USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 880 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 59 ASN : amide:sc= 0.0522 K(o=-2.1,f=-13!) USER MOD Set 1.2: A 62 ASN : amide:sc= -2.19 K(o=-2.1,f=-5!) USER MOD Set 2.1: A 16 SER OG : rot 180:sc= -1.2 USER MOD Set 2.2: A 56 GLN : amide:sc= 0.77 K(o=-0.43,f=-6.3!) USER MOD Set 3.1: A 25 THR OG1 : rot -18:sc= 0.78 USER MOD Set 3.2: A 50 LYS NZ :NH3+ 170:sc= 1.03 (180deg=0.903) USER MOD Set 4.1: A 7 ASN : amide:sc= -0.482 K(o=0.73,f=-0.22) USER MOD Set 4.2: B 5 U O2' : rot -37:sc= 1.22 USER MOD Set 5.1: A 6 THR OG1 : rot 89:sc= 1.2 USER MOD Set 5.2: A 47 SER OG : rot 103:sc= 0.759 USER MOD Set 5.3: A 49 HIS : no HE2:sc= -1.79 K(o=0.17,f=-0.5) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0.402 X(o=0.4,f=-0.085) USER MOD Single : A 8 LYS NZ :NH3+ -159:sc= -0.0677 (180deg=-0.393) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot -40:sc= 0.227 USER MOD Single : A 14 MET CE :methyl 179:sc= -1.06 (180deg=-1.08) USER MOD Single : A 15 ASN : amide:sc= 1.09 K(o=1.1,f=-2.7!) USER MOD Single : A 22 ASN : amide:sc= 0.894 K(o=0.89,f=-0.29) USER MOD Single : A 24 ASN : amide:sc= -2.18 K(o=-2.2,f=-6.9!) USER MOD Single : A 29 LYS NZ :NH3+ 144:sc= 1.13 (180deg=0.135) USER MOD Single : A 30 LYS NZ :NH3+ -143:sc= 0.0707 (180deg=-0.0273) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -30:sc= 0.282 USER MOD Single : A 39 LYS NZ :NH3+ -165:sc= 0.987 (180deg=0.719) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 CYS SG : rot 35:sc= -0.0237 USER MOD Single : A 57 TYR OH : rot -7:sc= 0.71 USER MOD Single : A 74 MET CE :methyl -135:sc= -0.0659 (180deg=-0.803) USER MOD Single : A 78 GLN : amide:sc= -0.702 K(o=-0.7,f=-2.3!) USER MOD Single : A 83 ASN : amide:sc= 0.811 K(o=0.81,f=-0.1) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.479 X(o=-0.48,f=-0.0091) USER MOD Single : A 94 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0918) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc=0.000563 USER MOD Single : A 104 MET CE :methyl 172:sc= 0 (180deg=-0.0342) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 A O2' : rot 25:sc= 0.159 USER MOD Single : B 1 A O5' : rot -75:sc= 0.0236 USER MOD Single : B 2 U O2' : rot 26:sc= 0.122 USER MOD Single : B 3 U O2' : rot -39:sc= 1.17 USER MOD Single : B 4 U O2' : rot 15:sc= 0.271 USER MOD Single : B 6 U O2' : rot 151:sc= 0.846 USER MOD Single : B 7 C O2' : rot 176:sc= 0 USER MOD Single : B 7 C O3' : rot 141:sc= 0.0773 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 1.092 10.190 -6.321 1.00 0.00 N ATOM 2 CA ALA A 2 0.461 11.266 -5.534 1.00 0.00 C ATOM 3 C ALA A 2 1.197 11.465 -4.211 1.00 0.00 C ATOM 4 O ALA A 2 2.139 10.728 -3.904 1.00 0.00 O ATOM 5 CB ALA A 2 -1.019 10.963 -5.297 1.00 0.00 C ATOM 0 HA ALA A 2 0.529 12.194 -6.102 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -1.467 11.768 -4.715 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.531 10.880 -6.255 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.115 10.024 -4.752 1.00 0.00 H new ATOM 12 N SER A 3 0.770 12.460 -3.428 1.00 0.00 N ATOM 13 CA SER A 3 1.388 12.788 -2.149 1.00 0.00 C ATOM 14 C SER A 3 1.283 11.629 -1.155 1.00 0.00 C ATOM 15 O SER A 3 0.630 10.622 -1.422 1.00 0.00 O ATOM 16 CB SER A 3 0.736 14.046 -1.576 1.00 0.00 C ATOM 17 OG SER A 3 0.847 15.105 -2.503 1.00 0.00 O ATOM 0 H SER A 3 -0.018 13.061 -3.669 1.00 0.00 H new ATOM 0 HA SER A 3 2.449 12.972 -2.319 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.314 13.854 -1.353 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.216 14.320 -0.637 1.00 0.00 H new ATOM 0 HG SER A 3 0.426 15.909 -2.133 1.00 0.00 H new ATOM 23 N ASN A 4 1.932 11.775 0.002 1.00 0.00 N ATOM 24 CA ASN A 4 1.984 10.739 1.025 1.00 0.00 C ATOM 25 C ASN A 4 1.110 11.082 2.235 1.00 0.00 C ATOM 26 O ASN A 4 1.376 10.610 3.338 1.00 0.00 O ATOM 27 CB ASN A 4 3.444 10.488 1.409 1.00 0.00 C ATOM 28 CG ASN A 4 4.124 11.748 1.925 1.00 0.00 C ATOM 29 OD1 ASN A 4 4.806 12.439 1.174 1.00 0.00 O ATOM 30 ND2 ASN A 4 3.946 12.061 3.204 1.00 0.00 N ATOM 0 H ASN A 4 2.439 12.624 0.253 1.00 0.00 H new ATOM 0 HA ASN A 4 1.568 9.817 0.620 1.00 0.00 H new ATOM 0 HB2 ASN A 4 3.489 9.713 2.174 1.00 0.00 H new ATOM 0 HB3 ASN A 4 3.987 10.112 0.542 1.00 0.00 H new ATOM 0 HD21 ASN A 4 4.383 12.898 3.590 1.00 0.00 H new ATOM 0 HD22 ASN A 4 3.373 11.464 3.800 1.00 0.00 H new ATOM 37 N VAL A 5 0.072 11.902 2.046 1.00 0.00 N ATOM 38 CA VAL A 5 -0.727 12.429 3.144 1.00 0.00 C ATOM 39 C VAL A 5 -2.184 12.027 2.980 1.00 0.00 C ATOM 40 O VAL A 5 -2.783 12.255 1.931 1.00 0.00 O ATOM 41 CB VAL A 5 -0.577 13.953 3.191 1.00 0.00 C ATOM 42 CG1 VAL A 5 -1.328 14.518 4.393 1.00 0.00 C ATOM 43 CG2 VAL A 5 0.900 14.326 3.288 1.00 0.00 C ATOM 0 H VAL A 5 -0.234 12.216 1.125 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.373 12.011 4.086 1.00 0.00 H new ATOM 0 HB VAL A 5 -0.997 14.376 2.278 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -1.214 15.602 4.416 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.385 14.266 4.313 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -0.921 14.091 5.310 1.00 0.00 H new ATOM 0 HG21 VAL A 5 1.000 15.411 3.321 1.00 0.00 H new ATOM 0 HG22 VAL A 5 1.325 13.895 4.194 1.00 0.00 H new ATOM 0 HG23 VAL A 5 1.431 13.939 2.418 1.00 0.00 H new ATOM 53 N THR A 6 -2.750 11.424 4.031 1.00 0.00 N ATOM 54 CA THR A 6 -4.118 10.928 4.004 1.00 0.00 C ATOM 55 C THR A 6 -4.778 10.978 5.385 1.00 0.00 C ATOM 56 O THR A 6 -5.771 10.290 5.601 1.00 0.00 O ATOM 57 CB THR A 6 -4.153 9.482 3.487 1.00 0.00 C ATOM 58 OG1 THR A 6 -3.407 8.654 4.348 1.00 0.00 O ATOM 59 CG2 THR A 6 -3.543 9.341 2.096 1.00 0.00 C ATOM 0 H THR A 6 -2.270 11.270 4.918 1.00 0.00 H new ATOM 0 HA THR A 6 -4.677 11.581 3.333 1.00 0.00 H new ATOM 0 HB THR A 6 -5.204 9.194 3.447 1.00 0.00 H new ATOM 0 HG1 THR A 6 -3.990 8.309 5.057 1.00 0.00 H new ATOM 0 HG21 THR A 6 -3.594 8.299 1.780 1.00 0.00 H new ATOM 0 HG22 THR A 6 -4.097 9.961 1.391 1.00 0.00 H new ATOM 0 HG23 THR A 6 -2.502 9.662 2.121 1.00 0.00 H new ATOM 67 N ASN A 7 -4.257 11.770 6.327 1.00 0.00 N ATOM 68 CA ASN A 7 -4.754 11.761 7.705 1.00 0.00 C ATOM 69 C ASN A 7 -5.279 13.119 8.181 1.00 0.00 C ATOM 70 O ASN A 7 -5.187 13.442 9.365 1.00 0.00 O ATOM 71 CB ASN A 7 -3.670 11.207 8.628 1.00 0.00 C ATOM 72 CG ASN A 7 -4.181 10.896 10.026 1.00 0.00 C ATOM 73 OD1 ASN A 7 -5.354 10.587 10.221 1.00 0.00 O ATOM 74 ND2 ASN A 7 -3.293 10.980 11.010 1.00 0.00 N ATOM 0 H ASN A 7 -3.492 12.424 6.160 1.00 0.00 H new ATOM 0 HA ASN A 7 -5.625 11.107 7.737 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -3.255 10.300 8.189 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -2.856 11.928 8.697 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -3.576 10.784 11.970 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -2.328 11.240 10.805 1.00 0.00 H new ATOM 81 N LYS A 8 -5.829 13.931 7.276 1.00 0.00 N ATOM 82 CA LYS A 8 -6.473 15.183 7.661 1.00 0.00 C ATOM 83 C LYS A 8 -7.810 14.878 8.336 1.00 0.00 C ATOM 84 O LYS A 8 -8.295 13.750 8.277 1.00 0.00 O ATOM 85 CB LYS A 8 -6.651 16.084 6.435 1.00 0.00 C ATOM 86 CG LYS A 8 -5.404 16.912 6.093 1.00 0.00 C ATOM 87 CD LYS A 8 -4.138 16.084 5.855 1.00 0.00 C ATOM 88 CE LYS A 8 -3.379 15.765 7.150 1.00 0.00 C ATOM 89 NZ LYS A 8 -2.830 16.986 7.772 1.00 0.00 N ATOM 0 H LYS A 8 -5.840 13.742 6.274 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.845 15.719 8.372 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.913 15.466 5.576 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -7.488 16.759 6.610 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -5.609 17.503 5.201 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -5.216 17.615 6.905 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -4.408 15.152 5.359 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -3.478 16.626 5.177 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -4.048 15.268 7.852 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -2.568 15.069 6.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -2.052 16.730 8.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -2.473 17.623 7.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -3.578 17.467 8.311 1.00 0.00 H new ATOM 103 N THR A 9 -8.413 15.875 8.984 1.00 0.00 N ATOM 104 CA THR A 9 -9.664 15.683 9.711 1.00 0.00 C ATOM 105 C THR A 9 -10.689 16.756 9.356 1.00 0.00 C ATOM 106 O THR A 9 -11.609 17.025 10.127 1.00 0.00 O ATOM 107 CB THR A 9 -9.415 15.608 11.221 1.00 0.00 C ATOM 108 OG1 THR A 9 -8.749 16.775 11.655 1.00 0.00 O ATOM 109 CG2 THR A 9 -8.561 14.385 11.557 1.00 0.00 C ATOM 0 H THR A 9 -8.051 16.828 9.019 1.00 0.00 H new ATOM 0 HA THR A 9 -10.087 14.727 9.401 1.00 0.00 H new ATOM 0 HB THR A 9 -10.376 15.524 11.729 1.00 0.00 H new ATOM 0 HG1 THR A 9 -8.594 16.723 12.621 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.392 14.344 12.633 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.078 13.481 11.236 1.00 0.00 H new ATOM 0 HG23 THR A 9 -7.603 14.457 11.042 1.00 0.00 H new ATOM 117 N ASP A 10 -10.540 17.376 8.181 1.00 0.00 N ATOM 118 CA ASP A 10 -11.460 18.398 7.712 1.00 0.00 C ATOM 119 C ASP A 10 -12.809 17.772 7.344 1.00 0.00 C ATOM 120 O ASP A 10 -12.864 16.595 6.985 1.00 0.00 O ATOM 121 CB ASP A 10 -10.844 19.128 6.519 1.00 0.00 C ATOM 122 CG ASP A 10 -9.615 19.930 6.938 1.00 0.00 C ATOM 123 OD1 ASP A 10 -9.811 21.053 7.454 1.00 0.00 O ATOM 124 OD2 ASP A 10 -8.491 19.415 6.743 1.00 0.00 O ATOM 0 H ASP A 10 -9.776 17.178 7.534 1.00 0.00 H new ATOM 0 HA ASP A 10 -11.638 19.121 8.508 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -10.566 18.406 5.751 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -11.583 19.795 6.076 1.00 0.00 H new ATOM 129 N PRO A 11 -13.899 18.549 7.431 1.00 0.00 N ATOM 130 CA PRO A 11 -15.262 18.078 7.243 1.00 0.00 C ATOM 131 C PRO A 11 -15.543 17.591 5.821 1.00 0.00 C ATOM 132 O PRO A 11 -16.626 17.065 5.564 1.00 0.00 O ATOM 133 CB PRO A 11 -16.153 19.267 7.600 1.00 0.00 C ATOM 134 CG PRO A 11 -15.264 20.477 7.321 1.00 0.00 C ATOM 135 CD PRO A 11 -13.891 19.968 7.734 1.00 0.00 C ATOM 0 HA PRO A 11 -15.451 17.208 7.872 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.058 19.286 6.993 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -16.469 19.233 8.643 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -15.291 20.769 6.271 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -15.567 21.348 7.902 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -13.101 20.482 7.187 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -13.710 20.142 8.795 1.00 0.00 H new ATOM 143 N ARG A 12 -14.591 17.757 4.895 1.00 0.00 N ATOM 144 CA ARG A 12 -14.730 17.256 3.530 1.00 0.00 C ATOM 145 C ARG A 12 -13.587 16.317 3.145 1.00 0.00 C ATOM 146 O ARG A 12 -13.644 15.685 2.094 1.00 0.00 O ATOM 147 CB ARG A 12 -14.899 18.427 2.556 1.00 0.00 C ATOM 148 CG ARG A 12 -13.659 19.322 2.431 1.00 0.00 C ATOM 149 CD ARG A 12 -12.646 18.772 1.425 1.00 0.00 C ATOM 150 NE ARG A 12 -11.508 19.691 1.274 1.00 0.00 N ATOM 151 CZ ARG A 12 -10.664 19.680 0.238 1.00 0.00 C ATOM 152 NH1 ARG A 12 -10.806 18.802 -0.753 1.00 0.00 N ATOM 153 NH2 ARG A 12 -9.667 20.556 0.189 1.00 0.00 N ATOM 0 H ARG A 12 -13.710 18.239 5.073 1.00 0.00 H new ATOM 0 HA ARG A 12 -15.633 16.649 3.472 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -15.150 18.033 1.571 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -15.743 19.036 2.880 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -13.965 20.323 2.125 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -13.183 19.418 3.407 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -12.290 17.797 1.757 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -13.130 18.623 0.460 1.00 0.00 H new ATOM 0 HE ARG A 12 -11.353 20.382 2.008 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -11.568 18.124 -0.729 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -10.153 18.807 -1.536 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -9.547 21.235 0.941 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -9.021 20.550 -0.600 1.00 0.00 H new ATOM 167 N SER A 13 -12.554 16.224 3.986 1.00 0.00 N ATOM 168 CA SER A 13 -11.440 15.311 3.760 1.00 0.00 C ATOM 169 C SER A 13 -11.701 13.970 4.438 1.00 0.00 C ATOM 170 O SER A 13 -11.148 12.951 4.034 1.00 0.00 O ATOM 171 CB SER A 13 -10.139 15.933 4.270 1.00 0.00 C ATOM 172 OG SER A 13 -10.094 15.877 5.682 1.00 0.00 O ATOM 0 H SER A 13 -12.470 16.778 4.838 1.00 0.00 H new ATOM 0 HA SER A 13 -11.343 15.135 2.689 1.00 0.00 H new ATOM 0 HB2 SER A 13 -9.284 15.403 3.850 1.00 0.00 H new ATOM 0 HB3 SER A 13 -10.067 16.968 3.937 1.00 0.00 H new ATOM 0 HG SER A 13 -10.982 16.077 6.046 1.00 0.00 H new ATOM 178 N MET A 14 -12.552 13.978 5.470 1.00 0.00 N ATOM 179 CA MET A 14 -12.947 12.776 6.187 1.00 0.00 C ATOM 180 C MET A 14 -13.885 11.923 5.342 1.00 0.00 C ATOM 181 O MET A 14 -14.098 10.753 5.655 1.00 0.00 O ATOM 182 CB MET A 14 -13.634 13.189 7.490 1.00 0.00 C ATOM 183 CG MET A 14 -12.597 13.570 8.546 1.00 0.00 C ATOM 184 SD MET A 14 -12.264 12.286 9.780 1.00 0.00 S ATOM 185 CE MET A 14 -11.931 10.853 8.719 1.00 0.00 C ATOM 0 H MET A 14 -12.985 14.829 5.828 1.00 0.00 H new ATOM 0 HA MET A 14 -12.063 12.178 6.405 1.00 0.00 H new ATOM 0 HB2 MET A 14 -14.300 14.032 7.305 1.00 0.00 H new ATOM 0 HB3 MET A 14 -14.252 12.370 7.858 1.00 0.00 H new ATOM 0 HG2 MET A 14 -11.663 13.823 8.044 1.00 0.00 H new ATOM 0 HG3 MET A 14 -12.936 14.469 9.060 1.00 0.00 H new ATOM 0 HE1 MET A 14 -11.692 9.989 9.339 1.00 0.00 H new ATOM 0 HE2 MET A 14 -12.812 10.634 8.116 1.00 0.00 H new ATOM 0 HE3 MET A 14 -11.089 11.074 8.064 1.00 0.00 H new ATOM 195 N ASN A 15 -14.444 12.492 4.270 1.00 0.00 N ATOM 196 CA ASN A 15 -15.354 11.779 3.389 1.00 0.00 C ATOM 197 C ASN A 15 -14.870 11.781 1.939 1.00 0.00 C