USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 992 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 43 HIS : no HD1:sc= 0.389 K(o=0.39,f=-3.7!) USER MOD Set 1.2: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 34 SER OG : rot -85:sc= 1.28 USER MOD Set 2.2: A 60 GLN : amide:sc= 0.397 K(o=1.7,f=-0.2) USER MOD Set 3.1: A 15 SER OG : rot 67:sc= 0.476 USER MOD Set 3.2: A 16 GLN : amide:sc= 1.78 K(o=5.4,f=1.4!) USER MOD Set 3.3: A 40 SER OG : rot 121:sc= 1.99 USER MOD Set 3.4: A 62 SER OG : rot 148:sc= 1.13 USER MOD Set 4.1: A 8 CYS SG : rot -144:sc= -0.0771 USER MOD Set 4.2: A 12 SER OG : rot -33:sc= 1.29 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 132:sc= 0.00582 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -169:sc= 1.22 (180deg=1.18) USER MOD Single : A 5 MET CE :methyl -172:sc= -0.609 (180deg=-0.725) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 1.6 K(o=1.6,f=0) USER MOD Single : A 13 CYS SG : rot 120:sc= 0.0468 USER MOD Single : A 17 MET CE :methyl 158:sc= -0.27 (180deg=-1.36) USER MOD Single : A 23 LYS NZ :NH3+ 163:sc= 1.68 (180deg=1.38) USER MOD Single : A 24 THR OG1 : rot 75:sc= 0.0733 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -150:sc= 0 USER MOD Single : A 35 CYS SG : rot 49:sc= -0.0538 USER MOD Single : A 39 SER OG : rot 180:sc= 0.00279 USER MOD Single : A 49 MET CE :methyl 177:sc= -0.0288 (180deg=-0.033) USER MOD Single : A 50 MET CE :methyl -131:sc= -0.0146 (180deg=-0.117) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 2.25 K(o=2.2,f=-0.0037) USER MOD Single : A 69 ASN : amide:sc= 1.01 K(o=1,f=-0.031) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -103:sc= 1.24 USER MOD Single : A 80 CYS SG : rot 170:sc= 0 USER MOD Single : A 82 CYS SG : rot 180:sc= -0.0814 USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 92 THR OG1 : rot -45:sc= 0.0955 USER MOD Single : A 93 GLN : amide:sc= -1.1 X(o=-1.1,f=-0.64) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 60:sc= 1.19 USER MOD Single : A 118 GLN : amide:sc= 1.15 K(o=1.2,f=-0.0055) USER MOD Single : A 120 LYS NZ :NH3+ -161:sc= 1.25 (180deg=1.16) USER MOD Single : A 125 ASN : amide:sc= 0.485 K(o=0.49,f=-0.085) USER MOD Single : A 129 LYS NZ :NH3+ -173:sc= 1.32 (180deg=1.21) USER MOD Single : A 131 SER OG : rot 76:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.922 1.921 1.628 1.00 0.00 N ATOM 2 CA MET A 1 4.049 1.739 0.144 1.00 0.00 C ATOM 3 C MET A 1 5.016 0.586 -0.198 1.00 0.00 C ATOM 4 O MET A 1 6.033 0.424 0.471 1.00 0.00 O ATOM 5 CB MET A 1 4.459 3.068 -0.552 1.00 0.00 C ATOM 6 CG MET A 1 4.566 2.982 -2.086 1.00 0.00 C ATOM 7 SD MET A 1 4.866 4.563 -2.934 1.00 0.00 S ATOM 8 CE MET A 1 3.200 5.282 -2.892 1.00 0.00 C ATOM 0 H1 MET A 1 4.030 2.928 1.865 1.00 0.00 H new ATOM 0 H2 MET A 1 2.986 1.590 1.940 1.00 0.00 H new ATOM 0 H3 MET A 1 4.662 1.371 2.110 1.00 0.00 H new ATOM 0 HA MET A 1 3.069 1.461 -0.245 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.731 3.837 -0.294 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.420 3.391 -0.151 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.372 2.294 -2.339 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.644 2.549 -2.474 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.213 6.259 -3.375 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.507 4.626 -3.419 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.878 5.394 -1.857 1.00 0.00 H new ATOM 18 N LYS A 2 4.729 -0.196 -1.256 1.00 0.00 N ATOM 19 CA LYS A 2 5.589 -1.303 -1.729 1.00 0.00 C ATOM 20 C LYS A 2 6.867 -0.794 -2.384 1.00 0.00 C ATOM 21 O LYS A 2 6.820 0.168 -3.151 1.00 0.00 O ATOM 22 CB LYS A 2 4.849 -2.194 -2.742 1.00 0.00 C ATOM 23 CG LYS A 2 3.649 -2.969 -2.175 1.00 0.00 C ATOM 24 CD LYS A 2 2.811 -3.567 -3.325 1.00 0.00 C ATOM 25 CE LYS A 2 1.779 -2.583 -3.910 1.00 0.00 C ATOM 26 NZ LYS A 2 0.520 -2.520 -3.105 1.00 0.00 N ATOM 0 H LYS A 2 3.884 -0.077 -1.814 1.00 0.00 H new ATOM 0 HA LYS A 2 5.847 -1.883 -0.843 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.502 -1.570 -3.566 1.00 0.00 H new ATOM 0 HB3 LYS A 2 5.558 -2.908 -3.160 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.998 -3.765 -1.517 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.030 -2.305 -1.571 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.481 -3.894 -4.120 1.00 0.00 H new ATOM 0 HD3 LYS A 2 2.291 -4.453 -2.962 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.221 -1.588 -3.963 1.00 0.00 H new ATOM 0 HE3 LYS A 2 1.538 -2.880 -4.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.138 -1.844 -3.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 0.080 -3.462 -3.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 0.742 -2.210 -2.137 1.00 0.00 H new ATOM 40 N LYS A 3 7.973 -1.508 -2.177 1.00 0.00 N ATOM 41 CA LYS A 3 9.244 -1.289 -2.879 1.00 0.00 C ATOM 42 C LYS A 3 9.546 -2.437 -3.845 1.00 0.00 C ATOM 43 O LYS A 3 9.616 -3.594 -3.433 1.00 0.00 O ATOM 44 CB LYS A 3 10.345 -1.067 -1.833 1.00 0.00 C ATOM 45 CG LYS A 3 11.608 -0.395 -2.392 1.00 0.00 C ATOM 46 CD LYS A 3 12.625 -0.078 -1.280 1.00 0.00 C ATOM 47 CE LYS A 3 12.048 0.873 -0.215 1.00 0.00 C ATOM 48 NZ LYS A 3 13.074 1.252 0.794 1.00 0.00 N ATOM 0 H LYS A 3 8.015 -2.272 -1.503 1.00 0.00 H new ATOM 0 HA LYS A 3 9.186 -0.397 -3.503 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.946 -0.454 -1.025 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.619 -2.028 -1.398 1.00 0.00 H new ATOM 0 HG2 LYS A 3 12.070 -1.048 -3.132 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.333 0.526 -2.907 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.940 -1.006 -0.803 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.515 0.371 -1.721 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.663 1.771 -0.698 1.00 0.00 H new ATOM 0 HE3 LYS A 3 11.206 0.394 0.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.614 1.735 1.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.555 0.397 1.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.771 1.889 0.358 1.00 0.00 H new ATOM 62 N VAL A 4 9.727 -2.101 -5.122 1.00 0.00 N ATOM 63 CA VAL A 4 10.070 -3.028 -6.208 1.00 0.00 C ATOM 64 C VAL A 4 11.579 -3.039 -6.440 1.00 0.00 C ATOM 65 O VAL A 4 12.118 -2.058 -6.950 1.00 0.00 O ATOM 66 CB VAL A 4 9.336 -2.672 -7.517 1.00 0.00 C ATOM 67 CG1 VAL A 4 9.631 -3.700 -8.619 1.00 0.00 C ATOM 68 CG2 VAL A 4 7.815 -2.636 -7.333 1.00 0.00 C ATOM 0 H VAL A 4 9.636 -1.138 -5.444 1.00 0.00 H new ATOM 0 HA VAL A 4 9.745 -4.023 -5.904 1.00 0.00 H new ATOM 0 HB VAL A 4 9.701 -1.685 -7.800 1.00 0.00 H new ATOM 0 HG11 VAL A 4 9.099 -3.421 -9.529 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.702 -3.723 -8.818 1.00 0.00 H new ATOM 0 HG13 VAL A 4 9.301 -4.687 -8.294 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.340 -2.381 -8.280 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.465 -3.614 -7.003 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.557 -1.887 -6.585 1.00 0.00 H new ATOM 78 N MET A 5 12.271 -4.131 -6.098 1.00 0.00 N ATOM 79 CA MET A 5 13.674 -4.297 -6.508 1.00 0.00 C ATOM 80 C MET A 5 13.732 -5.000 -7.868 1.00 0.00 C ATOM 81 O MET A 5 13.181 -6.087 -8.034 1.00 0.00 O ATOM 82 CB MET A 5 14.534 -5.043 -5.474 1.00 0.00 C ATOM 83 CG MET A 5 16.024 -4.875 -5.816 1.00 0.00 C ATOM 84 SD MET A 5 17.186 -5.797 -4.780 1.00 0.00 S ATOM 85 CE MET A 5 17.242 -4.747 -3.311 1.00 0.00 C ATOM 0 H MET A 5 11.893 -4.902 -5.548 1.00 0.00 H new ATOM 0 HA MET A 5 14.103 -3.298 -6.584 1.00 0.00 H new ATOM 0 HB2 MET A 5 14.335 -4.656 -4.475 1.00 0.00 H new ATOM 0 HB3 MET A 5 14.271 -6.101 -5.464 1.00 0.00 H new ATOM 0 HG2 MET A 5 16.174 -5.177 -6.853 1.00 0.00 H new ATOM 0 HG3 MET A 5 16.273 -3.816 -5.753 1.00 0.00 H new ATOM 0 HE1 MET A 5 18.022 -5.104 -2.638 1.00 0.00 H new ATOM 0 HE2 MET A 5 17.459 -3.720 -3.606 1.00 0.00 H new ATOM 0 HE3 MET A 5 16.279 -4.782 -2.802 1.00 0.00 H new ATOM 95 N PHE A 6 14.439 -4.402 -8.822 1.00 0.00 N ATOM 96 CA PHE A 6 14.790 -5.002 -10.105 1.00 0.00 C ATOM 97 C PHE A 6 16.198 -5.614 -10.013 1.00 0.00 C ATOM 98 O PHE A 6 17.143 -4.911 -9.654 1.00 0.00 O ATOM 99 CB PHE A 6 14.660 -3.936 -11.201 1.00 0.00 C ATOM 100 CG PHE A 6 13.222 -3.528 -11.470 1.00 0.00 C ATOM 101 CD1 PHE A 6 12.423 -4.338 -12.295 1.00 0.00 C ATOM 102 CD2 PHE A 6 12.664 -2.377 -10.882 1.00 0.00 C ATOM 103 CE1 PHE A 6 11.093 -3.983 -12.569 1.00 0.00 C ATOM 104 CE2 PHE A 6 11.331 -2.017 -11.164 1.00 0.00 C ATOM 105 CZ PHE A 6 10.551 -2.806 -12.032 1.00 0.00 C ATOM 0 H PHE A 6 14.796 -3.452 -8.719 1.00 0.00 H new ATOM 0 HA PHE A 6 14.112 -5.815 -10.363 1.00 0.00 H new ATOM 0 HB2 PHE A 6 15.233 -3.055 -10.912 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.102 -4.315 -12.122 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.836 -5.240 -12.721 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.258 -1.770 -10.215 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.485 -4.618 -13.196 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.906 -1.133 -10.713 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.544 -2.507 -12.282 1.00 0.00 H new ATOM 115 N VAL A 7 16.358 -6.907 -10.315 1.00 0.00 N ATOM 116 CA VAL A 7 17.612 -7.672 -10.101 1.00 0.00 C ATOM 117 C VAL A 7 18.073 -8.409 -11.362 1.00 0.00 C ATOM 118 O VAL A 7 17.249 -8.889 -12.133 1.00 0.00 O ATOM 119 CB VAL A 7 17.527 -8.612 -8.874 1.00 0.00 C ATOM 120 CG1 VAL A 7 17.109 -7.829 -7.626 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.556 -9.786 -9.022 1.00 0.00 C ATOM 0 H VAL A 7 15.612 -7.470 -10.723 1.00 0.00 H new ATOM 0 HA VAL A 7 18.382 -6.935 -9.876 1.00 0.00 H new ATOM 0 HB VAL A 7 18.531 -9.026 -8.786 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.054 -8.506 -6.773 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.842 -7.049 -7.424 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.132 -7.375 -7.792 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.568 -10.385 -8.111 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.549 -9.406 -9.193 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.859 -10.404 -9.867 1.00 0.00 H new ATOM 131 N CYS A 8 19.385 -8.487 -11.610 1.00 0.00 N ATOM 132 CA CYS A 8 19.932 -9.078 -12.847 1.00 0.00 C ATOM 133 C CYS A 8 21.355 -9.654 -12.674 1.00 0.00 C ATOM 134 O CYS A 8 21.950 -9.542 -11.601 1.00 0.00 O ATOM 135 CB CYS A 8 19.870 -7.981 -13.932 1.00 0.00 C ATOM 136 SG CYS A 8 19.971 -8.713 -15.596 1.00 0.00 S ATOM 0 H CYS A 8 20.098 -8.146 -10.966 1.00 0.00 H new ATOM 0 HA CYS A 8 19.334 -9.942 -13.137 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.942 -7.417 -13.833 1.00 0.00 H new ATOM 0 HB3 CYS A 8 20.689 -7.275 -13.790 1.00 0.00 H new ATOM 0 HG CYS A 8 20.643 -7.921 -16.378 1.00 0.00 H new ATOM 142 N LYS A 9 21.910 -10.261 -13.732 1.00 0.00 N ATOM 143 CA LYS A 9 23.320 -10.703 -13.826 1.00 0.00 C ATOM 144 C LYS A 9 24.275 -9.522 -14.092 1.00 0.00 C ATOM 145 O LYS A 9 23.848 -8.427 -14.453 1.00 0.00 O ATOM 146 CB LYS A 9 23.446 -11.834 -14.872 1.00 0.00 C ATOM 147 CG LYS A 9 22.719 -13.111 -14.407 1.00 0.00 C ATOM 148 CD LYS A 9 22.851 -14.290 -15.387 1.00 0.00 C ATOM 149 CE LYS A 9 24.294 -14.806 -15.519 1.00 0.00 C ATOM 150 NZ LYS A 9 24.367 -16.015 -16.391 1.00 0.00 N ATOM 0 H LYS A 9 21.377 -10.468 -14.577 1.00 0.00 H new ATOM 0 HA LYS A 9 23.628 -11.111 -12.863 1.00 0.00 H new ATOM 0 HB2 LYS A 9 23.029 -11.501 -15.822 1.00 0.00 H new ATOM 0 HB3 LYS A 9 24.499 -12.055 -15.046 1.00 0.00 H new ATOM 0 HG2 LYS A 9 23.115 -13.411 -13.437 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.662 -12.885 -14.264 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.209 -15.105 -15.054 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.491 -13.981 -16.368 1.00 0.00 H new ATOM 0 HE2 LYS A 9 24.926 -14.020 -15.932 1.00 0.00 H new ATOM 0 HE3 LYS A 9 24.688 -15.045 -14.