78 -1.726 -13.384 2.093 1.00 0.00 C ATOM 1129 O ALA A 78 -2.675 -13.960 2.633 1.00 0.00 O ATOM 1130 CB ALA A 78 -0.943 -12.829 -0.239 1.00 0.00 C ATOM 0 H ALA A 78 -1.433 -10.932 2.074 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.980 -12.729 0.497 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.999 -13.888 -0.493 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -1.154 -12.232 -1.126 1.00 0.00 H new ATOM 0 HB3 ALA A 78 0.057 -12.596 0.126 1.00 0.00 H new ATOM 1136 N LYS A 79 -0.462 -13.435 2.558 1.00 0.00 N ATOM 1137 CA LYS A 79 0.066 -14.317 3.628 1.00 0.00 C ATOM 1138 C LYS A 79 -0.208 -15.830 3.404 1.00 0.00 C ATOM 1139 O LYS A 79 -0.907 -16.196 2.456 1.00 0.00 O ATOM 1140 CB LYS A 79 -0.405 -13.754 4.995 1.00 0.00 C ATOM 1141 CG LYS A 79 0.722 -13.129 5.844 1.00 0.00 C ATOM 1142 CD LYS A 79 1.512 -11.992 5.169 1.00 0.00 C ATOM 1143 CE LYS A 79 2.738 -11.562 5.995 1.00 0.00 C ATOM 1144 NZ LYS A 79 2.379 -10.877 7.267 1.00 0.00 N ATOM 0 H LYS A 79 0.263 -12.828 2.177 1.00 0.00 H new ATOM 0 HA LYS A 79 1.156 -14.296 3.607 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -1.173 -13.001 4.820 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -0.871 -14.558 5.565 1.00 0.00 H new ATOM 0 HG2 LYS A 79 0.287 -12.747 6.767 1.00 0.00 H new ATOM 0 HG3 LYS A 79 1.421 -13.917 6.123 1.00 0.00 H new ATOM 0 HD2 LYS A 79 1.838 -12.316 4.181 1.00 0.00 H new ATOM 0 HD3 LYS A 79 0.856 -11.134 5.023 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.342 -12.441 6.221 1.00 0.00 H new ATOM 0 HE3 LYS A 79 3.357 -10.896 5.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 3.246 -10.643 7.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 1.856 -10.003 7.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 1.784 -11.505 7.844 1.00 0.00 H new ATOM 1154 N PRO A 80 0.381 -16.747 4.211 1.00 0.00 N ATOM 1155 CA PRO A 80 0.157 -18.182 4.026 1.00 0.00 C ATOM 1156 C PRO A 80 -1.256 -18.569 4.477 1.00 0.00 C ATOM 1157 O PRO A 80 -2.011 -19.180 3.720 1.00 0.00 O ATOM 1158 CB PRO A 80 1.240 -18.889 4.844 1.00 0.00 C ATOM 1159 CG PRO A 80 1.676 -17.868 5.897 1.00 0.00 C ATOM 1160 CD PRO A 80 1.306 -16.507 5.311 1.00 0.00 C ATOM 0 HA PRO A 80 0.224 -18.474 2.978 1.00 0.00 H new ATOM 0 HB2 PRO A 80 0.853 -19.795 5.310 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.078 -19.187 4.214 1.00 0.00 H new ATOM 0 HG2 PRO A 80 1.168 -18.040 6.846 1.00 0.00 H new ATOM 0 HG3 PRO A 80 2.746 -17.935 6.092 1.00 0.00 H new ATOM 0 HD2 PRO A 80 0.845 -15.874 6.070 1.00 0.00 H new ATOM 0 HD3 PRO A 80 2.196 -15.986 4.958 1.00 0.00 H new ATOM 1165 N ASP A 81 -1.641 -18.158 5.691 1.00 0.00 N ATOM 1166 CA ASP A 81 -2.976 -18.355 6.258 1.00 0.00 C ATOM 1167 C ASP A 81 -3.248 -17.355 7.398 1.00 0.00 C ATOM 1168 O ASP A 81 -3.332 -17.713 8.576 1.00 0.00 O ATOM 1169 CB ASP A 81 -3.172 -19.825 6.682 1.00 0.00 C ATOM 1170 CG ASP A 81 -4.649 -20.219 6.896 1.00 0.00 C ATOM 1171 OD1 ASP A 81 -5.511 -19.357 7.152 1.00 0.00 O ATOM 1172 OD2 ASP A 81 -4.955 -21.434 6.760 1.00 0.00 O ATOM 0 H ASP A 81 -1.011 -17.664 6.323 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.721 -18.148 5.490 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -2.739 -20.474 5.921 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -2.620 -20.004 7.605 1.00 0.00 H new ATOM 1176 N GLN A 82 -3.321 -16.068 7.044 1.00 0.00 N ATOM 1177 CA GLN A 82 -3.771 -15.007 7.947 1.00 0.00 C ATOM 1178 C GLN A 82 -4.396 -13.838 7.170 1.00 0.00 C ATOM 1179 O GLN A 82 -3.848 -13.379 6.167 1.00 0.00 O ATOM 1180 CB GLN A 82 -2.601 -14.499 8.822 1.00 0.00 C ATOM 1181 CG GLN A 82 -2.903 -14.685 10.321 1.00 0.00 C ATOM 1182 CD GLN A 82 -2.024 -13.845 11.252 1.00 0.00 C ATOM 1183 OE1 GLN A 82 -1.450 -12.823 10.901 1.00 0.00 O ATOM 1184 NE2 GLN A 82 -1.902 -14.240 12.505 1.00 0.00 N ATOM 0 H GLN A 82 -3.067 -15.732 6.115 1.00 0.00 H new ATOM 0 HA GLN A 82 -4.537 -15.432 8.596 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -1.689 -15.037 8.563 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -2.419 -13.445 8.613 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -3.948 -14.433 10.503 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -2.780 -15.737 10.576 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -2.372 -15.089 12.820 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -1.338 -13.696 13.158 1.00 0.00 H new ATOM 1191 N ASP A 83 -5.528 -13.335 7.667 1.00 0.00 N ATOM 1192 CA ASP A 83 -6.087 -12.028 7.292 1.00 0.00 C ATOM 1193 C ASP A 83 -5.065 -10.906 7.549 1.00 0.00 C ATOM 1194 O ASP A 83 -4.468 -10.841 8.630 1.00 0.00 O ATOM 1195 CB ASP A 83 -7.373 -11.801 8.109 1.00 0.00 C ATOM 1196 CG ASP A 83 -7.943 -10.374 8.009 1.00 0.00 C ATOM 1197 OD1 ASP A 83 -8.793 -10.127 7.121 1.00 0.00 O ATOM 1198 OD2 ASP A 83 -7.593 -9.523 8.860 1.00 0.00 O ATOM 0 H ASP A 83 -6.095 -13.832 8.354 1.00 0.00 H new ATOM 0 HA ASP A 83 -6.321 -12.014 6.227 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.132 -12.507 7.773 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -7.169 -12.026 9.156 1.00 0.00 H new ATOM 1202 N ILE A 84 -4.880 -10.013 6.571 1.00 0.00 N ATOM 1203 CA ILE A 84 -4.088 -8.792 6.755 1.00 0.00 C ATOM 1204 C ILE A 84 -5.026 -7.637 7.111 1.00 0.00 C ATOM 1205 O ILE A 84 -6.026 -7.408 6.433 1.00 0.00 O ATOM 1206 CB ILE A 84 -3.151 -8.539 5.541 1.00 0.00 C ATOM 1207 CG1 ILE A 84 -1.670 -8.692 5.950 1.00 0.00 C ATOM 1208 CG2 ILE A 84 -3.280 -7.144 4.904 1.00 0.00 C ATOM 1209 CD1 ILE A 84 -1.328 -10.085 6.490 1.00 0.00 C ATOM 0 H ILE A 84 -5.272 -10.115 5.635 1.00 0.00 H new ATOM 0 HA ILE A 84 -3.402 -8.898 7.595 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.466 -9.284 4.810 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -1.039 -8.480 5.087 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.432 -7.947 6.710 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.588 -7.061 4.066 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -4.300 -7.000 4.548 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.044 -6.382 5.646 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -0.272 -10.122 6.758 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -1.934 -10.292 7.372 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.535 -10.833 5.724 1.00 0.00 H new ATOM 1220 N LYS A 85 -4.670 -6.916 8.177 1.00 0.00 N ATOM 1221 CA LYS A 85 -5.322 -5.702 8.664 1.00 0.00 C ATOM 1222 C LYS A 85 -4.244 -4.826 9.298 1.00 0.00 C ATOM 1223 O LYS A 85 -3.555 -5.255 10.225 1.00 0.00 O ATOM 1224 CB LYS A 85 -6.421 -6.044 9.688 1.00 0.00 C ATOM 1225 CG LYS A 85 -7.073 -4.780 10.302 1.00 0.00 C ATOM 1226 CD LYS A 85 -7.611 -4.999 11.723 1.00 0.00 C ATOM 1227 CE LYS A 85 -9.133 -5.176 11.756 1.00 0.00 C ATOM 1228 NZ LYS A 85 -9.606 -5.450 13.137 1.00 0.00 N ATOM 0 H LYS A 85 -3.873 -7.181 8.755 1.00 0.00 H new ATOM 0 HA LYS A 85 -5.805 -5.175 7.842 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.189 -6.647 9.204 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -5.994 -6.652 10.485 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -6.339 -3.974 10.320 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.890 -4.453 9.659 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -7.137 -5.880 12.155 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -7.334 -4.150 12.347 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.616 -4.277 11.374 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -9.422 -5.996 11.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -10.640 -5.566 13.