ATOM 198 O ASN A 15 -15.559 11.258 1.068 1.00 0.00 O ATOM 199 CB ASN A 15 -16.779 12.320 3.538 1.00 0.00 C ATOM 200 CG ASN A 15 -16.815 13.833 3.650 1.00 0.00 C ATOM 201 OD1 ASN A 15 -16.906 14.540 2.653 1.00 0.00 O ATOM 202 ND2 ASN A 15 -16.743 14.335 4.878 1.00 0.00 N ATOM 0 H ASN A 15 -14.274 13.459 3.994 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.369 10.732 3.693 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.375 12.008 2.680 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.240 11.882 4.423 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -16.763 15.345 5.018 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.668 13.710 5.681 1.00 0.00 H new ATOM 209 N SER A 16 -13.696 12.360 1.674 1.00 0.00 N ATOM 210 CA SER A 16 -13.052 12.273 0.368 1.00 0.00 C ATOM 211 C SER A 16 -11.922 11.247 0.415 1.00 0.00 C ATOM 212 O SER A 16 -11.095 11.170 -0.494 1.00 0.00 O ATOM 213 CB SER A 16 -12.557 13.650 -0.079 1.00 0.00 C ATOM 214 OG SER A 16 -11.471 14.044 0.723 1.00 0.00 O ATOM 0 H SER A 16 -13.169 12.901 2.360 1.00 0.00 H new ATOM 0 HA SER A 16 -13.778 11.937 -0.372 1.00 0.00 H new ATOM 0 HB2 SER A 16 -12.256 13.617 -1.126 1.00 0.00 H new ATOM 0 HB3 SER A 16 -13.363 14.380 -0.002 1.00 0.00 H new ATOM 0 HG SER A 16 -11.154 14.925 0.435 1.00 0.00 H new ATOM 220 N ARG A 17 -11.891 10.457 1.494 1.00 0.00 N ATOM 221 CA ARG A 17 -10.842 9.486 1.772 1.00 0.00 C ATOM 222 C ARG A 17 -11.378 8.062 1.680 1.00 0.00 C ATOM 223 O ARG A 17 -12.576 7.831 1.821 1.00 0.00 O ATOM 224 CB ARG A 17 -10.305 9.800 3.163 1.00 0.00 C ATOM 225 CG ARG A 17 -9.111 8.929 3.563 1.00 0.00 C ATOM 226 CD ARG A 17 -8.602 9.402 4.920 1.00 0.00 C ATOM 227 NE ARG A 17 -8.344 10.842 4.865 1.00 0.00 N ATOM 228 CZ ARG A 17 -8.450 11.688 5.886 1.00 0.00 C ATOM 229 NH1 ARG A 17 -8.718 11.264 7.118 1.00 0.00 N ATOM 230 NH2 ARG A 17 -8.288 12.985 5.657 1.00 0.00 N ATOM 0 H ARG A 17 -12.615 10.480 2.212 1.00 0.00 H new ATOM 0 HA ARG A 17 -10.041 9.554 1.036 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -10.010 10.849 3.203 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -11.104 9.666 3.892 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -9.406 7.881 3.613 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -8.321 9.002 2.815 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -9.337 9.182 5.694 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -7.690 8.867 5.186 1.00 0.00 H new ATOM 0 HE ARG A 17 -8.058 11.230 3.966 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -8.848 10.268 7.298 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -8.794 11.935 7.883 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -8.087 13.315 4.713 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -8.365 13.652 6.425 1.00 0.00 H new ATOM 244 N VAL A 18 -10.472 7.112 1.442 1.00 0.00 N ATOM 245 CA VAL A 18 -10.804 5.701 1.324 1.00 0.00 C ATOM 246 C VAL A 18 -9.980 4.894 2.315 1.00 0.00 C ATOM 247 O VAL A 18 -8.757 5.033 2.360 1.00 0.00 O ATOM 248 CB VAL A 18 -10.519 5.223 -0.105 1.00 0.00 C ATOM 249 CG1 VAL A 18 -10.995 3.785 -0.281 1.00 0.00 C ATOM 250 CG2 VAL A 18 -11.204 6.104 -1.146 1.00 0.00 C ATOM 0 H VAL A 18 -9.478 7.308 1.325 1.00 0.00 H new ATOM 0 HA VAL A 18 -11.862 5.560 1.544 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.442 5.284 -0.258 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -10.788 3.455 -1.299 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -10.470 3.139 0.423 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -12.067 3.731 -0.093 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -10.977 5.731 -2.145 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -12.282 6.083 -0.988 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -10.843 7.128 -1.050 1.00 0.00 H new ATOM 260 N PHE A 19 -10.649 4.053 3.103 1.00 0.00 N ATOM 261 CA PHE A 19 -9.989 3.103 3.981 1.00 0.00 C ATOM 262 C PHE A 19 -9.907 1.775 3.238 1.00 0.00 C ATOM 263 O PHE A 19 -10.887 1.361 2.620 1.00 0.00 O ATOM 264 CB PHE A 19 -10.779 2.982 5.285 1.00 0.00 C ATOM 265 CG PHE A 19 -10.255 1.938 6.244 1.00 0.00 C ATOM 266 CD1 PHE A 19 -8.884 1.860 6.532 1.00 0.00 C ATOM 267 CD2 PHE A 19 -11.147 1.043 6.854 1.00 0.00 C ATOM 268 CE1 PHE A 19 -8.412 0.883 7.419 1.00 0.00 C ATOM 269 CE2 PHE A 19 -10.673 0.072 7.746 1.00 0.00 C ATOM 270 CZ PHE A 19 -9.304 -0.014 8.026 1.00 0.00 C ATOM 0 H PHE A 19 -11.667 4.016 3.146 1.00 0.00 H new ATOM 0 HA PHE A 19 -8.982 3.428 4.244 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.778 3.950 5.786 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -11.816 2.748 5.046 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -8.194 2.551 6.071 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -12.203 1.103 6.635 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.356 0.820 7.636 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -11.364 -0.611 8.218 1.00 0.00 H new ATOM 0 HZ PHE A 19 -8.936 -0.768 8.706 1.00 0.00 H new ATOM 280 N ILE A 20 -8.755 1.105 3.295 1.00 0.00 N ATOM 281 CA ILE A 20 -8.537 -0.151 2.592 1.00 0.00 C ATOM 282 C ILE A 20 -7.976 -1.165 3.581 1.00 0.00 C ATOM 283 O ILE A 20 -6.767 -1.267 3.758 1.00 0.00 O ATOM 284 CB ILE A 20 -7.582 0.069 1.410 1.00 0.00 C ATOM 285 CG1 ILE A 20 -8.108 1.176 0.487 1.00 0.00 C ATOM 286 CG2 ILE A 20 -7.428 -1.241 0.631 1.00 0.00 C ATOM 287 CD1 ILE A 20 -7.044 1.600 -0.528 1.00 0.00 C ATOM 0 H ILE A 20 -7.948 1.422 3.832 1.00 0.00 H new ATOM 0 HA ILE A 20 -9.475 -0.531 2.188 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.610 0.380 1.793 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.996 0.824 -0.038 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -8.410 2.037 1.083 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -6.750 -1.087 -0.209 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -7.022 -2.010 1.289 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -8.402 -1.559 0.258 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -7.445 2.386 -1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -6.167 1.974 -0.001 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -6.762 0.743 -1.139 1.00 0.00 H new ATOM 299 N GLY A 21 -8.866 -1.914 4.231 1.00 0.00 N ATOM 300 CA GLY A 21 -8.487 -2.881 5.250 1.00 0.00 C ATOM 301 C GLY A 21 -8.297 -4.289 4.692 1.00 0.00 C ATOM 302 O GLY A 21 -8.612 -4.561 3.533 1.00 0.00 O ATOM 0 H GLY A 21 -9.871 -1.864 4.063 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -7.561 -2.556 5.725 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -9.253 -2.903 6.025 1.00 0.00 H new ATOM 306 N ASN A 22 -7.775 -5.184 5.536 1.00 0.00 N ATOM 307 CA ASN A 22 -7.529 -6.589 5.227 1.00 0.00 C ATOM 308 C ASN A 22 -6.636 -6.780 3.994 1.00 0.00 C ATOM 309 O ASN A 22 -6.594 -7.865 3.416 1.00 0.00 O ATOM 310 CB ASN A 22 -8.863 -7.336 5.134 1.00 0.00 C ATOM 311 CG ASN A 22 -8.684 -8.837 5.312 1.00 0.00 C ATOM 312 OD1 ASN A 22 -8.510 -9.319 6.428 1.00 0.00 O ATOM 313 ND2 ASN A 22 -8.727 -9.592 4.221 1.00 0.00 N ATOM 0 H ASN A 22 -7.503 -4.937 6.488 1.00 0.00 H new ATOM 0 HA ASN A 22 -6.956 -7.028 6.044 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -9.545 -6.958 5.896 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -9.324 -7.137 4.167 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -8.614 -10.603 4.296 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -8.873 -9.161 3.308 1.00 0.00 H new ATOM 320 N LEU A 23 -5.917 -5.735 3.580 1.00 0.00 N ATOM 321 CA LEU A 23 -5.050 -5.795 2.415 1.00 0.00 C ATOM 322 C LEU A 23 -3.859 -6.713 2.705 1.00 0.00 C ATOM 323 O LEU A 23 -3.453 -6.847 3.861 1.00 0.00 O ATOM 324 CB LEU A 23 -4.637 -4.362 2.050 1.00 0.00 C ATOM 325 CG LEU A 23 -3.820 -4.252 0.762 1.00 0.00 C ATOM 326 CD1 LEU A 23 -4.567 -4.833 -0.435 1.00 0.00 C ATOM 327 CD2 LEU A 23 -3.553 -2.775 0.490 1.00 0.00 C ATOM 0 H LEU A 23 -5.923 -4.828 4.046 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.564 -6.224 1.555 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.535 -3.752 1.950 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.056 -3.943 2.872 1.00 0.00 H new ATOM 0 HG LEU A 23 -2.895 -4.814 0.893 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.952 -4.735 -1.330 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.780 -5.887 -0.254 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.503 -4.293 -0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.971 -2.673 -0.426 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -4.501 -2.249 0.378 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.997 -2.346 1.323 1.00 0.00 H new ATOM 339 N ASN A 24 -3.299 -7.342 1.669 1.00 0.00 N ATOM 340 CA ASN A 24 -2.199 -8.286 1.836 1.00 0.00 C ATOM 341 C ASN A 24 -0.948 -7.590 2.371 1.00 0.00 C ATOM 342 O ASN A 24 -0.271 -8.122 3.246 1.00 0.00 O ATOM 343 CB ASN A 24 -1.909 -8.960 0.495 1.00 0.00 C ATOM 344 CG ASN A 24 -1.374 -7.979 -0.541 1.00 0.00 C ATOM 345 OD1 ASN A 24 -1.938 -6.911 -0.756 1.00 0.00 O ATOM 346 ND2 ASN A 24 -0.274 -8.336 -1.189 1.00 0.00 N ATOM 0 H ASN A 24 -3.594 -7.211 0.701 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.489 -9.040 2.568 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -1.184 -9.761 0.642 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -2.822 -9.422 0.118 1.00 0.00 H new ATOM 0 HD21 ASN A 24 0.129 -7.715 -1.891 1.00 0.00 H new ATOM 0 HD22 ASN A 24 0.170 -9.232 -0.986 1.00 0.00 H new ATOM 353 N THR A 25 -0.656 -6.400 1.837 1.00 0.00 N ATOM 354 CA THR A 25 0.471 -5.544 2.212 1.00 0.00 C ATOM 355 C THR A 25 1.839 -6.229 2.207 1.00 0.00 C ATOM 356 O THR A 25 2.805 -5.634 2.685 1.00 0.00 O ATOM 357 CB THR A 25 0.183 -4.824 3.534 1.00 0.00 C ATOM 358 OG1 THR A 25 0.284 -5.711 4.622 1.00 0.00 O ATOM 359 CG2 THR A 25 -1.216 -4.218 3.512 1.00 0.00 C ATOM 0 H THR A 25 -1.226 -5.989 1.097 1.00 0.00 H new ATOM 0 HA THR A 25 0.555 -4.803 1.417 1.00 0.00 H new ATOM 0 HB THR A 25 0.924 -4.033 3.651 1.00 0.00 H new ATOM 0 HG1 THR A 25 0.224 -6.634 4.298 1.00 0.00 H new ATOM 0 HG21 THR A 25 -1.407 -3.710 4.457 1.00 0.00 H new ATOM 0 HG22 THR A 25 -1.289 -3.502 2.694 1.00 0.00 H new ATOM 0 HG23 THR A 25 -1.953 -5.009 3.370 1.00 0.00 H new ATOM 367 N LEU A 26 1.949 -7.455 1.683 1.00 0.00 N ATOM 368 CA LEU A 26 3.243 -8.123 1.547 1.00 0.00 C ATOM 369 C LEU A 26 3.757 -8.042 0.110 1.00 0.00 C ATOM 370 O LEU A 26 4.938 -8.272 -0.136 1.00 0.00 O ATOM 371 CB LEU A 26 3.163 -9.597 1.951 1.00 0.00 C ATOM 372 CG LEU A 26 2.574 -9.898 3.333 1.00 0.00 C ATOM 373 CD1 LEU A 26 3.047 -11.296 3.722 1.00 0.00 C ATOM 374 CD2 LEU A 26 3.011 -8.907 4.410 1.00 0.00 C ATOM 0 H LEU A 26 1.157 -8.002 1.347 1.00 0.00 H new ATOM 0 HA LEU A 26 3.931 -7.604 2.215 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.567 -10.123 1.205 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.168 -10.017 1.910 1.00 0.00 H new ATOM 0 HG LEU A 26 1.489 -9.820 3.269 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.650 -11.554 4.704 1.00 0.00 H new ATOM 0 HD12 LEU A 26 2.693 -12.018 2.986 1.00 0.00 H new ATOM 0 HD13 LEU A 26 4.136 -11.316 3.754 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.557 -9.181 5.362 1.00 0.00 H new ATOM 0 HD22 LEU A 26 4.097 -8.929 4.506 1.00 0.00 H new ATOM 0 HD23 LEU A 26 2.692 -7.903 4.131 1.00 0.00 H new ATOM 386 N VAL A 27 2.867 -7.716 -0.836 1.00 0.00 N ATOM 387 CA VAL A 27 3.195 -7.682 -2.254 1.00 0.00 C ATOM 388 C VAL A 27 2.730 -6.369 -2.885 1.00 0.00 C ATOM 389 O VAL A 27 3.160 -6.025 -3.986 1.00 0.00 O ATOM 390 CB VAL A 27 2.562 -8.890 -2.959 1.00 0.00 C ATOM 391 CG1 VAL A 27 3.164 -9.080 -4.353 1.00 0.00 C ATOM 392 CG2 VAL A 27 2.782 -10.177 -2.164 1.00 0.00 C ATOM 0 H VAL A 27 1.899 -7.469 -0.632 1.00 0.00 H new ATOM 0 HA VAL A 27 4.277 -7.738 -2.371 1.00 0.00 H new ATOM 0 HB VAL A 27 1.494 -8.688 -3.036 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.701 -9.941 -4.835 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.982 -8.188 -4.952 1.00 0.00 H new ATOM 0 HG13 VAL A 27 4.238 -9.246 -4.266 1.00 0.00 H new ATOM 0 HG21 VAL A 27 2.322 -11.013 -2.690 1.00 0.00 H new ATOM 0 HG22 VAL A 27 3.851 -10.360 -2.057 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.330 -10.077 -1.177 1.00 0.00 H new ATOM 402 N VAL A 28 1.852 -5.631 -2.197 1.00 0.00 N ATOM 403 CA VAL A 28 1.396 -4.331 -2.674 1.00 0.00 C ATOM 404 C VAL A 28 2.402 -3.273 -2.227 1.00 0.00 C ATOM 405 O VAL A 28 3.164 -3.498 -1.283 1.00 0.00 O ATOM 406 CB VAL A 28 -0.025 -4.054 -2.160 1.00 0.00 C ATOM 407 CG1 VAL A 28 0.015 -3.190 -0.901 1.00 0.00 C ATOM 408 CG2 VAL A 28 -0.870 -3.329 -3.206 1.00 0.00 C ATOM 0 H VAL A 28 1.445 -5.917 -1.307 1.00 0.00 H new ATOM 0 HA VAL A 28 1.343 -4.310 -3.762 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.473 -5.023 -1.940 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.002 -3.006 -0.554 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.576 -3.707 -0.123 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.499 -2.240 -1.127 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.868 -3.150 -2.807 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.403 -2.376 -3.455 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.943 -3.943 -4.104 1.00 0.00 H new ATOM 418 N LYS A 29 2.415 -2.120 -2.898 1.00 0.00 N ATOM 419 CA LYS A 29 3.312 -1.022 -2.566 1.00 0.00 C ATOM 420 C LYS A 29 2.605 0.316 -2.750 1.00 0.00 C ATOM 421 O LYS A 29 1.483 0.371 -3.250 1.00 0.00 O ATOM 422 CB LYS A 29 4.588 -1.073 -3.421 1.00 0.00 C ATOM 423 CG LYS A 29 4.357 -1.649 -4.820 1.00 0.00 C ATOM 424 CD LYS A 29 4.708 -3.140 -4.824 1.00 0.00 C ATOM 425 CE LYS A 29 4.128 -3.845 -6.049 1.00 0.00 C ATOM 426 NZ LYS A 29 4.571 -3.225 -7.311 1.00 0.00 N ATOM 0 H LYS A 29 1.800 -1.925 -3.688 1.00 0.00 H new ATOM 0 HA LYS A 29 3.600 -1.127 -1.520 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.996 -0.066 -3.513 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.338 -1.675 -2.907 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.317 -1.509 -5.115 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.970 -1.118 -5.549 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.791 -3.261 -4.812 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.325 -3.608 -3.917 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.426 -4.893 -6.037 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.039 -3.822 -5.