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.354 -16.336 -16.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 23.783 -16.773 -15.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 24.014 -15.780 -17.341 1.00 0.00 H new ATOM 164 N ARG A 10 25.584 -9.766 -13.944 1.00 0.00 N ATOM 165 CA ARG A 10 26.646 -8.734 -13.923 1.00 0.00 C ATOM 166 C ARG A 10 26.849 -7.908 -15.205 1.00 0.00 C ATOM 167 O ARG A 10 27.172 -6.725 -15.113 1.00 0.00 O ATOM 168 CB ARG A 10 27.973 -9.393 -13.489 1.00 0.00 C ATOM 169 CG ARG A 10 28.718 -8.501 -12.491 1.00 0.00 C ATOM 170 CD ARG A 10 30.094 -9.077 -12.140 1.00 0.00 C ATOM 171 NE ARG A 10 30.604 -8.476 -10.893 1.00 0.00 N ATOM 172 CZ ARG A 10 31.851 -8.434 -10.458 1.00 0.00 C ATOM 173 NH1 ARG A 10 32.848 -8.917 -11.145 1.00 0.00 N ATOM 174 NH2 ARG A 10 32.115 -7.898 -9.302 1.00 0.00 N ATOM 0 H ARG A 10 25.950 -10.711 -13.832 1.00 0.00 H new ATOM 0 HA ARG A 10 26.298 -7.991 -13.206 1.00 0.00 H new ATOM 0 HB2 ARG A 10 27.772 -10.364 -13.037 1.00 0.00 H new ATOM 0 HB3 ARG A 10 28.599 -9.572 -14.363 1.00 0.00 H new ATOM 0 HG2 ARG A 10 28.837 -7.503 -12.912 1.00 0.00 H new ATOM 0 HG3 ARG A 10 28.125 -8.395 -11.583 1.00 0.00 H new ATOM 0 HD2 ARG A 10 30.024 -10.159 -12.027 1.00 0.00 H new ATOM 0 HD3 ARG A 10 30.793 -8.887 -12.955 1.00 0.00 H new ATOM 0 HE ARG A 10 29.907 -8.038 -10.291 1.00 0.00 H new ATOM 0 HH11 ARG A 10 32.680 -9.347 -12.054 1.00 0.00 H new ATOM 0 HH12 ARG A 10 33.796 -8.865 -10.773 1.00 0.00 H new ATOM 0 HH21 ARG A 10 31.360 -7.512 -8.735 1.00 0.00 H new ATOM 0 HH22 ARG A 10 33.077 -7.864 -8.963 1.00 0.00 H new ATOM 188 N ASN A 11 26.694 -8.517 -16.385 1.00 0.00 N ATOM 189 CA ASN A 11 27.079 -7.882 -17.657 1.00 0.00 C ATOM 190 C ASN A 11 26.187 -6.702 -18.065 1.00 0.00 C ATOM 191 O ASN A 11 26.678 -5.717 -18.620 1.00 0.00 O ATOM 192 CB ASN A 11 27.082 -8.938 -18.781 1.00 0.00 C ATOM 193 CG ASN A 11 27.644 -8.349 -20.076 1.00 0.00 C ATOM 194 OD1 ASN A 11 28.847 -8.168 -20.207 1.00 0.00 O ATOM 195 ND2 ASN A 11 26.829 -7.978 -21.039 1.00 0.00 N ATOM 0 H ASN A 11 26.303 -9.453 -16.489 1.00 0.00 H new ATOM 0 HA ASN A 11 28.076 -7.471 -17.501 1.00 0.00 H new ATOM 0 HB2 ASN A 11 27.680 -9.798 -18.477 1.00 0.00 H new ATOM 0 HB3 ASN A 11 26.067 -9.299 -18.950 1.00 0.00 H new ATOM 0 HD21 ASN A 11 27.202 -7.545 -21.884 1.00 0.00 H new ATOM 0 HD22 ASN A 11 25.824 -8.124 -20.941 1.00 0.00 H new ATOM 202 N SER A 12 24.882 -6.808 -17.812 1.00 0.00 N ATOM 203 CA SER A 12 23.881 -5.874 -18.343 1.00 0.00 C ATOM 204 C SER A 12 23.523 -4.718 -17.402 1.00 0.00 C ATOM 205 O SER A 12 23.896 -4.684 -16.232 1.00 0.00 O ATOM 206 CB SER A 12 22.636 -6.661 -18.769 1.00 0.00 C ATOM 207 OG SER A 12 21.715 -6.824 -17.697 1.00 0.00 O ATOM 0 H SER A 12 24.485 -7.546 -17.231 1.00 0.00 H new ATOM 0 HA SER A 12 24.331 -5.385 -19.207 1.00 0.00 H new ATOM 0 HB2 SER A 12 22.145 -6.144 -19.593 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.936 -7.641 -19.141 1.00 0.00 H new ATOM 0 HG SER A 12 22.206 -6.900 -16.852 1.00 0.00 H new ATOM 213 N CYS A 13 22.726 -3.787 -17.932 1.00 0.00 N ATOM 214 CA CYS A 13 22.064 -2.716 -17.180 1.00 0.00 C ATOM 215 C CYS A 13 20.554 -2.969 -17.033 1.00 0.00 C ATOM 216 O CYS A 13 19.814 -2.040 -16.744 1.00 0.00 O ATOM 217 CB CYS A 13 22.406 -1.368 -17.846 1.00 0.00 C ATOM 218 SG CYS A 13 21.840 -1.311 -19.577 1.00 0.00 S ATOM 0 H CYS A 13 22.516 -3.756 -18.930 1.00 0.00 H new ATOM 0 HA CYS A 13 22.436 -2.691 -16.156 1.00 0.00 H new ATOM 0 HB2 CYS A 13 21.943 -0.557 -17.285 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.483 -1.207 -17.810 1.00 0.00 H new ATOM 0 HG CYS A 13 20.992 -0.336 -19.725 1.00 0.00 H new ATOM 224 N ARG A 14 20.052 -4.196 -17.262 1.00 0.00 N ATOM 225 CA ARG A 14 18.610 -4.514 -17.367 1.00 0.00 C ATOM 226 C ARG A 14 17.852 -4.225 -16.079 1.00 0.00 C ATOM 227 O ARG A 14 16.741 -3.725 -16.154 1.00 0.00 O ATOM 228 CB ARG A 14 18.436 -5.986 -17.802 1.00 0.00 C ATOM 229 CG ARG A 14 18.801 -6.234 -19.276 1.00 0.00 C ATOM 230 CD ARG A 14 18.681 -7.721 -19.645 1.00 0.00 C ATOM 231 NE ARG A 14 19.740 -8.541 -19.017 1.00 0.00 N ATOM 232 CZ ARG A 14 19.929 -9.844 -19.165 1.00 0.00 C ATOM 233 NH1 ARG A 14 19.156 -10.577 -19.909 1.00 0.00 N ATOM 234 NH2 ARG A 14 20.928 -10.441 -18.581 1.00 0.00 N ATOM 0 H ARG A 14 20.648 -5.015 -17.382 1.00 0.00 H new ATOM 0 HA ARG A 14 18.177 -3.861 -18.124 1.00 0.00 H new ATOM 0 HB2 ARG A 14 19.058 -6.620 -17.170 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.401 -6.287 -17.636 1.00 0.00 H new ATOM 0 HG2 ARG A 14 18.146 -5.645 -19.918 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.820 -5.893 -19.462 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.704 -8.093 -19.335 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.734 -7.830 -20.728 1.00 0.00 H new ATOM 0 HE ARG A 14 20.394 -8.052 -18.406 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.372 -10.152 -20.404 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.333 -11.577 -19.998 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.575 -9.905 -18.002 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.064 -11.445 -18.702 1.00 0.00 H new ATOM 248 N SER A 15 18.451 -4.443 -14.910 1.00 0.00 N ATOM 249 CA SER A 15 17.857 -4.046 -13.624 1.00 0.00 C ATOM 250 C SER A 15 17.759 -2.525 -13.483 1.00 0.00 C ATOM 251 O SER A 15 16.706 -2.010 -13.113 1.00 0.00 O ATOM 252 CB SER A 15 18.635 -4.671 -12.461 1.00 0.00 C ATOM 253 OG SER A 15 20.010 -4.773 -12.773 1.00 0.00 O ATOM 0 H SER A 15 19.360 -4.898 -14.822 1.00 0.00 H new ATOM 0 HA SER A 15 16.836 -4.427 -13.596 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.505 -4.066 -11.564 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.234 -5.660 -12.239 1.00 0.00 H new ATOM 0 HG SER A 15 20.396 -3.875 -12.846 1.00 0.00 H new ATOM 259 N GLN A 16 18.808 -1.783 -13.849 1.00 0.00 N ATOM 260 CA GLN A 16 18.801 -0.311 -13.844 1.00 0.00 C ATOM 261 C GLN A 16 17.807 0.260 -14.865 1.00 0.00 C ATOM 262 O GLN A 16 17.037 1.155 -14.530 1.00 0.00 O ATOM 263 CB GLN A 16 20.223 0.239 -14.081 1.00 0.00 C ATOM 264 CG GLN A 16 21.128 0.199 -12.834 1.00 0.00 C ATOM 265 CD GLN A 16 21.442 -1.202 -12.321 1.00 0.00 C ATOM 266 OE1 GLN A 16 21.507 -2.166 -13.065 1.00 0.00 O ATOM 267 NE2 GLN A 16 21.627 -1.377 -11.035 1.00 0.00 N ATOM 0 H GLN A 16 19.692 -2.185 -14.159 1.00 0.00 H new ATOM 0 HA GLN A 16 18.467 0.014 -12.859 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.695 -0.335 -14.878 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.149 1.269 -14.431 1.00 0.00 H new ATOM 0 HG2 GLN A 16 22.065 0.705 -13.065 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.649 0.765 -12.035 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.576 -0.581 -10.399 1.00 0.00 H new ATOM 0 HE22 GLN A 16 21.822 -2.309 -10.670 1.00 0.00 H new ATOM 276 N MET A 17 17.765 -0.283 -16.084 1.00 0.00 N ATOM 277 CA MET A 17 16.864 0.152 -17.161 1.00 0.00 C ATOM 278 C MET A 17 15.399 -0.196 -16.836 1.00 0.00 C ATOM 279 O MET A 17 14.511 0.631 -17.034 1.00 0.00 O ATOM 280 CB MET A 17 17.344 -0.451 -18.498 1.00 0.00 C ATOM 281 CG MET A 17 17.330 0.530 -19.677 1.00 0.00 C ATOM 282 SD MET A 17 15.704 1.105 -20.223 1.00 0.00 S ATOM 283 CE MET A 17 15.560 2.718 -19.389 1.00 0.00 C ATOM 0 H MET A 17 18.370 -1.057 -16.359 1.00 0.00 H new ATOM 0 HA MET A 17 16.896 1.238 -17.253 1.00 0.00 H new ATOM 0 HB2 MET A 17 18.358 -0.830 -18.368 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.713 -1.305 -18.744 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.927 1.400 -19.405 1.00 0.00 H new ATOM 0 HG3 MET A 17 17.827 0.055 -20.523 1.00 0.00 H new ATOM 0 HE1 MET A 17 14.834 3.337 -19.916 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.230 2.568 -18.361 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.530 3.216 -19.390 1.00 0.00 H new ATOM 293 N ALA A 18 15.153 -1.372 -16.243 1.00 0.00 N ATOM 294 CA ALA A 18 13.829 -1.731 -15.716 1.00 0.00 C ATOM 295 C ALA A 18 13.364 -0.799 -14.585 1.00 0.00 C ATOM 296 O ALA A 18 12.250 -0.283 -14.647 1.00 0.00 O ATOM 297 CB ALA A 18 13.834 -3.203 -15.302 1.00 0.00 C ATOM 0 H ALA A 18 15.860 -2.096 -16.116 1.00 0.00 H new ATOM 0 HA ALA A 18 13.093 -1.594 -16.508 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.854 -3.474 -14.910 1.00 0.00 H new ATOM 0 HB2 ALA A 18 14.063 -3.824 -16.168 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.589 -3.362 -14.532 1.00 0.00 H new ATOM 303 N GLU A 19 14.228 -0.482 -13.610 1.00 0.00 N ATOM 304 CA GLU A 19 13.919 0.568 -12.628 1.00 0.00 C ATOM 305 C GLU A 19 13.657 1.909 -13.330 1.00 0.00 C ATOM 306 O GLU A 19 12.716 2.599 -12.956 1.00 0.00 O ATOM 307 CB GLU A 19 15.043 0.706 -11.590 1.00 0.00 C ATOM 308 CG GLU A 19 14.655 1.627 -10.423 1.00 0.00 C ATOM 309 CD GLU A 19 15.853 2.412 -9.855 1.00 0.00 C ATOM 310 OE1 GLU A 19 16.839 1.771 -9.424 1.00 0.00 O ATOM 311 OE2 GLU A 19 15.808 3.664 -9.832 1.00 0.00 O ATOM 0 H GLU A 19 15.135 -0.931 -13.480 1.00 0.00 H new ATOM 0 HA GLU A 19 13.012 0.275 -12.100 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.298 -0.280 -11.201 1.00 0.00 H new ATOM 0 HB3 GLU A 19 15.936 1.098 -12.076 1.00 0.00 H new ATOM 0 HG2 GLU A 19 13.893 2.330 -10.759 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.209 1.030 -9.628 1.00 0.00 H new ATOM 318 N GLY A 20 14.402 2.238 -14.390 1.00 0.00 N ATOM 319 CA GLY A 20 14.240 3.446 -15.202 1.00 0.00 C ATOM 320 C GLY A 20 12.812 3.671 -15.702 1.00 0.00 C ATOM 321 O GLY A 20 12.195 4.674 -15.351 1.00 0.00 O ATOM 0 H GLY A 20 15.165 1.646 -14.718 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.549 4.311 -14.615 1.00 0.00 H new ATOM 0 HA3 GLY A 20 14.910 3.388 -16.060 1.00 0.00 H new ATOM 325 N PHE A 21 12.234 2.730 -16.456 1.00 0.00 N ATOM 326 CA PHE A 21 10.820 2.853 -16.860 1.00 0.00 C ATOM 327 C PHE A 21 9.868 2.784 -15.653 1.00 0.00 C ATOM 328 O PHE A 21 8.824 3.437 -15.649 1.00 0.00 O ATOM 329 CB PHE A 21 10.460 1.806 -17.925 1.00 0.00 C ATOM 330 CG PHE A 21 10.886 2.148 -19.332 1.00 0.00 C ATOM 331 CD1 PHE A 21 10.011 2.879 -20.157 1.00 0.00 C ATOM 332 CD2 PHE A 21 12.114 1.698 -19.845 1.00 0.00 C ATOM 333 CE1 PHE A 21 10.364 3.173 -21.482 1.00 0.00 C ATOM 334 CE2 PHE A 21 12.465 1.989 -21.175 1.00 0.00 C ATOM 335 CZ PHE A 21 11.596 2.737 -21.990 1.00 0.00 C ATOM 0 H PHE A 21 12.706 1.892 -16.795 1.00 0.00 H new ATOM 0 HA PHE A 21 10.692 3.840 -17.305 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.915 0.856 -17.646 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.380 1.658 -17.915 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.062 3.216 -19.767 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.787 1.130 -19.219 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.688 3.734 -22.110 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.405 1.637 -21.572 1.00 0.00 H new ATOM 0 HZ PHE A 21 11.877 2.975 -23.005 1.00 0.00 H new ATOM 345 N ALA A 22 10.226 2.055 -14.591 1.00 0.00 N ATOM 346 CA ALA A 22 9.407 1.963 -13.383 1.00 0.00 C ATOM 347 C ALA A 22 9.370 3.264 -12.549 1.00 0.00 C ATOM 348 O ALA A 22 8.314 3.569 -12.011 1.00 0.00 O ATOM 349 CB ALA A 22 9.858 0.744 -12.569 1.00 0.00 C ATOM 0 H ALA A 22 11.090 1.514 -14.547 1.00 0.00 H new ATOM 0 HA ALA A 22 8.370 1.826 -13.688 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.253 0.666 -11.665 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.735 -0.159 -13.167 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.907 0.857 -12.295 1.00 0.00 H new ATOM 355 N LYS A 23 10.431 4.087 -12.491 1.00 0.00 N ATOM 356 CA LYS A 23 10.377 5.429 -11.853 1.00 0.00 C ATOM 357 C LYS A 23 9.546 6.435 -12.661 1.00 0.00 C ATOM 358 O LYS A 23 8.944 7.328 -12.074 1.00 0.00 O ATOM 359 CB LYS A 23 11.779 5.976 -11.486 1.00 0.00 C ATOM 360 CG LYS A 23 12.775 6.043 -12.649 1.00 0.00 C ATOM 361 CD LYS A 23 14.144 6.632 -12.281 1.00 0.00 C ATOM 362 CE LYS A 23 14.144 8.169 -12.242 1.00 0.00 C ATOM 363 NZ LYS A 23 15.534 8.693 -12.129 1.00 0.00 N ATOM 0 H LYS A 23 11.345 3.851 -12.878 1.00 0.00 H new ATOM 0 HA LYS A 23 9.851 5.290 -10.908 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.664 6.976 -11.068 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.202 5.350 -10.701 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.920 5.038 -13.045 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.340 6.641 -13.450 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.449 6.249 -11.307 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.886 6.292 -13.003 1.00 0.00 H new ATOM 0 HE2 LYS A 23 13.675 8.561 -13.145 1.00 0.00 H new ATOM 0 HE3 LYS A 23 13.549 8.516 -11.