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -9.161 -6.321 13.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -9.349 -4.655 13.756 1.00 0.00 H new ATOM 1238 N PHE A 86 -4.147 -3.595 8.823 1.00 0.00 N ATOM 1239 CA PHE A 86 -3.301 -2.543 9.369 1.00 0.00 C ATOM 1240 C PHE A 86 -4.077 -1.218 9.285 1.00 0.00 C ATOM 1241 O PHE A 86 -4.753 -0.969 8.291 1.00 0.00 O ATOM 1242 CB PHE A 86 -1.976 -2.510 8.577 1.00 0.00 C ATOM 1243 CG PHE A 86 -0.753 -2.921 9.370 1.00 0.00 C ATOM 1244 CD1 PHE A 86 -0.493 -4.280 9.646 1.00 0.00 C ATOM 1245 CD2 PHE A 86 0.150 -1.946 9.829 1.00 0.00 C ATOM 1246 CE1 PHE A 86 0.633 -4.649 10.409 1.00 0.00 C ATOM 1247 CE2 PHE A 86 1.280 -2.308 10.585 1.00 0.00 C ATOM 1248 CZ PHE A 86 1.515 -3.662 10.883 1.00 0.00 C ATOM 0 H PHE A 86 -4.679 -3.287 8.009 1.00 0.00 H new ATOM 0 HA PHE A 86 -3.049 -2.721 10.414 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -2.069 -3.167 7.712 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -1.822 -1.501 8.195 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -1.160 -5.042 9.271 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -0.026 -0.906 9.598 1.00 0.00 H new ATOM 0 HE1 PHE A 86 0.818 -5.690 10.630 1.00 0.00 H new ATOM 0 HE2 PHE A 86 1.964 -1.549 10.935 1.00 0.00 H new ATOM 0 HZ PHE A 86 2.373 -3.944 11.476 1.00 0.00 H new ATOM 1257 N THR A 87 -4.008 -0.363 10.303 1.00 0.00 N ATOM 1258 CA THR A 87 -4.669 0.952 10.297 1.00 0.00 C ATOM 1259 C THR A 87 -3.704 2.025 10.782 1.00 0.00 C ATOM 1260 O THR A 87 -3.192 1.961 11.902 1.00 0.00 O ATOM 1261 CB THR A 87 -6.009 0.948 11.057 1.00 0.00 C ATOM 1262 OG1 THR A 87 -6.620 2.219 10.956 1.00 0.00 O ATOM 1263 CG2 THR A 87 -5.942 0.619 12.552 1.00 0.00 C ATOM 0 H THR A 87 -3.492 -0.558 11.161 1.00 0.00 H new ATOM 0 HA THR A 87 -4.938 1.193 9.269 1.00 0.00 H new ATOM 0 HB THR A 87 -6.571 0.146 10.577 1.00 0.00 H new ATOM 0 HG1 THR A 87 -7.473 2.211 11.439 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.946 0.647 12.976 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.519 -0.376 12.687 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.314 1.352 13.058 1.00 0.00 H new ATOM 1271 N ILE A 88 -3.395 2.980 9.900 1.00 0.00 N ATOM 1272 CA ILE A 88 -2.456 4.073 10.160 1.00 0.00 C ATOM 1273 C ILE A 88 -3.236 5.388 10.135 1.00 0.00 C ATOM 1274 O ILE A 88 -4.043 5.637 9.236 1.00 0.00 O ATOM 1275 CB ILE A 88 -1.267 4.045 9.155 1.00 0.00 C ATOM 1276 CG1 ILE A 88 -0.089 3.194 9.683 1.00 0.00 C ATOM 1277 CG2 ILE A 88 -0.687 5.441 8.856 1.00 0.00 C ATOM 1278 CD1 ILE A 88 -0.313 1.686 9.623 1.00 0.00 C ATOM 0 H ILE A 88 -3.800 3.015 8.965 1.00 0.00 H new ATOM 0 HA ILE A 88 -2.001 3.961 11.144 1.00 0.00 H new ATOM 0 HB ILE A 88 -1.695 3.618 8.248 1.00 0.00 H new ATOM 0 HG12 ILE A 88 0.804 3.438 9.107 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.111 3.477 10.717 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.138 5.349 8.149 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -1.464 6.073 8.427 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.324 5.890 9.781 1.00 0.00 H new ATOM 0 HD11 ILE A 88 0.565 1.172 10.014 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.184 1.423 10.223 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.480 1.384 8.589 1.00 0.00 H new ATOM 1289 N LYS A 89 -2.956 6.240 11.120 1.00 0.00 N ATOM 1290 CA LYS A 89 -3.529 7.581 11.255 1.00 0.00 C ATOM 1291 C LYS A 89 -2.447 8.636 11.057 1.00 0.00 C ATOM 1292 O LYS A 89 -1.296 8.452 11.456 1.00 0.00 O ATOM 1293 CB LYS A 89 -4.254 7.704 12.609 1.00 0.00 C ATOM 1294 CG LYS A 89 -3.292 7.668 13.807 1.00 0.00 C ATOM 1295 CD LYS A 89 -3.999 7.503 15.158 1.00 0.00 C ATOM 1296 CE LYS A 89 -4.317 8.851 15.815 1.00 0.00 C ATOM 1297 NZ LYS A 89 -5.338 8.693 16.886 1.00 0.00 N ATOM 0 H LYS A 89 -2.304 6.010 11.870 1.00 0.00 H new ATOM 0 HA LYS A 89 -4.275 7.751 10.478 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.818 8.636 12.630 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -4.976 6.893 12.704 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.588 6.847 13.672 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -2.709 8.589 13.822 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.923 6.943 15.016 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -3.370 6.915 15.826 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.407 9.279 16.235 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -4.680 9.550 15.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -5.537 9.619 17.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -6.213 8.306 16.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -4.979 8.043 17.614 1.00 0.00 H new ATOM 1307 N PHE A 90 -2.820 9.745 10.438 1.00 0.00 N ATOM 1308 CA PHE A 90 -1.929 10.861 10.142 1.00 0.00 C ATOM 1309 C PHE A 90 -2.000 11.875 11.291 1.00 0.00 C ATOM 1310 O PHE A 90 -2.654 12.908 11.180 1.00 0.00 O ATOM 1311 CB PHE A 90 -2.304 11.461 8.774 1.00 0.00 C ATOM 1312 CG PHE A 90 -1.726 10.809 7.528 1.00 0.00 C ATOM 1313 CD1 PHE A 90 -1.546 9.413 7.422 1.00 0.00 C ATOM 1314 CD2 PHE A 90 -1.390 11.636 6.436 1.00 0.00 C ATOM 1315 CE1 PHE A 90 -1.015 8.857 6.243 1.00 0.00 C ATOM 1316 CE2 PHE A 90 -0.856 11.081 5.260 1.00 0.00 C ATOM 1317 CZ PHE A 90 -0.666 9.694 5.167 1.00 0.00 C ATOM 0 H PHE A 90 -3.776 9.900 10.118 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.892 10.533 10.069 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -3.390 11.443 8.687 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -2.002 12.508 8.774 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.816 8.770 8.247 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.544 12.703 6.504 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.876 7.789 6.164 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.593 11.720 4.430 1.00 0.00 H new ATOM 0 HZ PHE A 90 -0.250 9.267 4.266 1.00 0.00 H new ATOM 1326 N GLN A 91 -1.383 11.553 12.430 1.00 0.00 N ATOM 1327 CA GLN A 91 -1.256 12.451 13.591 1.00 0.00 C ATOM 1328 C GLN A 91 0.010 13.331 13.512 1.00 0.00 C ATOM 1329 O GLN A 91 0.892 13.103 12.682 1.00 0.00 O ATOM 1330 CB GLN A 91 -1.303 11.605 14.878 1.00 0.00 C ATOM 1331 CG GLN A 91 -0.061 10.722 15.100 1.00 0.00 C ATOM 1332 CD GLN A 91 -0.365 9.560 16.044 1.00 0.00 C ATOM 1333 OE1 GLN A 91 -0.964 8.568 15.673 1.00 0.00 O ATOM 1334 NE2 GLN A 91 -0.004 9.632 17.302 1.00 0.00 N ATOM 0 H GLN A 91 -0.947 10.643 12.579 1.00 0.00 H new ATOM 0 HA GLN A 91 -2.092 13.151 13.596 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -1.419 12.271 15.733 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -2.187 10.968 14.848 1.00 0.00 H new ATOM 0 HG2 GLN A 91 0.287 10.334 14.143 1.00 0.00 H new ATOM 0 HG3 GLN A 91 0.748 11.326 15.512 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.499 10.451 17.642 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -0.226 8.869 17.941 1.00 0.00 H new ATOM 1341 N GLU A 92 0.124 14.338 14.387 1.00 0.00 N ATOM 1342 CA GLU A 92 1.314 15.208 14.460 1.00 0.00 C ATOM 1343 C GLU A 92 2.499 14.557 15.193 1.00 0.00 C ATOM 1344 O GLU A 92 3.633 14.614 14.714 1.00 0.00 O ATOM 1345 CB GLU A 92 0.970 16.525 15.178 1.00 0.00 C ATOM 1346 CG GLU A 92 0.630 17.646 14.190 1.00 0.00 C ATOM 1347 CD GLU A 92 0.548 19.008 14.907 1.00 0.00 C ATOM 1348 OE1 GLU A 92 1.609 19.570 15.277 1.00 0.00 O ATOM 1349 OE2 GLU A 92 -0.575 19.535 15.098 1.00 0.00 O ATOM 0 H GLU A 92 -0.601 14.576 15.064 1.00 0.00 H new ATOM 0 HA GLU A 92 1.614 15.389 13.428 1.00 0.00 H new ATOM 0 HB2 