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 4.708 -3.963 -8.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.850 -2.552 -7.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.468 -2.722 -7.155 1.00 0.00 H new ATOM 440 N LYS A 30 3.270 1.400 -2.338 1.00 0.00 N ATOM 441 CA LYS A 30 2.732 2.748 -2.448 1.00 0.00 C ATOM 442 C LYS A 30 2.391 3.071 -3.900 1.00 0.00 C ATOM 443 O LYS A 30 1.484 3.859 -4.150 1.00 0.00 O ATOM 444 CB LYS A 30 3.775 3.737 -1.906 1.00 0.00 C ATOM 445 CG LYS A 30 3.441 5.197 -2.232 1.00 0.00 C ATOM 446 CD LYS A 30 2.114 5.646 -1.610 1.00 0.00 C ATOM 447 CE LYS A 30 1.695 7.000 -2.184 1.00 0.00 C ATOM 448 NZ LYS A 30 2.651 8.070 -1.841 1.00 0.00 N ATOM 0 H LYS A 30 4.199 1.361 -1.918 1.00 0.00 H new ATOM 0 HA LYS A 30 1.814 2.827 -1.866 1.00 0.00 H new ATOM 0 HB2 LYS A 30 3.851 3.620 -0.825 1.00 0.00 H new ATOM 0 HB3 LYS A 30 4.752 3.492 -2.323 1.00 0.00 H new ATOM 0 HG2 LYS A 30 4.244 5.840 -1.871 1.00 0.00 H new ATOM 0 HG3 LYS A 30 3.393 5.323 -3.314 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.341 4.903 -1.808 1.00 0.00 H new ATOM 0 HD3 LYS A 30 2.217 5.718 -0.527 1.00 0.00 H new ATOM 0 HE2 LYS A 30 1.612 6.923 -3.268 1.00 0.00 H new ATOM 0 HE3 LYS A 30 0.707 7.263 -1.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 2.133 8.953 -1.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 3.184 7.800 -0.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 3.311 8.212 -2.632 1.00 0.00 H new ATOM 462 N SER A 31 3.114 2.470 -4.847 1.00 0.00 N ATOM 463 CA SER A 31 2.926 2.729 -6.265 1.00 0.00 C ATOM 464 C SER A 31 1.840 1.839 -6.872 1.00 0.00 C ATOM 465 O SER A 31 1.491 2.011 -8.039 1.00 0.00 O ATOM 466 CB SER A 31 4.261 2.544 -6.983 1.00 0.00 C ATOM 467 OG SER A 31 4.727 1.224 -6.794 1.00 0.00 O ATOM 0 H SER A 31 3.847 1.789 -4.646 1.00 0.00 H new ATOM 0 HA SER A 31 2.584 3.756 -6.391 1.00 0.00 H new ATOM 0 HB2 SER A 31 4.144 2.749 -8.047 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.992 3.256 -6.600 1.00 0.00 H new ATOM 0 HG SER A 31 5.583 1.110 -7.258 1.00 0.00 H new ATOM 473 N ASP A 32 1.302 0.895 -6.092 1.00 0.00 N ATOM 474 CA ASP A 32 0.226 0.038 -6.551 1.00 0.00 C ATOM 475 C ASP A 32 -1.121 0.570 -6.080 1.00 0.00 C ATOM 476 O ASP A 32 -2.085 0.549 -6.840 1.00 0.00 O ATOM 477 CB ASP A 32 0.460 -1.386 -6.035 1.00 0.00 C ATOM 478 CG ASP A 32 1.302 -2.208 -7.011 1.00 0.00 C ATOM 479 OD1 ASP A 32 2.280 -1.649 -7.558 1.00 0.00 O ATOM 480 OD2 ASP A 32 0.959 -3.394 -7.205 1.00 0.00 O ATOM 0 H ASP A 32 1.603 0.712 -5.135 1.00 0.00 H new ATOM 0 HA ASP A 32 0.214 0.025 -7.641 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.960 -1.345 -5.067 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.499 -1.879 -5.877 1.00 0.00 H new ATOM 485 N VAL A 33 -1.214 1.059 -4.839 1.00 0.00 N ATOM 486 CA VAL A 33 -2.489 1.551 -4.324 1.00 0.00 C ATOM 487 C VAL A 33 -2.902 2.800 -5.101 1.00 0.00 C ATOM 488 O VAL A 33 -4.087 3.021 -5.340 1.00 0.00 O ATOM 489 CB VAL A 33 -2.374 1.825 -2.821 1.00 0.00 C ATOM 490 CG1 VAL A 33 -3.724 2.284 -2.267 1.00 0.00 C ATOM 491 CG2 VAL A 33 -1.962 0.557 -2.077 1.00 0.00 C ATOM 0 H VAL A 33 -0.434 1.123 -4.185 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.264 0.797 -4.461 1.00 0.00 H new ATOM 0 HB VAL A 33 -1.622 2.601 -2.677 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.632 2.476 -1.198 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -4.034 3.197 -2.775 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -4.469 1.506 -2.433 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -1.885 0.770 -1.011 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.710 -0.219 -2.239 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -0.997 0.214 -2.449 1.00 0.00 H new ATOM 501 N GLU A 34 -1.926 3.622 -5.505 1.00 0.00 N ATOM 502 CA GLU A 34 -2.196 4.816 -6.292 1.00 0.00 C ATOM 503 C GLU A 34 -2.360 4.484 -7.775 1.00 0.00 C ATOM 504 O GLU A 34 -2.514 5.385 -8.597 1.00 0.00 O ATOM 505 CB GLU A 34 -1.105 5.862 -6.053 1.00 0.00 C ATOM 506 CG GLU A 34 0.247 5.416 -6.603 1.00 0.00 C ATOM 507 CD GLU A 34 1.329 6.471 -6.364 1.00 0.00 C ATOM 508 OE1 GLU A 34 1.040 7.467 -5.660 1.00 0.00 O ATOM 509 OE2 GLU A 34 2.447 6.273 -6.892 1.00 0.00 O ATOM 0 H GLU A 34 -0.939 3.475 -5.295 1.00 0.00 H new ATOM 0 HA GLU A 34 -3.145 5.241 -5.964 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.395 6.802 -6.523 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.016 6.054 -4.984 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.541 4.479 -6.130 1.00 0.00 H new ATOM 0 HG3 GLU A 34 0.159 5.220 -7.672 1.00 0.00 H new ATOM 516 N ALA A 35 -2.331 3.191 -8.120 1.00 0.00 N ATOM 517 CA ALA A 35 -2.525 2.726 -9.486 1.00 0.00 C ATOM 518 C ALA A 35 -3.766 1.836 -9.596 1.00 0.00 C ATOM 519 O ALA A 35 -4.179 1.485 -10.702 1.00 0.00 O ATOM 520 CB ALA A 35 -1.271 1.972 -9.925 1.00 0.00 C ATOM 0 H ALA A 35 -2.171 2.439 -7.450 1.00 0.00 H new ATOM 0 HA ALA A 35 -2.688 3.581 -10.142 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.400 1.616 -10.947 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.410 2.639 -9.878 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -1.107 1.122 -9.263 1.00 0.00 H new ATOM 526 N ILE A 36 -4.364 1.473 -8.456 1.00 0.00 N ATOM 527 CA ILE A 36 -5.548 0.628 -8.405 1.00 0.00 C ATOM 528 C ILE A 36 -6.786 1.469 -8.095 1.00 0.00 C ATOM 529 O ILE A 36 -7.903 1.070 -8.420 1.00 0.00 O ATOM 530 CB ILE A 36 -5.307 -0.470 -7.362 1.00 0.00 C ATOM 531 CG1 ILE A 36 -4.194 -1.401 -7.859 1.00 0.00 C ATOM 532 CG2 ILE A 36 -6.567 -1.296 -7.101 1.00 0.00 C ATOM 533 CD1 ILE A 36 -3.583 -2.197 -6.707 1.00 0.00 C ATOM 0 H ILE A 36 -4.031 1.764 -7.537 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.731 0.156 -9.370 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.021 0.013 -6.428 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.596 -2.087 -8.605 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.418 -0.814 -8.351 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.352 -2.062 -6.356 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.359 -0.644 -6.733 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -6.889 -1.771 -8.028 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.797 -2.848 -7.091 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.160 -1.510 -5.974 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.356 -2.802 -6.233 1.00 0.00 H new ATOM 545 N PHE A 37 -6.595 2.635 -7.471 1.00 0.00 N ATOM 546 CA PHE A 37 -7.694 3.520 -7.108 1.00 0.00 C ATOM 547 C PHE A 37 -7.712 4.783 -7.973 1.00 0.00 C ATOM 548 O PHE A 37 -8.686 5.531 -7.953 1.00 0.00 O ATOM 549 CB PHE A 37 -7.590 3.833 -5.615 1.00 0.00 C ATOM 550 CG PHE A 37 -7.933 2.653 -4.731 1.00 0.00 C ATOM 551 CD1 PHE A 37 -7.069 1.550 -4.661 1.00 0.00 C ATOM 552 CD2 PHE A 37 -9.125 2.659 -3.994 1.00 0.00 C ATOM 553 CE1 PHE A 37 -7.408 0.444 -3.873 1.00 0.00 C ATOM 554 CE2 PHE A 37 -9.464 1.552 -3.200 1.00 0.00 C ATOM 555 CZ PHE A 37 -8.604 0.445 -3.138 1.00 0.00 C ATOM 0 H PHE A 37 -5.675 2.987 -7.206 1.00 0.00 H new ATOM 0 HA PHE A 37 -8.646 3.024 -7.299 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -6.576 4.164 -5.390 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.256 4.662 -5.377 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -6.142 1.554 -5.215 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -9.782 3.515 -4.037 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -6.749 -0.411 -3.830 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -10.386 1.552 -2.637 1.00 0.00 H new ATOM 0 HZ PHE A 37 -8.862 -0.406 -2.525 1.00 0.00 H new ATOM 565 N SER A 38 -6.652 5.038 -8.745 1.00 0.00 N ATOM 566 CA SER A 38 -6.601 6.218 -9.600 1.00 0.00 C ATOM 567 C SER A 38 -7.542 6.080 -10.802 1.00 0.00 C ATOM 568 O SER A 38 -7.762 7.041 -11.534 1.00 0.00 O ATOM 569 CB SER A 38 -5.157 6.459 -10.038 1.00 0.00 C ATOM 570 OG SER A 38 -5.055 7.651 -10.792 1.00 0.00 O ATOM 0 H SER A 38 -5.824 4.444 -8.793 1.00 0.00 H new ATOM 0 HA SER A 38 -6.947 7.083 -9.035 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.512 6.521 -9.162 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.807 5.616 -10.633 1.00 0.00 H new ATOM 0 HG SER A 38 -5.894 7.806 -11.274 1.00 0.00 H new ATOM 576 N LYS A 39 -8.103 4.885 -11.013 1.00 0.00 N ATOM 577 CA LYS A 39 -9.053 4.632 -12.092 1.00 0.00 C ATOM 578 C LYS A 39 -10.468 5.066 -11.707 1.00 0.00 C ATOM 579 O LYS A 39 -11.365 5.052 -12.549 1.00 0.00 O ATOM 580 CB LYS A 39 -9.026 3.146 -12.465 1.00 0.00 C ATOM 581 CG LYS A 39 -9.528 2.283 -11.308 1.00 0.00 C ATOM 582 CD LYS A 39 -9.629 0.821 -11.740 1.00 0.00 C ATOM 583 CE LYS A 39 -10.180 0.001 -10.576 1.00 0.00 C ATOM 584 NZ LYS A 39 -10.408 -1.407 -10.962 1.00 0.00 N ATOM 0 H LYS A 39 -7.908 4.066 -10.437 1.00 0.00 H new ATOM 0 HA LYS A 39 -8.756 5.225 -12.957 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.646 2.977 -13.345 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -8.010 2.852 -12.729 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.851 2.372 -10.459 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -10.503 2.639 -10.976 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -10.281 0.728 -12.609 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.649 0.446 -12.035 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.482 0.041 -9.740 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -11.116 0.441 -10.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -11.008 -1.870 -10.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.881 -1.441 -11.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.496 -1.903 -11.021 1.00 0.00 H new ATOM 598 N TYR A 40 -10.671 5.449 -10.442 1.00 0.00 N ATOM 599 CA TYR A 40 -11.975 5.844 -9.926 1.00 0.00 C ATOM 600 C TYR A 40 -11.979 7.287 -9.421 1.00 0.00 C ATOM 601 O TYR A 40 -13.018 7.778 -8.982 1.00 0.00 O ATOM 602 CB TYR A 40 -12.392 4.872 -8.821 1.00 0.00 C ATOM 603 CG TYR A 40 -13.138 3.654 -9.316 1.00 0.00 C ATOM 604 CD1 TYR A 40 -14.307 3.818 -10.074 1.00 0.00 C ATOM 605 CD2 TYR A 40 -12.669 2.364 -9.018 1.00 0.00 C ATOM 606 CE1 TYR A 40 -15.016 2.698 -10.538 1.00 0.00 C ATOM 607 CE2 TYR A 40 -13.373 1.243 -9.476 1.00 0.00 C ATOM 608 CZ TYR A 40 -14.546 1.403 -10.241 1.00 0.00 C ATOM 609 OH TYR A 40 -15.222 0.308 -10.689 1.00 0.00 O ATOM 0 H TYR A 40 -9.926 5.492 -9.747 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.698 5.801 -10.741 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -11.501 4.545 -8.285 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -13.019 5.402 -8.104 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.664 4.811 -10.302 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.768 2.237 -8.437 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -15.917 2.828 -11.119 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.015 0.251 -9.242 1.00 0.00 H new ATOM 0 HH TYR A 40 -14.760 -0.505 -10.395 1.00 0.00 H new ATOM 619 N GLY A 41 -10.834 7.974 -9.475 1.00 0.00 N ATOM 620 CA GLY A 41 -10.778 9.362 -9.052 1.00 0.00 C ATOM 621 C GLY A 41 -9.363 9.920 -9.040 1.00 0.00 C ATOM 622 O GLY A 41 -8.390 9.172 -9.149 1.00 0.00 O ATOM 0 H GLY A 41 -9.948 7.591 -9.804 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -11.395 9.965 -9.718 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -11.206 9.450 -8.054 1.00 0.00 H new ATOM 626 N LYS A 42 -9.248 11.244 -8.905 1.00 0.00 N ATOM 627 CA LYS A 42 -7.964 11.918 -8.817 1.00 0.00 C ATOM 628 C LYS A 42 -7.420 11.771 -7.405 1.00 0.00 C ATOM 629 O LYS A 42 -7.999 12.304 -6.459 1.00 0.00 O ATOM 630 CB LYS A 42 -8.131 13.399 -9.187 1.00 0.00 C ATOM 631 CG LYS A 42 -6.887 14.221 -8.831 1.00 0.00 C ATOM 632 CD LYS A 42 -5.625 13.717 -9.530 1.00 0.00 C ATOM 633 CE LYS A 42 -4.426 14.480 -8.972 1.00 0.00 C ATOM 634 NZ LYS A 42 -3.174 14.042 -9.611 1.00 0.00 N ATOM 0 H LYS A 42 -10.049 11.874 -8.854 1.00 0.00 H new ATOM 0 HA LYS A 42 -7.258 11.469 -9.515 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -8.330 13.486 -10.255 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.997 13.808 -8.667 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -7.056 15.263 -9.102 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -6.735 14.193 -7.752 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.503 12.646 -9.366 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -5.702 13.868 -10.607 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -4.565 15.549 -9.132 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -4.362 14.325 -7.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -2.376 14.577 -9.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -3.032 13.027 -9.