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 15.548 9.700 -12.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 15.867 8.585 -11.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.159 8.161 -12.768 1.00 0.00 H new ATOM 377 N THR A 24 9.441 6.259 -13.982 1.00 0.00 N ATOM 378 CA THR A 24 8.562 7.072 -14.850 1.00 0.00 C ATOM 379 C THR A 24 7.080 6.697 -14.700 1.00 0.00 C ATOM 380 O THR A 24 6.234 7.577 -14.560 1.00 0.00 O ATOM 381 CB THR A 24 8.980 6.927 -16.323 1.00 0.00 C ATOM 382 OG1 THR A 24 10.373 7.091 -16.450 1.00 0.00 O ATOM 383 CG2 THR A 24 8.322 7.941 -17.258 1.00 0.00 C ATOM 0 H THR A 24 9.964 5.545 -14.489 1.00 0.00 H new ATOM 0 HA THR A 24 8.677 8.108 -14.531 1.00 0.00 H new ATOM 0 HB THR A 24 8.653 5.929 -16.615 1.00 0.00 H new ATOM 0 HG1 THR A 24 10.828 6.284 -16.130 1.00 0.00 H new ATOM 0 HG21 THR A 24 8.668 7.773 -18.278 1.00 0.00 H new ATOM 0 HG22 THR A 24 7.239 7.824 -17.218 1.00 0.00 H new ATOM 0 HG23 THR A 24 8.589 8.951 -16.946 1.00 0.00 H new ATOM 391 N LEU A 25 6.753 5.396 -14.715 1.00 0.00 N ATOM 392 CA LEU A 25 5.363 4.892 -14.796 1.00 0.00 C ATOM 393 C LEU A 25 4.769 4.484 -13.439 1.00 0.00 C ATOM 394 O LEU A 25 3.567 4.609 -13.216 1.00 0.00 O ATOM 395 CB LEU A 25 5.311 3.730 -15.811 1.00 0.00 C ATOM 396 CG LEU A 25 5.825 4.115 -17.210 1.00 0.00 C ATOM 397 CD1 LEU A 25 5.860 2.889 -18.113 1.00 0.00 C ATOM 398 CD2 LEU A 25 4.967 5.180 -17.894 1.00 0.00 C ATOM 0 H LEU A 25 7.449 4.652 -14.671 1.00 0.00 H new ATOM 0 HA LEU A 25 4.734 5.715 -15.136 1.00 0.00 H new ATOM 0 HB2 LEU A 25 5.904 2.899 -15.430 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.283 3.376 -15.895 1.00 0.00 H new ATOM 0 HG LEU A 25 6.823 4.526 -17.060 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.225 3.174 -19.100 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.524 2.139 -17.683 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.856 2.475 -18.204 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.383 5.407 -18.876 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.949 4.809 -18.008 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.957 6.085 -17.286 1.00 0.00 H new ATOM 410 N GLY A 26 5.624 4.045 -12.511 1.00 0.00 N ATOM 411 CA GLY A 26 5.307 3.800 -11.101 1.00 0.00 C ATOM 412 C GLY A 26 5.363 5.065 -10.241 1.00 0.00 C ATOM 413 O GLY A 26 5.149 4.971 -9.031 1.00 0.00 O ATOM 0 H GLY A 26 6.599 3.842 -12.732 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.310 3.364 -11.030 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.006 3.065 -10.701 1.00 0.00 H new ATOM 417 N ALA A 27 5.639 6.235 -10.842 1.00 0.00 N ATOM 418 CA ALA A 27 5.650 7.534 -10.152 1.00 0.00 C ATOM 419 C ALA A 27 4.389 7.747 -9.283 1.00 0.00 C ATOM 420 O ALA A 27 3.268 7.794 -9.794 1.00 0.00 O ATOM 421 CB ALA A 27 5.783 8.647 -11.202 1.00 0.00 C ATOM 0 H ALA A 27 5.864 6.305 -11.835 1.00 0.00 H new ATOM 0 HA ALA A 27 6.500 7.558 -9.470 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.793 9.617 -10.705 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.712 8.515 -11.757 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.939 8.600 -11.890 1.00 0.00 H new ATOM 427 N GLY A 28 4.572 7.857 -7.959 1.00 0.00 N ATOM 428 CA GLY A 28 3.483 8.044 -6.987 1.00 0.00 C ATOM 429 C GLY A 28 2.645 6.792 -6.672 1.00 0.00 C ATOM 430 O GLY A 28 1.597 6.922 -6.036 1.00 0.00 O ATOM 0 H GLY A 28 5.495 7.818 -7.526 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.912 8.415 -6.056 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.816 8.820 -7.362 1.00 0.00 H new ATOM 434 N LYS A 29 3.077 5.591 -7.095 1.00 0.00 N ATOM 435 CA LYS A 29 2.343 4.318 -6.919 1.00 0.00 C ATOM 436 C LYS A 29 3.147 3.308 -6.102 1.00 0.00 C ATOM 437 O LYS A 29 2.595 2.572 -5.284 1.00 0.00 O ATOM 438 CB LYS A 29 2.016 3.706 -8.297 1.00 0.00 C ATOM 439 CG LYS A 29 1.206 4.652 -9.199 1.00 0.00 C ATOM 440 CD LYS A 29 0.910 4.027 -10.571 1.00 0.00 C ATOM 441 CE LYS A 29 0.309 5.036 -11.566 1.00 0.00 C ATOM 442 NZ LYS A 29 -1.074 5.463 -11.195 1.00 0.00 N ATOM 0 H LYS A 29 3.966 5.472 -7.580 1.00 0.00 H new ATOM 0 HA LYS A 29 1.424 4.542 -6.378 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.946 3.441 -8.800 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.456 2.782 -8.154 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.267 4.907 -8.707 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.757 5.582 -9.336 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.831 3.618 -10.986 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.220 3.193 -10.444 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.953 5.914 -11.620 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.292 4.592 -12.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.428 6.142 -11.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.699 4.632 -11.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.059 5.913 -10.258 1.00 0.00 H new ATOM 456 N ILE A 30 4.460 3.296 -6.339 1.00 0.00 N ATOM 457 CA ILE A 30 5.444 2.383 -5.752 1.00 0.00 C ATOM 458 C ILE A 30 6.818 3.049 -5.583 1.00 0.00 C ATOM 459 O ILE A 30 7.138 4.041 -6.237 1.00 0.00 O ATOM 460 CB ILE A 30 5.626 1.130 -6.640 1.00 0.00 C ATOM 461 CG1 ILE A 30 5.812 1.464 -8.138 1.00 0.00 C ATOM 462 CG2 ILE A 30 4.497 0.106 -6.417 1.00 0.00 C ATOM 463 CD1 ILE A 30 6.455 0.317 -8.919 1.00 0.00 C ATOM 0 H ILE A 30 4.890 3.961 -6.982 1.00 0.00 H new ATOM 0 HA ILE A 30 5.058 2.104 -4.772 1.00 0.00 H new ATOM 0 HB ILE A 30 6.560 0.668 -6.320 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.843 1.700 -8.577 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.431 2.356 -8.234 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.660 -0.760 -7.058 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.493 -0.210 -5.374 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.538 0.563 -6.661 1.00 0.00 H new ATOM 0 HD11 ILE A 30 6.562 0.604 -9.965 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.437 0.097 -8.500 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.824 -0.569 -8.849 1.00 0.00 H new ATOM 475 N ALA A 31 7.646 2.444 -4.730 1.00 0.00 N ATOM 476 CA ALA A 31 9.069 2.759 -4.608 1.00 0.00 C ATOM 477 C ALA A 31 9.842 1.771 -5.501 1.00 0.00 C ATOM 478 O ALA A 31 9.403 0.637 -5.681 1.00 0.00 O ATOM 479 CB ALA A 31 9.485 2.708 -3.131 1.00 0.00 C ATOM 0 H ALA A 31 7.340 1.708 -4.093 1.00 0.00 H new ATOM 0 HA ALA A 31 9.296 3.770 -4.947 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.546 2.943 -3.043 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.904 3.435 -2.564 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.301 1.709 -2.735 1.00 0.00 H new ATOM 485 N VAL A 32 10.968 2.171 -6.087 1.00 0.00 N ATOM 486 CA VAL A 32 11.726 1.345 -7.051 1.00 0.00 C ATOM 487 C VAL A 32 13.238 1.397 -6.805 1.00 0.00 C ATOM 488 O VAL A 32 13.777 2.446 -6.456 1.00 0.00 O ATOM 489 CB VAL A 32 11.391 1.704 -8.513 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.918 1.448 -8.841 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.693 3.156 -8.889 1.00 0.00 C ATOM 0 H VAL A 32 11.391 3.082 -5.912 1.00 0.00 H new ATOM 0 HA VAL A 32 11.406 0.317 -6.882 1.00 0.00 H new ATOM 0 HB VAL A 32 12.043 1.051 -9.093 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.725 1.714 -9.880 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.689 0.393 -8.688 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.289 2.054 -8.189 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.429 3.324 -9.933 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.111 3.825 -8.255 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.755 3.355 -8.747 1.00 0.00 H new ATOM 501 N THR A 33 13.919 0.265 -6.999 1.00 0.00 N ATOM 502 CA THR A 33 15.366 0.095 -6.756 1.00 0.00 C ATOM 503 C THR A 33 15.959 -0.889 -7.768 1.00 0.00 C ATOM 504 O THR A 33 15.252 -1.778 -8.239 1.00 0.00 O ATOM 505 CB THR A 33 15.608 -0.427 -5.324 1.00 0.00 C ATOM 506 OG1 THR A 33 14.887 0.340 -4.380 1.00 0.00 O ATOM 507 CG2 THR A 33 17.073 -0.404 -4.882 1.00 0.00 C ATOM 0 H THR A 33 13.472 -0.587 -7.339 1.00 0.00 H new ATOM 0 HA THR A 33 15.853 1.063 -6.871 1.00 0.00 H new ATOM 0 HB THR A 33 15.272 -1.463 -5.357 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.370 0.347 -3.527 1.00 0.00 H new ATOM 0 HG21 THR A 33 17.152 -0.787 -3.865 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.665 -1.028 -5.552 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.447 0.619 -4.914 1.00 0.00 H new ATOM 515 N SER A 34 17.251 -0.781 -8.087 1.00 0.00 N ATOM 516 CA SER A 34 17.962 -1.687 -9.001 1.00 0.00 C ATOM 517 C SER A 34 19.255 -2.239 -8.395 1.00 0.00 C ATOM 518 O SER A 34 19.942 -1.573 -7.621 1.00 0.00 O ATOM 519 CB SER A 34 18.212 -1.036 -10.363 1.00 0.00 C ATOM 520 OG SER A 34 18.745 0.273 -10.267 1.00 0.00 O ATOM 0 H SER A 34 17.848 -0.045 -7.710 1.00 0.00 H new ATOM 0 HA SER A 34 17.304 -2.541 -9.161 1.00 0.00 H new ATOM 0 HB2 SER A 34 18.898 -1.660 -10.936 1.00 0.00 H new ATOM 0 HB3 SER A 34 17.275 -1.000 -10.919 1.00 0.00 H new ATOM 0 HG SER A 34 18.014 0.916 -10.152 1.00 0.00 H new ATOM 526 N CYS A 35 19.551 -3.499 -8.718 1.00 0.00 N ATOM 527 CA CYS A 35 20.604 -4.303 -8.102 1.00 0.00 C ATOM 528 C CYS A 35 21.070 -5.408 -9.073 1.00 0.00 C ATOM 529 O CYS A 35 20.366 -5.738 -10.028 1.00 0.00 O ATOM 530 CB CYS A 35 19.988 -4.847 -6.793 1.00 0.00 C ATOM 531 SG CYS A 35 20.961 -6.174 -6.030 1.00 0.00 S ATOM 0 H CYS A 35 19.044 -4.005 -9.444 1.00 0.00 H new ATOM 0 HA CYS A 35 21.505 -3.732 -7.877 1.00 0.00 H new ATOM 0 HB2 CYS A 35 19.886 -4.028 -6.081 1.00 0.00 H new ATOM 0 HB3 CYS A 35 18.984 -5.217 -7.000 1.00 0.00 H new ATOM 0 HG CYS A 35 22.209 -5.816 -5.968 1.00 0.00 H new ATOM 537 N GLY A 36 22.242 -6.002 -8.845 1.00 0.00 N ATOM 538 CA GLY A 36 22.698 -7.206 -9.551 1.00 0.00 C ATOM 539 C GLY A 36 23.169 -8.281 -8.573 1.00 0.00 C ATOM 540 O GLY A 36 23.601 -7.965 -7.465 1.00 0.00 O ATOM 0 H GLY A 36 22.912 -5.658 -8.157 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.887 -7.600 -10.164 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.512 -6.946 -10.228 1.00 0.00 H new ATOM 544 N LEU A 37 23.121 -9.560 -8.955 1.00 0.00 N ATOM 545 CA LEU A 37 23.470 -10.659 -8.035 1.00 0.00 C ATOM 546 C LEU A 37 24.947 -10.580 -7.593 1.00 0.00 C ATOM 547 O LEU A 37 25.252 -10.717 -6.410 1.00 0.00 O ATOM 548 CB LEU A 37 23.112 -12.021 -8.659 1.00 0.00 C ATOM 549 CG LEU A 37 21.629 -12.413 -8.487 1.00 0.00 C ATOM 550 CD1 LEU A 37 20.675 -11.656 -9.415 1.00 0.00 C ATOM 551 CD2 LEU A 37 21.449 -13.905 -8.752 1.00 0.00 C ATOM 0 H LEU A 37 22.846 -9.865 -9.889 1.00 0.00 H new ATOM 0 HA LEU A 37 22.874 -10.552 -7.128 1.00 0.00 H new ATOM 0 HB2 LEU A 37 23.351 -11.997 -9.722 1.00 0.00 H new ATOM 0 HB3 LEU A 37 23.737 -12.792 -8.209 1.00 0.00 H new ATOM 0 HG LEU A 37 21.376 -12.149 -7.460 1.00 0.00 H new ATOM 0 HD11 LEU A 37 19.652 -11.987 -9.234 1.00 0.00 H new ATOM 0 HD12 LEU A 37 20.750 -10.586 -9.220 1.00 0.00 H new ATOM 0 HD13 LEU A 37 20.942 -11.855 -10.453 1.00 0.00 H new ATOM 0 HD21 LEU A 37 