GLU A 92 0.125 16.363 15.847 1.00 0.00 H new ATOM 0 HB3 GLU A 92 1.813 16.831 15.797 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.388 17.688 13.407 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.321 17.430 13.702 1.00 0.00 H new ATOM 1354 N PHE A 93 2.240 13.941 16.350 1.00 0.00 N ATOM 1355 CA PHE A 93 3.250 13.364 17.247 1.00 0.00 C ATOM 1356 C PHE A 93 2.763 12.026 17.793 1.00 0.00 C ATOM 1357 O PHE A 93 1.562 11.834 17.991 1.00 0.00 O ATOM 1358 CB PHE A 93 3.550 14.331 18.409 1.00 0.00 C ATOM 1359 CG PHE A 93 4.889 15.034 18.299 1.00 0.00 C ATOM 1360 CD1 PHE A 93 5.049 16.112 17.405 1.00 0.00 C ATOM 1361 CD2 PHE A 93 5.983 14.613 19.082 1.00 0.00 C ATOM 1362 CE1 PHE A 93 6.293 16.759 17.291 1.00 0.00 C ATOM 1363 CE2 PHE A 93 7.226 15.265 18.972 1.00 0.00 C ATOM 1364 CZ PHE A 93 7.381 16.337 18.075 1.00 0.00 C ATOM 0 H PHE A 93 1.289 13.825 16.701 1.00 0.00 H new ATOM 0 HA PHE A 93 4.167 13.203 16.681 1.00 0.00 H new ATOM 0 HB2 PHE A 93 2.761 15.081 18.456 1.00 0.00 H new ATOM 0 HB3 PHE A 93 3.519 13.776 19.347 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.214 16.442 16.805 1.00 0.00 H new ATOM 0 HD2 PHE A 93 5.867 13.787 19.769 1.00 0.00 H new ATOM 0 HE1 PHE A 93 6.412 17.581 16.600 1.00 0.00 H new ATOM 0 HE2 PHE A 93 8.061 14.942 19.577 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.335 16.836 17.988 1.00 0.00 H new ATOM 1373 N SER A 94 3.692 11.111 18.067 1.00 0.00 N ATOM 1374 CA SER A 94 3.390 9.738 18.470 1.00 0.00 C ATOM 1375 C SER A 94 3.808 9.469 19.917 1.00 0.00 C ATOM 1376 O SER A 94 4.872 9.938 20.335 1.00 0.00 O ATOM 1377 CB SER A 94 4.103 8.784 17.523 1.00 0.00 C ATOM 1378 OG SER A 94 3.531 7.510 17.653 1.00 0.00 O ATOM 0 H SER A 94 4.692 11.306 18.014 1.00 0.00 H new ATOM 0 HA SER A 94 2.312 9.583 18.416 1.00 0.00 H new ATOM 0 HB2 SER A 94 4.014 9.135 16.495 1.00 0.00 H new ATOM 0 HB3 SER A 94 5.167 8.746 17.756 1.00 0.00 H new ATOM 0 HG SER A 94 2.626 7.518 17.278 1.00 0.00 H new ATOM 1383 N PRO A 95 3.008 8.723 20.708 1.00 0.00 N ATOM 1384 CA PRO A 95 3.359 8.439 22.094 1.00 0.00 C ATOM 1385 C PRO A 95 4.524 7.442 22.190 1.00 0.00 C ATOM 1386 O PRO A 95 5.365 7.580 23.082 1.00 0.00 O ATOM 1387 CB PRO A 95 2.073 7.918 22.746 1.00 0.00 C ATOM 1388 CG PRO A 95 1.252 7.348 21.588 1.00 0.00 C ATOM 1389 CD PRO A 95 1.729 8.115 20.355 1.00 0.00 C ATOM 0 HA PRO A 95 3.719 9.328 22.612 1.00 0.00 H new ATOM 0 HB2 PRO A 95 2.289 7.153 23.492 1.00 0.00 H new ATOM 0 HB3 PRO A 95 1.536 8.718 23.256 1.00 0.00 H new ATOM 0 HG2 PRO A 95 1.418 6.277 21.476 1.00 0.00 H new ATOM 0 HG3 PRO A 95 0.184 7.490 21.753 1.00 0.00 H new ATOM 0 HD2 PRO A 95 1.841 7.445 19.502 1.00 0.00 H new ATOM 0 HD3 PRO A 95 1.004 8.877 20.069 1.00 0.00 H new ATOM 1394 N ASN A 96 4.609 6.471 21.267 1.00 0.00 N ATOM 1395 CA ASN A 96 5.707 5.496 21.215 1.00 0.00 C ATOM 1396 C ASN A 96 5.885 4.808 19.834 1.00 0.00 C ATOM 1397 O ASN A 96 6.411 3.693 19.773 1.00 0.00 O ATOM 1398 CB ASN A 96 5.505 4.470 22.364 1.00 0.00 C ATOM 1399 CG ASN A 96 6.814 3.922 22.927 1.00 0.00 C ATOM 1400 OD1 ASN A 96 7.877 4.521 22.847 1.00 0.00 O ATOM 1401 ND2 ASN A 96 6.773 2.770 23.562 1.00 0.00 N ATOM 0 H ASN A 96 3.914 6.341 20.532 1.00 0.00 H new ATOM 0 HA ASN A 96 6.643 6.036 21.355 1.00 0.00 H new ATOM 0 HB2 ASN A 96 4.942 4.943 23.169 1.00 0.00 H new ATOM 0 HB3 ASN A 96 4.900 3.640 21.998 1.00 0.00 H new ATOM 0 HD21 ASN A 96 7.621 2.388 23.980 1.00 0.00 H new ATOM 0 HD22 ASN A 96 5.893 2.260 23.636 1.00 0.00 H new ATOM 1407 N LEU A 97 5.439 5.430 18.727 1.00 0.00 N ATOM 1408 CA LEU A 97 5.397 4.817 17.384 1.00 0.00 C ATOM 1409 C LEU A 97 6.162 5.655 16.339 1.00 0.00 C ATOM 1410 O LEU A 97 5.648 6.648 15.816 1.00 0.00 O ATOM 1411 CB LEU A 97 3.918 4.580 16.960 1.00 0.00 C ATOM 1412 CG LEU A 97 3.523 3.185 16.460 1.00 0.00 C ATOM 1413 CD1 LEU A 97 4.396 2.704 15.300 1.00 0.00 C ATOM 1414 CD2 LEU A 97 3.548 2.174 17.600 1.00 0.00 C ATOM 0 H LEU A 97 5.092 6.389 18.740 1.00 0.00 H new ATOM 0 HA LEU A 97 5.906 3.854 17.432 1.00 0.00 H new ATOM 0 HB2 LEU A 97 3.284 4.820 17.814 1.00 0.00 H new ATOM 0 HB3 LEU A 97 3.678 5.296 16.174 1.00 0.00 H new ATOM 0 HG LEU A 97 2.505 3.267 16.080 1.00 0.00 H new ATOM 0 HD11 LEU A 97 4.071 1.712 14.987 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.303 3.397 14.463 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.437 2.661 15.621 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.264 1.192 17.222 1.00 0.00 H new ATOM 0 HD22 LEU A 97 4.552 2.125 18.021 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.845 2.481 18.374 1.00 0.00 H new ATOM 1425 N TRP A 98 7.370 5.216 15.981 1.00 0.00 N ATOM 1426 CA TRP A 98 8.214 5.829 14.939 1.00 0.00 C ATOM 1427 C TRP A 98 7.651 5.738 13.500 1.00 0.00 C ATOM 1428 O TRP A 98 8.264 6.260 12.566 1.00 0.00 O ATOM 1429 CB TRP A 98 9.638 5.245 15.046 1.00 0.00 C ATOM 1430 CG TRP A 98 10.606 6.082 15.839 1.00 0.00 C ATOM 1431 CD1 TRP A 98 10.416 6.540 17.093 1.00 0.00 C ATOM 1432 CD2 TRP A 98 11.920 6.590 15.420 1.00 0.00 C ATOM 1433 NE1 TRP A 98 11.506 7.307 17.481 1.00 0.00 N ATOM 1434 CE2 TRP A 98 12.450 7.368 16.488 1.00 0.00 C ATOM 1435 CE3 TRP A 98 12.697 6.475 14.254 1.00 0.00 C ATOM 1436 CZ2 TRP A 98 13.704 8.015 16.396 1.00 0.00 C ATOM 1437 CZ3 TRP A 98 13.956 7.114 14.149 1.00 0.00 C ATOM 1438 CH2 TRP A 98 14.450 7.882 15.220 1.00 0.00 C ATOM 0 H TRP A 98 7.805 4.403 16.416 1.00 0.00 H new ATOM 0 HA TRP A 98 8.231 6.902 15.132 1.00 0.00 H new ATOM 0 HB2 TRP A 98 9.577 4.256 15.501 1.00 0.00 H new ATOM 0 HB3 TRP A 98 10.036 5.109 14.040 1.00 0.00 H new ATOM 0 HD1 TRP A 98 9.547 6.340 17.703 1.00 0.00 H new ATOM 0 HE1 TRP A 98 11.594 7.766 18.388 1.00 0.00 H new ATOM 0 HE3 TRP A 98 12.328 5.890 13.425 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 14.080 8.603 17.221 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 14.538 7.012 13.245 1.00 0.00 H new ATOM 0 HH2 TRP A 98 15.409 8.371 15.134 1.00 0.00 H new ATOM 1448 N GLY A 99 6.482 5.109 13.306 1.00 0.00 N ATOM 1449 CA GLY A 99 5.797 4.972 12.010 1.00 0.00 C ATOM 1450 C GLY A 99 4.510 5.800 11.861 1.00 0.00 C ATOM 1451 O GLY A 99 4.172 6.198 10.744 1.00 0.00 O ATOM 0 H GLY A 99 5.971 4.668 14.070 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.489 5.260 11.219 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.554 3.921 11.854 1.00 0.00 H new ATOM 1454 N LEU A 100 3.801 6.087 12.964 1.00 0.00 N ATOM 1455 CA LEU A 100 2.666 7.022 12.967 1.00 0.00 C ATOM 1456 C LEU A 100 3.127 8.483 12.863 1.00 0.00 C ATOM 1457 O LEU A 100 2.425 9.314 12.284 1.00 0.00 O ATOM 1458 CB LEU A 100 1.829 6.849 14.246 1.00 0.00 C ATOM 1459 CG LEU A 100 1.082 5.507 14.362 1.00 0.00 C ATOM 1460 CD1 LEU A 100 0.386 5.410 15.721 1.00 0.00 C ATOM 1461 CD2 LEU A 100 0.036 5.346 13.258 1.00 0.00 C ATOM 0 H LEU A 100 3.998 5.678 13.877 1.00 0.00 H new ATOM 0 HA LEU A 100 2.059 6.789 12.092 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.486 6.957 15.109 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.100 7.658 14.297 1.00 0.00 H new ATOM 0 HG LEU A 100 1.821 4.713 14.259 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.139 4.458 15.794 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.129 5.476 16.516 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.328 6.227 15.823 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.470 4.387 13.373 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.694 6.152 13.328 1.00 0.00 H new ATOM 0 HD23 LEU A 100 0.525 5.383 12.285 1.00 0.00 H new