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -3.229 14.213 -10.635 1.00 0.00 H new ATOM 648 N ILE A 43 -6.305 11.053 -7.262 1.00 0.00 N ATOM 649 CA ILE A 43 -5.653 10.891 -5.974 1.00 0.00 C ATOM 650 C ILE A 43 -4.687 12.051 -5.759 1.00 0.00 C ATOM 651 O ILE A 43 -3.862 12.343 -6.625 1.00 0.00 O ATOM 652 CB ILE A 43 -4.948 9.528 -5.910 1.00 0.00 C ATOM 653 CG1 ILE A 43 -5.985 8.412 -6.077 1.00 0.00 C ATOM 654 CG2 ILE A 43 -4.226 9.388 -4.566 1.00 0.00 C ATOM 655 CD1 ILE A 43 -5.383 7.009 -5.975 1.00 0.00 C ATOM 0 H ILE A 43 -5.837 10.574 -8.031 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.388 10.908 -5.170 1.00 0.00 H new ATOM 0 HB ILE A 43 -4.214 9.453 -6.713 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.757 8.525 -5.316 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -6.474 8.521 -7.045 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -3.726 8.421 -4.521 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.488 10.183 -4.465 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -4.950 9.460 -3.755 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -6.170 6.265 -6.102 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.631 6.878 -6.753 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.919 6.883 -4.997 1.00 0.00 H new ATOM 667 N VAL A 44 -4.792 12.709 -4.604 1.00 0.00 N ATOM 668 CA VAL A 44 -3.925 13.820 -4.223 1.00 0.00 C ATOM 669 C VAL A 44 -3.157 13.488 -2.950 1.00 0.00 C ATOM 670 O VAL A 44 -2.472 14.340 -2.388 1.00 0.00 O ATOM 671 CB VAL A 44 -4.738 15.106 -4.070 1.00 0.00 C ATOM 672 CG1 VAL A 44 -5.219 15.572 -5.443 1.00 0.00 C ATOM 673 CG2 VAL A 44 -5.946 14.887 -3.163 1.00 0.00 C ATOM 0 H VAL A 44 -5.492 12.481 -3.898 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.195 13.982 -5.016 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.097 15.864 -3.619 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -5.799 16.489 -5.334 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.359 15.761 -6.085 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.844 14.799 -5.891 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.506 15.818 -3.072 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.588 14.118 -3.592 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.608 14.569 -2.177 1.00 0.00 H new ATOM 683 N GLY A 45 -3.273 12.238 -2.498 1.00 0.00 N ATOM 684 CA GLY A 45 -2.562 11.725 -1.336 1.00 0.00 C ATOM 685 C GLY A 45 -2.813 10.226 -1.234 1.00 0.00 C ATOM 686 O GLY A 45 -3.920 9.771 -1.513 1.00 0.00 O ATOM 0 H GLY A 45 -3.876 11.545 -2.941 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.494 11.924 -1.428 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.904 12.228 -0.431 1.00 0.00 H new ATOM 690 N CYS A 46 -1.809 9.446 -0.840 1.00 0.00 N ATOM 691 CA CYS A 46 -1.967 8.010 -0.689 1.00 0.00 C ATOM 692 C CYS A 46 -0.900 7.469 0.256 1.00 0.00 C ATOM 693 O CYS A 46 0.219 7.979 0.297 1.00 0.00 O ATOM 694 CB CYS A 46 -1.876 7.353 -2.069 1.00 0.00 C ATOM 695 SG CYS A 46 -1.939 5.549 -1.910 1.00 0.00 S ATOM 0 H CYS A 46 -0.875 9.791 -0.620 1.00 0.00 H new ATOM 0 HA CYS A 46 -2.941 7.780 -0.257 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -2.696 7.698 -2.699 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -0.949 7.650 -2.561 1.00 0.00 H new ATOM 0 HG CYS A 46 -2.723 5.227 -0.924 1.00 0.00 H new ATOM 701 N SER A 47 -1.247 6.433 1.015 1.00 0.00 N ATOM 702 CA SER A 47 -0.319 5.772 1.914 1.00 0.00 C ATOM 703 C SER A 47 -0.677 4.297 2.039 1.00 0.00 C ATOM 704 O SER A 47 -1.814 3.899 1.789 1.00 0.00 O ATOM 705 CB SER A 47 -0.347 6.463 3.281 1.00 0.00 C ATOM 706 OG SER A 47 -1.617 6.317 3.870 1.00 0.00 O ATOM 0 H SER A 47 -2.184 6.031 1.020 1.00 0.00 H new ATOM 0 HA SER A 47 0.692 5.842 1.512 1.00 0.00 H new ATOM 0 HB2 SER A 47 0.415 6.033 3.930 1.00 0.00 H new ATOM 0 HB3 SER A 47 -0.109 7.521 3.168 1.00 0.00 H new ATOM 0 HG SER A 47 -1.578 5.628 4.566 1.00 0.00 H new ATOM 712 N VAL A 48 0.296 3.475 2.427 1.00 0.00 N ATOM 713 CA VAL A 48 0.083 2.048 2.595 1.00 0.00 C ATOM 714 C VAL A 48 0.869 1.560 3.807 1.00 0.00 C ATOM 715 O VAL A 48 1.974 2.029 4.070 1.00 0.00 O ATOM 716 CB VAL A 48 0.419 1.306 1.295 1.00 0.00 C ATOM 717 CG1 VAL A 48 1.812 1.648 0.777 1.00 0.00 C ATOM 718 CG2 VAL A 48 0.303 -0.206 1.469 1.00 0.00 C ATOM 0 H VAL A 48 1.247 3.782 2.632 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.967 1.835 2.795 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.313 1.640 0.559 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.003 1.098 -0.145 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.874 2.718 0.580 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.556 1.373 1.525 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.548 -0.700 0.529 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.994 -0.537 2.244 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.716 -0.462 1.759 1.00 0.00 H new ATOM 728 N HIS A 49 0.284 0.613 4.539 1.00 0.00 N ATOM 729 CA HIS A 49 0.795 0.158 5.824 1.00 0.00 C ATOM 730 C HIS A 49 0.656 -1.357 5.924 1.00 0.00 C ATOM 731 O HIS A 49 0.339 -2.011 4.935 1.00 0.00 O ATOM 732 CB HIS A 49 -0.009 0.844 6.934 1.00 0.00 C ATOM 733 CG HIS A 49 -0.244 2.314 6.691 1.00 0.00 C ATOM 734 ND1 HIS A 49 0.557 3.359 7.153 1.00 0.00 N ATOM 735 CD2 HIS A 49 -1.286 2.825 5.976 1.00 0.00 C ATOM 736 CE1 HIS A 49 -0.027 4.479 6.694 1.00 0.00 C ATOM 737 NE2 HIS A 49 -1.128 4.188 5.978 1.00 0.00 N ATOM 0 H HIS A 49 -0.570 0.136 4.249 1.00 0.00 H new ATOM 0 HA HIS A 49 1.850 0.413 5.925 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -0.972 0.343 7.036 1.00 0.00 H new ATOM 0 HB3 HIS A 49 0.517 0.721 7.881 1.00 0.00 H new ATOM 0 HD1 HIS A 49 1.404 3.288 7.718 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -2.080 2.267 5.501 1.00 0.00 H new ATOM 0 HE1 HIS A 49 0.339 5.479 6.876 1.00 0.00 H new ATOM 745 N LYS A 50 0.890 -1.929 7.109 1.00 0.00 N ATOM 746 CA LYS A 50 0.666 -3.354 7.328 1.00 0.00 C ATOM 747 C LYS A 50 -0.824 -3.605 7.555 1.00 0.00 C ATOM 748 O LYS A 50 -1.441 -2.967 8.405 1.00 0.00 O ATOM 749 CB LYS A 50 1.480 -3.832 8.535 1.00 0.00 C ATOM 750 CG LYS A 50 2.990 -3.877 8.270 1.00 0.00 C ATOM 751 CD LYS A 50 3.452 -5.260 7.795 1.00 0.00 C ATOM 752 CE LYS A 50 2.893 -5.660 6.431 1.00 0.00 C ATOM 753 NZ LYS A 50 3.410 -4.790 5.359 1.00 0.00 N ATOM 0 H LYS A 50 1.233 -1.425 7.927 1.00 0.00 H new ATOM 0 HA LYS A 50 0.990 -3.913 6.450 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.286 -3.171 9.380 1.00 0.00 H new ATOM 0 HB3 LYS A 50 1.139 -4.826 8.823 1.00 0.00 H new ATOM 0 HG2 LYS A 50 3.248 -3.131 7.518 1.00 0.00 H new ATOM 0 HG3 LYS A 50 3.526 -3.610 9.181 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.541 -5.274 7.749 1.00 0.00 H new ATOM 0 HD3 LYS A 50 3.155 -6.006 8.532 1.00 0.00 H new ATOM 0 HE2 LYS A 50 3.156 -6.696 6.219 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.805 -5.605 6.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.150 -5.187 4.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.000 -3.839 5.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.446 -4.729 5.431 1.00 0.00 H new ATOM 767 N GLY A 51 -1.394 -4.536 6.790 1.00 0.00 N ATOM 768 CA GLY A 51 -2.782 -4.959 6.916 1.00 0.00 C ATOM 769 C GLY A 51 -3.804 -3.950 6.389 1.00 0.00 C ATOM 770 O GLY A 51 -4.968 -4.311 6.216 1.00 0.00 O ATOM 0 H GLY A 51 -0.890 -5.025 6.051 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.911 -5.900 6.382 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.994 -5.157 7.967 1.00 0.00 H new ATOM 774 N PHE A 52 -3.409 -2.700 6.126 1.00 0.00 N ATOM 775 CA PHE A 52 -4.329 -1.699 5.601 1.00 0.00 C ATOM 776 C PHE A 52 -3.594 -0.644 4.776 1.00 0.00 C ATOM 777 O PHE A 52 -2.365 -0.569 4.789 1.00 0.00 O ATOM 778 CB PHE A 52 -5.090 -1.020 6.744 1.00 0.00 C ATOM 779 CG PHE A 52 -4.213 -0.255 7.705 1.00 0.00 C ATOM 780 CD1 PHE A 52 -3.644 -0.900 8.812 1.00 0.00 C ATOM 781 CD2 PHE A 52 -3.958 1.104 7.482 1.00 0.00 C ATOM 782 CE1 PHE A 52 -2.816 -0.188 9.690 1.00 0.00 C ATOM 783 CE2 PHE A 52 -3.129 1.815 8.359 1.00 0.00 C ATOM 784 CZ PHE A 52 -2.554 1.169 9.461 1.00 0.00 C ATOM 0 H PHE A 52 -2.457 -2.362 6.270 1.00 0.00 H new ATOM 0 HA PHE A 52 -5.036 -2.213 4.950 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -5.826 -0.337 6.320 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -5.642 -1.779 7.299 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -3.844 -1.947 8.988 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -4.401 1.604 6.633 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -2.380 -0.686 10.544 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -2.933 2.863 8.185 1.00 0.00 H new ATOM 0 HZ PHE A 52 -1.910 1.716 10.133 1.00 0.00 H new ATOM 794 N ALA A 53 -4.361 0.176 4.057 1.00 0.00 N ATOM 795 CA ALA A 53 -3.848 1.282 3.268 1.00 0.00 C ATOM 796 C ALA A 53 -4.875 2.415 3.238 1.00 0.00 C ATOM 797 O ALA A 53 -6.018 2.234 3.659 1.00 0.00 O ATOM 798 CB ALA A 53 -3.524 0.786 1.863 1.00 0.00 C ATOM 0 H ALA A 53 -5.376 0.083 4.010 1.00 0.00 H new ATOM 0 HA ALA A 53 -2.934 1.672 3.716 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -3.138 1.612 1.265 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -2.773 -0.002 1.920 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.428 0.393 1.398 1.00 0.00 H new ATOM 804 N PHE A 54 -4.466 3.582 2.740 1.00 0.00 N ATOM 805 CA PHE A 54 -5.325 4.751 2.646 1.00 0.00 C ATOM 806 C PHE A 54 -5.114 5.489 1.330 1.00 0.00 C ATOM 807 O PHE A 54 -4.024 5.489 0.762 1.00 0.00 O ATOM 808 CB PHE A 54 -5.059 5.692 3.822 1.00 0.00 C ATOM 809 CG PHE A 54 -5.917 5.411 5.030 1.00 0.00 C ATOM 810 CD1 PHE A 54 -7.259 5.818 5.027 1.00 0.00 C ATOM 811 CD2 PHE A 54 -5.387 4.749 6.150 1.00 0.00 C ATOM 812 CE1 PHE A 54 -8.076 5.558 6.133 1.00 0.00 C ATOM 813 CE2 PHE A 54 -6.207 4.485 7.253 1.00 0.00 C ATOM 814 CZ PHE A 54 -7.550 4.886 7.243 1.00 0.00 C ATOM 0 H PHE A 54 -3.521 3.739 2.389 1.00 0.00 H new ATOM 0 HA PHE A 54 -6.360 4.412 2.681 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.010 5.615 4.107 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.227 6.719 3.499 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.663 6.334 4.168 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.351 4.445 6.160 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.109 5.875 6.130 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.804 3.971 8.113 1.00 0.00 H new ATOM 0 HZ PHE A 54 -8.181 4.676 8.094 1.00 0.00 H new ATOM 824 N VAL A 55 -6.183 6.128 0.854 1.00 0.00 N ATOM 825 CA VAL A 55 -6.155 6.941 -0.350 1.00 0.00 C ATOM 826 C VAL A 55 -6.957 8.209 -0.095 1.00 0.00 C ATOM 827 O VAL A 55 -8.010 8.167 0.533 1.00 0.00 O ATOM 828 CB VAL A 55 -6.723 6.157 -1.538 1.00 0.00 C ATOM 829 CG1 VAL A 55 -6.776 7.035 -2.788 1.00 0.00 C ATOM 830 CG2 VAL A 55 -5.844 4.947 -1.843 1.00 0.00 C ATOM 0 H VAL A 55 -7.099 6.092 1.302 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.128 7.208 -0.598 1.00 0.00 H new ATOM 0 HB VAL A 55 -7.729 5.833 -1.271 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.182 6.460 -3.620 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.413 7.899 -2.599 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.770 7.374 -3.038 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -6.259 4.399 -2.689 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.836 5.282 -2.087 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.808 4.294 -0.971 1.00 0.00 H new ATOM 840 N GLN A 56 -6.450 9.338 -0.589 1.00 0.00 N ATOM 841 CA GLN A 56 -7.061 10.640 -0.407 1.00 0.00 C ATOM 842 C GLN A 56 -7.400 11.227 -1.773 1.00 0.00 C ATOM 843 O GLN A 56 -6.510 11.555 -2.559 1.00 0.00 O ATOM 844 CB GLN A 56 -6.089 11.530 0.373 1.00 0.00 C ATOM 845 CG GLN A 56 -6.649 12.916 0.687 1.00 0.00 C ATOM 846 CD GLN A 56 -7.792 12.844 1.690 1.00 0.00 C ATOM 847 OE1 GLN A 56 -7.571 12.819 2.898 1.00 0.00 O ATOM 848 NE2 GLN A 56 -9.023 12.808 1.202 1.00 0.00 N ATOM 0 H GLN A 56 -5.589 9.366 -1.135 1.00 0.00 H new ATOM 0 HA GLN A 56 -7.988 10.564 0.162 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -5.824 11.034 1.307 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -5.169 11.640 -0.201 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -5.855 13.549 1.084 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -7.000 13.384 -0.233 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -9.173 12.830 0.193 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -9.821 12.758 1.835 1.00 0.00 H new ATOM 857 N TYR A 57 -8.698 11.352 -2.045 1.00 0.00 N ATOM 858 CA TYR A 57 -9.191 11.942 -3.277 1.00 0.00 C ATOM 859 C TYR A 57 -9.411 13.440 -3.094 1.00 0.00 C ATOM 860 O TYR A 57 -9.159 13.991 -2.022 1.00 0.00 O ATOM 861 CB TYR A 57 -10.496 11.272 -3.698 1.00 0.00 C ATOM 862 CG TYR A 57 -10.362 9.851 -4.186 1.00 0.00 C ATOM 863 CD1 TYR A 57 -9.448 9.535 -5.201 1.00 0.00 C ATOM 864 CD2 TYR A 57 -11.178 8.854 -3.637 1.00 0.00 C ATOM 865 CE1 TYR A 57 -9.385 8.230 -5.707 1.00 0.00 C ATOM 866 CE2 TYR A 57 -11.124 7.548 -4.144 1.00 0.00 C ATOM 867 CZ TYR A 57 -10.232 7.235 -5.186 1.00 0.00 C ATOM 868 OH TYR A 57 -10.197 5.971 -5.683 1.00 0.00 O ATOM 0 H TYR A 57 -9.436 11.044 -1.411 1.00 0.00 H new ATOM 0 HA TYR A 57 -8.447 11.788 -4.058 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -11.182 11.285 -2.851 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -10.953 11.868 -4.487 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -8.792 10.298 -5.593 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -11.848 9.091 -2.824 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -8.688 7.988 -6.495 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -11.767 6.783 -3.735 1.00 0.00 H new ATOM 0 HH TYR A 57 -9.619 5.946 -6.474 1.00 0.00 H new ATOM 878 N VAL A 58 -9.889 14.099 -4.152 1.00 0.00 N ATOM 879 CA VAL A 58 -10.132 15.534 -4.131 1.00 0.00 C ATOM 880 C VAL A 58 -11.505 15.838 -3.529 1.00 0.00 C ATOM 881 O VAL A 58 -11.716 16.921 -2.986 1.00 0.00 O ATOM 882 CB VAL A 58 -10.027 16.085 -5.560 1.00 0.00 C ATOM 883 CG1 VAL A 58 -10.319 17.583 -5.606 1.00 0.00 C ATOM 884 CG2 VAL A 58 -8.615 15.863 -6.096 1.00 0.00 C ATOM 0 H VAL A 58 -10.116 13.652 -5.040 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.382 16.019 -3.506 1.00 0.00 H new ATOM 0 HB VAL A 58 -10.763 15.558 -6.168 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -10.235 17.939 -6.633 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -11.328 17.768 -5.239 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.602 18.113 -4.979 