20.400 -14.173 -8.628 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.764 -14.134 -9.770 1.00 0.00 H new ATOM 0 HD23 LEU A 37 22.054 -14.475 -8.047 1.00 0.00 H new ATOM 563 N GLU A 38 25.835 -10.240 -8.532 1.00 0.00 N ATOM 564 CA GLU A 38 27.252 -9.895 -8.293 1.00 0.00 C ATOM 565 C GLU A 38 27.475 -8.394 -8.576 1.00 0.00 C ATOM 566 O GLU A 38 28.537 -7.983 -9.048 1.00 0.00 O ATOM 567 CB GLU A 38 28.156 -10.786 -9.167 1.00 0.00 C ATOM 568 CG GLU A 38 27.971 -12.298 -8.962 1.00 0.00 C ATOM 569 CD GLU A 38 28.242 -12.763 -7.513 1.00 0.00 C ATOM 570 OE1 GLU A 38 29.199 -12.271 -6.865 1.00 0.00 O ATOM 571 OE2 GLU A 38 27.519 -13.666 -7.025 1.00 0.00 O ATOM 0 H GLU A 38 25.583 -10.194 -9.519 1.00 0.00 H new ATOM 0 HA GLU A 38 27.512 -10.079 -7.251 1.00 0.00 H new ATOM 0 HB2 GLU A 38 27.969 -10.551 -10.215 1.00 0.00 H new ATOM 0 HB3 GLU A 38 29.196 -10.532 -8.964 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.953 -12.572 -9.238 1.00 0.00 H new ATOM 0 HG3 GLU A 38 28.639 -12.832 -9.637 1.00 0.00 H new ATOM 578 N SER A 39 26.461 -7.569 -8.278 1.00 0.00 N ATOM 579 CA SER A 39 26.329 -6.158 -8.684 1.00 0.00 C ATOM 580 C SER A 39 26.031 -6.033 -10.192 1.00 0.00 C ATOM 581 O SER A 39 26.022 -7.020 -10.928 1.00 0.00 O ATOM 582 CB SER A 39 27.525 -5.307 -8.239 1.00 0.00 C ATOM 583 OG SER A 39 27.138 -3.946 -8.219 1.00 0.00 O ATOM 0 H SER A 39 25.668 -7.882 -7.718 1.00 0.00 H new ATOM 0 HA SER A 39 25.467 -5.748 -8.158 1.00 0.00 H new ATOM 0 HB2 SER A 39 27.861 -5.618 -7.250 1.00 0.00 H new ATOM 0 HB3 SER A 39 28.364 -5.450 -8.920 1.00 0.00 H new ATOM 0 HG SER A 39 27.896 -3.394 -7.934 1.00 0.00 H new ATOM 589 N SER A 40 25.695 -4.830 -10.648 1.00 0.00 N ATOM 590 CA SER A 40 25.420 -4.492 -12.057 1.00 0.00 C ATOM 591 C SER A 40 25.811 -3.027 -12.342 1.00 0.00 C ATOM 592 O SER A 40 26.602 -2.447 -11.595 1.00 0.00 O ATOM 593 CB SER A 40 23.960 -4.817 -12.412 1.00 0.00 C ATOM 594 OG SER A 40 23.058 -4.040 -11.648 1.00 0.00 O ATOM 0 H SER A 40 25.601 -4.026 -10.028 1.00 0.00 H new ATOM 0 HA SER A 40 26.037 -5.108 -12.711 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.792 -4.633 -13.473 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.769 -5.876 -12.238 1.00 0.00 H new ATOM 0 HG SER A 40 22.497 -3.506 -12.248 1.00 0.00 H new ATOM 600 N ARG A 41 25.328 -2.416 -13.436 1.00 0.00 N ATOM 601 CA ARG A 41 25.807 -1.098 -13.915 1.00 0.00 C ATOM 602 C ARG A 41 24.792 -0.326 -14.760 1.00 0.00 C ATOM 603 O ARG A 41 23.743 -0.846 -15.116 1.00 0.00 O ATOM 604 CB ARG A 41 27.100 -1.331 -14.741 1.00 0.00 C ATOM 605 CG ARG A 41 26.869 -2.199 -15.993 1.00 0.00 C ATOM 606 CD ARG A 41 28.074 -2.169 -16.932 1.00 0.00 C ATOM 607 NE ARG A 41 27.812 -3.017 -18.111 1.00 0.00 N ATOM 608 CZ ARG A 41 27.803 -2.675 -19.385 1.00 0.00 C ATOM 609 NH1 ARG A 41 28.094 -1.479 -19.803 1.00 0.00 N ATOM 610 NH2 ARG A 41 27.483 -3.572 -20.260 1.00 0.00 N ATOM 0 H ARG A 41 24.593 -2.818 -14.018 1.00 0.00 H new ATOM 0 HA ARG A 41 25.984 -0.480 -13.035 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.509 -0.367 -15.045 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.847 -1.809 -14.108 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.668 -3.227 -15.691 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.985 -1.844 -16.524 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.275 -1.145 -17.247 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.963 -2.522 -16.409 1.00 0.00 H new ATOM 0 HE ARG A 41 27.611 -3.998 -17.915 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.345 -0.752 -19.133 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.072 -1.268 -20.801 1.00 0.00 H new ATOM 0 HH21 ARG A 41 27.246 -4.517 -19.958 1.00 0.00 H new ATOM 0 HH22 ARG A 41 27.468 -3.334 -21.252 1.00 0.00 H new ATOM 624 N VAL A 42 25.147 0.908 -15.120 1.00 0.00 N ATOM 625 CA VAL A 42 24.459 1.731 -16.136 1.00 0.00 C ATOM 626 C VAL A 42 25.350 1.703 -17.393 1.00 0.00 C ATOM 627 O VAL A 42 26.557 1.484 -17.304 1.00 0.00 O ATOM 628 CB VAL A 42 24.176 3.168 -15.643 1.00 0.00 C ATOM 629 CG1 VAL A 42 23.296 3.966 -16.615 1.00 0.00 C ATOM 630 CG2 VAL A 42 23.443 3.167 -14.297 1.00 0.00 C ATOM 0 H VAL A 42 25.947 1.385 -14.703 1.00 0.00 H new ATOM 0 HA VAL A 42 23.472 1.324 -16.355 1.00 0.00 H new ATOM 0 HB VAL A 42 25.158 3.633 -15.559 1.00 0.00 H new ATOM 0 HG11 VAL A 42 23.130 4.967 -16.217 1.00 0.00 H new ATOM 0 HG12 VAL A 42 23.794 4.037 -17.582 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.338 3.461 -16.737 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.261 4.194 -13.981 1.00 0.00 H new ATOM 0 HG22 VAL A 42 22.492 2.645 -14.401 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.055 2.661 -13.550 1.00 0.00 H new ATOM 640 N HIS A 43 24.760 1.897 -18.572 1.00 0.00 N ATOM 641 CA HIS A 43 25.456 1.838 -19.870 1.00 0.00 C ATOM 642 C HIS A 43 25.173 3.113 -20.682 1.00 0.00 C ATOM 643 O HIS A 43 23.997 3.442 -20.822 1.00 0.00 O ATOM 644 CB HIS A 43 25.017 0.563 -20.610 1.00 0.00 C ATOM 645 CG HIS A 43 25.720 0.389 -21.930 1.00 0.00 C ATOM 646 ND1 HIS A 43 27.086 0.150 -22.079 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.163 0.584 -23.159 1.00 0.00 C ATOM 648 CE1 HIS A 43 27.326 0.209 -23.401 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.192 0.475 -24.071 1.00 0.00 N ATOM 0 H HIS A 43 23.765 2.104 -18.660 1.00 0.00 H new ATOM 0 HA HIS A 43 26.535 1.792 -19.723 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.214 -0.304 -19.980 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.940 0.597 -20.777 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.124 0.784 -23.375 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.293 0.063 -23.859 1.00 0.00 H new ATOM 0 HE2 HIS A 43 26.107 0.579 -25.082 1.00 0.00 H new ATOM 657 N PRO A 44 26.166 3.820 -21.259 1.00 0.00 N ATOM 658 CA PRO A 44 25.947 5.115 -21.921 1.00 0.00 C ATOM 659 C PRO A 44 24.878 5.095 -23.018 1.00 0.00 C ATOM 660 O PRO A 44 24.026 5.981 -23.077 1.00 0.00 O ATOM 661 CB PRO A 44 27.317 5.528 -22.475 1.00 0.00 C ATOM 662 CG PRO A 44 28.287 4.877 -21.496 1.00 0.00 C ATOM 663 CD PRO A 44 27.599 3.556 -21.169 1.00 0.00 C ATOM 0 HA PRO A 44 25.552 5.832 -21.201 1.00 0.00 H new ATOM 0 HB2 PRO A 44 27.467 5.168 -23.493 1.00 0.00 H new ATOM 0 HB3 PRO A 44 27.433 6.611 -22.500 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.269 4.722 -21.942 1.00 0.00 H new ATOM 0 HG3 PRO A 44 28.434 5.488 -20.605 1.00 0.00 H new ATOM 0 HD2 PRO A 44 27.897 2.776 -21.869 1.00 0.00 H new ATOM 0 HD3 PRO A 44 27.871 3.210 -20.172 1.00 0.00 H new ATOM 671 N THR A 45 24.827 4.030 -23.823 1.00 0.00 N ATOM 672 CA THR A 45 23.802 3.877 -24.872 1.00 0.00 C ATOM 673 C THR A 45 22.406 3.685 -24.278 1.00 0.00 C ATOM 674 O THR A 45 21.437 4.195 -24.825 1.00 0.00 O ATOM 675 CB THR A 45 24.159 2.714 -25.820 1.00 0.00 C ATOM 676 OG1 THR A 45 25.546 2.686 -26.087 1.00 0.00 O ATOM 677 CG2 THR A 45 23.423 2.751 -27.154 1.00 0.00 C ATOM 0 H THR A 45 25.486 3.253 -23.771 1.00 0.00 H new ATOM 0 HA THR A 45 23.786 4.801 -25.450 1.00 0.00 H new ATOM 0 HB THR A 45 23.843 1.817 -25.288 1.00 0.00 H new ATOM 0 HG1 THR A 45 25.748 1.939 -26.689 1.00 0.00 H new ATOM 0 HG21 THR A 45 23.730 1.900 -27.762 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.348 2.703 -26.978 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.664 3.676 -27.677 1.00 0.00 H new ATOM 685 N ALA A 46 22.275 3.057 -23.104 1.00 0.00 N ATOM 686 CA ALA A 46 20.992 2.949 -22.398 1.00 0.00 C ATOM 687 C ALA A 46 20.576 4.253 -21.699 1.00 0.00 C ATOM 688 O ALA A 46 19.444 4.361 -21.244 1.00 0.00 O ATOM 689 CB ALA A 46 21.025 1.745 -21.446 1.00 0.00 C ATOM 0 H ALA A 46 23.052 2.610 -22.617 1.00 0.00 H new ATOM 0 HA ALA A 46 20.212 2.777 -23.140 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.071 1.668 -20.924 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.200 0.834 -22.018 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.827 1.877 -20.720 1.00 0.00 H new ATOM 695 N ILE A 47 21.459 5.248 -21.609 1.00 0.00 N ATOM 696 CA ILE A 47 21.069 6.599 -21.191 1.00 0.00 C ATOM 697 C ILE A 47 20.469 7.268 -22.440 1.00 0.00 C ATOM 698 O ILE A 47 19.286 7.601 -22.473 1.00 0.00 O ATOM 699 CB ILE A 47 22.264 7.381 -20.593 1.00 0.00 C ATOM 700 CG1 ILE A 47 22.931 6.601 -19.435 1.00 0.00 C ATOM 701 CG2 ILE A 47 21.776 8.755 -20.100 1.00 0.00 C ATOM 702 CD1 ILE A 47 24.200 7.255 -18.873 1.00 0.00 C ATOM 0 H ILE A 47 22.452 5.145 -21.820 1.00 0.00 H new ATOM 0 HA ILE A 47 20.335 6.578 -20.386 1.00 0.00 H new ATOM 0 HB ILE A 47 23.015 7.514 -21.372 1.00 0.00 H new ATOM 0 HG12 ILE A 47 22.208 6.487 -18.627 1.00 0.00 H new ATOM 0 HG13 ILE A 47 23.179 5.599 -19.785 1.00 0.00 H new ATOM 0 HG21 ILE A 47 22.615 9.309 -19.678 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.356 9.314 -20.937 1.00 0.00 H new ATOM 0 HG23 ILE A 47 21.011 8.617 -19.336 1.00 0.00 H new ATOM 0 HD11 ILE A 47 24.599 6.640 -18.066 1.00 0.00 H new ATOM 0 HD12 ILE A 47 24.944 7.344 -19.664 1.00 0.00 H new ATOM 0 HD13 ILE A 47 23.959 8.246 -18.489 1.00 0.00 H new ATOM 714 N ALA A 48 21.245 7.348 -23.526 1.00 0.00 N ATOM 715 CA ALA A 48 20.884 8.135 -24.709 1.00 0.00 C ATOM 716 C ALA A 48 19.684 7.571 -25.496 1.00 0.00 C ATOM 717 O ALA A 48 18.836 8.338 -25.948 1.00 0.00 O ATOM 718 CB ALA A 48 22.130 8.261 -25.596 1.00 0.00 C ATOM 0 H ALA A 48 22.141 6.869 -23.609 1.00 0.00 H new ATOM 0 HA ALA A 48 20.549 9.116 -24.372 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.887 8.844 -26.485 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.923 8.761 -25.040 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.466 7.268 -25.894 1.00 0.00 H new ATOM 724 N MET A 49 19.558 6.239 -25.601 1.00 0.00 N ATOM 725 CA MET A 49 18.428 5.589 -26.293 1.00 0.00 C ATOM 726 C MET A 49 17.107 5.636 -25.512 1.00 0.00 C ATOM 727 O MET A 49 16.068 5.259 -26.055 1.00 0.00 O ATOM 728 CB MET A 49 18.773 4.142 -26.685 1.00 0.00 C ATOM 729 CG MET A 49 19.958 4.020 -27.655 1.00 0.00 C ATOM 730 SD MET A 49 19.956 5.096 -29.120 1.00 0.00 S ATOM 731 CE MET A 49 18.350 4.694 -29.853 1.00 0.00 C ATOM 0 H MET A 49 20.233 5.582 -25.211 1.00 0.00 H new ATOM 0 HA MET A 49 18.266 6.176 -27.197 1.00 0.00 H new ATOM 0 HB2 MET A 49 18.998 3.576 -25.781 1.00 0.00 H new ATOM 0 HB3 MET A 49 17.896 3.681 -27.140 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.873 4.215 -27.095 1.00 0.00 H new ATOM 0 HG3 MET A 49 20.008 2.986 -27.997 1.00 0.00 H new ATOM 0 HE1 MET A 49 18.185 5.317 -30.732 1.00 0.00 H new ATOM 0 HE2 MET A 49 18.336 3.644 -30.145 1.00 0.00 H new ATOM 0 HE3 MET A 49 17.561 4.878 -29.124 1.00 0.00 H new ATOM 741 N MET A 50 17.135 6.082 -24.252 1.00 0.00 N ATOM 742 CA MET A 50 15.989 6.080 -23.328 1.00 0.00 C ATOM 743 C MET A 50 15.607 7.503 -22.891 1.00 0.00 C ATOM 744 O MET A 50 14.434 7.772 -22.643 1.00 0.00 O ATOM 745 CB MET A 50 16.277 5.142 -22.141 1.00 0.00 C ATOM 746 CG MET A 50 16.905 3.805 -22.564 1.00 0.00 C ATOM 747 SD MET A 50 15.970 2.785 -23.722 1.00 0.00 S ATOM 748 CE MET A 50 17.219 1.503 -24.034 1.00 0.00 C ATOM 0 H MET A 50 17.981 6.467 -23.831 1.00 0.00 H new ATOM 0 HA MET A 50 15.114 5.692 -23.850 1.00 0.00 H new ATOM 0 HB2 MET A 50 16.946 5.645 -21.443 1.00 0.00 H new ATOM 0 HB3 MET A 50 15.347 4.946 -21.607 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.878 4.014 -23.008 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.085 3.216 -21.664 1.00 0.00 H new ATOM 0 HE1 MET A 50 17.323 1.350 -25.108 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.176 1.818 -23.618 1.00 0.00 H new ATOM 0 HE3 MET A 50 16.908 0.570 -23.563 1.00 0.00 H new ATOM 758 N GLU A 51 16.545 8.457 -22.902 1.00 0.00 N ATOM 759 CA GLU A 51 16.257 9.890 -22.723 1.00 0.00 C ATOM 760 C GLU A 51 15.285 10.417 -23.798 1.00 0.00 C ATOM 761 O GLU A 51 14.461 11.284 -23.514 1.00 0.00 O ATOM 