ATOM 1472 N GLU A 101 4.307 8.807 13.404 1.00 0.00 N ATOM 1473 CA GLU A 101 4.968 10.079 13.105 1.00 0.00 C ATOM 1474 C GLU A 101 5.414 10.154 11.636 1.00 0.00 C ATOM 1475 O GLU A 101 5.846 9.167 11.032 1.00 0.00 O ATOM 1476 CB GLU A 101 6.164 10.321 14.044 1.00 0.00 C ATOM 1477 CG GLU A 101 5.798 11.365 15.101 1.00 0.00 C ATOM 1478 CD GLU A 101 6.983 11.666 16.034 1.00 0.00 C ATOM 1479 OE1 GLU A 101 7.924 12.381 15.614 1.00 0.00 O ATOM 1480 OE2 GLU A 101 6.963 11.196 17.196 1.00 0.00 O ATOM 0 H GLU A 101 4.821 8.207 14.049 1.00 0.00 H new ATOM 0 HA GLU A 101 4.235 10.868 13.274 1.00 0.00 H new ATOM 0 HB2 GLU A 101 6.452 9.387 14.528 1.00 0.00 H new ATOM 0 HB3 GLU A 101 7.025 10.661 13.469 1.00 0.00 H new ATOM 0 HG2 GLU A 101 5.478 12.284 14.610 1.00 0.00 H new ATOM 0 HG3 GLU A 101 4.953 11.007 15.689 1.00 0.00 H new ATOM 1485 N PHE A 102 5.345 11.363 11.085 1.00 0.00 N ATOM 1486 CA PHE A 102 5.657 11.673 9.694 1.00 0.00 C ATOM 1487 C PHE A 102 6.424 13.000 9.605 1.00 0.00 C ATOM 1488 O PHE A 102 6.271 13.877 10.459 1.00 0.00 O ATOM 1489 CB PHE A 102 4.334 11.711 8.898 1.00 0.00 C ATOM 1490 CG PHE A 102 4.011 10.468 8.079 1.00 0.00 C ATOM 1491 CD1 PHE A 102 4.960 9.925 7.188 1.00 0.00 C ATOM 1492 CD2 PHE A 102 2.734 9.876 8.165 1.00 0.00 C ATOM 1493 CE1 PHE A 102 4.643 8.801 6.401 1.00 0.00 C ATOM 1494 CE2 PHE A 102 2.416 8.752 7.378 1.00 0.00 C ATOM 1495 CZ PHE A 102 3.370 8.214 6.496 1.00 0.00 C ATOM 0 H PHE A 102 5.059 12.185 11.617 1.00 0.00 H new ATOM 0 HA PHE A 102 6.303 10.908 9.264 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.517 11.883 9.598 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.363 12.568 8.225 1.00 0.00 H new ATOM 0 HD1 PHE A 102 5.938 10.375 7.109 1.00 0.00 H new ATOM 0 HD2 PHE A 102 1.996 10.287 8.838 1.00 0.00 H new ATOM 0 HE1 PHE A 102 5.378 8.390 5.725 1.00 0.00 H new ATOM 0 HE2 PHE A 102 1.437 8.302 7.452 1.00 0.00 H new ATOM 0 HZ PHE A 102 3.125 7.352 5.893 1.00 0.00 H new ATOM 1504 N GLN A 103 7.249 13.150 8.568 1.00 0.00 N ATOM 1505 CA GLN A 103 8.142 14.299 8.379 1.00 0.00 C ATOM 1506 C GLN A 103 7.764 15.065 7.105 1.00 0.00 C ATOM 1507 O GLN A 103 7.363 14.458 6.114 1.00 0.00 O ATOM 1508 CB GLN A 103 9.603 13.821 8.298 1.00 0.00 C ATOM 1509 CG GLN A 103 10.105 13.119 9.572 1.00 0.00 C ATOM 1510 CD GLN A 103 9.996 13.997 10.822 1.00 0.00 C ATOM 1511 OE1 GLN A 103 10.371 15.162 10.841 1.00 0.00 O ATOM 1512 NE2 GLN A 103 9.463 13.472 11.906 1.00 0.00 N ATOM 0 H GLN A 103 7.318 12.462 7.818 1.00 0.00 H new ATOM 0 HA GLN A 103 8.036 14.970 9.231 1.00 0.00 H new ATOM 0 HB2 GLN A 103 9.704 13.137 7.455 1.00 0.00 H new ATOM 0 HB3 GLN A 103 10.244 14.678 8.092 1.00 0.00 H new ATOM 0 HG2 GLN A 103 9.532 12.205 9.726 1.00 0.00 H new ATOM 0 HG3 GLN A 103 11.145 12.824 9.432 1.00 0.00 H new ATOM 0 HE21 GLN A 103 9.147 12.502 11.901 1.00 0.00 H new ATOM 0 HE22 GLN A 103 9.366 14.035 12.751 1.00 0.00 H new ATOM 1519 N LYS A 104 7.894 16.395 7.124 1.00 0.00 N ATOM 1520 CA LYS A 104 7.598 17.251 5.965 1.00 0.00 C ATOM 1521 C LYS A 104 8.662 17.140 4.860 1.00 0.00 C ATOM 1522 O LYS A 104 9.746 16.593 5.078 1.00 0.00 O ATOM 1523 CB LYS A 104 7.369 18.709 6.409 1.00 0.00 C ATOM 1524 CG LYS A 104 6.234 18.853 7.447 1.00 0.00 C ATOM 1525 CD LYS A 104 6.695 18.884 8.920 1.00 0.00 C ATOM 1526 CE LYS A 104 6.525 20.272 9.559 1.00 0.00 C ATOM 1527 NZ LYS A 104 7.637 21.199 9.215 1.00 0.00 N ATOM 0 H LYS A 104 8.208 16.912 7.945 1.00 0.00 H new ATOM 0 HA LYS A 104 6.672 16.888 5.520 1.00 0.00 H new ATOM 0 HB2 LYS A 104 8.293 19.103 6.832 1.00 0.00 H new ATOM 0 HB3 LYS A 104 7.134 19.316 5.535 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.683 19.769 7.235 1.00 0.00 H new ATOM 0 HG3 LYS A 104 5.537 18.025 7.318 1.00 0.00 H new ATOM 0 HD2 LYS A 104 6.125 18.152 9.492 1.00 0.00 H new ATOM 0 HD3 LYS A 104 7.742 18.587 8.976 1.00 0.00 H new ATOM 0 HE2 LYS A 104 5.580 20.706 9.231 1.00 0.00 H new ATOM 0 HE3 LYS A 104 6.468 20.165 10.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 7.475 22.120 9.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 8.537 20.801 9.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.677 21.325 8.183 1.00 0.00 H new ATOM 1537 N ASN A 105 8.361 17.698 3.681 1.00 0.00 N ATOM 1538 CA ASN A 105 9.197 17.644 2.471 1.00 0.00 C ATOM 1539 C ASN A 105 9.599 16.203 2.071 1.00 0.00 C ATOM 1540 O ASN A 105 10.729 15.955 1.631 1.00 0.00 O ATOM 1541 CB ASN A 105 10.372 18.628 2.631 1.00 0.00 C ATOM 1542 CG ASN A 105 11.087 18.922 1.319 1.00 0.00 C ATOM 1543 OD1 ASN A 105 10.486 19.063 0.263 1.00 0.00 O ATOM 1544 ND2 ASN A 105 12.397 19.043 1.346 1.00 0.00 N ATOM 0 H ASN A 105 7.496 18.220 3.536 1.00 0.00 H new ATOM 0 HA ASN A 105 8.613 17.973 1.612 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.001 19.562 3.053 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.087 18.218 3.344 1.00 0.00 H new ATOM 0 HD21 ASN A 105 12.907 19.254 0.488 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.902 18.926 2.225 1.00 0.00 H new ATOM 1550 N LYS A 106 8.679 15.246 2.247 1.00 0.00 N ATOM 1551 CA LYS A 106 8.892 13.815 1.982 1.00 0.00 C ATOM 1552 C LYS A 106 7.768 13.246 1.115 1.00 0.00 C ATOM 1553 O LYS A 106 6.609 13.649 1.211 1.00 0.00 O ATOM 1554 CB LYS A 106 9.024 13.065 3.329 1.00 0.00 C ATOM 1555 CG LYS A 106 10.432 12.517 3.619 1.00 0.00 C ATOM 1556 CD LYS A 106 10.783 11.270 2.789 1.00 0.00 C ATOM 1557 CE LYS A 106 12.135 10.683 3.233 1.00 0.00 C ATOM 1558 NZ LYS A 106 13.107 10.601 2.110 1.00 0.00 N ATOM 0 H LYS A 106 7.739 15.450 2.587 1.00 0.00 H new ATOM 0 HA LYS A 106 9.816 13.680 1.419 1.00 0.00 H new ATOM 0 HB2 LYS A 106 8.737 13.740 4.136 1.00 0.00 H new ATOM 0 HB3 LYS A 106 8.316 12.236 3.340 1.00 0.00 H new ATOM 0 HG2 LYS A 106 11.166 13.297 3.418 1.00 0.00 H new ATOM 0 HG3 LYS A 106 10.508 12.273 4.679 1.00 0.00 H new ATOM 0 HD2 LYS A 106 10.000 10.520 2.902 1.00 0.00 H new ATOM 0 HD3 LYS A 106 10.824 11.531 1.731 1.00 0.00 H new ATOM 0 HE2 LYS A 106 12.553 11.299 4.029 1.00 0.00 H new ATOM 0 HE3 LYS A 106 11.978 9.688 3.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 14.003 10.200 2.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 12.721 9.992 1.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 13.278 11.553 1.729 1.00 0.00 H new ATOM 1568 N ASP A 107 8.121 12.275 0.282 1.00 0.00 N ATOM 1569 CA ASP A 107 7.203 11.574 -0.615 1.00 0.00 C ATOM 1570 C ASP A 107 7.353 10.058 -0.442 1.00 0.00 C ATOM 1571 O ASP A 107 8.458 9.543 -0.245 1.00 0.00 O ATOM 1572 CB ASP A 107 7.485 11.965 -2.075 1.00 0.00 C ATOM 1573 CG ASP A 107 6.772 13.260 -2.483 1.00 0.00 C ATOM 1574 OD1 ASP A 107 5.537 13.215 -2.682 1.00 0.00 O ATOM 1575 OD2 ASP A 107 7.443 14.307 -2.643 1.00 0.00 O ATOM 0 H ASP A 107 9.082 11.942 0.208 1.00 0.00 H new ATOM 0 HA ASP A 107 6.182 11.861 -0.364 1.00 0.00 H new ATOM 0 HB2 ASP A 107 8.559 12.086 -2.215 1.00 0.00 H new ATOM 0 HB3 ASP A 107 7.167 11.156 -2.733 1.00 0.00 H new ATOM 1579 N TYR A 108 6.230 9.352 -0.547 1.00 0.00 N ATOM 1580 CA TYR A 108 6.140 7.906 -0.403 1.00 0.00 C ATOM 1581 C TYR A 108 5.470 7.329 -1.647 1.00 0.00 C ATOM 1582 O TYR A 108 4.346 7.696 -1.994 1.00 0.00 O ATOM 1583 CB TYR A 108 5.368 7.561 0.883 1.00 0.00 C ATOM 1584 CG TYR A 108 6.211 7.079 2.049 1.00 0.00 C ATOM 1585 CD1 TYR A 108 7.211 7.907 2.597 1.00 0.00 C ATOM 1586 CD2 TYR A 108 5.964 5.812 2.618 1.00 0.00 C ATOM 1587 CE1 TYR A 108 7.980 7.462 3.695 1.00 0.00 C ATOM 1588 CE2 TYR A 108 6.725 5.367 3.719 1.00 0.00 C ATOM 1589 CZ TYR A 108 7.740 