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.545 16.256 -7.110 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.898 16.379 -5.457 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.392 14.796 -6.104 1.00 0.00 H new ATOM 894 N ASN A 59 -12.443 14.888 -3.619 1.00 0.00 N ATOM 895 CA ASN A 59 -13.804 15.093 -3.147 1.00 0.00 C ATOM 896 C ASN A 59 -14.463 13.783 -2.703 1.00 0.00 C ATOM 897 O ASN A 59 -13.894 12.702 -2.855 1.00 0.00 O ATOM 898 CB ASN A 59 -14.626 15.751 -4.261 1.00 0.00 C ATOM 899 CG ASN A 59 -14.700 14.869 -5.493 1.00 0.00 C ATOM 900 OD1 ASN A 59 -15.203 13.755 -5.441 1.00 0.00 O ATOM 901 ND2 ASN A 59 -14.198 15.360 -6.618 1.00 0.00 N ATOM 0 H ASN A 59 -12.275 13.965 -4.019 1.00 0.00 H new ATOM 0 HA ASN A 59 -13.768 15.743 -2.273 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -15.633 15.956 -3.898 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -14.181 16.710 -4.525 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -14.225 14.805 -7.473 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -13.785 16.293 -6.628 1.00 0.00 H new ATOM 908 N GLU A 60 -15.672 13.901 -2.153 1.00 0.00 N ATOM 909 CA GLU A 60 -16.444 12.788 -1.611 1.00 0.00 C ATOM 910 C GLU A 60 -16.957 11.859 -2.708 1.00 0.00 C ATOM 911 O GLU A 60 -17.080 10.652 -2.501 1.00 0.00 O ATOM 912 CB GLU A 60 -17.612 13.385 -0.823 1.00 0.00 C ATOM 913 CG GLU A 60 -18.710 12.357 -0.549 1.00 0.00 C ATOM 914 CD GLU A 60 -19.771 12.916 0.399 1.00 0.00 C ATOM 915 OE1 GLU A 60 -20.302 14.006 0.101 1.00 0.00 O ATOM 916 OE2 GLU A 60 -20.038 12.239 1.419 1.00 0.00 O ATOM 0 H GLU A 60 -16.152 14.797 -2.071 1.00 0.00 H new ATOM 0 HA GLU A 60 -15.807 12.180 -0.968 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -17.244 13.782 0.123 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -18.032 14.223 -1.379 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -19.178 12.062 -1.488 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -18.270 11.458 -0.116 1.00 0.00 H new ATOM 923 N ARG A 61 -17.252 12.423 -3.880 1.00 0.00 N ATOM 924 CA ARG A 61 -17.782 11.681 -5.013 1.00 0.00 C ATOM 925 C ARG A 61 -16.767 10.633 -5.476 1.00 0.00 C ATOM 926 O ARG A 61 -17.137 9.513 -5.825 1.00 0.00 O ATOM 927 CB ARG A 61 -18.137 12.728 -6.082 1.00 0.00 C ATOM 928 CG ARG A 61 -17.802 12.327 -7.518 1.00 0.00 C ATOM 929 CD ARG A 61 -18.695 11.189 -8.010 1.00 0.00 C ATOM 930 NE ARG A 61 -18.360 10.803 -9.385 1.00 0.00 N ATOM 931 CZ ARG A 61 -18.820 9.704 -9.985 1.00 0.00 C ATOM 932 NH1 ARG A 61 -19.631 8.864 -9.347 1.00 0.00 N ATOM 933 NH2 ARG A 61 -18.466 9.433 -11.238 1.00 0.00 N ATOM 0 H ARG A 61 -17.127 13.418 -4.066 1.00 0.00 H new ATOM 0 HA ARG A 61 -18.678 11.111 -4.767 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -19.204 12.940 -6.020 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -17.613 13.655 -5.848 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -17.918 13.190 -8.173 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -16.757 12.021 -7.576 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -18.585 10.327 -7.351 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -19.740 11.497 -7.961 1.00 0.00 H new ATOM 0 HE ARG A 61 -17.737 11.412 -9.915 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -19.910 9.056 -8.385 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -19.974 8.028 -9.820 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -17.843 10.065 -11.740 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -18.818 8.593 -11.697 1.00 0.00 H new ATOM 947 N ASN A 62 -15.484 10.994 -5.477 1.00 0.00 N ATOM 948 CA ASN A 62 -14.422 10.093 -5.900 1.00 0.00 C ATOM 949 C ASN A 62 -14.267 8.942 -4.902 1.00 0.00 C ATOM 950 O ASN A 62 -13.964 7.817 -5.294 1.00 0.00 O ATOM 951 CB ASN A 62 -13.127 10.901 -6.016 1.00 0.00 C ATOM 952 CG ASN A 62 -13.038 11.700 -7.313 1.00 0.00 C ATOM 953 OD1 ASN A 62 -12.013 11.690 -7.985 1.00 0.00 O ATOM 954 ND2 ASN A 62 -14.099 12.407 -7.686 1.00 0.00 N ATOM 0 H ASN A 62 -15.157 11.915 -5.186 1.00 0.00 H new ATOM 0 HA ASN A 62 -14.665 9.652 -6.867 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -13.054 11.584 -5.169 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -12.275 10.223 -5.954 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -14.070 12.955 -8.546 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -14.943 12.402 -7.113 1.00 0.00 H new ATOM 961 N ALA A 63 -14.474 9.208 -3.608 1.00 0.00 N ATOM 962 CA ALA A 63 -14.332 8.174 -2.594 1.00 0.00 C ATOM 963 C ALA A 63 -15.401 7.100 -2.739 1.00 0.00 C ATOM 964 O ALA A 63 -15.088 5.919 -2.633 1.00 0.00 O ATOM 965 CB ALA A 63 -14.402 8.794 -1.201 1.00 0.00 C ATOM 0 H ALA A 63 -14.738 10.124 -3.246 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.360 7.701 -2.733 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -14.295 8.012 -0.449 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -13.598 9.521 -1.086 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -15.363 9.292 -1.072 1.00 0.00 H new ATOM 971 N ARG A 64 -16.653 7.492 -2.985 1.00 0.00 N ATOM 972 CA ARG A 64 -17.738 6.528 -3.099 1.00 0.00 C ATOM 973 C ARG A 64 -17.646 5.768 -4.417 1.00 0.00 C ATOM 974 O ARG A 64 -18.228 4.693 -4.548 1.00 0.00 O ATOM 975 CB ARG A 64 -19.075 7.248 -2.940 1.00 0.00 C ATOM 976 CG ARG A 64 -19.141 7.897 -1.557 1.00 0.00 C ATOM 977 CD ARG A 64 -20.485 8.592 -1.374 1.00 0.00 C ATOM 978 NE ARG A 64 -20.517 9.364 -0.125 1.00 0.00 N ATOM 979 CZ ARG A 64 -20.614 8.842 1.103 1.00 0.00 C ATOM 980 NH1 ARG A 64 -20.719 7.531 1.292 1.00 0.00 N ATOM 981 NH2 ARG A 64 -20.602 9.648 2.159 1.00 0.00 N ATOM 0 H ARG A 64 -16.935 8.465 -3.108 1.00 0.00 H new ATOM 0 HA ARG A 64 -17.656 5.787 -2.303 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -19.187 8.006 -3.715 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -19.897 6.543 -3.063 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -19.005 7.141 -0.784 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -18.331 8.618 -1.445 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -20.673 9.254 -2.219 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -21.283 7.850 -1.367 1.00 0.00 H new ATOM 0 HE ARG A 64 -20.461 10.380 -0.200 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -20.727 6.899 0.491 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -20.792 7.156 2.238 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -20.519 10.656 2.030 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -20.676 9.258 3.099 1.00 0.00 H new ATOM 995 N ALA A 65 -16.919 6.316 -5.392 1.00 0.00 N ATOM 996 CA ALA A 65 -16.679 5.642 -6.657 1.00 0.00 C ATOM 997 C ALA A 65 -15.801 4.411 -6.446 1.00 0.00 C ATOM 998 O ALA A 65 -16.060 3.364 -7.039 1.00 0.00 O ATOM 999 CB ALA A 65 -15.991 6.611 -7.615 1.00 0.00 C ATOM 0 H ALA A 65 -16.484 7.236 -5.322 1.00 0.00 H new ATOM 0 HA ALA A 65 -17.631 5.319 -7.078 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -15.807 6.113 -8.567 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -16.631 7.478 -7.777 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -15.043 6.935 -7.186 1.00 0.00 H new ATOM 1005 N ALA A 66 -14.765 4.521 -5.605 1.00 0.00 N ATOM 1006 CA ALA A 66 -13.875 3.395 -5.352 1.00 0.00 C ATOM 1007 C ALA A 66 -14.336 2.560 -4.156 1.00 0.00 C ATOM 1008 O ALA A 66 -14.075 1.359 -4.111 1.00 0.00 O ATOM 1009 CB ALA A 66 -12.462 3.920 -5.133 1.00 0.00 C ATOM 0 H ALA A 66 -14.529 5.372 -5.095 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.893 2.736 -6.220 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -11.789 3.084 -4.943 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.132 4.457 -6.022 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -12.453 4.595 -4.277 1.00 0.00 H new ATOM 1015 N VAL A 67 -15.020 3.175 -3.188 1.00 0.00 N ATOM 1016 CA VAL A 67 -15.554 2.457 -2.036 1.00 0.00 C ATOM 1017 C VAL A 67 -16.675 1.516 -2.470 1.00 0.00 C ATOM 1018 O VAL A 67 -16.993 0.564 -1.760 1.00 0.00 O ATOM 1019 CB VAL A 67 -16.005 3.458 -0.964 1.00 0.00 C ATOM 1020 CG1 VAL A 67 -16.932 2.812 0.067 1.00 0.00 C ATOM 1021 CG2 VAL A 67 -14.779 3.996 -0.237 1.00 0.00 C ATOM 0 H VAL A 67 -15.216 4.176 -3.183 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.775 1.836 -1.594 1.00 0.00 H new ATOM 0 HB VAL A 67 -16.551 4.257 -1.465 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -17.227 3.556 0.807 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -17.820 2.426 -0.434 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -16.410 1.994 0.563 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -15.092 4.708 0.526 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -14.244 3.171 0.234 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -14.122 4.494 -0.950 1.00 0.00 H new ATOM 1031 N ALA A 68 -17.278 1.771 -3.634 1.00 0.00 N ATOM 1032 CA ALA A 68 -18.256 0.870 -4.217 1.00 0.00 C ATOM 1033 C ALA A 68 -17.739 0.212 -5.497 1.00 0.00 C ATOM 1034 O ALA A 68 -18.372 -0.712 -6.009 1.00 0.00 O ATOM 1035 CB ALA A 68 -19.550 1.639 -4.477 1.00 0.00 C ATOM 0 H ALA A 68 -17.098 2.606 -4.191 1.00 0.00 H new ATOM 0 HA ALA A 68 -18.448 0.062 -3.511 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -20.290 0.969 -4.915 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -19.932 2.037 -3.537 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -19.353 2.461 -5.165 1.00 0.00 H new ATOM 1041 N GLY A 69 -16.598 0.674 -6.021 1.00 0.00 N ATOM 1042 CA GLY A 69 -16.037 0.143 -7.252 1.00 0.00 C ATOM 1043 C GLY A 69 -14.981 -0.943 -7.026 1.00 0.00 C ATOM 1044 O GLY A 69 -14.790 -1.792 -7.896 1.00 0.00 O ATOM 0 H GLY A 69 -16.046 1.422 -5.601 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.843 -0.266 -7.862 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -15.591 0.959 -7.820 1.00 0.00 H new ATOM 1048 N GLU A 70 -14.300 -0.929 -5.877 1.00 0.00 N ATOM 1049 CA GLU A 70 -13.223 -1.874 -5.587 1.00 0.00 C ATOM 1050 C GLU A 70 -13.504 -2.703 -4.336 1.00 0.00 C ATOM 1051 O GLU A 70 -12.844 -3.714 -4.118 1.00 0.00 O ATOM 1052 CB GLU A 70 -11.910 -1.100 -5.411 1.00 0.00 C ATOM 1053 CG GLU A 70 -11.444 -0.427 -6.701 1.00 0.00 C ATOM 1054 CD GLU A 70 -10.954 -1.451 -7.723 1.00 0.00 C ATOM 1055 OE1 GLU A 70 -9.756 -1.806 -7.661 1.00 0.00 O ATOM 1056 OE2 GLU A 70 -11.771 -1.882 -8.565 1.00 0.00 O ATOM 0 H GLU A 70 -14.480 -0.264 -5.125 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.149 -2.567 -6.425 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.040 -0.343 -4.638 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -11.135 -1.782 -5.062 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -12.264 0.150 -7.128 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -10.642 0.276 -6.476 1.00 0.00 H new ATOM 1063 N ASP A 71 -14.466 -2.305 -3.501 1.00 0.00 N ATOM 1064 CA ASP A 71 -14.726 -3.024 -2.265 1.00 0.00 C ATOM 1065 C ASP A 71 -15.084 -4.484 -2.547 1.00 0.00 C ATOM 1066 O ASP A 71 -15.940 -4.772 -3.384 1.00 0.00 O ATOM 1067 CB ASP A 71 -15.837 -2.318 -1.493 1.00 0.00 C ATOM 1068 CG ASP A 71 -16.260 -3.125 -0.270 1.00 0.00 C ATOM 1069 OD1 ASP A 71 -15.351 -3.566 0.470 1.00 0.00 O ATOM 1070 OD2 ASP A 71 -17.485 -3.300 -0.084 1.00 0.00 O ATOM 0 H ASP A 71 -15.068 -1.498 -3.660 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.823 -3.027 -1.655 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -15.495 -1.331 -1.180 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -16.696 -2.165 -2.146 1.00 0.00 H new ATOM 1075 N GLY A 72 -14.420 -5.403 -1.841 1.00 0.00 N ATOM 1076 CA GLY A 72 -14.673 -6.827 -1.973 1.00 0.00 C ATOM 1077 C GLY A 72 -13.901 -7.456 -3.132 1.00 0.00 C ATOM 1078 O GLY A 72 -14.198 -8.588 -3.514 1.00 0.00 O ATOM 0 H GLY A 72 -13.693 -5.173 -1.163 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.400 -7.328 -1.045 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.740 -6.990 -2.121 1.00 0.00 H new ATOM 1082 N ARG A 73 -12.918 -6.746 -3.702 1.00 0.00 N ATOM 1083 CA ARG A 73 -12.144 -7.276 -4.822 1.00 0.00 C ATOM 1084 C ARG A 73 -10.908 -8.021 -4.333 1.00 0.00 C ATOM 1085 O ARG A 73 -10.480 -7.826 -3.199 1.00 0.00 O ATOM 1086 CB ARG A 73 -11.770 -6.170 -5.810 1.00 0.00 C ATOM 1087 CG ARG A 73 -10.540 -5.363 -5.378 1.00 0.00 C ATOM 1088 CD ARG A 73 -9.959 -4.615 -6.573 1.00 0.00 C ATOM 1089 NE ARG A 73 -9.264 -5.545 -7.471 1.00 0.00 N ATOM 1090 CZ ARG A 73 -8.518 -5.171 -8.513 1.00 0.00 C ATOM 1091 NH1 ARG A 73 -8.380 -3.887 -8.828 1.00 0.00 N ATOM 1092 NH2 ARG A 73 -7.906 -6.096 -9.246 1.00 0.00 N ATOM 0 H ARG A 73 -12.645 -5.809 -3.405 1.00 0.00 H new ATOM 0 HA ARG A 73 -12.774 -7.991 -5.351 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -11.580 -6.614 -6.787 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -12.617 -5.494 -5.926 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -10.816 -4.656 -4.595 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.788 -6.029 -4.955 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -10.757 -4.105 -7.114 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.267 -3.847 -6.228 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.357 -6.544 -7.287 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -8.847 -3.172 -8.271 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -7.807 -3.617 -9.627 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -8.008 -7.083 -9.011 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.334 -5.818 -10.044 1.00 0.00 H new ATOM 1106 N MET A 74 -10.332 -8.867 -5.189 1.00 0.00 N ATOM 1107 CA MET A 74 -9.109 -9.574 -4.854 1.00 0.00 C ATOM 1108 C MET A 74 -7.896 -8.867 -5.451 1.00 0.00 C ATOM 1109 O MET A 74 -7.928 -8.412 -6.593 1.00 0.00 O ATOM 1110 CB MET A 74 -9.202 -11.030 -5.304 1.00 0.00 C ATOM 1111 CG MET A 74 -7.856 -11.725 -5.098 1.00 0.00 C ATOM 1112 SD MET A 74 -7.964 -13.526 -4.974 1.00 0.00 S ATOM 1113 CE MET A 74 -8.690 -13.598 -3.320 1.00 0.00 C ATOM 0 H MET A 74 -10.698 -9.075 -6.118 1.00 0.00 H new ATOM 0 HA MET A 74 -8.981 -9.570 -3.772 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.978 -11.546 -4.738 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.489 -11.077 -6.355 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.196 -11.468 -5.927 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.394 -11.336 -4.190 1.00 0.00 H new ATOM 0 HE1 MET A 74 -8.177 -14.358 -2.730 1.00 0.00 H new ATOM 0 HE2 MET A 74 -8.584 -12.628 -2.833 1.00 0.00 H new ATOM 0 HE3 MET A 74 -9.747 -13.851 -3.397 1.00 0.00 H new ATOM 1123 N ILE A 75 -6.825 -8.788 -4.655 1.00 0.00 N ATOM 1124 CA ILE A 75 -5.539 -8.240 -5.059 1.00 0.00 C ATOM 1125 C ILE A 75 -4.453 -9.079 -4.395 1.00 0.00 C ATOM 1126 O ILE A 75 -4.551 -9.400 -3.212 1.00 0.00 O ATOM 1127 CB ILE A 75 -5.422 -6.765 -4.643 1.00 0.00 C ATOM 1128 CG1 ILE A 75 -6.598 -5.947 -5.198 1.00 0.00 C ATOM 1129 CG2 ILE A 75 -4.095 -6.177 -5.137 1.00 0.00 C ATOM 1130 CD1 ILE A 75 -6.598 -4.507 -4.690 1.00 0.00 C ATOM 0 H ILE A 75 -6.835 -9.113 -3.688 1.00 0.00 H new ATOM 0 HA ILE A 75 -5.434 -8.276 -6.143 1.00 0.00 H new ATOM 0 HB ILE A 75 -5.449 -6.715 -3.554 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -6.553 -5.945 -6.287 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -7.535 -6.428 -4.918 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -4.025 -5.132 -4.835 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.266 -6.736 -4.703 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -4.049 -6.245 -6.224 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -7.449 -3.972 -5.112 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -6.671 -4.505 -3.602 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -5.674 -4.014 -4.993 1.00 0.00 H new ATOM 1142 N ALA A 76 -3.411 -9.432 -5.156 1.00 0.00 N ATOM 1143 CA ALA A 76 -2.293 -10.230 -4.665 1.00 0.00 C ATOM 1144 C ALA A 76 -2.701 -11.545 -3.981 1.00 0.00 C ATOM 1145 O ALA A 76 -1.885 -12.149 -3.286 1.00 0.00 O ATOM 1146 CB ALA A 76 -1.419 -9.365 -3.763 1.00 0.00 C ATOM 0 H ALA A 76 -3.324 -9.167 -6.137 1.00 0.00 H new ATOM 0 HA ALA A 76 -1.722 -10.552 -5.536 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -0.581 -9.956 -3.393 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -1.040 -8.515 -4.330 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -2.010 -9.005 -2.921 1.00 0.00 H new ATOM 1152 N GLY A 77 -3.944 -12.006 -4.164 1.00 0.00 N ATOM 1153 CA GLY A 77 -4.394 -13.286 -3.628 1.00 0.00 C ATOM 1154 C GLY A 77 -5.264 -13.156 -2.382 1.00 0.00 C ATOM 1155 O GLY A 77 -5.691 -14.170 -1.833 1.00 0.00 O ATOM 0 H GLY A 77 -4.660 -11.501 -4.686 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -4.954 -13.816 -4.398 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -3.523 -13.897 -3.390 1.00 0.00 H new ATOM 1159 N GLN A 78 -5.536 -11.929 -1.925 1.00 0.00 N ATOM 1160 CA GLN A 78 -6.426 -11.691 -0.793 1.00 0.00 C ATOM 1161 C GLN A 78 -7.452 -10.624 -1.149 1.00 0.00 C ATOM 1162 O GLN A 78 -7.232 -9.818 -2.051 1.00 0.00 O ATOM 1163 CB GLN A 78 -5.643 -11.263 0.451 1.00 0.00 C ATOM 1164 CG GLN A 78 -4.834 -12.412 1.063 1.00 0.00 C ATOM 1165 CD GLN A 78 -3.335 -12.167 0.947 1.00 0.00 C ATOM 1166 OE1 GLN A 78 -2.666 -11.864 1.933 1.00 0.00 O ATOM 1167 NE2 GLN A 78 -2.795 -12.292 -0.262 1.00 0.00 N ATOM 0 H GLN A 78 -5.145 -11.079 -2.330 1.00 0.00 H new ATOM 0 HA GLN A 78 -6.938 -12.627 -0.568 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.968 -10.448 0.188 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -6.337 -10.875 1.197 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -5.104 -12.529 2.113 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -5.090 -13.345 0.562 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -3.380 -12.545 -1.058 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -1.796 -12.135 -0.393 1.00 0.00 H new ATOM 1176 N VAL A 79 -8.580 -10.620 -0.433 1.00 0.00 N ATOM 1177 CA VAL A 79 -9.619 -9.614 -0.618 1.00 0.00 C ATOM 1178 C VAL A 79 -9.434 -8.515 0.416 1.00 0.00 C ATOM 1179 O VAL A 79 -8.991 -8.772 1.537 1.00 0.00 O ATOM 1180 CB VAL A 79 -11.014 -10.243 -0.528 1.00 0.00 C ATOM 1181 CG1 VAL A 79 -12.115 -9.188 -0.651 1.00 0.00 C ATOM 1182 CG2 VAL A 79 -11.195 -11.255 -1.657 1.00 0.00 C ATOM 0 H VAL A 79 -8.794 -11.311 0.286 1.00 0.00 H new ATOM 0 HA VAL A 79 -9.532 -9.180 -1.614 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.094 -10.727 0.445 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.090 -9.670 -0.583 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.013 -8.460 0.154 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.027 -8.681 -1.612 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.188 -11.701 -1.591 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.087 -10.752 -2.618 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.440 -12.036 -1.570 1.00 0.00 H new ATOM 1192 N LEU A 80 -9.778 -7.287 0.031 1.00 0.00 N ATOM 1193 CA LEU A 80 -9.639 -6.113 0.873 1.00 0.00 C ATOM 1194 C LEU A 80 -11.006 -5.485 1.109 1.00 0.00 C ATOM 1195 O LEU A 80 -11.845 -5.428 0.210 1.00 0.00 O ATOM 1196 CB LEU A 80 -8.624 -5.098 0.305 1.00 0.00 C ATOM 1197 CG LEU A 80 -8.347 -5.101 -1.204 1.00 0.00 C ATOM 1198 CD1 LEU A 80 -7.642 -6.370 -1.689 1.00 0.00 C ATOM 1199 CD2 LEU A 80 -9.623 -4.879 -2.008 1.00 0.00 C ATOM 0 H LEU A 80 -10.166 -7.083 -0.890 1.00 0.00 H new ATOM 0 HA LEU A 80 -9.232 -6.429 1.834 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.967 -4.100 0.576 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.675 -5.258 0.816 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.666 -4.267 -1.374 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -7.477 -6.306 -2.764 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.683 -6.471 -1.180 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -8.263 -7.238 -1.468 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.388 -4.887 -3.072 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -10.335 -5.674 -1.787 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -10.059 -3.917 -1.740 1.00 0.00 H new ATOM 1211 N ASP A 81 -11.221 -5.017 2.338 1.00 0.00 N ATOM 1212 CA ASP A 81 -12.470 -4.393 2.733 1.00 0.00 C ATOM 1213 C ASP A 81 -12.307 -2.883 2.613 1.00 0.00 C ATOM 1214 O ASP A 81 -11.563 -2.272 3.381 1.00 0.00 O ATOM 1215 CB ASP A 81 -12.819 -4.815 4.161 1.00 0.00 C ATOM 1216 CG ASP A 81 -14.198 -4.305 4.568 1.00 0.00 C ATOM 1217 OD1 ASP A 81 -15.185 -5.015 4.271 1.00 0.00 O ATOM 1218 OD2 ASP A 81 -14.254 -3.212 5.171 1.00 0.00 O ATOM 0 H ASP A 81 -10.528 -5.063 3.085 1.00 0.00 H new ATOM 0 HA ASP A 81 -13.289 -4.709 2.087 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -12.794 -5.902 4.238 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -12.068 -4.429 4.850 1.00 0.00 H new ATOM 1223 N ILE A 82 -13.000 -2.283 1.644 1.00 0.00 N ATOM 1224 CA ILE A 82 -12.872 -0.864 1.369 1.00 0.00 C ATOM 1225 C ILE A 82 -14.116 -0.136 1.851 1.00 0.00 C ATOM 1226 O ILE A 82 -15.234 -0.610 1.667 1.00 0.00 O ATOM 1227 CB ILE A 82 -12.609 -0.661 -0.124 1.00 0.00 C ATOM 1228 CG1 ILE A 82 -11.321 -1.389 -0.530 1.00 0.00 C ATOM 1229 CG2 ILE A 82 -12.502 0.823 -0.457 1.00 0.00 C ATOM 1230 CD1 ILE A 82 -11.242 -1.537 -2.043 1.00 0.00 C ATOM 0 H ILE A 82 -13.659 -2.769 1.036 1.00 0.00 H new ATOM 0 HA ILE A 82 -12.025 -0.442 1.910 1.00 0.00 H new ATOM 0 HB ILE A 82 -13.447 -1.077 -0.684 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -10.455 -0.835 -0.168 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -11.290 -2.372 -0.061 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -12.315 0.944 -1.524 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -13.434 1.323 -0.193 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -11.681 1.264 0.108 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -10.321 -2.056 -2.310 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -12.098 -2.111 -2.398 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -11.250 -0.550 -2.506 1.00 0.00 H new ATOM 1242 N ASN A 83 -13.920 1.031 2.470 1.00 0.00 N ATOM 1243 CA ASN A 83 -15.013 1.783 3.061 1.00 0.00 C ATOM 1244 C ASN A 83 -14.669 3.268 3.144 1.00 0.00 C ATOM 1245 O ASN A 83 -13.502 3.648 3.044 1.00 0.00 O ATOM 1246 CB ASN A 83 -15.290 1.207 4.455 1.00 0.00 C ATOM 1247 CG ASN A 83 -16.656 1.616 4.989 1.00 0.00 C ATOM 1248 OD1 ASN A 83 -17.644 0.924 4.765 1.00 0.00 O ATOM 1249 ND2 ASN A 83 -16.736 2.739 5.696 1.00 0.00 N ATOM 0 H ASN A 83 -13.006 1.472 2.571 1.00 0.00 H new ATOM 0 HA ASN A 83 -15.904 1.694 2.439 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -15.229 0.119 4.415 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -14.517 1.544 5.145 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -17.635 3.045 6.068 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -15.898 3.295 5.867 1.00 0.00 H new ATOM 1256 N LEU A 84 -15.685 4.112 3.328 1.00 0.00 N ATOM 1257 CA LEU A 84 -15.486 5.531 3.570 1.00 0.00 C ATOM 1258 C LEU A 84 -14.720 5.683 4.883 1.00 0.00 C ATOM 1259 O LEU A 84 -14.927 4.903 5.813 1.00 0.00 O ATOM 1260 CB LEU A 84 -16.856 6.216 3.651 1.00 0.00 C ATOM 1261 CG LEU A 84 -17.046 7.388 2.684 1.00 0.00 C ATOM 1262 CD1 LEU A 84 -16.079 8.514 3.024 1.00 0.00 C ATOM 1263 CD2 LEU A 84 -16.837 6.976 1.230 1.00 0.00 C ATOM 0 H LEU A 84 -16.664 3.827 3.313 1.00 0.00 H new ATOM 0 HA LEU A 84 -14.916 5.995 2.766 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -17.630 5.473 3.456 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -17.007 6.575 4.669 1.00 0.00 H new ATOM 0 HG LEU A 84 -18.075 7.728 2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -16.225 9.341 2.329 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -16.265 8.858 4.041 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -15.055 8.150 2.945 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -16.982 7.841 0.582 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -15.824 6.593 1.102 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -17.555 6.200 0.965 1.00 0.00 H new ATOM 1275 N ALA A 85 -13.835 6.677 4.977 1.00 0.00 N ATOM 1276 CA ALA A 85 -12.974 6.825 6.141 1.00 0.00 C ATOM 1277 C ALA A 85 -13.696 7.404 7.358 1.00 0.00 C ATOM 1278 O ALA A 85 -13.105 7.512 8.431 1.00 0.00 O ATOM 1279 CB ALA A 85 -11.775 7.689 5.762 1.00 0.00 C ATOM 0 H ALA A 85 -13.699 7.389 4.259 1.00 0.00 H new ATOM 0 HA ALA A 85 -12.646 5.829 6.439 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -11.123 7.806 6.628 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -11.222 7.210 4.954 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -12.122 8.669 5.434 1.00 0.00 H new ATOM 1285 N ALA A 86 -14.967 7.775 7.207 1.00 0.00 N ATOM 1286 CA ALA A 86 -15.766 8.317 8.295 1.00 0.00 C ATOM 1287 C ALA A 86 -17.116 7.609 8.404 1.00 0.00 C ATOM 1288 O ALA A 86 -18.011 8.094 9.094 1.00 0.00 O ATOM 1289 CB ALA A 86 -15.937 9.819 8.088 1.00 0.00 C ATOM 0 H ALA A 86 -15.469 7.706 6.322 1.00 0.00 H new ATOM 0 HA ALA A 86 -15.248 8.145 9.238 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -16.535 10.232 8.900 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -14.958 10.299 8.078 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -16.440 10.000 7.138 1.00 0.00 H new ATOM 1295 N GLU A 87 -17.270 6.466 7.728 1.00 0.00 N ATOM 1296 CA GLU A 87 -18.531 5.727 7.721 1.00 0.00 C ATOM 1297 C GLU A 87 -18.325 4.226 7.946 1.00 0.00 C ATOM 1298 O GLU A 87 -18.920 3.419 7.230 1.00 0.00 O ATOM 1299 CB GLU A 87 -19.287 5.985 6.413 1.00 0.00 C ATOM 1300 CG GLU A 87 -19.462 7.482 6.135 1.00 0.00 C ATOM 1301 CD GLU A 87 -20.306 7.737 4.887 1.00 0.00 C ATOM 1302 OE1 GLU A 87 -20.363 6.844 4.012 1.00 0.00 O ATOM 1303 OE2 GLU A 87 -20.899 8.837 4.811 1.00 0.00 O ATOM 0 H GLU A 87 -16.530 6.032 7.176 1.00 0.00 H new ATOM 0 HA GLU A 87 -19.130 6.091 8.556 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -18.748 5.524 5.586 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -20.266 5.508 6.460 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -19.933 7.958 6.995 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -18.483 7.945 6.011 1.00 0.00 H new ATOM 1310 N PRO A 88 -17.495 3.816 8.919 1.00 0.00 N ATOM 1311 CA PRO A 88 -17.161 2.417 9.133 1.00 0.00 C ATOM 1312 C PRO A 88 -18.405 1.609 9.494 1.00 0.00 C ATOM 1313 O PRO A 88 -19.238 2.046 10.289 1.00 0.00 O ATOM 1314 CB PRO A 88 -16.130 2.402 10.262 1.00 0.00 C ATOM 1315 CG PRO A 88 -16.410 3.705 11.015 1.00 0.00 C ATOM 1316 CD PRO A 88 -16.824 4.656 9.895 1.00 0.00 C ATOM 0 HA PRO A 88 -16.758 1.956 8.231 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -16.252 1.531 10.906 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -15.111 2.372 9.876 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -17.200 3.583 11.756 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.528 4.064 11.546 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.487 5.438 10.266 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.958 5.153 9.459 1.00 0.00 H new ATOM 1324 N LYS A 89 -18.515 0.419 8.894 1.00 0.00 N ATOM 1325 CA LYS A 89 -19.622 -0.504 9.128 1.00 0.00 C ATOM 1326 C LYS A 89 -19.099 -1.910 9.421 1.00 0.00 C ATOM 1327 O LYS A 89 -19.852 -2.776 9.866 1.00 0.00 O ATOM 1328 CB LYS A 89 -20.527 -0.473 7.892 1.00 0.00 C ATOM 1329 CG LYS A 89 -21.832 -1.245 8.108 1.00 0.00 C ATOM 1330 CD LYS A 89 -22.711 -1.187 6.857 1.00 0.00 C ATOM 1331 CE LYS A 89 -23.142 0.251 6.564 1.00 0.00 C ATOM 1332 NZ LYS A 89 -24.013 0.308 5.375 1.00 0.00 N ATOM 0 H LYS A 89 -17.829 0.069 8.226 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.197 -0.202 10.003 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.757 0.562 7.639 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -19.993 -0.898 7.042 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.609 -2.283 8.354 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -22.372 -0.825 8.957 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -22.165 -1.589 6.004 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -23.591 -1.814 6.996 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -23.670 0.659 7.426 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -22.261 0.873 6.