762 CB GLU A 51 17.553 10.716 -22.788 1.00 0.00 C ATOM 763 CG GLU A 51 18.340 10.714 -21.476 1.00 0.00 C ATOM 764 CD GLU A 51 19.558 11.660 -21.574 1.00 0.00 C ATOM 765 OE1 GLU A 51 20.455 11.427 -22.422 1.00 0.00 O ATOM 766 OE2 GLU A 51 19.621 12.653 -20.808 1.00 0.00 O ATOM 0 H GLU A 51 17.536 8.257 -23.037 1.00 0.00 H new ATOM 0 HA GLU A 51 15.793 9.997 -21.743 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.186 10.323 -23.584 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.307 11.744 -23.054 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.693 11.028 -20.657 1.00 0.00 H new ATOM 0 HG3 GLU A 51 18.675 9.702 -21.248 1.00 0.00 H new ATOM 773 N GLU A 52 15.309 9.845 -25.012 1.00 0.00 N ATOM 774 CA GLU A 52 14.360 10.178 -26.094 1.00 0.00 C ATOM 775 C GLU A 52 12.936 9.626 -25.858 1.00 0.00 C ATOM 776 O GLU A 52 11.989 10.031 -26.535 1.00 0.00 O ATOM 777 CB GLU A 52 14.936 9.766 -27.459 1.00 0.00 C ATOM 778 CG GLU A 52 15.240 8.267 -27.592 1.00 0.00 C ATOM 779 CD GLU A 52 15.612 7.908 -29.043 1.00 0.00 C ATOM 780 OE1 GLU A 52 16.637 8.407 -29.564 1.00 0.00 O ATOM 781 OE2 GLU A 52 14.879 7.096 -29.659 1.00 0.00 O ATOM 0 H GLU A 52 15.991 9.133 -25.275 1.00 0.00 H new ATOM 0 HA GLU A 52 14.238 11.261 -26.091 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.230 10.052 -28.239 1.00 0.00 H new ATOM 0 HB3 GLU A 52 15.853 10.328 -27.637 1.00 0.00 H new ATOM 0 HG2 GLU A 52 16.059 7.997 -26.925 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.371 7.687 -27.281 1.00 0.00 H new ATOM 788 N VAL A 53 12.778 8.744 -24.861 1.00 0.00 N ATOM 789 CA VAL A 53 11.496 8.248 -24.318 1.00 0.00 C ATOM 790 C VAL A 53 11.148 8.979 -22.995 1.00 0.00 C ATOM 791 O VAL A 53 10.133 8.703 -22.360 1.00 0.00 O ATOM 792 CB VAL A 53 11.535 6.702 -24.195 1.00 0.00 C ATOM 793 CG1 VAL A 53 10.182 6.069 -23.839 1.00 0.00 C ATOM 794 CG2 VAL A 53 11.988 6.047 -25.515 1.00 0.00 C ATOM 0 H VAL A 53 13.580 8.333 -24.384 1.00 0.00 H new ATOM 0 HA VAL A 53 10.682 8.479 -25.006 1.00 0.00 H new ATOM 0 HB VAL A 53 12.240 6.518 -23.385 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.293 4.987 -23.772 1.00 0.00 H new ATOM 0 HG12 VAL A 53 9.839 6.459 -22.881 1.00 0.00 H new ATOM 0 HG13 VAL A 53 9.452 6.311 -24.612 1.00 0.00 H new ATOM 0 HG21 VAL A 53 12.005 4.964 -25.396 1.00 0.00 H new ATOM 0 HG22 VAL A 53 11.293 6.314 -26.311 1.00 0.00 H new ATOM 0 HG23 VAL A 53 12.987 6.400 -25.772 1.00 0.00 H new ATOM 804 N GLY A 54 11.975 9.951 -22.581 1.00 0.00 N ATOM 805 CA GLY A 54 11.825 10.724 -21.343 1.00 0.00 C ATOM 806 C GLY A 54 12.353 10.027 -20.078 1.00 0.00 C ATOM 807 O GLY A 54 12.057 10.479 -18.970 1.00 0.00 O ATOM 0 H GLY A 54 12.795 10.229 -23.120 1.00 0.00 H new ATOM 0 HA2 GLY A 54 12.345 11.675 -21.460 1.00 0.00 H new ATOM 0 HA3 GLY A 54 10.769 10.953 -21.200 1.00 0.00 H new ATOM 811 N ILE A 55 13.110 8.930 -20.221 1.00 0.00 N ATOM 812 CA ILE A 55 13.616 8.126 -19.096 1.00 0.00 C ATOM 813 C ILE A 55 14.960 8.671 -18.583 1.00 0.00 C ATOM 814 O ILE A 55 15.767 9.203 -19.345 1.00 0.00 O ATOM 815 CB ILE A 55 13.691 6.618 -19.439 1.00 0.00 C ATOM 816 CG1 ILE A 55 12.522 6.106 -20.305 1.00 0.00 C ATOM 817 CG2 ILE A 55 13.767 5.773 -18.156 1.00 0.00 C ATOM 818 CD1 ILE A 55 11.121 6.245 -19.688 1.00 0.00 C ATOM 0 H ILE A 55 13.393 8.570 -21.133 1.00 0.00 H new ATOM 0 HA ILE A 55 12.895 8.218 -18.283 1.00 0.00 H new ATOM 0 HB ILE A 55 14.599 6.507 -20.032 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.535 6.643 -21.254 1.00 0.00 H new ATOM 0 HG13 ILE A 55 12.696 5.054 -20.531 1.00 0.00 H new ATOM 0 HG21 ILE A 55 13.819 4.716 -18.419 1.00 0.00 H new ATOM 0 HG22 ILE A 55 14.656 6.050 -17.590 1.00 0.00 H new ATOM 0 HG23 ILE A 55 12.880 5.953 -17.549 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.377 5.854 -20.382 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.077 5.683 -18.755 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.914 7.296 -19.489 1.00 0.00 H new ATOM 830 N ASP A 56 15.204 8.523 -17.281 1.00 0.00 N ATOM 831 CA ASP A 56 16.322 9.140 -16.545 1.00 0.00 C ATOM 832 C ASP A 56 17.043 8.107 -15.658 1.00 0.00 C ATOM 833 O ASP A 56 16.542 7.766 -14.586 1.00 0.00 O ATOM 834 CB ASP A 56 15.734 10.303 -15.726 1.00 0.00 C ATOM 835 CG ASP A 56 16.736 10.898 -14.725 1.00 0.00 C ATOM 836 OD1 ASP A 56 17.842 11.309 -15.146 1.00 0.00 O ATOM 837 OD2 ASP A 56 16.413 10.947 -13.511 1.00 0.00 O ATOM 0 H ASP A 56 14.610 7.950 -16.682 1.00 0.00 H new ATOM 0 HA ASP A 56 17.081 9.516 -17.231 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.399 11.086 -16.406 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.854 9.952 -15.186 1.00 0.00 H new ATOM 842 N ILE A 57 18.202 7.590 -16.099 1.00 0.00 N ATOM 843 CA ILE A 57 18.938 6.507 -15.408 1.00 0.00 C ATOM 844 C ILE A 57 20.404 6.831 -15.076 1.00 0.00 C ATOM 845 O ILE A 57 21.066 6.026 -14.430 1.00 0.00 O ATOM 846 CB ILE A 57 18.808 5.152 -16.155 1.00 0.00 C ATOM 847 CG1 ILE A 57 19.667 5.073 -17.439 1.00 0.00 C ATOM 848 CG2 ILE A 57 17.341 4.827 -16.480 1.00 0.00 C ATOM 849 CD1 ILE A 57 19.688 3.669 -18.061 1.00 0.00 C ATOM 0 H ILE A 57 18.662 7.911 -16.951 1.00 0.00 H new ATOM 0 HA ILE A 57 18.445 6.415 -14.440 1.00 0.00 H new ATOM 0 HB ILE A 57 19.196 4.402 -15.466 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.282 5.783 -18.171 1.00 0.00 H new ATOM 0 HG13 ILE A 57 20.688 5.377 -17.206 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.287 3.872 -17.003 1.00 0.00 H new ATOM 0 HG22 ILE A 57 16.768 4.767 -15.555 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.926 5.611 -17.113 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.307 3.678 -18.958 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.100 2.959 -17.343 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.673 3.372 -18.323 1.00 0.00 H new ATOM 861 N SER A 58 20.935 7.988 -15.488 1.00 0.00 N ATOM 862 CA SER A 58 22.363 8.336 -15.328 1.00 0.00 C ATOM 863 C SER A 58 22.806 8.452 -13.861 1.00 0.00 C ATOM 864 O SER A 58 23.966 8.191 -13.543 1.00 0.00 O ATOM 865 CB SER A 58 22.660 9.646 -16.069 1.00 0.00 C ATOM 866 OG SER A 58 21.843 10.696 -15.568 1.00 0.00 O ATOM 0 H SER A 58 20.388 8.717 -15.945 1.00 0.00 H new ATOM 0 HA SER A 58 22.936 7.514 -15.758 1.00 0.00 H new ATOM 0 HB2 SER A 58 23.712 9.907 -15.951 1.00 0.00 H new ATOM 0 HB3 SER A 58 22.482 9.516 -17.136 1.00 0.00 H new ATOM 0 HG SER A 58 22.045 11.526 -16.049 1.00 0.00 H new ATOM 872 N GLY A 59 21.874 8.786 -12.961 1.00 0.00 N ATOM 873 CA GLY A 59 22.093 8.853 -11.512 1.00 0.00 C ATOM 874 C GLY A 59 22.004 7.509 -10.771 1.00 0.00 C ATOM 875 O GLY A 59 22.256 7.476 -9.565 1.00 0.00 O ATOM 0 H GLY A 59 20.919 9.024 -13.229 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.077 9.285 -11.330 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.360 9.536 -11.082 1.00 0.00 H new ATOM 879 N GLN A 60 21.637 6.406 -11.443 1.00 0.00 N ATOM 880 CA GLN A 60 21.477 5.092 -10.793 1.00 0.00 C ATOM 881 C GLN A 60 22.817 4.372 -10.529 1.00 0.00 C ATOM 882 O GLN A 60 23.834 4.626 -11.179 1.00 0.00 O ATOM 883 CB GLN A 60 20.509 4.204 -11.591 1.00 0.00 C ATOM 884 CG GLN A 60 19.050 4.653 -11.411 1.00 0.00 C ATOM 885 CD GLN A 60 18.105 3.891 -12.333 1.00 0.00 C ATOM 886 OE1 GLN A 60 17.400 4.457 -13.152 1.00 0.00 O ATOM 887 NE2 GLN A 60 18.065 2.581 -12.270 1.00 0.00 N ATOM 0 H GLN A 60 21.444 6.397 -12.444 1.00 0.00 H new ATOM 0 HA GLN A 60 21.045 5.283 -9.810 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.772 4.236 -12.648 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.614 3.168 -11.268 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.748 4.501 -10.375 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.971 5.721 -11.612 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.645 2.085 -11.593 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.454 2.059 -12.898 1.00 0.00 H new ATOM 896 N THR A 61 22.789 3.442 -9.569 1.00 0.00 N ATOM 897 CA THR A 61 23.931 2.649 -9.070 1.00 0.00 C ATOM 898 C THR A 61 23.552 1.161 -8.941 1.00 0.00 C ATOM 899 O THR A 61 22.445 0.756 -9.310 1.00 0.00 O ATOM 900 CB THR A 61 24.413 3.211 -7.713 1.00 0.00 C ATOM 901 OG1 THR A 61 23.353 3.202 -6.775 1.00 0.00 O ATOM 902 CG2 THR A 61 24.935 4.646 -7.821 1.00 0.00 C ATOM 0 H THR A 61 21.922 3.204 -9.088 1.00 0.00 H new ATOM 0 HA THR A 61 24.747 2.724 -9.789 1.00 0.00 H new ATOM 0 HB THR A 61 25.230 2.567 -7.389 1.00 0.00 H new ATOM 0 HG1 THR A 61 23.671 3.558 -5.919 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.260 4.990 -6.839 1.00 0.00 H new ATOM 0 HG22 THR A 61 25.777 4.676 -8.513 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.140 5.296 -8.188 1.00 0.00 H new ATOM 910 N SER A 62 24.471 0.320 -8.453 1.00 0.00 N ATOM 911 CA SER A 62 24.200 -1.078 -8.077 1.00 0.00 C ATOM 912 C SER A 62 25.132 -1.565 -6.956 1.00 0.00 C ATOM 913 O SER A 62 26.200 -0.989 -6.728 1.00 0.00 O ATOM 914 CB SER A 62 24.375 -2.002 -9.277 1.00 0.00 C ATOM 915 OG SER A 62 23.583 -3.164 -9.093 1.00 0.00 O ATOM 0 H SER A 62 25.442 0.594 -8.305 1.00 0.00 H new ATOM 0 HA SER A 62 23.170 -1.108 -7.721 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.080 -1.488 -10.192 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.424 -2.277 -9.389 1.00 0.00 H new ATOM 0 HG SER A 62 23.269 -3.487 -9.963 1.00 0.00 H new ATOM 921 N ASP A 63 24.732 -2.649 -6.290 1.00 0.00 N ATOM 922 CA ASP A 63 25.529 -3.416 -5.324 1.00 0.00 C ATOM 923 C ASP A 63 25.132 -4.907 -5.390 1.00 0.00 C ATOM 924 O ASP A 63 24.024 -5.208 -5.854 1.00 0.00 O ATOM 925 CB ASP A 63 25.319 -2.884 -3.897 1.00 0.00 C ATOM 926 CG ASP A 63 26.013 -1.536 -3.640 1.00 0.00 C ATOM 927 OD1 ASP A 63 27.260 -1.525 -3.480 1.00 0.00 O ATOM 928 OD2 ASP A 63 25.320 -0.496 -3.529 1.00 0.00 O ATOM 0 H ASP A 63 23.797 -3.038 -6.414 1.00 0.00 H new ATOM 0 HA ASP A 63 26.583 -3.307 -5.580 1.00 0.00 H new ATOM 0 HB2 ASP A 63 24.250 -2.775 -3.711 1.00 0.00 H new ATOM 0 HB3 ASP A 63 25.693 -3.619 -3.184 1.00 0.00 H new ATOM 933 N PRO A 64 25.974 -5.849 -4.913 1.00 0.00 N ATOM 934 CA PRO A 64 25.631 -7.273 -4.837 1.00 0.00 C ATOM 935 C PRO A 64 24.404 -7.520 -3.955 1.00 0.00 C ATOM 936 O PRO A 64 24.328 -7.000 -2.840 1.00 0.00 O ATOM 937 CB PRO A 64 26.871 -7.985 -4.279 1.00 0.00 C ATOM 938 CG PRO A 64 28.012 -7.014 -4.581 1.00 0.00 C ATOM 939 CD PRO A 64 27.336 -5.650 -4.441 1.00 0.00 C ATOM 0 HA PRO A 64 25.364 -7.657 -5.822 1.00 0.00 H new ATOM 0 HB2 PRO A 64 26.778 -8.173 -3.209 1.00 0.00 H new ATOM 0 HB3 PRO A 64 27.029 -8.950 -4.760 1.00 0.00 H new ATOM 0 HG2 PRO A 64 28.839 -7.130 -3.881 1.00 0.00 H new ATOM 0 HG3 PRO A 64 28.418 -7.164 -5.581 1.00 0.00 H new ATOM 0 HD2 PRO A 64 27.348 -5.309 -3.406 1.00 0.00 H new ATOM 0 HD3 PRO A 64 27.851 -4.893 -5.032 1.00 0.00 H new ATOM 947 N ILE A 65 23.455 -8.339 -4.413 1.00 0.00 N ATOM 948 CA ILE A 65 22.141 -8.479 -3.753 1.00 0.00 C ATOM 949 C ILE A 65 22.208 -8.910 -2.274 1.00 0.00 C ATOM 950 O ILE A 65 21.416 -8.442 -1.461 1.00 0.00 O ATOM 951 CB ILE A 65 21.216 -9.386 -4.601 1.00 0.00 C ATOM 952 CG1 ILE A 65 19.750 -9.144 -4.189 1.00 0.00 C ATOM 953 CG2 ILE A 65 21.606 -10.881 -4.535 1.00 0.00 C ATOM 954 CD1 ILE A 65 18.751 -9.978 -4.983 1.00 0.00 C ATOM 0 H ILE A 65 23.567 -8.921 -5.243 1.00 0.00 H new ATOM 0 HA ILE A 65 21.706 -7.481 -3.707 1.00 0.00 H new ATOM 0 HB ILE A 65 21.340 -9.112 -5.649 1.00 0.00 H new ATOM 0 HG12 ILE A 65 19.637 -9.368 -3.128 1.00 0.00 H new ATOM 0 HG13 ILE A 65 19.514 -8.088 -4.318 1.00 0.00 H new ATOM 0 HG21 ILE A 65 20.920 -11.463 -5.150 1.00 0.00 H new ATOM 0 HG22 ILE A 65 22.623 -11.008 -4.906 1.00 0.00 H new ATOM 0 HG23 ILE A 65 21.550 -11.226 -3.503 1.00 0.00 H new ATOM 0 HD11 ILE A 65 17.740 -9.757 -4.641 1.00 0.00 H new ATOM 0 HD12 ILE A 65 18.836 -9.737 -6.043 1.00 0.00 H new ATOM 0 HD13 ILE A 65 18.961 -11.037 -4.834 1.00 0.00 H new