6.189 4.251 1.00 0.00 C ATOM 1590 OH TYR A 108 8.482 5.756 5.303 1.00 0.00 O ATOM 0 H TYR A 108 5.329 9.788 -0.741 1.00 0.00 H new ATOM 0 HA TYR A 108 7.133 7.464 -0.314 1.00 0.00 H new ATOM 0 HB2 TYR A 108 4.814 8.445 1.200 1.00 0.00 H new ATOM 0 HB3 TYR A 108 4.633 6.791 0.648 1.00 0.00 H new ATOM 0 HD1 TYR A 108 7.390 8.885 2.176 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.189 5.180 2.209 1.00 0.00 H new ATOM 0 HE1 TYR A 108 8.751 8.096 4.108 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.531 4.398 4.154 1.00 0.00 H new ATOM 0 HH TYR A 108 8.187 4.859 5.564 1.00 0.00 H new ATOM 1599 N TYR A 109 6.183 6.415 -2.301 1.00 0.00 N ATOM 1600 CA TYR A 109 5.762 5.702 -3.500 1.00 0.00 C ATOM 1601 C TYR A 109 5.663 4.222 -3.158 1.00 0.00 C ATOM 1602 O TYR A 109 6.598 3.630 -2.616 1.00 0.00 O ATOM 1603 CB TYR A 109 6.802 5.892 -4.616 1.00 0.00 C ATOM 1604 CG TYR A 109 6.479 6.926 -5.661 1.00 0.00 C ATOM 1605 CD1 TYR A 109 5.679 6.578 -6.767 1.00 0.00 C ATOM 1606 CD2 TYR A 109 7.034 8.218 -5.573 1.00 0.00 C ATOM 1607 CE1 TYR A 109 5.439 7.520 -7.791 1.00 0.00 C ATOM 1608 CE2 TYR A 109 6.789 9.165 -6.589 1.00 0.00 C ATOM 1609 CZ TYR A 109 6.000 8.812 -7.705 1.00 0.00 C ATOM 1610 OH TYR A 109 5.793 9.711 -8.697 1.00 0.00 O ATOM 0 H TYR A 109 7.115 6.140 -1.992 1.00 0.00 H new ATOM 0 HA TYR A 109 4.801 6.085 -3.843 1.00 0.00 H new ATOM 0 HB2 TYR A 109 7.753 6.157 -4.155 1.00 0.00 H new ATOM 0 HB3 TYR A 109 6.946 4.934 -5.116 1.00 0.00 H new ATOM 0 HD1 TYR A 109 5.249 5.590 -6.832 1.00 0.00 H new ATOM 0 HD2 TYR A 109 7.648 8.484 -4.726 1.00 0.00 H new ATOM 0 HE1 TYR A 109 4.827 7.252 -8.639 1.00 0.00 H new ATOM 0 HE2 TYR A 109 7.205 10.159 -6.513 1.00 0.00 H new ATOM 0 HH TYR A 109 6.249 10.550 -8.478 1.00 0.00 H new ATOM 1619 N ILE A 110 4.527 3.618 -3.488 1.00 0.00 N ATOM 1620 CA ILE A 110 4.280 2.185 -3.294 1.00 0.00 C ATOM 1621 C ILE A 110 4.332 1.466 -4.653 1.00 0.00 C ATOM 1622 O ILE A 110 4.343 2.101 -5.703 1.00 0.00 O ATOM 1623 CB ILE A 110 2.958 2.020 -2.519 1.00 0.00 C ATOM 1624 CG1 ILE A 110 3.073 2.288 -0.998 1.00 0.00 C ATOM 1625 CG2 ILE A 110 2.281 0.643 -2.657 1.00 0.00 C ATOM 1626 CD1 ILE A 110 3.541 3.693 -0.588 1.00 0.00 C ATOM 0 H ILE A 110 3.738 4.113 -3.904 1.00 0.00 H new ATOM 0 HA ILE A 110 5.053 1.711 -2.689 1.00 0.00 H new ATOM 0 HB ILE A 110 2.347 2.782 -3.003 1.00 0.00 H new ATOM 0 HG12 ILE A 110 2.099 2.106 -0.544 1.00 0.00 H new ATOM 0 HG13 ILE A 110 3.764 1.560 -0.574 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.360 0.630 -2.075 1.00 0.00 H new ATOM 0 HG22 ILE A 110 2.050 0.455 -3.705 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.954 -0.132 -2.289 1.00 0.00 H new ATOM 0 HD11 ILE A 110 3.582 3.760 0.499 1.00 0.00 H new ATOM 0 HD12 ILE A 110 4.532 3.881 -1.001 1.00 0.00 H new ATOM 0 HD13 ILE A 110 2.841 4.436 -0.971 1.00 0.00 H new ATOM 1637 N ILE A 111 4.358 0.140 -4.647 1.00 0.00 N ATOM 1638 CA ILE A 111 4.227 -0.730 -5.816 1.00 0.00 C ATOM 1639 C ILE A 111 3.675 -2.107 -5.387 1.00 0.00 C ATOM 1640 O ILE A 111 3.868 -2.519 -4.239 1.00 0.00 O ATOM 1641 CB ILE A 111 5.597 -0.820 -6.533 1.00 0.00 C ATOM 1642 CG1 ILE A 111 5.530 -1.731 -7.771 1.00 0.00 C ATOM 1643 CG2 ILE A 111 6.700 -1.249 -5.543 1.00 0.00 C ATOM 1644 CD1 ILE A 111 6.735 -1.615 -8.706 1.00 0.00 C ATOM 0 H ILE A 111 4.477 -0.389 -3.783 1.00 0.00 H new ATOM 0 HA ILE A 111 3.512 -0.318 -6.528 1.00 0.00 H new ATOM 0 HB ILE A 111 5.858 0.173 -6.900 1.00 0.00 H new ATOM 0 HG12 ILE A 111 5.440 -2.766 -7.441 1.00 0.00 H new ATOM 0 HG13 ILE A 111 4.626 -1.495 -8.332 1.00 0.00 H new ATOM 0 HG21 ILE A 111 7.655 -1.307 -6.065 1.00 0.00 H new ATOM 0 HG22 ILE A 111 6.770 -0.518 -4.738 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.455 -2.226 -5.126 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.606 -2.291 -9.552 1.00 0.00 H new ATOM 0 HD12 ILE A 111 6.816 -0.591 -9.069 1.00 0.00 H new ATOM 0 HD13 ILE A 111 7.643 -1.881 -8.164 1.00 0.00 H new ATOM 1655 N SER A 112 3.008 -2.818 -6.305 1.00 0.00 N ATOM 1656 CA SER A 112 2.520 -4.196 -6.134 1.00 0.00 C ATOM 1657 C SER A 112 2.652 -5.018 -7.427 1.00 0.00 C ATOM 1658 O SER A 112 2.764 -4.458 -8.523 1.00 0.00 O ATOM 1659 CB SER A 112 1.061 -4.171 -5.671 1.00 0.00 C ATOM 1660 OG SER A 112 0.581 -5.480 -5.383 1.00 0.00 O ATOM 0 H SER A 112 2.784 -2.436 -7.224 1.00 0.00 H new ATOM 0 HA SER A 112 3.139 -4.679 -5.378 1.00 0.00 H new ATOM 0 HB2 SER A 112 0.971 -3.546 -4.782 1.00 0.00 H new ATOM 0 HB3 SER A 112 0.441 -3.717 -6.444 1.00 0.00 H new ATOM 0 HG SER A 112 -0.352 -5.429 -5.089 1.00 0.00 H new ATOM 1665 N THR A 113 2.637 -6.352 -7.317 1.00 0.00 N ATOM 1666 CA THR A 113 3.020 -7.279 -8.403 1.00 0.00 C ATOM 1667 C THR A 113 2.000 -8.399 -8.660 1.00 0.00 C ATOM 1668 O THR A 113 2.347 -9.523 -9.029 1.00 0.00 O ATOM 1669 CB THR A 113 4.464 -7.802 -8.246 1.00 0.00 C ATOM 1670 OG1 THR A 113 4.583 -8.592 -7.082 1.00 0.00 O ATOM 1671 CG2 THR A 113 5.459 -6.653 -8.101 1.00 0.00 C ATOM 0 H THR A 113 2.355 -6.830 -6.461 1.00 0.00 H new ATOM 0 HA THR A 113 3.003 -6.680 -9.313 1.00 0.00 H new ATOM 0 HB THR A 113 4.682 -8.384 -9.141 1.00 0.00 H new ATOM 0 HG1 THR A 113 5.504 -8.916 -7.000 1.00 0.00 H new ATOM 0 HG21 THR A 113 6.466 -7.055 -7.992 1.00 0.00 H new ATOM 0 HG22 THR A 113 5.415 -6.020 -8.987 1.00 0.00 H new ATOM 0 HG23 THR A 113 5.207 -6.063 -7.220 1.00 0.00 H new ATOM 1679 N SER A 114 0.708 -8.059 -8.552 1.00 0.00 N ATOM 1680 CA SER A 114 -0.457 -8.925 -8.840 1.00 0.00 C ATOM 1681 C SER A 114 -0.376 -9.773 -10.129 1.00 0.00 C ATOM 1682 O SER A 114 -0.890 -10.893 -10.161 1.00 0.00 O ATOM 1683 CB SER A 114 -1.720 -8.047 -8.854 1.00 0.00 C ATOM 1684 OG SER A 114 -2.853 -8.736 -9.349 1.00 0.00 O ATOM 0 H SER A 114 0.427 -7.127 -8.247 1.00 0.00 H new ATOM 0 HA SER A 114 -0.480 -9.670 -8.044 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.926 -7.695 -7.843 1.00 0.00 H new ATOM 0 HB3 SER A 114 -1.539 -7.165 -9.468 1.00 0.00 H new ATOM 0 HG SER A 114 -3.397 -9.052 -8.598 1.00 0.00 H new ATOM 1689 N ASN A 115 0.307 -9.292 -11.179 1.00 0.00 N ATOM 1690 CA ASN A 115 0.394 -9.993 -12.466 1.00 0.00 C ATOM 1691 C ASN A 115 1.216 -11.290 -12.395 1.00 0.00 C ATOM 1692 O ASN A 115 1.071 -12.139 -13.275 1.00 0.00 O ATOM 1693 CB ASN A 115 0.981 -9.055 -13.550 1.00 0.00 C ATOM 1694 CG ASN A 115 0.321 -9.231 -14.916 1.00 0.00 C ATOM 1695 OD1 ASN A 115 -0.886 -9.366 -15.040 1.00 0.00 O ATOM 1696 ND2 ASN A 115 1.075 -9.200 -15.990 1.00 0.00 N ATOM 0 H ASN A 115 0.814 -8.407 -11.158 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.624 -10.278 -12.732 1.00 0.00 H new ATOM 0 HB2 ASN A 115 0.865 -8.020 -13.228 1.00 0.00 H new ATOM 0 HB3 ASN A 115 2.051 -9.242 -13.643 1.00 0.00 H new ATOM 0 HD21 ASN A 115 0.651 -9.288 -16.914 1.00 0.00 H new ATOM 0 HD22 ASN A 115 2.085 -9.088 -15.901 1.00 0.00 H new ATOM 1702 N GLY A 116 2.082 -11.433 -11.379 1.00 0.00 N ATOM 1703 CA GLY A 116 2.981 -12.577 -11.191 1.00 0.00 C ATOM 1704 C GLY A 116 3.678 -13.033 -12.481 1.00 0.00 C ATOM 1705 O GLY A 116 3.537 -14.192 -12.881 1.00 0.00 O ATOM 0 H GLY A 116 2.177 -10.732 -10.644 1.00 0.00 H new ATOM 0 HA2 GLY A 116 3.739 -12.315 -10.452 1.00 0.00 H new ATOM 0 HA3 GLY A 116 2.412 -13.412 -10.782 1.00 0.00 H new ATOM 1708 N SER A 117 4.355 -12.097 -13.165 1.00 0.00 N ATOM 1709 CA SER A 117 5.117 -12.345 -14.404 1.00 0.00 C ATOM 1710 C SER A 117 6.060 -13.546 -14.280 1.00 0.00 C ATOM 1711 O SER A 117 6.496 -13.859 -13.179 1.00 0.00 O ATOM 1712 CB SER A 117 5.933 -11.093 -14.749 1.00 0.00 C ATOM 