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -24.292 1.294 5.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -23.499 -0.061 4.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -24.863 -0.268 5.539 1.00 0.00 H new ATOM 1346 N VAL A 90 -17.808 -2.146 9.178 1.00 0.00 N ATOM 1347 CA VAL A 90 -17.170 -3.434 9.425 1.00 0.00 C ATOM 1348 C VAL A 90 -16.731 -3.518 10.885 1.00 0.00 C ATOM 1349 O VAL A 90 -16.494 -2.498 11.530 1.00 0.00 O ATOM 1350 CB VAL A 90 -16.016 -3.641 8.433 1.00 0.00 C ATOM 1351 CG1 VAL A 90 -14.870 -2.661 8.687 1.00 0.00 C ATOM 1352 CG2 VAL A 90 -15.480 -5.071 8.501 1.00 0.00 C ATOM 0 H VAL A 90 -17.174 -1.441 8.801 1.00 0.00 H new ATOM 0 HA VAL A 90 -17.876 -4.248 9.260 1.00 0.00 H new ATOM 0 HB VAL A 90 -16.421 -3.455 7.438 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.073 -2.839 7.965 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -15.235 -1.639 8.581 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -14.485 -2.805 9.696 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -14.664 -5.188 7.788 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -15.114 -5.275 9.507 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -16.279 -5.771 8.256 1.00 0.00 H new ATOM 1362 N ASN A 91 -16.621 -4.743 11.403 1.00 0.00 N ATOM 1363 CA ASN A 91 -16.303 -4.984 12.803 1.00 0.00 C ATOM 1364 C ASN A 91 -14.804 -4.856 13.079 1.00 0.00 C ATOM 1365 O ASN A 91 -14.375 -5.008 14.222 1.00 0.00 O ATOM 1366 CB ASN A 91 -16.803 -6.370 13.202 1.00 0.00 C ATOM 1367 CG ASN A 91 -18.184 -6.675 12.640 1.00 0.00 C ATOM 1368 OD1 ASN A 91 -19.200 -6.386 13.266 1.00 0.00 O ATOM 1369 ND2 ASN A 91 -18.225 -7.264 11.448 1.00 0.00 N ATOM 0 H ASN A 91 -16.751 -5.595 10.858 1.00 0.00 H new ATOM 0 HA ASN A 91 -16.804 -4.224 13.403 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -16.097 -7.123 12.851 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -16.832 -6.443 14.289 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -19.124 -7.492 11.022 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -17.358 -7.488 10.960 1.00 0.00 H new ATOM 1376 N ARG A 92 -14.017 -4.583 12.033 1.00 0.00 N ATOM 1377 CA ARG A 92 -12.561 -4.543 12.100 1.00 0.00 C ATOM 1378 C ARG A 92 -12.015 -5.763 12.837 1.00 0.00 C ATOM 1379 O ARG A 92 -11.202 -5.642 13.751 1.00 0.00 O ATOM 1380 CB ARG A 92 -12.074 -3.214 12.688 1.00 0.00 C ATOM 1381 CG ARG A 92 -12.370 -2.080 11.699 1.00 0.00 C ATOM 1382 CD ARG A 92 -11.676 -0.779 12.112 1.00 0.00 C ATOM 1383 NE ARG A 92 -12.131 -0.327 13.431 1.00 0.00 N ATOM 1384 CZ ARG A 92 -11.361 -0.248 14.520 1.00 0.00 C ATOM 1385 NH1 ARG A 92 -10.076 -0.586 14.486 1.00 0.00 N ATOM 1386 NH2 ARG A 92 -11.887 0.177 15.667 1.00 0.00 N ATOM 0 H ARG A 92 -14.384 -4.381 11.103 1.00 0.00 H new ATOM 0 HA ARG A 92 -12.162 -4.593 11.087 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.571 -3.021 13.639 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -11.004 -3.264 12.891 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -12.038 -2.370 10.702 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -13.446 -1.917 11.642 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.597 -0.930 12.129 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.878 -0.006 11.371 1.00 0.00 H new ATOM 0 HE ARG A 92 -13.109 -0.052 13.524 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -9.658 -0.914 13.615 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -9.508 -0.517 15.330 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.872 0.440 15.710 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -11.305 0.240 16.502 1.00 0.00 H new ATOM 1400 N GLY A 93 -12.477 -6.947 12.421 1.00 0.00 N ATOM 1401 CA GLY A 93 -12.084 -8.217 13.016 1.00 0.00 C ATOM 1402 C GLY A 93 -10.661 -8.633 12.639 1.00 0.00 C ATOM 1403 O GLY A 93 -10.217 -9.714 13.023 1.00 0.00 O ATOM 0 H GLY A 93 -13.141 -7.045 11.653 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -12.161 -8.144 14.101 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.781 -8.993 12.698 1.00 0.00 H new ATOM 1407 N LYS A 94 -9.946 -7.780 11.895 1.00 0.00 N ATOM 1408 CA LYS A 94 -8.559 -7.985 11.500 1.00 0.00 C ATOM 1409 C LYS A 94 -8.307 -9.286 10.736 1.00 0.00 C ATOM 1410 O LYS A 94 -7.157 -9.711 10.625 1.00 0.00 O ATOM 1411 CB LYS A 94 -7.653 -7.871 12.725 1.00 0.00 C ATOM 1412 CG LYS A 94 -7.865 -6.550 13.466 1.00 0.00 C ATOM 1413 CD LYS A 94 -6.823 -6.384 14.575 1.00 0.00 C ATOM 1414 CE LYS A 94 -6.908 -7.519 15.599 1.00 0.00 C ATOM 1415 NZ LYS A 94 -8.194 -7.499 16.321 1.00 0.00 N ATOM 0 H LYS A 94 -10.334 -6.904 11.544 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.317 -7.196 10.788 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -7.849 -8.703 13.401 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -6.611 -7.951 12.415 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -7.795 -5.718 12.765 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -8.867 -6.523 13.894 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -5.825 -6.361 14.137 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.973 -5.428 15.077 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.788 -8.477 15.093 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.088 -7.430 16.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -8.161 -8.179 17.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -8.367 -6.544 16.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -8.962 -7.759 15.670 1.00 0.00 H new ATOM 1429 N ALA A 95 -9.356 -9.924 10.208 1.00 0.00 N ATOM 1430 CA ALA A 95 -9.202 -11.156 9.459 1.00 0.00 C ATOM 1431 C ALA A 95 -10.279 -11.289 8.386 1.00 0.00 C ATOM 1432 O ALA A 95 -11.382 -10.759 8.519 1.00 0.00 O ATOM 1433 CB ALA A 95 -9.247 -12.344 10.420 1.00 0.00 C ATOM 0 H ALA A 95 -10.320 -9.600 10.291 1.00 0.00 H new ATOM 0 HA ALA A 95 -8.237 -11.139 8.952 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -9.131 -13.271 9.858 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -8.438 -12.256 11.145 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -10.204 -12.353 10.942 1.00 0.00 H new ATOM 1439 N GLY A 96 -9.927 -12.012 7.325 1.00 0.00 N ATOM 1440 CA GLY A 96 -10.798 -12.310 6.197 1.00 0.00 C ATOM 1441 C GLY A 96 -10.128 -13.358 5.311 1.00 0.00 C ATOM 1442 O GLY A 96 -10.427 -13.461 4.123 1.00 0.00 O ATOM 0 H GLY A 96 -8.997 -12.418 7.226 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -11.761 -12.678 6.552 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -10.995 -11.404 5.624 1.00 0.00 H new ATOM 1446 N VAL A 97 -9.212 -14.129 5.905 1.00 0.00 N ATOM 1447 CA VAL A 97 -8.349 -15.064 5.198 1.00 0.00 C ATOM 1448 C VAL A 97 -9.112 -16.318 4.784 1.00 0.00 C ATOM 1449 O VAL A 97 -8.737 -16.981 3.816 1.00 0.00 O ATOM 1450 CB VAL A 97 -7.190 -15.446 6.126 1.00 0.00 C ATOM 1451 CG1 VAL A 97 -6.143 -16.262 5.373 1.00 0.00 C ATOM 1452 CG2 VAL A 97 -6.529 -14.193 6.709 1.00 0.00 C ATOM 0 H VAL A 97 -9.051 -14.116 6.912 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.976 -14.589 4.291 1.00 0.00 H new ATOM 0 HB VAL A 97 -7.599 -16.048 6.938 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.329 -16.523 6.050 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -6.600 -17.173 4.987 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -5.751 -15.674 4.544 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.709 -14.486 7.365 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.143 -13.575 5.899 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.264 -13.625 7.279 1.00 0.00 H new ATOM 1462 N LYS A 98 -10.181 -16.637 5.516 1.00 0.00 N ATOM 1463 CA LYS A 98 -10.975 -17.832 5.290 1.00 0.00 C ATOM 1464 C LYS A 98 -12.448 -17.470 5.122 1.00 0.00 C ATOM 1465 O LYS A 98 -12.877 -16.389 5.519 1.00 0.00 O ATOM 1466 CB LYS A 98 -10.786 -18.808 6.454 1.00 0.00 C ATOM 1467 CG LYS A 98 -9.335 -19.287 6.603 1.00 0.00 C ATOM 1468 CD LYS A 98 -8.886 -20.104 5.390 1.00 0.00 C ATOM 1469 CE LYS A 98 -7.453 -20.590 5.605 1.00 0.00 C ATOM 1470 NZ LYS A 98 -6.985 -21.389 4.459 1.00 0.00 N ATOM 0 H LYS A 98 -10.518 -16.063 6.289 1.00 0.00 H new ATOM 0 HA LYS A 98 -10.639 -18.313 4.372 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -11.101 -18.327 7.380 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -11.435 -19.671 6.307 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -8.678 -18.426 6.727 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -9.241 -19.892 7.505 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.552 -20.955 5.244 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -8.944 -19.496 4.487 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -6.793 -19.734 5.749 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -7.402 -21.189 6.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -6.010 -21.706 4.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -7.602 -22.218 4.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -7.013 -20.808 3.597 1.00 0.00 H new ATOM 1484 N ARG A 99 -13.224 -18.382 4.532 1.00 0.00 N ATOM 1485 CA ARG A 99 -14.654 -18.191 4.321 1.00 0.00 C ATOM 1486 C ARG A 99 -15.415 -18.452 5.621 1.00 0.00 C ATOM 1487 O ARG A 99 -14.854 -18.975 6.581 1.00 0.00 O ATOM 1488 CB ARG A 99 -15.129 -19.110 3.187 1.00 0.00 C ATOM 1489 CG ARG A 99 -16.356 -18.564 2.451 1.00 0.00 C ATOM 1490 CD ARG A 99 -16.011 -17.299 1.673 1.00 0.00 C ATOM 1491 NE ARG A 99 -17.174 -16.814 0.922 1.00 0.00 N ATOM 1492 CZ ARG A 99 -17.245 -15.615 0.337 1.00 0.00 C ATOM 1493 NH1 ARG A 99 -16.220 -14.766 0.398 1.00 0.00 N ATOM 1494 NH2 ARG A 99 -18.348 -15.260 -0.315 1.00 0.00 N ATOM 0 H ARG A 99 -12.873 -19.276 4.187 1.00 0.00 H new ATOM 0 HA ARG A 99 -14.853 -17.160 4.028 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -14.316 -19.249 2.474 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -15.365 -20.092 3.597 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -16.741 -19.321 1.768 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -17.148 -18.349 3.168 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -15.669 -16.526 2.361 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -15.189 -17.502 0.987 1.00 0.00 H new ATOM 0 HE ARG A 99 -17.981 -17.432 0.841 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -15.369 -15.029 0.895 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -16.286 -13.853 -0.053 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -19.138 -15.903 -0.368 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -18.404 -14.345 -0.762 1.00 0.00 H new ATOM 1508 N SER A 100 -16.697 -18.088 5.653 1.00 0.00 N ATOM 1509 CA SER A 100 -17.541 -18.294 6.819 1.00 0.00 C ATOM 1510 C SER A 100 -17.886 -19.769 6.964 1.00 0.00 C ATOM 1511 O SER A 100 -17.966 -20.487 5.972 1.00 0.00 O ATOM 1512 CB SER A 100 -18.819 -17.475 6.661 1.00 0.00 C ATOM 1513 OG SER A 100 -19.655 -17.663 7.784 1.00 0.00 O ATOM 0 H SER A 100 -17.175 -17.643 4.869 1.00 0.00 H new ATOM 0 HA SER A 100 -17.007 -17.973 7.713 1.00 0.00 H new ATOM 0 HB2 SER A 100 -18.573 -16.419 6.553 1.00 0.00 H new ATOM 0 HB3 SER A 100 -19.343 -17.774 5.753 1.00 0.00 H new ATOM 0 HG SER A 100 -20.472 -17.133 7.676 1.00 0.00 H new ATOM 1519 N ALA A 101 -18.098 -20.232 8.197 1.00 0.00 N ATOM 1520 CA ALA A 101 -18.437 -21.627 8.447 1.00 0.00 C ATOM 1521 C ALA A 101 -19.829 -21.958 7.900 1.00 0.00 C ATOM 1522 O ALA A 101 -20.218 -23.123 7.872 1.00 0.00 O ATOM 1523 CB ALA A 101 -18.359 -21.898 9.949 1.00 0.00 C ATOM 0 H ALA A 101 -18.040 -19.657 9.037 1.00 0.00 H new ATOM 0 HA ALA A 101 -17.725 -22.270 7.929 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -18.611 -22.940 10.144 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -17.348 -21.697 10.303 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -19.062 -21.250 10.473 1.00 0.00 H new ATOM 1529 N ALA A 102 -20.573 -20.934 7.469 1.00 0.00 N ATOM 1530 CA ALA A 102 -21.892 -21.086 6.873 1.00 0.00 C ATOM 1531 C ALA A 102 -21.831 -20.939 5.352 1.00 0.00 C ATOM 1532 O ALA A 102 -22.831 -21.170 4.669 1.00 0.00 O ATOM 1533 CB ALA A 102 -22.810 -20.029 7.476 1.00 0.00 C ATOM 0 H ALA A 102 -20.265 -19.963 7.528 1.00 0.00 H new ATOM 0 HA ALA A 102 -22.276 -22.084 7.085 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -23.806 -20.123 7.044 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -22.868 -20.170 8.555 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -22.413 -19.037 7.261 1.00 0.00 H new ATOM 1539 N GLU A 103 -20.666 -20.552 4.822 1.00 0.00 N ATOM 1540 CA GLU A 103 -20.464 -20.336 3.395 1.00 0.00 C ATOM 1541 C GLU A 103 -19.421 -21.296 2.828 1.00 0.00 C ATOM 1542 O GLU A 103 -19.107 -21.237 1.640 1.00 0.00 O ATOM 1543 CB GLU A 103 -20.050 -18.883 3.154 1.00 0.00 C ATOM 1544 CG GLU A 103 -21.116 -17.890 3.618 1.00 0.00 C ATOM 1545 CD GLU A 103 -22.426 -18.044 2.847 1.00 0.00 C ATOM 1546 OE1 GLU A 103 -22.361 -18.146 1.600 1.00 0.00 O ATOM 1547 OE2 GLU A 103 -23.488 -18.060 3.508 1.00 0.00 O ATOM 0 H GLU A 103 -19.831 -20.379 5.382 1.00 0.00 H new ATOM 0 HA GLU A 103 -21.402 -20.535 2.877 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -19.116 -18.682 3.679 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -19.856 -18.734 2.092 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -21.304 -18.033 4.682 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -20.741 -16.874 3.494 1.00 0.00 H new ATOM 1554 N MET A 104 -18.882 -22.182 3.670 1.00 0.00 N ATOM 1555 CA MET A 104 -17.919 -23.188 3.244 1.00 0.00 C ATOM 1556 C MET A 104 -18.632 -24.365 2.578 1.00 0.00 C ATOM 1557 O MET A 104 -19.858 -24.378 2.459 1.00 0.00 O ATOM 1558 CB MET A 104 -17.071 -23.652 4.427 1.00 0.00 C ATOM 1559 CG MET A 104 -15.931 -22.659 4.618 1.00 0.00 C ATOM 1560 SD MET A 104 -14.733 -23.134 5.880 1.00 0.00 S ATOM 1561 CE MET A 104 -13.440 -21.979 5.377 1.00 0.00 C ATOM 0 H MET A 104 -19.104 -22.218 4.665 1.00 0.00 H new ATOM 0 HA MET A 104 -17.251 -22.741 2.508 1.00 0.00 H new ATOM 0 HB2 MET A 104 -17.679 -23.710 5.330 1.00 0.00 H new ATOM 0 HB3 MET A 104 -16.677 -24.651 4.243 1.00 0.00 H new ATOM 0 HG2 MET A 104 -15.410 -22.535 3.668 1.00 0.00 H new ATOM 0 HG3 MET A 104 -16.351 -21.688 4.880 1.00 0.00 H new ATOM 0 HE1 MET A 104 -12.636 -21.991 6.112 1.00 0.00 H new ATOM 0 HE2 MET A 104 -13.047 -22.274 4.404 1.00 0.00 H new ATOM 0 HE3 MET A 104 -13.856 -20.974 5.310 1.00 0.00 H new ATOM 1571 N TYR A 105 -17.855 -25.360 2.141 1.00 0.00 N ATOM 1572 CA TYR A 105 -18.357 -26.529 1.434 1.00 0.00 C ATOM 1573 C TYR A 105 -19.278 -27.395 2.297 1.00 0.00 C ATOM 1574 O TYR A 105 -19.988 -28.250 1.767 1.00 0.00 O ATOM 1575 CB TYR A 105 -17.158 -27.357 0.970 1.00 0.00 C ATOM 1576 CG TYR A 105 -16.095 -26.539 0.273 1.00 0.00 C ATOM 1577 CD1 TYR A 105 -16.164 -26.321 -1.109 1.00 0.00 C ATOM 1578 CD2 TYR A 105 -15.038 -25.989 1.019 1.00 0.00 C ATOM 1579 CE1 TYR A 105 -15.184 -25.551 -1.752 1.00 0.00 C ATOM 1580 CE2 TYR A 105 -14.061 -25.208 0.387 1.00 0.00 C ATOM 1581 CZ TYR A 105 -14.128 -24.988 -1.003 1.00 0.00 C ATOM 1582 OH TYR A 105 -13.176 -24.235 -1.624 1.00 0.00 O ATOM 0 H TYR A 105 -16.844 -25.371 2.274 1.00 0.00 H new ATOM 0 HA TYR A 105 -18.954 -26.185 0.589 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -16.715 -27.855 1.832 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -17.506 -28.138 0.294 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -16.975 -26.747 -1.681 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -14.979 -26.169 2.082 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -15.237 -25.389 -2.818 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -13.258 -24.775 0.965 1.00 0.00 H new ATOM 0 HH TYR A 105 -12.523 -23.923 -0.963 1.00 0.00 H new ATOM 1592 N GLY A 106 -19.270 -27.177 3.615 1.00 0.00 N ATOM 1593 CA GLY A 106 -20.092 -27.923 4.557 1.00 0.00 C ATOM 1594 C GLY A 106 -19.612 -29.362 4.690 1.00 0.00 C ATOM 1595 O GLY A 106 -18.642 -29.752 4.043 1.00 0.00 O ATOM 1596 OXT GLY A 106 -20.171 -30.150 5.433 1.00 0.00 O ATOM 0 H GLY A 106 -18.684 -26.469 4.057 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -20.064 -27.436 5.532 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -21.130 -27.913 4.225 1.00 0.00 H new TER 1600 GLY A 106 ATOM 1601 O5' A B 1 3.688 -14.186 8.988 1.00 0.00 O ATOM 1602 C5' A B 1 3.272 -12.976 8.392 1.00 0.00 C ATOM 1603 C4' A B 1 3.571 -11.801 9.323 1.00 0.00 C ATOM 1604 O4' A B 1 4.954 -11.486 9.305 1.00 0.00 O ATOM 1605 C3' A B 1 2.883 -10.540 8.815 1.00 0.00 C ATOM 1606 O3' A B 1 2.810 -9.563 9.834 1.00 0.00 O ATOM 1607 C2' A B 1 3.850 -10.098 7.726 1.00 0.00 C ATOM 1608 O2' A B 1 3.817 -8.696 7.555 1.00 0.00 O ATOM 1609 C1' A B 1 5.205 -10.579 8.242 1.00 0.00 C ATOM 1610 N9 A B 1 5.998 -11.168 7.136 1.00 0.00 N ATOM 1611 C8 A B 1 6.215 -10.634 5.892 1.00 0.00 C ATOM 1612 N7 A B 1 6.951 -11.373 5.112 1.00 0.00 N ATOM 1613 C5 A B 1 7.256 -12.482 5.898 1.00 0.00 C ATOM 1614 C6 A B 1 8.019 -13.644 5.668 1.00 0.00 C ATOM 1615 N6 A B 1 8.642 -13.911 4.517 1.00 0.00 N ATOM 1616 N1 A B 1 8.130 -14.545 6.654 1.00 0.00 N ATOM 1617 C2 A B 1 7.524 -14.302 7.806 1.00 0.00 C ATOM 1618 N3 A B 1 6.785 -13.257 8.156 1.00 0.00 N ATOM 1619 C4 A B 1 6.684 -12.365 7.138 1.00 0.00 C ATOM 0 H5' A B 1 2.204 -13.016 8.176 1.00 0.00 H new ATOM 0 H5'' A B 1 3.785 -12.835 7.440 1.00 0.00 H new ATOM 0 H4' A B 1 3.230 -12.093 10.316 1.00 0.00 H new ATOM 0 H3' A B 1 1.857 -10.693 8.479 1.00 0.00 H new ATOM 0 H2' A B 1 3.610 -10.506 6.744 1.00 0.00 H new ATOM 0 HO2' A B 1 3.513 -8.272 8.385 1.00 0.00 H new ATOM 0 HO5' A B 1 4.664 -14.258 8.936 1.00 0.00 H new ATOM 0 H1' A B 1 5.809 -9.756 8.624 1.00 0.00 H new ATOM 0 H8 A B 1 5.810 -9.681 5.585 1.00 0.00 H new ATOM 0 H61 A B 1 9.179 -14.772 4.416 1.00 0.00 H new ATOM 0 H62 A B 1 8.580 -13.254 3.739 1.00 0.00 H new ATOM 0 H2 A B 1 7.648 -15.059 8.566 1.00 0.00 H new ATOM 1631 P U B 2 1.596 -9.565 10.885 1.00 0.00 P ATOM 1632 OP1 U B 2 1.932 -8.635 11.988 1.00 0.00 O ATOM 1633 OP2 U B 2 1.245 -10.970 11.195 1.00 0.00 O ATOM 1634 O5' U B 2 0.387 -8.927 10.029 1.00 0.00 O ATOM 1635 C5' U B 2 0.343 -7.539 9.763 1.00 0.00 C ATOM 1636 C4' U B 2 -0.948 -7.156 9.037 1.00 0.00 C ATOM 1637 O4' U B 2 -0.859 -7.483 7.655 1.00 0.00 O ATOM 1638 C3' U B 2 -2.156 -7.892 9.622 1.00 0.00 C ATOM 1639 O3' U B 2 -3.306 -7.067 9.568 1.00 0.00 O ATOM 1640 C2' U B 2 -2.280 -9.063 8.660 1.00 0.00 C ATOM 1641 O2' U B 2 -3.592 -9.587 8.633 1.00 0.00 O ATOM 1642 C1' U B 2 -1.858 -8.441 7.336 1.00 0.00 C ATOM 1643 N1 U B 2 -1.335 -9.508 6.457 1.00 0.00 N ATOM 1644 C2 U B 2 -2.139 -9.964 5.417 1.00 0.00 C ATOM 1645 O2 U B 2 -3.237 -9.474 5.163 1.00 0.00 O ATOM 1646 N3 U B 2 -1.633 -11.013 4.670 1.00 0.00 N ATOM 1647 C4 U B 2 -0.422 -11.651 4.877 1.00 0.00 C ATOM 1648 O4 U B 2 -0.087 -12.602 4.175 1.00 0.00 O ATOM 1649 C5 U B 2 0.356 -11.092 5.959 1.00 0.00 C ATOM 1650 C6 U B 2 -0.100 -10.047 6.688 1.00 0.00 C ATOM 0 H5' U B 2 1.203 -7.255 9.156 1.00 0.00 H new ATOM 0 H5'' U B 2 0.416 -6.984 10.698 1.00 0.00 H new ATOM 0 H4' U B 2 -1.079 -6.082 9.165 1.00 0.00 H new ATOM 0 H3' U B 2 -2.052 -8.183 10.667 1.00 0.00 H new ATOM 0 H2' U B 2 -1.672 -9.925 8.933 1.00 0.00 H new ATOM 0 HO2' U B 2 -4.229 -8.887 8.886 1.00 0.00 H new ATOM 0 H1' U B 2 -2.682 -7.960 6.809 1.00 0.00 H new ATOM 0 H3 U B 2 -2.205 -11.347 3.895 1.00 0.00 H new ATOM 0 H5 U B 2 1.321 -11.517 6.191 1.00 0.00 H new ATOM 0 H6 U B 2 0.523 -9.631 7.466 1.00 0.00 H new ATOM 1661 P U B 3 -3.596 -6.011 10.747 1.00 0.00 P ATOM 1662 OP1 U B 3 -2.307 -5.412 11.164 1.00 0.00 O ATOM 1663 OP2 U B 3 -4.452 -6.668 11.759 1.00 0.00 O ATOM 1664 O5' U B 3 -4.458 -4.859 10.025 1.00 0.00 O ATOM 1665 C5' U B 3 -5.728 -5.142 9.472 1.00 0.00 C ATOM 1666 C4' U B 3 -6.421 -3.818 9.157 1.00 0.00 C ATOM 1667 O4' U B 3 -7.446 -4.023 8.193 1.00 0.00 O ATOM 1668 C3' U B 3 -7.056 -3.257 10.430 1.00 0.00 C ATOM 1669 O3' U B 3 -7.019 -1.842 10.441 1.00 0.00 O ATOM 1670 C2' U B 3 -8.475 -3.795 10.292 1.00 0.00 C ATOM 1671 O2' U B 3 -9.434 -3.025 10.971 1.00 0.00 O ATOM 1672 C1' U B 3 -8.695 -3.727 8.789 1.00 0.00 C ATOM 1673 N1 U B 3 -9.747 -4.682 8.392 1.00 0.00 N ATOM 1674 C2 U B 3 -10.921 -4.193 7.831 1.00 0.00 C ATOM 1675 O2 U B 3 -11.095 -2.999 7.601 1.00 0.00 O ATOM 1676 N3 U B 3 -11.898 -5.129 7.537 1.00 0.00 N ATOM 1677 C4 U B 3 -11.809 -6.491 7.757 1.00 0.00 C ATOM 1678 O4 U B 3 -12.746 -7.229 7.473 1.00 0.00 O ATOM 1679 C5 U B 3 -10.549 -6.914 8.325 1.00 0.00 C ATOM 1680 C6 U B 3 -9.575 -6.019 8.606 1.00 0.00 C ATOM 0 H5' U B 3 -6.325 -5.726 10.172 1.00 0.00 H new ATOM 0 H5'' U B 3 -5.623 -5.740 8.567 1.00 0.00 H new ATOM 0 H4' U B 3 -5.681 -3.120 8.766 1.00 0.00 H new ATOM 0 H3' U B 3 -6.559 -3.541 11.358 1.00 0.00 H new ATOM 0 H2' U B 3 -8.584 -4.788 10.727 1.00 0.00 H new ATOM 0 HO2' U B 3 -9.065 -2.724 11.828 1.00 0.00 H new ATOM 0 H1' U B 3 -9.037 -2.745 8.464 1.00 0.00 H new ATOM 0 H3 U B 3 -12.762 -4.782 7.120 1.00 0.00 H new ATOM 0 H5 U B 3 -10.383 -7.962 8.528 1.00 0.00 H new ATOM 0 H6 U B 3 -8.637 -6.371 9.010 1.00 0.00 H new ATOM 1691 P U B 4 -7.037 -1.048 11.844 1.00 0.00 P ATOM 1692 OP1 U B 4 -5.686 -1.149 12.441 1.00 0.00 O ATOM 1693 OP2 U B 4 -8.210 -1.512 12.623 1.00 0.00 O ATOM 1694 O5' U B 4 -7.302 0.481 11.427 1.00 0.00 O ATOM 1695 C5' U B 4 -6.306 1.230 10.764 1.00 0.00 C ATOM 1696 C4' U B 4 -6.702 2.706 10.704 1.00 0.00 C ATOM 1697 O4' U B 4 -7.822 2.894 9.854 1.00 0.00 O ATOM 1698 C3' U B 4 -7.070 3.262 12.087 1.00 0.00 C ATOM 1699 O3' U B 4 -6.356 4.451 12.372 1.00 0.00 O ATOM 1700 C2' U B 4 -8.547 3.610 11.929 1.00 0.00 C ATOM 1701 O2' U B 4 -8.931 4.717 12.723 1.00 0.00 O ATOM 1702 C1' U B 4 -8.629 3.894 10.439 1.00 0.00 C ATOM 1703 N1 U B 4 -10.024 3.870 9.942 1.00 0.00 N ATOM 1704 C2 U B 4 -10.551 5.051 9.436 1.00 0.00 C ATOM 1705 O2 U B 4 -9.916 6.104 9.395 1.00 0.00 O ATOM 1706 N3 U B 4 -11.850 4.994 8.968 1.00 0.00 N ATOM 1707 C4 U B 4 -12.652 3.870 8.941 1.00 0.00 C ATOM 1708 O4 U B 4 -13.780 3.926 8.463 1.00 0.00 O ATOM 1709 C5 U B 4 -12.040 2.694 9.510 1.00 0.00 C ATOM 1710 C6 U B 4 -10.773 2.722 9.988 1.00 0.00 C ATOM 0 H5' U B 4 -6.163 0.844 9.755 1.00 0.00 H new ATOM 0 H5'' U B 4 -5.354 1.123 11.284 1.00 0.00 H new ATOM 0 H4' U B 4 -5.832 3.237 10.319 1.00 0.00 H new ATOM 0 H3' U B 4 -6.846 2.558 12.888 1.00 0.00 H new ATOM 0 H2' U B 4 -9.227 2.826 12.264 1.00 0.00 H new ATOM 0 HO2' U B 4 -8.131 5.186 13.039 1.00 0.00 H new ATOM 0 H1' U B 4 -8.281 4.895 10.185 1.00 0.00 H new ATOM 0 H3 U B 4 -12.253 5.860 8.610 1.00 0.00 H new ATOM 0 H5 U B 4 -12.603 1.773 9.556 1.00 0.00 H new ATOM 0 H6 U B 4 -10.346 1.826 10.412 1.00 0.00 H new ATOM 1721 P U B 5 -4.889 4.418 13.035 1.00 0.00 P ATOM 1722 OP1 U B 5 -4.537 3.017 13.351 1.00 0.00 O ATOM 1723 OP2 U B 5 -4.868 5.435 14.112 1.00 0.00 O ATOM 1724 O5' U B 5 -3.919 4.935 11.859 1.00 0.00 O ATOM 1725 C5' U B 5 -3.200 4.031 11.047 1.00 0.00 C ATOM 1726 C4' U B 5 -2.408 4.777 9.966 1.00 0.00 C ATOM 1727 O4' U B 5 -3.290 5.209 8.940 1.00 0.00 O ATOM 1728 C3' U B 5 -1.694 6.001 10.533 1.00 0.00 C ATOM 1729 O3' U B 5 -0.461 6.175 9.860 1.00 0.00 O ATOM 1730 C2' U B 5 -2.683 7.115 10.214 1.00 0.00 C ATOM 1731 O2' U B 5 -2.054 8.366 10.027 1.00 0.00 O ATOM 1732 C1' U B 5 -3.323 6.622 8.923 1.00 0.00 C ATOM 1733 N1 U B 5 -4.709 7.122 8.794 1.00 0.00 N ATOM 1734 C2 U B 5 -5.006 7.917 7.699 1.00 0.00 C ATOM 1735 O2 U B 5 -4.177 8.193 6.834 1.00 0.00 O ATOM 1736 N3 U B 5 -6.300 8.398 7.619 1.00 0.00 N ATOM 1737 C4 U B 5 -7.312 8.155 8.529 1.00 0.00 C ATOM 1738 O4 U B 5 -8.426 8.650 8.359 1.00 0.00 O ATOM 1739 C5 U B 5 -6.926 7.301 9.632 1.00 0.00 C ATOM 1740 C6 U B 5 -5.662 6.820 9.730 1.00 0.00 C ATOM 0 H5' U B 5 -3.890 3.329 10.579 1.00 0.00 H new ATOM 0 H5'' U B 5 -2.518 3.445 11.664 1.00 0.00 H new ATOM 0 H4' U B 5 -1.662 4.087 9.572 1.00 0.00 H new ATOM 0 H3' U B 5 -1.447 5.949 11.593 1.00 0.00 H new ATOM 0 H2' U B 5 -3.391 7.293 11.023 1.00 0.00 H new ATOM 0 HO2' U B 5 -1.307 8.453 10.655 1.00 0.00 H new ATOM 0 H1' U B 5 -2.772 6.999 8.061 1.00 0.00 H new ATOM 0 H3 U B 5 -6.528 8.985 6.817 1.00 0.00 H new ATOM 0 H5 U B 5 -7.654 7.044 10.387 1.00 0.00 H new ATOM 0 H6 U B 5 -5.401 6.185 10.564 1.00 0.00 H new ATOM 1751 P U B 6 0.793 6.887 10.589 1.00 0.00 P ATOM 1752 OP1 U B 6 1.400 5.911 11.522 1.00 0.00 O ATOM 1753 OP2 U B 6 0.352 8.208 11.096 1.00 0.00 O ATOM 1754 O5' U B 6 1.811 7.128 9.365 1.00 0.00 O ATOM 1755 C5' U B 6 2.417 6.025 8.725 1.00 0.00 C ATOM 1756 C4' U B 6 3.181 6.444 7.466 1.00 0.00 C ATOM 1757 O4' U B 6 2.327 7.154 6.577 1.00 0.00 O ATOM 1758 C3' U B 6 4.365 7.353 7.803 1.00 0.00 C ATOM 1759 O3' U B 6 5.408 7.135 6.870 1.00 0.00 O ATOM 1760 C2' U B 6 3.758 8.736 7.611 1.00 0.00 C ATOM 1761 O2' U B 6 4.749 9.696 7.290 1.00 0.00 O ATOM 1762 C1' U B 6 2.755 8.507 6.486 1.00 0.00 C ATOM 1763 N1 U B 6 1.635 9.464 6.623 1.00 0.00 N ATOM 1764 C2 U B 6 1.847 10.770 6.206 1.00 0.00 C ATOM 1765 O2 U B 6 2.925 11.155 5.754 1.00 0.00 O ATOM 1766 N3 U B 6 0.772 11.636 6.317 1.00 0.00 N ATOM 1767 C4 U B 6 -0.481 11.310 6.799 1.00 0.00 C ATOM 1768 O4 U B 6 -1.375 12.152 6.813 1.00 0.00 O ATOM 1769 C5 U B 6 -0.602 9.945 7.253 1.00 0.00 C ATOM 1770 C6 U B 6 0.434 9.081 7.156 1.00 0.00 C ATOM 0 H5' U B 6 1.653 5.295 8.460 1.00 0.00 H new ATOM 0 H5'' U B 6 3.100 5.534 9.418 1.00 0.00 H new ATOM 0 H4' U B 6 3.545 5.528 6.999 1.00 0.00 H new ATOM 0 H3' U B 6 4.794 7.195 8.792 1.00 0.00 H new ATOM 0 H2' U B 6 3.288 9.143 8.506 1.00 0.00 H new ATOM 0 HO2' U B 6 4.353 10.403 6.738 1.00 0.00 H new ATOM 0 H1' U B 6 3.195 8.677 5.503 1.00 0.00 H new ATOM 0 H3 U B 6 0.918 12.600 6.016 1.00 0.00 H new ATOM 0 H5 U B 6 -1.536 9.608 7.678 1.00 0.00 H new ATOM 0 H6 U B 6 0.311 8.067 7.507 1.00 0.00 H new ATOM 1781 P C B 7 6.407 5.877 7.005 1.00 0.00 P ATOM 1782 OP1 C B 7 7.007 5.625 5.673 1.00 0.00 O ATOM 1783 OP2 C B 7 5.696 4.782 7.704 1.00 0.00 O ATOM 1784 O5' C B 7 7.578 6.419 7.972 1.00 0.00 O ATOM 1785 C5' C B 7 7.352 6.611 9.354 1.00 0.00 C ATOM 1786 C4' C B 7 8.664 6.988 10.044 1.00 0.00 C ATOM 1787 O4' C B 7 9.021 8.325 9.728 1.00 0.00 O ATOM 1788 C3' C B 7 8.486 6.975 11.557 1.00 0.00 C ATOM 1789 O3' C B 7 9.760 6.931 12.178 1.00 0.00 O ATOM 1790 C2' C B 7 7.803 8.320 11.755 1.00 0.00 C ATOM 1791 O2' C B 7 7.976 8.806 13.073 1.00 0.00 O ATOM 1792 C1' C B 7 8.503 9.206 10.720 1.00 0.00 C ATOM 1793 N1 C B 7 7.608 10.250 10.145 1.00 0.00 N ATOM 1794 C2 C B 7 7.982 10.862 8.945 1.00 0.00 C ATOM 1795 O2 C B 7 9.039 10.578 8.384 1.00 0.00 O ATOM 1796 N3 C B 7 7.158 11.792 8.395 1.00 0.00 N ATOM 1797 C4 C B 7 6.021 12.134 9.005 1.00 0.00 C ATOM 1798 N4 C B 7 5.240 13.045 8.424 1.00 0.00 N ATOM 1799 C5 C B 7 5.630 11.554 10.250 1.00 0.00 C ATOM 1800 C6 C B 7 6.454 10.625 10.782 1.00 0.00 C ATOM 0 H5' C B 7 6.946 5.701 9.796 1.00 0.00 H new ATOM 0 H5'' C B 7 6.612 7.396 9.505 1.00 0.00 H new ATOM 0 H4' C B 7 9.417 6.273 9.712 1.00 0.00 H new ATOM 0 H3' C B 7 7.932 6.133 11.972 1.00 0.00 H new ATOM 0 H2' C B 7 6.722 8.280 11.623 1.00 0.00 H new ATOM 0 HO2' C B 7 7.588 9.703 13.144 1.00 0.00 H new ATOM 0 HO3' C B 7 9.757 7.506 12.972 1.00 0.00 H new ATOM 0 H1' C B 7 9.303 9.779 11.189 1.00 0.00 H new ATOM 0 H41 C B 7 4.365 13.325 8.868 1.00 0.00 H new ATOM 0 H42 C B 7 5.517 13.462 7.535 1.00 0.00 H new ATOM 0 H5 C B 7 4.715 11.845 10.745 1.00 0.00 H new ATOM 0 H6 C B 7 6.198 10.169 11.727 1.00 0.00 H new TER 1812 C B 7