ATOM 966 N GLU A 66 23.202 -9.714 -1.888 1.00 0.00 N ATOM 967 CA GLU A 66 23.374 -10.177 -0.500 1.00 0.00 C ATOM 968 C GLU A 66 23.779 -9.064 0.493 1.00 0.00 C ATOM 969 O GLU A 66 23.734 -9.286 1.706 1.00 0.00 O ATOM 970 CB GLU A 66 24.368 -11.353 -0.452 1.00 0.00 C ATOM 971 CG GLU A 66 23.887 -12.579 -1.240 1.00 0.00 C ATOM 972 CD GLU A 66 24.841 -13.771 -1.024 1.00 0.00 C ATOM 973 OE1 GLU A 66 25.853 -13.885 -1.759 1.00 0.00 O ATOM 974 OE2 GLU A 66 24.593 -14.597 -0.113 1.00 0.00 O ATOM 0 H GLU A 66 23.914 -10.066 -2.528 1.00 0.00 H new ATOM 0 HA GLU A 66 22.392 -10.514 -0.167 1.00 0.00 H new ATOM 0 HB2 GLU A 66 25.328 -11.026 -0.851 1.00 0.00 H new ATOM 0 HB3 GLU A 66 24.535 -11.638 0.587 1.00 0.00 H new ATOM 0 HG2 GLU A 66 22.880 -12.850 -0.923 1.00 0.00 H new ATOM 0 HG3 GLU A 66 23.833 -12.337 -2.302 1.00 0.00 H new ATOM 981 N ASN A 67 24.128 -7.857 0.017 1.00 0.00 N ATOM 982 CA ASN A 67 24.320 -6.683 0.881 1.00 0.00 C ATOM 983 C ASN A 67 22.979 -6.090 1.388 1.00 0.00 C ATOM 984 O ASN A 67 22.965 -5.388 2.403 1.00 0.00 O ATOM 985 CB ASN A 67 25.205 -5.635 0.166 1.00 0.00 C ATOM 986 CG ASN A 67 24.419 -4.451 -0.388 1.00 0.00 C ATOM 987 OD1 ASN A 67 24.378 -3.374 0.188 1.00 0.00 O ATOM 988 ND2 ASN A 67 23.744 -4.625 -1.493 1.00 0.00 N ATOM 0 H ASN A 67 24.284 -7.669 -0.973 1.00 0.00 H new ATOM 0 HA ASN A 67 24.845 -7.008 1.779 1.00 0.00 H new ATOM 0 HB2 ASN A 67 25.956 -5.267 0.865 1.00 0.00 H new ATOM 0 HB3 ASN A 67 25.740 -6.120 -0.651 1.00 0.00 H new ATOM 0 HD21 ASN A 67 23.184 -3.862 -1.874 1.00 0.00 H new ATOM 0 HD22 ASN A 67 23.777 -5.523 -1.975 1.00 0.00 H new ATOM 995 N PHE A 68 21.865 -6.357 0.691 1.00 0.00 N ATOM 996 CA PHE A 68 20.534 -5.825 1.002 1.00 0.00 C ATOM 997 C PHE A 68 19.701 -6.777 1.888 1.00 0.00 C ATOM 998 O PHE A 68 20.073 -7.928 2.127 1.00 0.00 O ATOM 999 CB PHE A 68 19.802 -5.484 -0.313 1.00 0.00 C ATOM 1000 CG PHE A 68 20.472 -4.443 -1.192 1.00 0.00 C ATOM 1001 CD1 PHE A 68 20.785 -3.170 -0.675 1.00 0.00 C ATOM 1002 CD2 PHE A 68 20.757 -4.733 -2.541 1.00 0.00 C ATOM 1003 CE1 PHE A 68 21.386 -2.202 -1.497 1.00 0.00 C ATOM 1004 CE2 PHE A 68 21.370 -3.766 -3.356 1.00 0.00 C ATOM 1005 CZ PHE A 68 21.676 -2.499 -2.838 1.00 0.00 C ATOM 0 H PHE A 68 21.867 -6.966 -0.127 1.00 0.00 H new ATOM 0 HA PHE A 68 20.661 -4.916 1.590 1.00 0.00 H new ATOM 0 HB2 PHE A 68 19.688 -6.401 -0.891 1.00 0.00 H new ATOM 0 HB3 PHE A 68 18.799 -5.134 -0.068 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.562 -2.938 0.356 1.00 0.00 H new ATOM 0 HD2 PHE A 68 20.504 -5.700 -2.949 1.00 0.00 H new ATOM 0 HE1 PHE A 68 21.625 -1.228 -1.097 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.606 -3.999 -4.384 1.00 0.00 H new ATOM 0 HZ PHE A 68 22.134 -1.753 -3.470 1.00 0.00 H new ATOM 1015 N ASN A 69 18.546 -6.285 2.357 1.00 0.00 N ATOM 1016 CA ASN A 69 17.562 -7.028 3.152 1.00 0.00 C ATOM 1017 C ASN A 69 16.205 -7.090 2.434 1.00 0.00 C ATOM 1018 O ASN A 69 15.528 -6.072 2.304 1.00 0.00 O ATOM 1019 CB ASN A 69 17.460 -6.396 4.563 1.00 0.00 C ATOM 1020 CG ASN A 69 17.495 -4.865 4.621 1.00 0.00 C ATOM 1021 OD1 ASN A 69 18.351 -4.271 5.262 1.00 0.00 O ATOM 1022 ND2 ASN A 69 16.593 -4.167 3.962 1.00 0.00 N ATOM 0 H ASN A 69 18.262 -5.321 2.185 1.00 0.00 H new ATOM 0 HA ASN A 69 17.891 -8.061 3.268 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.533 -6.736 5.025 1.00 0.00 H new ATOM 0 HB3 ASN A 69 18.279 -6.781 5.171 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.616 -3.148 3.991 1.00 0.00 H new ATOM 0 HD22 ASN A 69 15.872 -4.646 3.422 1.00 0.00 H new ATOM 1029 N ALA A 70 15.749 -8.269 2.012 1.00 0.00 N ATOM 1030 CA ALA A 70 14.519 -8.405 1.228 1.00 0.00 C ATOM 1031 C ALA A 70 13.236 -8.071 2.017 1.00 0.00 C ATOM 1032 O ALA A 70 12.179 -7.876 1.424 1.00 0.00 O ATOM 1033 CB ALA A 70 14.473 -9.811 0.644 1.00 0.00 C ATOM 0 H ALA A 70 16.219 -9.154 2.202 1.00 0.00 H new ATOM 0 HA ALA A 70 14.546 -7.665 0.428 1.00 0.00 H new ATOM 0 HB1 ALA A 70 13.563 -9.931 0.056 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.342 -9.968 0.004 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.482 -10.541 1.453 1.00 0.00 H new ATOM 1039 N ASP A 71 13.325 -7.935 3.345 1.00 0.00 N ATOM 1040 CA ASP A 71 12.221 -7.515 4.223 1.00 0.00 C ATOM 1041 C ASP A 71 11.660 -6.122 3.862 1.00 0.00 C ATOM 1042 O ASP A 71 10.522 -5.788 4.196 1.00 0.00 O ATOM 1043 CB ASP A 71 12.748 -7.492 5.663 1.00 0.00 C ATOM 1044 CG ASP A 71 11.632 -7.263 6.695 1.00 0.00 C ATOM 1045 OD1 ASP A 71 10.755 -8.150 6.837 1.00 0.00 O ATOM 1046 OD2 ASP A 71 11.655 -6.226 7.401 1.00 0.00 O ATOM 0 H ASP A 71 14.189 -8.118 3.855 1.00 0.00 H new ATOM 0 HA ASP A 71 11.402 -8.223 4.101 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.249 -8.436 5.878 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.496 -6.705 5.760 1.00 0.00 H new ATOM 1051 N ASP A 72 12.462 -5.322 3.153 1.00 0.00 N ATOM 1052 CA ASP A 72 12.167 -3.951 2.743 1.00 0.00 C ATOM 1053 C ASP A 72 11.770 -3.834 1.256 1.00 0.00 C ATOM 1054 O ASP A 72 11.488 -2.732 0.794 1.00 0.00 O ATOM 1055 CB ASP A 72 13.386 -3.090 3.108 1.00 0.00 C ATOM 1056 CG ASP A 72 13.112 -1.578 3.029 1.00 0.00 C ATOM 1057 OD1 ASP A 72 12.156 -1.094 3.681 1.00 0.00 O ATOM 1058 OD2 ASP A 72 13.892 -0.854 2.365 1.00 0.00 O ATOM 0 H ASP A 72 13.380 -5.631 2.835 1.00 0.00 H new ATOM 0 HA ASP A 72 11.286 -3.590 3.274 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.709 -3.341 4.118 1.00 0.00 H new ATOM 0 HB3 ASP A 72 14.210 -3.338 2.439 1.00 0.00 H new ATOM 1063 N TYR A 73 11.747 -4.952 0.508 1.00 0.00 N ATOM 1064 CA TYR A 73 11.436 -5.020 -0.919 1.00 0.00 C ATOM 1065 C TYR A 73 10.297 -6.018 -1.139 1.00 0.00 C ATOM 1066 O TYR A 73 10.501 -7.162 -1.545 1.00 0.00 O ATOM 1067 CB TYR A 73 12.688 -5.362 -1.732 1.00 0.00 C ATOM 1068 CG TYR A 73 13.821 -4.384 -1.510 1.00 0.00 C ATOM 1069 CD1 TYR A 73 14.706 -4.597 -0.442 1.00 0.00 C ATOM 1070 CD2 TYR A 73 13.962 -3.246 -2.321 1.00 0.00 C ATOM 1071 CE1 TYR A 73 15.743 -3.688 -0.174 1.00 0.00 C ATOM 1072 CE2 TYR A 73 15.010 -2.339 -2.073 1.00 0.00 C ATOM 1073 CZ TYR A 73 15.898 -2.547 -0.993 1.00 0.00 C ATOM 1074 OH TYR A 73 16.893 -1.647 -0.759 1.00 0.00 O ATOM 0 H TYR A 73 11.955 -5.868 0.905 1.00 0.00 H new ATOM 0 HA TYR A 73 11.100 -4.046 -1.273 1.00 0.00 H new ATOM 0 HB2 TYR A 73 13.024 -6.365 -1.468 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.433 -5.380 -2.792 1.00 0.00 H new ATOM 0 HD1 TYR A 73 14.588 -5.471 0.182 1.00 0.00 H new ATOM 0 HD2 TYR A 73 13.270 -3.068 -3.131 1.00 0.00 H new ATOM 0 HE1 TYR A 73 16.417 -3.860 0.652 1.00 0.00 H new ATOM 0 HE2 TYR A 73 15.136 -1.478 -2.713 1.00 0.00 H new ATOM 0 HH TYR A 73 16.846 -0.928 -1.423 1.00 0.00 H new ATOM 1084 N ASP A 74 9.088 -5.556 -0.831 1.00 0.00 N ATOM 1085 CA ASP A 74 7.823 -6.306 -0.841 1.00 0.00 C ATOM 1086 C ASP A 74 7.536 -7.005 -2.179 1.00 0.00 C ATOM 1087 O ASP A 74 6.767 -7.965 -2.241 1.00 0.00 O ATOM 1088 CB ASP A 74 6.659 -5.337 -0.574 1.00 0.00 C ATOM 1089 CG ASP A 74 6.972 -4.276 0.495 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.657 -3.288 0.134 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.536 -4.428 1.662 1.00 0.00 O ATOM 0 H ASP A 74 8.951 -4.586 -0.549 1.00 0.00 H new ATOM 0 HA ASP A 74 7.916 -7.071 -0.070 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.394 -4.835 -1.505 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.786 -5.909 -0.261 1.00 0.00 H new ATOM 1096 N VAL A 75 8.130 -6.499 -3.262 1.00 0.00 N ATOM 1097 CA VAL A 75 7.969 -6.985 -4.629 1.00 0.00 C ATOM 1098 C VAL A 75 9.354 -7.041 -5.283 1.00 0.00 C ATOM 1099 O VAL A 75 10.143 -6.108 -5.151 1.00 0.00 O ATOM 1100 CB VAL A 75 6.972 -6.072 -5.368 1.00 0.00 C ATOM 1101 CG1 VAL A 75 6.838 -6.457 -6.847 1.00 0.00 C ATOM 1102 CG2 VAL A 75 5.575 -6.134 -4.735 1.00 0.00 C ATOM 0 H VAL A 75 8.765 -5.703 -3.204 1.00 0.00 H new ATOM 0 HA VAL A 75 7.553 -7.992 -4.663 1.00 0.00 H new ATOM 0 HB VAL A 75 7.372 -5.062 -5.286 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.126 -5.790 -7.334 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.809 -6.370 -7.335 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.484 -7.485 -6.925 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.898 -5.478 -5.282 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.201 -7.157 -4.777 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.632 -5.811 -3.695 1.00 0.00 H new ATOM 1112 N VAL A 76 9.692 -8.136 -5.971 1.00 0.00 N ATOM 1113 CA VAL A 76 11.037 -8.322 -6.560 1.00 0.00 C ATOM 1114 C VAL A 76 10.925 -8.910 -7.964 1.00 0.00 C ATOM 1115 O VAL A 76 10.344 -9.975 -8.154 1.00 0.00 O ATOM 1116 CB VAL A 76 11.943 -9.178 -5.646 1.00 0.00 C ATOM 1117 CG1 VAL A 76 13.314 -9.460 -6.283 1.00 0.00 C ATOM 1118 CG2 VAL A 76 12.213 -8.494 -4.293 1.00 0.00 C ATOM 0 H VAL A 76 9.055 -8.915 -6.138 1.00 0.00 H new ATOM 0 HA VAL A 76 11.513 -7.345 -6.643 1.00 0.00 H new ATOM 0 HB VAL A 76 11.394 -10.108 -5.501 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.914 -10.064 -5.603 1.00 0.00 H new ATOM 0 HG12 VAL A 76 13.176 -9.998 -7.221 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.826 -8.517 -6.478 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.854 -9.132 -3.684 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.708 -7.538 -4.461 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.269 -8.328 -3.775 1.00 0.00 H new ATOM 1128 N ILE A 77 11.477 -8.207 -8.956 1.00 0.00 N ATOM 1129 CA ILE A 77 11.494 -8.619 -10.366 1.00 0.00 C ATOM 1130 C ILE A 77 12.936 -8.943 -10.750 1.00 0.00 C ATOM 1131 O ILE A 77 13.810 -8.078 -10.731 1.00 0.00 O ATOM 1132 CB ILE A 77 10.891 -7.517 -11.285 1.00 0.00 C ATOM 1133 CG1 ILE A 77 9.345 -7.390 -11.312 1.00 0.00 C ATOM 1134 CG2 ILE A 77 11.317 -7.712 -12.754 1.00 0.00 C ATOM 1135 CD1 ILE A 77 8.578 -7.825 -10.062 1.00 0.00 C ATOM 0 H ILE A 77 11.938 -7.311 -8.799 1.00 0.00 H new ATOM 0 HA ILE A 77 10.872 -9.504 -10.500 1.00 0.00 H new ATOM 0 HB ILE A 77 11.291 -6.612 -10.828 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.097 -6.348 -11.513 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.974 -7.974 -12.154 1.00 0.00 H new ATOM 0 HG21 ILE A 77 10.878 -6.925 -13.368 1.00 0.00 H new ATOM 0 HG22 ILE A 77 12.404 -7.666 -12.827 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.971 -8.683 -13.107 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.509 -7.681 -10.222 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.776 -8.878 -9.861 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.901 -7.226 -9.210 1.00 0.00 H new ATOM 1147 N SER A 78 13.187 -10.189 -11.128 1.00 0.00 N ATOM 1148 CA SER A 78 14.436 -10.620 -11.743 1.00 0.00 C ATOM 1149 C SER A 78 14.351 -10.456 -13.263 1.00 0.00 C ATOM 1150 O SER A 78 13.260 -10.454 -13.831 1.00 0.00 O ATOM 1151 CB SER A 78 14.752 -12.050 -11.303 1.00 0.00 C ATOM 1152 OG SER A 78 15.849 -12.553 -12.033 1.00 0.00 O ATOM 0 H SER A 78 12.513 -10.946 -11.013 1.00 0.00 H new ATOM 0 HA SER A 78 15.265 -9.995 -11.411 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.976 -12.069 -10.236 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.881 -12.687 -11.457 1.00 0.00 H new ATOM 0 HG SER A 78 15.528 -13.172 -12.722 1.00 0.00 H new ATOM 1158 N LEU A 79 15.495 -10.302 -13.931 1.00 0.00 N ATOM 1159 CA LEU A 79 15.614 -10.215 -15.392 1.00 0.00 C ATOM 1160 C LEU A 79 16.639 -11.238 -15.921 1.00 0.00 C ATOM 1161 O LEU A 79 17.533 -10.895 -16.694 1.00 0.00 O ATOM 1162 CB LEU A 79 15.883 -8.757 -15.832 1.00 0.00 C ATOM 1163 CG LEU A 79 14.792 -7.751 -15.397 1.00 0.00 C ATOM 1164 CD1 LEU A 79 15.184 -7.008 -14.118 1.00 0.00 C ATOM 1165 CD2 LEU A 79 14.560 -6.692 -16.468 1.00 0.00 C ATOM 0 H LEU A 79 16.395 -10.232 -13.457 1.00 0.00 H new ATOM 0 HA LEU A 79 14.665 -10.491 -15.852 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.841 -8.437 -15.422 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.975 -8.728 -16.918 1.00 0.00 H new ATOM 0 HG LEU A 79 13.891 -8.341 -15.232 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.392 -6.311 -13.845 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.330 -7.726 -13.311 1.00 0.00 H new ATOM 0 HD13 LEU A 79 16.110 -6.458 -14.286 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.788 -5.999 -16.133 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.486 -6.145 -16.645 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.240 -7.173 -17.392 1.00 0.00 H new ATOM 1177 N CYS A 80 16.542 -12.484 -15.446 1.00 0.00 N ATOM 1178 CA CYS A 80 17.404 -13.609 -15.828 1.00 0.00 C ATOM 1179 C CYS A 80 16.678 -14.597 -16.766 1.00 0.00 C ATOM 1180 O CYS A 80 17.289 -15.141 -17.691 1.00 0.00 O ATOM 1181 CB CYS A 80 17.846 -14.302 -14.536 1.00 0.00 C ATOM 1182 SG CYS A 80 19.247 -15.415 -14.842 1.00 0.00 S ATOM 0 H CYS A 80 15.835 -12.747 -14.759 1.00 0.00 H new ATOM 0 HA CYS A 80 18.267 -13.243 -16.385 1.00 0.00 H new ATOM 0 HB2 CYS A 80 18.127 -13.553 -13.795 1.00 0.00 H new ATOM 0 HB3 CYS A 80 17.013 -14.867 -14.118 1.00 0.00 H new ATOM 0 HG CYS A 80 19.734 -15.821 -13.707 1.00 0.00 H new ATOM 1188 N GLY A 81 15.377 -14.805 -16.542 1.00 0.00 N ATOM 1189 CA GLY A 81 14.491 -15.645 -17.350 1.00 0.00 C ATOM 1190 C GLY A 81 14.243 -17.011 -16.712 1.00 0.00 C ATOM 1191 O GLY A 81 14.990 -17.957 -16.974 1.00 0.00 O ATOM 0 H GLY A 81 14.892 -14.372 -15.756 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.538 -15.134 -17.490 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.928 -15.783 -18.339 1.00 0.00 H new ATOM 1195 N CYS A 82 13.191 -17.088 -15.884 1.00 0.00 N ATOM 1196 CA CYS A 82 12.691 -18.287 -15.184 1.00 0.00 C ATOM 1197 C CYS A 82 13.780 -19.269 -14.674 1.00 0.00 C ATOM 1198 O CYS A 82 13.673 -20.488 -14.853 1.00 0.00 O ATOM 1199 CB CYS A 82 11.559 -18.938 -16.008 1.00 0.00 C ATOM 1200 SG CYS A 82 12.107 -19.516 -17.644 1.00 0.00 S ATOM 0 H CYS A 82 12.629 -16.264 -15.670 1.00 0.00 H new ATOM 0 HA CYS A 82 12.264 -17.951 -14.239 1.00 0.00 H new ATOM 0 HB2 CYS A 82 11.150 -19.780 -15.450 1.00 0.00 H new ATOM 0 HB3 CYS A 82 10.751 -18.218 -16.136 1.00 0.00 H new ATOM 0 HG CYS A 82 11.103 -20.051 -18.274 1.00 0.00 H new ATOM 1206 N GLY A 83 14.839 -18.744 -14.044 1.00 0.00 N ATOM 1207 CA GLY A 83 16.026 -19.516 -13.648 1.00 0.00 C ATOM 1208 C GLY A 83 17.110 -18.771 -12.851 1.00 0.00 C ATOM 1209 O GLY A 83 18.234 -19.265 -12.759 1.00 0.00 O ATOM 0 H GLY A 83 14.897 -17.758 -13.791 1.00 0.00 H new ATOM 0 HA2 GLY A 83 15.694 -20.367 -13.054 1.00 0.00 H new ATOM 0 HA3 GLY A 83 16.486 -19.918 -14.551 1.00 0.00 H new ATOM 1213 N VAL A 84 16.815 -17.596 -12.280 1.00 0.00 N ATOM 1214 CA VAL A 84 17.740 -16.816 -11.448 1.00 0.00 C ATOM 1215 C VAL A 84 18.153 -17.577 -10.179 1.00 0.00 C ATOM 1216 O VAL A 84 17.374 -18.337 -9.601 1.00 0.00 O ATOM 1217 CB VAL A 84 17.127 -15.438 -11.126 1.00 0.00 C ATOM 1218 CG1 VAL A 84 15.951 -15.495 -10.146 1.00 0.00 C ATOM 1219 CG2 VAL A 84 18.190 -14.452 -10.630 1.00 0.00 C ATOM 0 H VAL A 84 15.904 -17.150 -12.387 1.00 0.00 H new ATOM 0 HA VAL A 84 18.657 -16.655 -12.014 1.00 0.00 H new ATOM 0 HB VAL A 84 16.722 -15.078 -12.072 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.575 -14.487 -9.970 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.156 -16.111 -10.567 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.284 -15.928 -9.203 1.00 0.00 H new ATOM 0 HG21 VAL A 84 17.722 -13.492 -10.413 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.654 -14.843 -9.724 1.00 0.00 H new ATOM 0 HG23 VAL A 84 18.951 -14.319 -11.399 1.00 0.00 H new ATOM 1229 N ASN A 85 19.387 -17.348 -9.722 1.00 0.00 N ATOM 1230 CA ASN A 85 19.998 -18.061 -8.595 1.00 0.00 C ATOM 1231 C ASN A 85 19.919 -17.233 -7.290 1.00 0.00 C ATOM 1232 O ASN A 85 20.936 -16.831 -6.717 1.00 0.00 O ATOM 1233 CB ASN A 85 21.424 -18.490 -8.991 1.00 0.00 C ATOM 1234 CG ASN A 85 22.069 -19.447 -7.995 1.00 0.00 C ATOM 1235 OD1 ASN A 85 21.435 -20.017 -7.116 1.00 0.00 O ATOM 1236 ND2 ASN A 85 23.356 -19.685 -8.122 1.00 0.00 N ATOM 0 H ASN A 85 20.003 -16.647 -10.133 1.00 0.00 H new ATOM 0 HA ASN A 85 19.438 -18.969 -8.372 1.00 0.00 H new ATOM 0 HB2 ASN A 85 21.393 -18.965 -9.972 1.00 0.00 H new ATOM 0 HB3 ASN A 85 22.049 -17.602 -9.087 1.00 0.00 H new ATOM 0 HD21 ASN A 85 23.818 -20.340 -7.491 1.00 0.00 H new ATOM 0 HD22 ASN A 85 23.892 -19.215 -8.851 1.00 0.00 H new ATOM 1243 N LEU A 86 18.695 -16.901 -6.867 1.00 0.00 N ATOM 1244 CA LEU A 86 18.428 -16.008 -5.730 1.00 0.00 C ATOM 1245 C LEU A 86 18.376 -16.723 -4.362 1.00 0.00 C ATOM 1246 O LEU A 86 17.864 -17.845 -4.287 1.00 0.00 O ATOM 1247 CB LEU A 86 17.080 -15.292 -5.945 1.00 0.00 C ATOM 1248 CG LEU A 86 17.093 -14.108 -6.919 1.00 0.00 C ATOM 1249 CD1 LEU A 86 15.670 -13.590 -7.089 1.00 0.00 C ATOM 1250 CD2 LEU A 86 17.945 -12.950 -6.415 1.00 0.00 C ATOM 0 H LEU A 86 17.846 -17.250 -7.311 1.00 0.00 H new ATOM 0 HA LEU A 86 19.265 -15.310 -5.699 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.356 -16.024 -6.304 1.00 0.00 H new ATOM 0 HB3 LEU A 86 16.722 -14.937 -4.979 1.00 0.00 H new ATOM 0 HG LEU A 86 17.514 -14.468 -7.858 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.670 -12.747 -7.780 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.038 -14.385 -7.485 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.283 -13.267 -6.123 1.00 0.00 H new ATOM 0 HD21 LEU A 86 17.921 -12.137 -7.141 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.552 -12.597 -5.462 1.00 0.00 H new ATOM 0 HD23 LEU A 86 18.973 -13.286 -6.281 1.00 0.00 H new ATOM 1262 N PRO A 87 18.819 -16.063 -3.270 1.00 0.00 N ATOM 1263 CA PRO A 87 18.592 -16.544 -1.905 1.00 0.00 C ATOM 1264 C PRO A 87 17.081 -16.515 -1.574 1.00 0.00 C ATOM 1265 O PRO A 87 16.362 -15.685 -2.140 1.00 0.00 O ATOM 1266 CB PRO A 87 19.403 -15.617 -0.981 1.00 0.00 C ATOM 1267 CG PRO A 87 20.426 -14.965 -1.911 1.00 0.00 C ATOM 1268 CD PRO A 87 19.704 -14.905 -3.253 1.00 0.00 C ATOM 0 HA PRO A 87 18.913 -17.578 -1.777 1.00 0.00 H new ATOM 0 HB2 PRO A 87 18.766 -14.872 -0.505 1.00 0.00 H new ATOM 0 HB3 PRO A 87 19.890 -16.177 -0.183 1.00 0.00 H new ATOM 0 HG2 PRO A 87 20.708 -13.971 -1.563 1.00 0.00 H new ATOM 0 HG3 PRO A 87 21.342 -15.553 -1.974 1.00 0.00 H new ATOM 0 HD2 PRO A 87 19.140 -13.978 -3.354 1.00 0.00 H new ATOM 0 HD3 PRO A 87 20.412 -14.939 -4.081 1.00 0.00 H new ATOM 1276 N PRO A 88 16.570 -17.348 -0.643 1.00 0.00 N ATOM 1277 CA PRO A 88 15.123 -17.523 -0.448 1.00 0.00 C ATOM 1278 C PRO A 88 14.337 -16.246 -0.122 1.00 0.00 C ATOM 1279 O PRO A 88 13.228 -16.049 -0.619 1.00 0.00 O ATOM 1280 CB PRO A 88 14.987 -18.560 0.675 1.00 0.00 C ATOM 1281 CG PRO A 88 16.266 -19.383 0.546 1.00 0.00 C ATOM 1282 CD PRO A 88 17.302 -18.341 0.134 1.00 0.00 C ATOM 0 HA PRO A 88 14.678 -17.843 -1.390 1.00 0.00 H new ATOM 0 HB2 PRO A 88 14.910 -18.086 1.654 1.00 0.00 H new ATOM 0 HB3 PRO A 88 14.097 -19.176 0.548 1.00 0.00 H new ATOM 0 HG2 PRO A 88 16.531 -19.867 1.486 1.00 0.00 H new ATOM 0 HG3 PRO A 88 16.166 -20.171 -0.201 1.00 0.00 H new ATOM 0 HD2 PRO A 88 17.771 -17.888 1.007 1.00 0.00 H new ATOM 0 HD3 PRO A 88 18.099 -18.792 -0.457 1.00 0.00 H new ATOM 1290 N GLU A 89 14.927 -15.319 0.637 1.00 0.00 N ATOM 1291 CA GLU A 89 14.260 -14.062 1.007 1.00 0.00 C ATOM 1292 C GLU A 89 13.917 -13.173 -0.204 1.00 0.00 C ATOM 1293 O GLU A 89 12.954 -12.407 -0.166 1.00 0.00 O ATOM 1294 CB GLU A 89 15.069 -13.335 2.091 1.00 0.00 C ATOM 1295 CG GLU A 89 16.431 -12.792 1.641 1.00 0.00 C ATOM 1296 CD GLU A 89 17.103 -12.005 2.786 1.00 0.00 C ATOM 1297 OE1 GLU A 89 17.812 -12.628 3.613 1.00 0.00 O ATOM 1298 OE2 GLU A 89 16.921 -10.765 2.871 1.00 0.00 O ATOM 0 H GLU A 89 15.871 -15.414 1.011 1.00 0.00 H new ATOM 0 HA GLU A 89 13.288 -14.313 1.432 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.473 -12.505 2.470 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.227 -14.020 2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.074 -13.616 1.332 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.303 -12.145 0.773 1.00 0.00 H new ATOM 1305 N TRP A 90 14.625 -13.326 -1.329 1.00 0.00 N ATOM 1306 CA TRP A 90 14.391 -12.553 -2.556 1.00 0.00 C ATOM 1307 C TRP A 90 13.304 -13.124 -3.479 1.00 0.00 C ATOM 1308 O TRP A 90 12.909 -12.462 -4.436 1.00 0.00 O ATOM 1309 CB TRP A 90 15.732 -12.365 -3.276 1.00 0.00 C ATOM 1310 CG TRP A 90 16.674 -11.510 -2.497 1.00 0.00 C ATOM 1311 CD1 TRP A 90 17.713 -11.925 -1.739 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.567 -10.078 -2.280 1.00 0.00 C ATOM 1313 NE1 TRP A 90 18.243 -10.844 -1.057 1.00 0.00 N ATOM 1314 CE2 TRP A 90 17.532 -9.692 -1.309 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.700 -9.081 -2.767 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 17.576 -8.395 -0.787 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.741 -7.774 -2.258 1.00 0.00 C ATOM 1318 CH2 TRP A 90 16.653 -7.441 -1.244 1.00 0.00 C ATOM 0 H TRP A 90 15.387 -13.999 -1.415 1.00 0.00 H new ATOM 0 HA TRP A 90 13.984 -11.585 -2.263 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.188 -13.339 -3.451 1.00 0.00 H new ATOM 0 HB3 TRP A 90 15.558 -11.914 -4.253 1.00 0.00 H new ATOM 0 HD1 TRP A 90 18.073 -12.941 -1.676 1.00 0.00 H new ATOM 0 HE1 TRP A 90 19.057 -10.894 -0.445 1.00 0.00 H new ATOM 0 HE3 TRP A 90 14.992 -9.326 -3.545 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 18.311 -8.131 -0.041 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.070 -7.023 -2.647 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.645 -6.450 -0.815 1.00 0.00 H new ATOM 1329 N VAL A 91 12.789 -14.322 -3.179 1.00 0.00 N ATOM 1330 CA VAL A 91 11.761 -15.038 -3.978 1.00 0.00 C ATOM 1331 C VAL A 91 10.465 -15.305 -3.204 1.00 0.00 C ATOM 1332 O VAL A 91 9.403 -15.449 -3.802 1.00 0.00 O ATOM 1333 CB VAL A 91 12.302 -16.373 -4.528 1.00 0.00 C ATOM 1334 CG1 VAL A 91 13.408 -16.134 -5.558 1.00 0.00 C ATOM 1335 CG2 VAL A 91 12.862 -17.280 -3.425 1.00 0.00 C ATOM 0 H VAL A 91 13.078 -14.844 -2.351 1.00 0.00 H new ATOM 0 HA VAL A 91 11.524 -14.367 -4.803 1.00 0.00 H new ATOM 0 HB VAL A 91 11.451 -16.870 -4.993 1.00 0.00 H new ATOM 0 HG11 VAL A 91 13.772 -17.092 -5.930 1.00 0.00 H new ATOM 0 HG12 VAL A 91 13.012 -15.549 -6.388 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.229 -15.591 -5.091 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.229 -18.206 -3.867 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.681 -16.771 -2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.074 -17.508 -2.707 1.00 0.00 H new ATOM 1345 N THR A 92 10.541 -15.323 -1.870 1.00 0.00 N ATOM 1346 CA THR A 92 9.423 -15.611 -0.943 1.00 0.00 C ATOM 1347 C THR A 92 8.529 -14.379 -0.651 1.00 0.00 C ATOM 1348 O THR A 92 7.692 -14.380 0.257 1.00 0.00 O ATOM 1349 CB THR A 92 10.000 -16.280 0.320 1.00 0.00 C ATOM 1350 OG1 THR A 92 9.000 -16.937 1.072 1.00 0.00 O ATOM 1351 CG2 THR A 92 10.742 -15.282 1.201 1.00 0.00 C ATOM 0 H THR A 92 11.414 -15.131 -1.379 1.00 0.00 H new ATOM 0 HA THR A 92 8.732 -16.306 -1.420 1.00 0.00 H new ATOM 0 HB THR A 92 10.713 -17.027 -0.028 1.00 0.00 H new ATOM 0 HG1 THR A 92 8.213 -16.358 1.146 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.133 -15.794 2.080 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.567 -14.844 0.639 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.057 -14.494 1.514 1.00 0.00 H new ATOM 1359 N GLN A 93 8.708 -13.307 -1.432 1.00 0.00 N ATOM 1360 CA GLN A 93 7.916 -12.071 -1.388 1.00 0.00 C ATOM 1361 C GLN A 93 6.451 -12.292 -1.805 1.00 0.00 C ATOM 1362 O GLN A 93 6.114 -13.312 -2.415 1.00 0.00 O ATOM 1363 CB GLN A 93 8.570 -11.030 -2.317 1.00 0.00 C ATOM 1364 CG GLN A 93 9.991 -10.626 -1.901 1.00 0.00 C ATOM 1365 CD GLN A 93 10.094 -10.040 -0.493 