1713 OG SER A 117 6.672 -11.284 -15.943 1.00 0.00 O ATOM 0 H SER A 117 4.390 -11.122 -12.866 1.00 0.00 H new ATOM 0 HA SER A 117 4.401 -12.572 -15.194 1.00 0.00 H new ATOM 0 HB2 SER A 117 5.265 -10.239 -14.863 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.613 -10.860 -13.929 1.00 0.00 H new ATOM 0 HG SER A 117 7.183 -10.473 -16.145 1.00 0.00 H new ATOM 1718 N LEU A 118 6.432 -14.204 -15.383 1.00 0.00 N ATOM 1719 CA LEU A 118 7.307 -15.387 -15.359 1.00 0.00 C ATOM 1720 C LEU A 118 8.635 -15.109 -14.613 1.00 0.00 C ATOM 1721 O LEU A 118 9.078 -15.908 -13.789 1.00 0.00 O ATOM 1722 CB LEU A 118 7.524 -15.882 -16.812 1.00 0.00 C ATOM 1723 CG LEU A 118 7.818 -17.387 -17.029 1.00 0.00 C ATOM 1724 CD1 LEU A 118 9.019 -17.912 -16.239 1.00 0.00 C ATOM 1725 CD2 LEU A 118 6.596 -18.252 -16.706 1.00 0.00 C ATOM 0 H LEU A 118 6.136 -13.933 -16.321 1.00 0.00 H new ATOM 0 HA LEU A 118 6.824 -16.183 -14.793 1.00 0.00 H new ATOM 0 HB2 LEU A 118 6.634 -15.629 -17.388 1.00 0.00 H new ATOM 0 HB3 LEU A 118 8.351 -15.315 -17.238 1.00 0.00 H new ATOM 0 HG LEU A 118 8.066 -17.465 -18.088 1.00 0.00 H new ATOM 0 HD11 LEU A 118 9.156 -18.973 -16.447 1.00 0.00 H new ATOM 0 HD12 LEU A 118 9.915 -17.366 -16.533 1.00 0.00 H new ATOM 0 HD13 LEU A 118 8.843 -17.772 -15.173 1.00 0.00 H new ATOM 0 HD21 LEU A 118 6.840 -19.302 -16.870 1.00 0.00 H new ATOM 0 HD22 LEU A 118 6.311 -18.104 -15.665 1.00 0.00 H new ATOM 0 HD23 LEU A 118 5.767 -17.967 -17.354 1.00 0.00 H new ATOM 1736 N GLU A 119 9.235 -13.935 -14.827 1.00 0.00 N ATOM 1737 CA GLU A 119 10.449 -13.480 -14.123 1.00 0.00 C ATOM 1738 C GLU A 119 10.218 -13.171 -12.626 1.00 0.00 C ATOM 1739 O GLU A 119 11.125 -13.328 -11.806 1.00 0.00 O ATOM 1740 CB GLU A 119 10.984 -12.217 -14.818 1.00 0.00 C ATOM 1741 CG GLU A 119 11.487 -12.472 -16.252 1.00 0.00 C ATOM 1742 CD GLU A 119 13.024 -12.421 -16.338 1.00 0.00 C ATOM 1743 OE1 GLU A 119 13.689 -13.453 -16.085 1.00 0.00 O ATOM 1744 OE2 GLU A 119 13.581 -11.344 -16.674 1.00 0.00 O ATOM 0 H GLU A 119 8.888 -13.257 -15.506 1.00 0.00 H new ATOM 0 HA GLU A 119 11.167 -14.299 -14.168 1.00 0.00 H new ATOM 0 HB2 GLU A 119 10.195 -11.465 -14.846 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.798 -11.802 -14.224 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.136 -13.446 -16.592 1.00 0.00 H new ATOM 0 HG3 GLU A 119 11.061 -11.727 -16.924 1.00 0.00 H new ATOM 1749 N GLY A 120 8.994 -12.773 -12.261 1.00 0.00 N ATOM 1750 CA GLY A 120 8.551 -12.406 -10.907 1.00 0.00 C ATOM 1751 C GLY A 120 7.441 -13.322 -10.369 1.00 0.00 C ATOM 1752 O GLY A 120 6.506 -12.854 -9.716 1.00 0.00 O ATOM 0 H GLY A 120 8.239 -12.693 -12.942 1.00 0.00 H new ATOM 0 HA2 GLY A 120 9.404 -12.442 -10.229 1.00 0.00 H new ATOM 0 HA3 GLY A 120 8.193 -11.377 -10.914 1.00 0.00 H new ATOM 1755 N LEU A 121 7.514 -14.621 -10.692 1.00 0.00 N ATOM 1756 CA LEU A 121 6.464 -15.614 -10.415 1.00 0.00 C ATOM 1757 C LEU A 121 6.262 -15.815 -8.906 1.00 0.00 C ATOM 1758 O LEU A 121 5.149 -16.024 -8.424 1.00 0.00 O ATOM 1759 CB LEU A 121 6.864 -16.942 -11.096 1.00 0.00 C ATOM 1760 CG LEU A 121 5.803 -17.493 -12.067 1.00 0.00 C ATOM 1761 CD1 LEU A 121 6.402 -18.642 -12.876 1.00 0.00 C ATOM 1762 CD2 LEU A 121 4.569 -18.021 -11.334 1.00 0.00 C ATOM 0 H LEU A 121 8.324 -15.021 -11.165 1.00 0.00 H new ATOM 0 HA LEU A 121 5.514 -15.258 -10.814 1.00 0.00 H new ATOM 0 HB2 LEU A 121 7.797 -16.793 -11.640 1.00 0.00 H new ATOM 0 HB3 LEU A 121 7.060 -17.689 -10.326 1.00 0.00 H new ATOM 0 HG LEU A 121 5.498 -16.670 -12.713 1.00 0.00 H new ATOM 0 HD11 LEU A 121 5.652 -19.033 -13.564 1.00 0.00 H new ATOM 0 HD12 LEU A 121 7.260 -18.280 -13.443 1.00 0.00 H new ATOM 0 HD13 LEU A 121 6.722 -19.435 -12.200 1.00 0.00 H new ATOM 0 HD21 LEU A 121 3.849 -18.399 -12.060 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.863 -18.826 -10.661 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.115 -17.214 -10.758 1.00 0.00 H new ATOM 1773 N ASP A 122 7.365 -15.691 -8.170 1.00 0.00 N ATOM 1774 CA ASP A 122 7.435 -15.683 -6.707 1.00 0.00 C ATOM 1775 C ASP A 122 8.322 -14.523 -6.215 1.00 0.00 C ATOM 1776 O ASP A 122 8.017 -13.892 -5.199 1.00 0.00 O ATOM 1777 CB ASP A 122 7.991 -17.039 -6.247 1.00 0.00 C ATOM 1778 CG ASP A 122 7.915 -17.236 -4.723 1.00 0.00 C ATOM 1779 OD1 ASP A 122 8.821 -16.770 -3.995 1.00 0.00 O ATOM 1780 OD2 ASP A 122 6.959 -17.901 -4.252 1.00 0.00 O ATOM 0 H ASP A 122 8.284 -15.588 -8.600 1.00 0.00 H new ATOM 0 HA ASP A 122 6.442 -15.532 -6.283 1.00 0.00 H new ATOM 0 HB2 ASP A 122 7.437 -17.838 -6.739 1.00 0.00 H new ATOM 0 HB3 ASP A 122 9.029 -17.127 -6.568 1.00 0.00 H new ATOM 1784 N ASN A 123 9.379 -14.199 -6.976 1.00 0.00 N ATOM 1785 CA ASN A 123 10.255 -13.053 -6.730 1.00 0.00 C ATOM 1786 C ASN A 123 9.495 -11.718 -6.740 1.00 0.00 C ATOM 1787 O ASN A 123 8.499 -11.530 -7.442 1.00 0.00 O ATOM 1788 CB ASN A 123 11.378 -12.965 -7.784 1.00 0.00 C ATOM 1789 CG ASN A 123 12.375 -14.109 -7.797 1.00 0.00 C ATOM 1790 OD1 ASN A 123 12.371 -15.013 -6.974 1.00 0.00 O ATOM 1791 ND2 ASN A 123 13.274 -14.091 -8.754 1.00 0.00 N ATOM 0 H ASN A 123 9.651 -14.741 -7.796 1.00 0.00 H new ATOM 0 HA ASN A 123 10.677 -13.218 -5.739 1.00 0.00 H new ATOM 0 HB2 ASN A 123 10.918 -12.900 -8.770 1.00 0.00 H new ATOM 0 HB3 ASN A 123 11.925 -12.036 -7.625 1.00 0.00 H new ATOM 0 HD21 ASN A 123 13.972 -14.833 -8.812 1.00 0.00 H new ATOM 0 HD22 ASN A 123 13.275 -13.335 -9.439 1.00 0.00 H new ATOM 1797 N GLN A 124 10.058 -10.747 -6.028 1.00 0.00 N ATOM 1798 CA GLN A 124 9.564 -9.378 -5.961 1.00 0.00 C ATOM 1799 C GLN A 124 10.023 -8.534 -7.178 1.00 0.00 C ATOM 1800 O GLN A 124 10.781 -7.580 -7.060 1.00 0.00 O ATOM 1801 CB GLN A 124 9.895 -8.825 -4.561 1.00 0.00 C ATOM 1802 CG GLN A 124 11.384 -8.615 -4.202 1.00 0.00 C ATOM 1803 CD GLN A 124 11.982 -9.837 -3.511 1.00 0.00 C ATOM 1804 OE1 GLN A 124 11.608 -10.204 -2.408 1.00 0.00 O ATOM 1805 NE2 GLN A 124 12.914 -10.528 -4.135 1.00 0.00 N ATOM 0 H GLN A 124 10.896 -10.897 -5.465 1.00 0.00 H new ATOM 0 HA GLN A 124 8.479 -9.331 -6.060 1.00 0.00 H new ATOM 0 HB2 GLN A 124 9.386 -7.868 -4.450 1.00 0.00 H new ATOM 0 HB3 GLN A 124 9.465 -9.502 -3.823 1.00 0.00 H new ATOM 0 HG2 GLN A 124 11.949 -8.398 -5.109 1.00 0.00 H new ATOM 0 HG3 GLN A 124 11.481 -7.746 -3.551 1.00 0.00 H new ATOM 0 HE21 GLN A 124 13.236 -10.233 -5.057 1.00 0.00 H new ATOM 0 HE22 GLN A 124 13.313 -11.358 -3.696 1.00 0.00 H new ATOM 1812 N GLU A 125 9.610 -8.898 -8.391 1.00 0.00 N ATOM 1813 CA GLU A 125 9.998 -8.210 -9.638 1.00 0.00 C ATOM 1814 C GLU A 125 8.825 -8.161 -10.636 1.00 0.00 C ATOM 1815 O GLU A 125 7.867 -8.932 -10.521 1.00 0.00 O ATOM 1816 CB GLU A 125 11.196 -8.927 -10.295 1.00 0.00 C ATOM 1817 CG GLU A 125 12.521 -8.838 -9.515 1.00 0.00 C ATOM 1818 CD GLU A 125 13.417 -10.071 -9.731 1.00 0.00 C ATOM 1819 OE1 GLU A 125 13.602 -10.508 -10.892 1.00 0.00 O ATOM 1820 OE2 GLU A 125 13.951 -10.609 -8.732 1.00 0.00 O ATOM 0 H GLU A 125 8.987 -9.690 -8.546 1.00 0.00 H new ATOM 0 HA GLU A 125 10.279 -7.189 -9.378 1.00 0.00 H new ATOM 0 HB2 GLU A 125 10.941 -9.978 -10.428 1.00 0.00 H new ATOM 0 HB3 GLU A 125 11.349 -8.508 -11.289 1.00 0.00 H new ATOM 0 HG2 GLU A 125 13.061 -7.942 -9.823 1.00 0.00 H new ATOM 0 HG3 GLU A 125 12.306 -8.731 -8.452 1.00 0.00 H new ATOM 1825 N GLY A 126 8.894 -7.270 -11.631 1.00 0.00 N ATOM 1826 CA GLY A 126 7.806 -7.039 -12.583 1.00 0.00 C ATOM 1827 C GLY A 126 6.543 -6.490 -11.905 1.00 0.00 C ATOM 1828 O GLY A 126 6.621 -5.689 -10.971 1.00 0.00 O ATOM 0 H GLY A 126 9.713 -6.685 -11.798 1.00 0.00 H new ATOM 0 HA2 GLY A 126 8.139 -6.337 -13.348 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.566 -7.973 -13.090 1.00 0.00 H new ATOM 1831 N GLY A 127 5.373 -6.906 -12.393 1.00 0.00 N ATOM 1832 CA GLY A 127 4.074 -6.635 -11.775 1.00 0.00 C ATOM 1833 C GLY A 127 3.063 -5.982 -12.709 1.00 0.00 C ATOM 1834 O GLY A 127 3.403 -5.519 -13.798 1.00 0.00 O ATOM 0 H GLY A 127 5.301 -7.454 -13.250 1.00 0.00 H new ATOM 0 HA2 GLY A 127 3.658 -7.572 -11.405 1.00 0.00 H new ATOM 0 HA3 GLY A 127 4.223 -5.989 -10.910 1.00 0.00 H new ATOM 1837 N VAL A 128 1.813 -5.875 -12.244 1.00 0.00 N ATOM 1838 CA VAL A 128 0.757 -5.135 -12.967 1.00 0.00 C ATOM 1839 C VAL A 128 1.089 -3.645 -13.109 1.00 0.00 C ATOM 1840 O VAL A 128 0.555 -2.981 -13.995 1.00 0.00 O ATOM 1841 CB VAL A 128 -0.635 -5.278 -12.323 1.00 0.00 C ATOM 1842 CG1 VAL A 128 -1.380 -6.566 -12.656 1.00 0.00 C ATOM 1843 CG2 VAL A 128 -0.604 -5.052 -10.815 1.00 0.00 C ATOM 0 H VAL A 128 1.501 -6.292 -11.367 1.00 0.00 H new ATOM 0 HA VAL A 128 0.724 -5.594 -13.955 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.211 -4.479 -12.789 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.347 -6.567 -12.154 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -1.531 -6.631 -13.734 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.795 -7.422 -12.319 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.610 -5.164 -10.410 1.00 0.00 H new ATOM 0 HG22 VAL A 128 0.058 -5.783 -10.351 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -0.238 -4.047 -10.605 1.00 0.00 H new ATOM 1853 N CYS A 129 2.031 -3.133 -12.306 1.00 0.00 N ATOM 1854 CA CYS A 129 2.677 -1.834 -12.485 1.00 0.00 C ATOM 1855 C CYS A 129 3.003 -1.494 -13.960 1.00 0.00 C ATOM 1856 O CYS A 129 2.884 -0.332 -14.350 1.00 0.00 O ATOM 1857 CB CYS A 129 3.895 -1.760 -11.545 1.00 0.00 C ATOM 1858 SG CYS A 129 5.227 -0.631 -12.022 1.00 0.00 S ATOM 0 H CYS A 129 2.374 -3.633 -11.486 1.00 0.00 H new ATOM 0 HA CYS A 129 1.972 -1.051 -12.208 1.00 0.00 H new ATOM 0 HB2 CYS A 129 3.543 -1.471 -10.555 1.00 0.00 H new ATOM 0 HB3 CYS A 129 4.315 -2.762 -11.454 1.00 0.00 H new ATOM 1862 N GLN A 130 3.345 -2.494 -14.788 1.00 0.00 N ATOM 1863 CA GLN A 130 3.705 -2.307 -16.202 1.00 0.00 C ATOM 1864 C GLN A 130 2.641 -1.566 -17.032 1.00 0.00 C ATOM 1865 O GLN A 130 2.997 -0.810 -17.940 1.00 0.00 O ATOM 1866 CB GLN A 130 3.997 -3.671 -16.858 1.00 0.00 C ATOM 1867 CG GLN A 130 5.496 -4.004 -16.938 1.00 0.00 C ATOM 1868 CD GLN A 130 5.762 -5.123 -17.948 1.00 0.00 C ATOM 1869 OE1 GLN A 130 5.135 -6.174 -17.948 1.00 0.00 O ATOM 1870 NE2 GLN A 130 6.685 -4.931 -18.870 1.00 0.00 N ATOM 0 H GLN A 130 3.380 -3.469 -14.489 1.00 0.00 H new ATOM 0 HA GLN A 130 4.593 -1.675 -16.198 1.00 0.00 H new ATOM 0 HB2 GLN A 130 3.489 -4.453 -16.294 1.00 0.00 H new ATOM 0 HB3 GLN A 130 3.577 -3.679 -17.864 1.00 0.00 H new ATOM 0 HG2 GLN A 130 6.054 -3.113 -17.224 1.00 0.00 H new ATOM 0 HG3 GLN A 130 5.857 -4.305 -15.955 1.00 0.00 H new ATOM 0 HE21 GLN A 130 7.217 -4.061 -18.885 1.00 0.00 H new ATOM 0 HE22 GLN A 130 6.867 -5.652 -19.568 1.00 0.00 H new ATOM 1877 N THR A 131 1.352 -1.756 -16.713 1.00 0.00 N ATOM 1878 CA THR A 131 0.219 -1.176 -17.468 1.00 0.00 C ATOM 1879 C THR A 131 -0.917 -0.726 -16.554 1.00 0.00 C ATOM 1880 O THR A 131 -1.375 0.412 -16.673 1.00 0.00 O ATOM 1881 CB THR A 131 -0.330 -2.185 -18.495 1.00 0.00 C ATOM 1882 OG1 THR A 131 0.683 -2.546 -19.411 1.00 0.00 O ATOM 1883 CG2 THR A 131 -1.485 -1.617 -19.325 1.00 0.00 C ATOM 0 H THR A 131 1.058 -2.322 -15.916 1.00 0.00 H new ATOM 0 HA THR A 131 0.610 -0.299 -17.984 1.00 0.00 H new ATOM 0 HB THR A 131 -0.683 -3.038 -17.915 1.00 0.00 H new ATOM 0 HG1 THR A 131 0.325 -3.189 -20.058 1.00 0.00 H new ATOM 0 HG21 THR A 131 -1.831 -2.372 -20.031 1.00 0.00 H new ATOM 0 HG22 THR A 131 -2.305 -1.336 -18.664 1.00 0.00 H new ATOM 0 HG23 THR A 131 -1.142 -0.738 -19.872 1.00 0.00 H new ATOM 1891 N ARG A 132 -1.346 -1.572 -15.602 1.00 0.00 N ATOM 1892 CA ARG A 132 -2.320 -1.175 -14.566 1.00 0.00 C ATOM 1893 C ARG A 132 -1.771 -0.120 -13.609 1.00 0.00 C ATOM 1894 O ARG A 132 -2.578 0.450 -12.891 1.00 0.00 O ATOM 1895 CB ARG A 132 -2.729 -2.348 -13.666 1.00 0.00 C ATOM 1896 CG ARG A 132 -3.365 -3.588 -14.316 1.00 0.00 C ATOM 1897 CD ARG A 132 -4.856 -3.402 -14.610 1.00 0.00 C ATOM 1898 NE ARG A 132 -5.097 -2.650 -15.855 1.00 0.00 N ATOM 1899 CZ ARG A 132 -6.263 -2.175 -16.254 1.00 0.00 C ATOM 1900 NH1 ARG A 132 -7.326 -2.244 -15.504 1.00 0.00 N ATOM 1901 NH2 ARG A 132 -6.384 -1.621 -17.425 1.00 0.00 N ATOM 0 H ARG A 132 -1.033 -2.540 -15.527 1.00 0.00 H new ATOM 0 HA ARG A 132 -3.164 -0.791 -15.140 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -1.841 -2.676 -13.126 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -3.430 -1.967 -12.924 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -2.841 -3.815 -15.245 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -3.233 -4.446 -13.657 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -5.333 -4.379 -14.682 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -5.325 -2.878 -13.777 1.00 0.00 H new ATOM 0 HE ARG A 132 -4.294 -2.482 -16.461 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -7.272 -2.674 -14.581 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -8.213 -1.868 -15.840 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -5.575 -1.551 -18.042 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -7.288 -1.257 -17.726 1.00 0.00 H new ATOM 1912 N ALA A 133 -0.445 0.072 -13.557 1.00 0.00 N ATOM 1913 CA ALA A 133 0.262 0.983 -12.653 1.00 0.00 C ATOM 1914 C ALA A 133 -0.202 0.872 -11.180 1.00 0.00 C ATOM 1915 O ALA A 133 -0.487 1.870 -10.528 1.00 0.00 O ATOM 1916 CB ALA A 133 0.292 2.386 -13.275 1.00 0.00 C ATOM 0 H ALA A 133 0.192 -0.430 -14.176 1.00 0.00 H new ATOM 0 HA ALA A 133 1.305 0.681 -12.556 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.817 3.069 -12.607 1.00 0.00 H new ATOM 0 HB2 ALA A 133 0.809 2.348 -14.234 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -0.728 2.739 -13.426 1.00 0.00 H new ATOM 1922 N MET A 134 -0.262 -0.356 -10.638 1.00 0.00 N ATOM 1923 CA MET A 134 -0.591 -0.619 -9.227 1.00 0.00 C ATOM 1924 C MET A 134 0.491 -0.094 -8.269 1.00 0.00 C ATOM 1925 O MET A 134 1.389 -0.816 -7.828 1.00 0.00 O ATOM 1926 CB MET A 134 -0.877 -2.105 -8.987 1.00 0.00 C ATOM 1927 CG MET A 134 -1.613 -2.333 -7.661 1.00 0.00 C ATOM 1928 SD MET A 134 -2.208 -4.035 -7.459 1.00 0.00 S ATOM 1929 CE MET A 134 -3.688 -3.715 -6.463 1.00 0.00 C ATOM 0 H MET A 134 -0.081 -1.205 -11.174 1.00 0.00 H new ATOM 0 HA MET A 134 -1.503 -0.065 -9.007 1.00 0.00 H new ATOM 0 HB2 MET A 134 -1.476 -2.498 -9.808 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.061 -2.660 -8.983 1.00 0.00 H new ATOM 0 HG2 MET A 134 -0.945 -2.088 -6.835 1.00 0.00 H new ATOM 0 HG3 MET A 134 -2.460 -1.649 -7.600 1.00 0.00 H new ATOM 0 HE1 MET A 134 -4.188 -4.658 -6.241 1.00 0.00 H new ATOM 0 HE2 MET A 134 -3.401 -3.228 -5.531 1.00 0.00 H new ATOM 0 HE3 MET A 134 -4.367 -3.067 -7.017 1.00 0.00 H new ATOM 1937 N LYS A 135 0.379 1.193 -7.970 1.00 0.00 N ATOM 1938 CA LYS A 135 1.170 1.967 -7.020 1.00 0.00 C ATOM 1939 C LYS A 135 0.249 2.911 -6.241 1.00 0.00 C ATOM 1940 O LYS A 135 -0.932 3.043 -6.567 1.00 0.00 O ATOM 1941 CB LYS A 135 2.330 2.679 -7.755 1.00 0.00 C ATOM 1942 CG LYS A 135 2.039 3.549 -8.993 1.00 0.00 C ATOM 1943 CD LYS A 135 3.058 3.279 -10.122 1.00 0.00 C ATOM 1944 CE LYS A 135 3.361 4.507 -10.992 1.00 0.00 C ATOM 1945 NZ LYS A 135 4.092 4.128 -12.232 1.00 0.00 N ATOM 0 H LYS A 135 -0.327 1.772 -8.424 1.00 0.00 H new ATOM 0 HA LYS A 135 1.640 1.316 -6.283 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.836 3.312 -7.026 1.00 0.00 H new ATOM 0 HB3 LYS A 135 3.041 1.911 -8.059 1.00 0.00 H new ATOM 0 HG2 LYS A 135 1.031 3.346 -9.354 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.072 4.603 -8.715 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.988 2.920 -9.681 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.678 2.480 -10.758 1.00 0.00 H new ATOM 0 HE2 LYS A 135 2.429 5.007 -11.256 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.955 5.221 -10.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 4.572 4.964 -12.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 4.797 3.396 -12.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 3.418 3.758 -12.933 1.00 0.00 H new ATOM 1955 N ILE A 136 0.770 3.536 -5.188 1.00 0.00 N ATOM 1956 CA ILE A 136 0.066 4.611 -4.473 1.00 0.00 C ATOM 1957 C ILE A 136 1.028 5.748 -4.154 1.00 0.00 C ATOM 1958 O ILE A 136 2.240 5.530 -4.058 1.00 0.00 O ATOM 1959 CB ILE A 136 -0.722 4.152 -3.209 1.00 0.00 C ATOM 1960 CG1 ILE A 136 0.122 3.701 -2.007 1.00 0.00 C ATOM 1961 CG2 ILE A 136 -1.712 3.029 -3.536 1.00 0.00 C ATOM 1962 CD1 ILE A 136 -0.498 3.972 -0.640 1.00 0.00 C ATOM 0 H ILE A 136 1.689 3.317 -4.803 1.00 0.00 H new ATOM 0 HA ILE A 136 -0.706 4.967 -5.155 1.00 0.00 H new ATOM 0 HB ILE A 136 -1.233 5.066 -2.907 1.00 0.00 H new ATOM 0 HG12 ILE A 136 0.311 2.631 -2.097 1.00 0.00 H new ATOM 0 HG13 ILE A 136 1.090 4.201 -2.055 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -2.242 2.736 -2.630 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -2.429 3.380 -4.278 1.00 0.00 H new ATOM 0 HG23 ILE A 136 -1.170 2.171 -3.933 1.00 0.00 H new ATOM 0 HD11 ILE A 136 0.174 3.617 0.141 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -0.661 5.043 -0.520 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -1.451 3.449 -0.563 1.00 0.00 H new ATOM 1973 N LEU A 137 0.476 6.948 -3.962 1.00 0.00 N ATOM 1974 CA LEU A 137 1.240 8.151 -3.637 1.00 0.00 C ATOM 1975 C LEU A 137 0.724 8.787 -2.349 1.00 0.00 C ATOM 1976 O LEU A 137 -0.477 9.005 -2.173 1.00 0.00 O ATOM 1977 CB LEU A 137 1.217 9.144 -4.822 1.00 0.00 C ATOM 1978 CG LEU A 137 2.450 9.021 -5.729 1.00 0.00 C ATOM 1979 CD1 LEU A 137 2.258 9.807 -7.027 1.00 0.00 C ATOM 1980 CD2 LEU A 137 3.697 9.562 -5.032 1.00 0.00 C ATOM 0 H LEU A 137 -0.528 7.112 -4.029 1.00 0.00 H new ATOM 0 HA LEU A 137 2.279 7.871 -3.465 1.00 0.00 H new ATOM 0 HB2 LEU A 137 0.318 8.974 -5.414 1.00 0.00 H new ATOM 0 HB3 LEU A 137 1.156 10.161 -4.436 1.00 0.00 H new ATOM 0 HG LEU A 137 2.575 7.961 -5.951 1.00 0.00 H new ATOM 0 HD11 LEU A 137 3.146 9.703 -7.650 1.00 0.00 H new ATOM 0 HD12 LEU A 137 1.391 9.419 -7.562 1.00 0.00 H new ATOM 0 HD13 LEU A 137 2.100 10.860 -6.795 1.00 0.00 H new ATOM 0 HD21 LEU A 137 4.556 9.463 -5.695 1.00 0.00 H new ATOM 0 HD22 LEU A 137 3.548 10.613 -4.785 1.00 0.00 H new ATOM 0 HD23 LEU A 137 3.877 8.996 -4.118 1.00 0.00 H new ATOM 1991 N MET A 138 1.674 9.091 -1.471 1.00 0.00 N ATOM 1992 CA MET A 138 1.455 9.653 -0.146 1.00 0.00 C ATOM 1993 C MET A 138 2.419 10.827 0.026 1.00 0.00 C ATOM 1994 O MET A 138 3.589 10.651 0.377 1.00 0.00 O ATOM 1995 CB MET A 138 1.667 8.574 0.929 1.00 0.00 C ATOM 1996 CG MET A 138 0.704 7.391 0.799 1.00 0.00 C ATOM 1997 SD MET A 138 1.050 6.015 1.928 1.00 0.00 S ATOM 1998 CE MET A 138 0.463 6.723 3.484 1.00 0.00 C ATOM 0 H MET A 138 2.663 8.945 -1.675 1.00 0.00 H new ATOM 0 HA MET A 138 0.431 10.009 -0.036 1.00 0.00 H new ATOM 0 HB2 MET A 138 2.692 8.207 0.869 1.00 0.00 H new ATOM 0 HB3 MET A 138 1.547 9.024 1.914 1.00 0.00 H new ATOM 0 HG2 MET A 138 -0.312 7.744 0.977 1.00 0.00 H new ATOM 0 HG3 MET A 138 0.738 7.021 -0.226 1.00 0.00 H new ATOM 0 HE1 MET A 138 0.217 5.920 4.179 1.00 0.00 H new ATOM 0 HE2 MET A 138 1.243 7.351 3.915 1.00 0.00 H new ATOM 0 HE3 MET A 138 -0.426 7.326 3.297 1.00 0.00 H new ATOM 2006 N LYS A 139 1.939 12.032 -0.293 1.00 0.00 N ATOM 2007 CA LYS A 139 2.654 13.271 0.037 1.00 0.00 C ATOM 2008 C LYS A 139 2.660 13.484 1.554 1.00 0.00 C ATOM 2009 O LYS A 139 1.661 13.225 2.229 1.00 0.00 O ATOM 2010 CB LYS A 139 2.023 14.474 -0.684 1.00 0.00 C ATOM 2011 CG LYS A 139 2.875 14.926 -1.867 1.00 0.00 C ATOM 2012 CD LYS A 139 2.294 16.187 -2.527 1.00 0.00 C ATOM 2013 CE LYS A 139 3.437 17.082 -3.017 1.00 0.00 C ATOM 2014 NZ LYS A 139 2.927 18.319 -3.662 1.00 0.00 N ATOM 0 H LYS A 139 1.055 12.178 -0.781 1.00 0.00 H new ATOM 0 HA LYS A 139 3.685 13.182 -0.305 1.00 0.00 H new ATOM 0 HB2 LYS A 139 1.025 14.208 -1.033 1.00 0.00 H new ATOM 0 HB3 LYS A 139 1.905 15.300 0.018 1.00 0.00 H new ATOM 0 HG2 LYS A 139 3.892 15.126 -1.530 1.00 0.00 H new ATOM 0 HG3 LYS A 139 2.935 14.123 -2.602 1.00 0.00 H new ATOM 0 HD2 LYS A 139 1.652 15.910 -3.363 1.00 0.00 H new ATOM 0 HD3 LYS A 139 1.673 16.730 -1.814 1.00 0.00 H new ATOM 0 HE2 LYS A 139 4.078 17.347 -2.176 1.00 0.00 H new ATOM 0 HE3 LYS A 139 4.054 16.530 -3.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 3.728 18.900 -3.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 2.336 18.066 -4.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 2.359 18.858 -2.978 1.00 0.00 H new ATOM 2024 N VAL A 140 3.772 13.998 2.073 1.00 0.00 N ATOM 2025 CA VAL A 140 3.965 14.250 3.504 1.00 0.00 C ATOM 2026 C VAL A 140 4.683 15.596 3.674 1.00 0.00 C ATOM 2027 O VAL A 140 5.900 15.709 3.500 1.00 0.00 O ATOM 2028 CB VAL A 140 4.718 13.087 4.191 1.00 0.00 C ATOM 2029 CG1 VAL A 140 4.581 13.212 5.707 1.00 0.00 C ATOM 2030 CG2 VAL A 140 4.194 11.688 3.824 1.00 0.00 C ATOM 0 H VAL A 140 4.579 14.256 1.505 1.00 0.00 H new ATOM 0 HA VAL A 140 2.996 14.305 4.000 1.00 0.00 H new ATOM 0 HB VAL A 140 5.748 13.172 3.843 1.00 0.00 H new ATOM 0 HG11 VAL A 140 5.112 12.391 6.189 1.00 0.00 H new ATOM 0 HG12 VAL A 140 5.006 14.161 6.034 1.00 0.00 H new ATOM 0 HG13 VAL A 140 3.527 13.173 5.982 1.00 0.00 H new ATOM 0 HG21 VAL A 140 4.777 10.932 4.349 1.00 0.00 H new ATOM 0 HG22 VAL A 140 3.147 11.604 4.114 1.00 0.00 H new ATOM 0 HG23 VAL A 140 4.286 11.535 2.749 1.00 0.00 H new ATOM 2040 N GLY A 141 3.909 16.652 3.947 1.00 0.00 N ATOM 2041 CA GLY A 141 4.414 18.010 4.187 1.00 0.00 C ATOM 2042 C GLY A 141 3.361 19.109 4.011 1.00 0.00 C ATOM 2043 O GLY A 141 2.902 19.683 5.001 1.00 0.00 O ATOM 0 H GLY A 141 2.893 16.586 4.009 1.00 0.00 H new ATOM 0 HA2 GLY A 141 4.814 18.064 5.200 1.00 0.00 H new ATOM 0 HA3 GLY A 141 5.243 18.203 3.506 1.00 0.00 H new ATOM 2046 N GLN A 142 2.953 19.358 2.762 1.00 0.00 N ATOM 2047 CA GLN A 142 1.907 20.320 2.372 1.00 0.00 C ATOM 2048 C GLN A 142 0.697 19.614 1.734 1.00 0.00 C ATOM 2049 O GLN A 142 0.908 18.694 0.911 1.00 0.00 O ATOM 2050 CB GLN A 142 2.470 21.366 1.390 1.00 0.00 C ATOM 2051 CG GLN A 142 3.159 22.573 2.053 1.00 0.00 C ATOM 2052 CD GLN A 142 2.727 23.892 1.400 1.00 0.00 C ATOM 2053 OE1 GLN A 142 3.168 24.270 0.322 1.00 0.00 O ATOM 2054 NE2 GLN A 142 1.822 24.632 2.015 1.00 0.00 N ATOM 0 H GLN A 142 3.357 18.876 1.959 1.00 0.00 H new ATOM 0 HA GLN A 142 1.573 20.820 3.281 1.00 0.00 H new ATOM 0 HB2 GLN A 142 3.185 20.875 0.730 1.00 0.00 H new ATOM 0 HB3 GLN A 142 1.656 21.730 0.763 1.00 0.00 H new ATOM 0 HG2 GLN A 142 2.916 22.594 3.115 1.00 0.00 H new ATOM 0 HG3 GLN A 142 4.241 22.464 1.976 1.00 0.00 H new ATOM 0 HE21 GLN A 142 1.444 24.333 2.914 1.00 0.00 H new ATOM 0 HE22 GLN A 142 1.502 25.503 1.591 1.00 0.00 H new TER 2061 GLN A 142