1.00 0.00 C ATOM 1366 OE1 GLN A 93 9.176 -9.443 0.057 1.00 0.00 O ATOM 1367 NE2 GLN A 93 11.229 -10.192 0.144 1.00 0.00 N ATOM 0 H GLN A 93 9.440 -13.275 -2.142 1.00 0.00 H new ATOM 0 HA GLN A 93 7.902 -11.718 -0.357 1.00 0.00 H new ATOM 0 HB2 GLN A 93 8.599 -11.430 -3.330 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.943 -10.139 -2.345 1.00 0.00 H new ATOM 0 HG2 GLN A 93 10.638 -11.501 -1.966 1.00 0.00 H new ATOM 0 HG3 GLN A 93 10.371 -9.895 -2.614 1.00 0.00 H new ATOM 0 HE21 GLN A 93 12.002 -10.687 -0.302 1.00 0.00 H new ATOM 0 HE22 GLN A 93 11.340 -9.816 1.085 1.00 0.00 H new ATOM 1376 N GLU A 94 5.576 -11.316 -1.530 1.00 0.00 N ATOM 1377 CA GLU A 94 4.161 -11.407 -1.929 1.00 0.00 C ATOM 1378 C GLU A 94 3.976 -11.457 -3.455 1.00 0.00 C ATOM 1379 O GLU A 94 3.106 -12.191 -3.933 1.00 0.00 O ATOM 1380 CB GLU A 94 3.304 -10.300 -1.292 1.00 0.00 C ATOM 1381 CG GLU A 94 3.726 -8.849 -1.564 1.00 0.00 C ATOM 1382 CD GLU A 94 2.666 -7.867 -1.027 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.670 -7.567 0.194 1.00 0.00 O ATOM 1384 OE2 GLU A 94 1.815 -7.389 -1.818 1.00 0.00 O ATOM 0 H GLU A 94 5.819 -10.458 -1.036 1.00 0.00 H new ATOM 0 HA GLU A 94 3.801 -12.359 -1.539 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.278 -10.425 -1.638 1.00 0.00 H new ATOM 0 HB3 GLU A 94 3.298 -10.455 -0.213 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.688 -8.649 -1.091 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.860 -8.698 -2.635 1.00 0.00 H new ATOM 1391 N ILE A 95 4.801 -10.725 -4.223 1.00 0.00 N ATOM 1392 CA ILE A 95 4.800 -10.762 -5.698 1.00 0.00 C ATOM 1393 C ILE A 95 6.242 -10.851 -6.226 1.00 0.00 C ATOM 1394 O ILE A 95 7.108 -10.060 -5.845 1.00 0.00 O ATOM 1395 CB ILE A 95 4.010 -9.561 -6.282 1.00 0.00 C ATOM 1396 CG1 ILE A 95 2.568 -9.538 -5.714 1.00 0.00 C ATOM 1397 CG2 ILE A 95 3.991 -9.609 -7.822 1.00 0.00 C ATOM 1398 CD1 ILE A 95 1.696 -8.362 -6.148 1.00 0.00 C ATOM 0 H ILE A 95 5.494 -10.085 -3.835 1.00 0.00 H new ATOM 0 HA ILE A 95 4.281 -11.659 -6.037 1.00 0.00 H new ATOM 0 HB ILE A 95 4.514 -8.642 -5.984 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.069 -10.462 -6.006 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.627 -9.538 -4.626 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.431 -8.756 -8.206 1.00 0.00 H new ATOM 0 HG22 ILE A 95 5.013 -9.572 -8.200 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.516 -10.533 -8.151 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.711 -8.451 -5.690 1.00 0.00 H new ATOM 0 HD12 ILE A 95 2.161 -7.428 -5.831 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.593 -8.366 -7.233 1.00 0.00 H new ATOM 1410 N PHE A 96 6.488 -11.805 -7.130 1.00 0.00 N ATOM 1411 CA PHE A 96 7.792 -12.061 -7.755 1.00 0.00 C ATOM 1412 C PHE A 96 7.668 -12.271 -9.277 1.00 0.00 C ATOM 1413 O PHE A 96 6.652 -12.777 -9.757 1.00 0.00 O ATOM 1414 CB PHE A 96 8.455 -13.270 -7.076 1.00 0.00 C ATOM 1415 CG PHE A 96 9.828 -13.612 -7.629 1.00 0.00 C ATOM 1416 CD1 PHE A 96 10.958 -12.899 -7.193 1.00 0.00 C ATOM 1417 CD2 PHE A 96 9.975 -14.598 -8.626 1.00 0.00 C ATOM 1418 CE1 PHE A 96 12.222 -13.159 -7.749 1.00 0.00 C ATOM 1419 CE2 PHE A 96 11.241 -14.873 -9.173 1.00 0.00 C ATOM 1420 CZ PHE A 96 12.364 -14.146 -8.739 1.00 0.00 C ATOM 0 H PHE A 96 5.762 -12.442 -7.458 1.00 0.00 H new ATOM 0 HA PHE A 96 8.422 -11.183 -7.614 1.00 0.00 H new ATOM 0 HB2 PHE A 96 8.544 -13.071 -6.008 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.804 -14.137 -7.185 1.00 0.00 H new ATOM 0 HD1 PHE A 96 10.854 -12.146 -6.426 1.00 0.00 H new ATOM 0 HD2 PHE A 96 9.110 -15.145 -8.972 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.084 -12.600 -7.416 1.00 0.00 H new ATOM 0 HE2 PHE A 96 11.351 -15.641 -9.925 1.00 0.00 H new ATOM 0 HZ PHE A 96 13.335 -14.346 -9.167 1.00 0.00 H new ATOM 1430 N GLU A 97 8.713 -11.920 -10.029 1.00 0.00 N ATOM 1431 CA GLU A 97 8.850 -12.201 -11.469 1.00 0.00 C ATOM 1432 C GLU A 97 10.301 -12.568 -11.828 1.00 0.00 C ATOM 1433 O GLU A 97 11.225 -12.158 -11.131 1.00 0.00 O ATOM 1434 CB GLU A 97 8.476 -10.964 -12.307 1.00 0.00 C ATOM 1435 CG GLU A 97 7.069 -10.371 -12.123 1.00 0.00 C ATOM 1436 CD GLU A 97 5.914 -11.278 -12.599 1.00 0.00 C ATOM 1437 OE1 GLU A 97 6.143 -12.291 -13.304 1.00 0.00 O ATOM 1438 OE2 GLU A 97 4.742 -10.917 -12.330 1.00 0.00 O ATOM 0 H GLU A 97 9.514 -11.417 -9.646 1.00 0.00 H new ATOM 0 HA GLU A 97 8.181 -13.033 -11.689 1.00 0.00 H new ATOM 0 HB2 GLU A 97 9.201 -10.180 -12.088 1.00 0.00 H new ATOM 0 HB3 GLU A 97 8.595 -11.224 -13.359 1.00 0.00 H new ATOM 0 HG2 GLU A 97 6.922 -10.144 -11.067 1.00 0.00 H new ATOM 0 HG3 GLU A 97 7.015 -9.426 -12.663 1.00 0.00 H new ATOM 1445 N ASP A 98 10.520 -13.267 -12.948 1.00 0.00 N ATOM 1446 CA ASP A 98 11.860 -13.489 -13.525 1.00 0.00 C ATOM 1447 C ASP A 98 11.832 -13.372 -15.063 1.00 0.00 C ATOM 1448 O ASP A 98 11.724 -14.369 -15.780 1.00 0.00 O ATOM 1449 CB ASP A 98 12.480 -14.816 -13.046 1.00 0.00 C ATOM 1450 CG ASP A 98 13.962 -14.948 -13.435 1.00 0.00 C ATOM 1451 OD1 ASP A 98 14.583 -13.943 -13.866 1.00 0.00 O ATOM 1452 OD2 ASP A 98 14.517 -16.060 -13.296 1.00 0.00 O ATOM 0 H ASP A 98 9.770 -13.700 -13.487 1.00 0.00 H new ATOM 0 HA ASP A 98 12.513 -12.698 -13.157 1.00 0.00 H new ATOM 0 HB2 ASP A 98 12.384 -14.888 -11.963 1.00 0.00 H new ATOM 0 HB3 ASP A 98 11.920 -15.649 -13.471 1.00 0.00 H new ATOM 1457 N TRP A 99 11.869 -12.131 -15.561 1.00 0.00 N ATOM 1458 CA TRP A 99 11.712 -11.760 -16.972 1.00 0.00 C ATOM 1459 C TRP A 99 12.867 -12.259 -17.861 1.00 0.00 C ATOM 1460 O TRP A 99 14.017 -12.332 -17.441 1.00 0.00 O ATOM 1461 CB TRP A 99 11.530 -10.232 -17.082 1.00 0.00 C ATOM 1462 CG TRP A 99 10.346 -9.626 -16.377 1.00 0.00 C ATOM 1463 CD1 TRP A 99 9.248 -10.292 -15.948 1.00 0.00 C ATOM 1464 CD2 TRP A 99 10.102 -8.219 -16.034 1.00 0.00 C ATOM 1465 NE1 TRP A 99 8.373 -9.419 -15.335 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.854 -8.135 -15.347 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.787 -6.998 -16.248 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.332 -6.930 -14.867 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.263 -5.772 -15.783 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.039 -5.737 -15.085 1.00 0.00 C ATOM 0 H TRP A 99 12.016 -11.319 -14.962 1.00 0.00 H new ATOM 0 HA TRP A 99 10.820 -12.260 -17.350 1.00 0.00 H new ATOM 0 HB2 TRP A 99 12.432 -9.756 -16.697 1.00 0.00 H new ATOM 0 HB3 TRP A 99 11.461 -9.976 -18.139 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.081 -11.352 -16.068 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.481 -9.694 -14.925 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.728 -7.005 -16.777 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.393 -6.917 -14.333 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 10.804 -4.855 -15.963 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.648 -4.799 -14.720 1.00 0.00 H new ATOM 1481 N GLN A 100 12.556 -12.541 -19.129 1.00 0.00 N ATOM 1482 CA GLN A 100 13.452 -13.150 -20.137 1.00 0.00 C ATOM 1483 C GLN A 100 13.709 -12.104 -21.232 1.00 0.00 C ATOM 1484 O GLN A 100 13.334 -12.232 -22.397 1.00 0.00 O ATOM 1485 CB GLN A 100 12.901 -14.518 -20.594 1.00 0.00 C ATOM 1486 CG GLN A 100 11.433 -14.552 -21.060 1.00 0.00 C ATOM 1487 CD GLN A 100 10.942 -15.989 -21.242 1.00 0.00 C ATOM 1488 OE1 GLN A 100 10.883 -16.525 -22.342 1.00 0.00 O ATOM 1489 NE2 GLN A 100 10.586 -16.676 -20.173 1.00 0.00 N ATOM 0 H GLN A 100 11.629 -12.344 -19.507 1.00 0.00 H new ATOM 0 HA GLN A 100 14.432 -13.405 -19.733 1.00 0.00 H new ATOM 0 HB2 GLN A 100 13.526 -14.881 -21.410 1.00 0.00 H new ATOM 0 HB3 GLN A 100 13.013 -15.222 -19.770 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.805 -14.040 -20.330 1.00 0.00 H new ATOM 0 HG3 GLN A 100 11.335 -14.010 -22.000 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.630 -16.243 -19.251 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.267 -17.640 -20.269 1.00 0.00 H new ATOM 1498 N LEU A 101 14.296 -11.002 -20.765 1.00 0.00 N ATOM 1499 CA LEU A 101 14.468 -9.730 -21.463 1.00 0.00 C ATOM 1500 C LEU A 101 15.890 -9.559 -22.039 1.00 0.00 C ATOM 1501 O LEU A 101 16.875 -9.826 -21.354 1.00 0.00 O ATOM 1502 CB LEU A 101 14.040 -8.700 -20.393 1.00 0.00 C ATOM 1503 CG LEU A 101 13.886 -7.218 -20.737 1.00 0.00 C ATOM 1504 CD1 LEU A 101 15.228 -6.493 -20.664 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.223 -6.981 -22.090 1.00 0.00 C ATOM 0 H LEU A 101 14.690 -10.974 -19.825 1.00 0.00 H new ATOM 0 HA LEU A 101 13.870 -9.624 -22.368 1.00 0.00 H new ATOM 0 HB2 LEU A 101 13.083 -9.035 -19.994 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.764 -8.765 -19.581 1.00 0.00 H new ATOM 0 HG LEU A 101 13.217 -6.802 -19.983 1.00 0.00 H new ATOM 0 HD11 LEU A 101 15.087 -5.441 -20.913 1.00 0.00 H new ATOM 0 HD12 LEU A 101 15.632 -6.576 -19.655 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.924 -6.944 -21.371 1.00 0.00 H new ATOM 0 HD21 LEU A 101 13.144 -5.910 -22.274 1.00 0.00 H new ATOM 0 HD22 LEU A 101 13.824 -7.440 -22.875 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.227 -7.424 -22.090 1.00 0.00 H new ATOM 1517 N GLU A 102 15.992 -9.104 -23.293 1.00 0.00 N ATOM 1518 CA GLU A 102 17.225 -9.000 -24.083 1.00 0.00 C ATOM 1519 C GLU A 102 18.271 -8.098 -23.426 1.00 0.00 C ATOM 1520 O GLU A 102 17.954 -7.034 -22.909 1.00 0.00 O ATOM 1521 CB GLU A 102 16.933 -8.423 -25.486 1.00 0.00 C ATOM 1522 CG GLU A 102 15.817 -9.139 -26.252 1.00 0.00 C ATOM 1523 CD GLU A 102 15.652 -8.545 -27.665 1.00 0.00 C ATOM 1524 OE1 GLU A 102 14.891 -7.558 -27.813 1.00 0.00 O ATOM 1525 OE2 GLU A 102 16.270 -9.067 -28.626 1.00 0.00 O ATOM 0 H GLU A 102 15.175 -8.782 -23.811 1.00 0.00 H new ATOM 0 HA GLU A 102 17.617 -10.015 -24.151 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.668 -7.371 -25.383 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.847 -8.465 -26.079 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.044 -10.203 -26.324 1.00 0.00 H new ATOM 0 HG3 GLU A 102 14.879 -9.050 -25.704 1.00 0.00 H new ATOM 1532 N ASP A 103 19.537 -8.496 -23.495 1.00 0.00 N ATOM 1533 CA ASP A 103 20.662 -7.635 -23.106 1.00 0.00 C ATOM 1534 C ASP A 103 21.192 -6.885 -24.343 1.00 0.00 C ATOM 1535 O ASP A 103 21.745 -7.521 -25.246 1.00 0.00 O ATOM 1536 CB ASP A 103 21.762 -8.468 -22.424 1.00 0.00 C ATOM 1537 CG ASP A 103 22.983 -7.635 -21.979 1.00 0.00 C ATOM 1538 OD1 ASP A 103 22.913 -6.386 -22.037 1.00 0.00 O ATOM 1539 OD2 ASP A 103 23.989 -8.242 -21.533 1.00 0.00 O ATOM 0 H ASP A 103 19.818 -9.421 -23.820 1.00 0.00 H new ATOM 0 HA ASP A 103 20.323 -6.893 -22.383 1.00 0.00 H new ATOM 0 HB2 ASP A 103 21.339 -8.970 -21.554 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.095 -9.246 -23.111 1.00 0.00 H new ATOM 1544 N PRO A 104 21.034 -5.550 -24.431 1.00 0.00 N ATOM 1545 CA PRO A 104 21.492 -4.781 -25.584 1.00 0.00 C ATOM 1546 C PRO A 104 23.009 -4.504 -25.575 1.00 0.00 C ATOM 1547 O PRO A 104 23.530 -3.978 -26.557 1.00 0.00 O ATOM 1548 CB PRO A 104 20.661 -3.502 -25.523 1.00 0.00 C ATOM 1549 CG PRO A 104 20.559 -3.252 -24.018 1.00 0.00 C ATOM 1550 CD PRO A 104 20.351 -4.670 -23.486 1.00 0.00 C ATOM 0 HA PRO A 104 21.352 -5.328 -26.516 1.00 0.00 H new ATOM 0 HB2 PRO A 104 21.148 -2.675 -26.041 1.00 0.00 H new ATOM 0 HB3 PRO A 104 19.681 -3.632 -25.981 1.00 0.00 H new ATOM 0 HG2 PRO A 104 21.462 -2.792 -23.617 1.00 0.00 H new ATOM 0 HG3 PRO A 104 19.727 -2.594 -23.767 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.764 -4.776 -22.483 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.290 -4.912 -23.421 1.00 0.00 H new ATOM 1558 N ASP A 105 23.741 -4.855 -24.510 1.00 0.00 N ATOM 1559 CA ASP A 105 25.192 -4.669 -24.430 1.00 0.00 C ATOM 1560 C ASP A 105 25.938 -5.301 -25.623 1.00 0.00 C ATOM 1561 O ASP A 105 25.822 -6.501 -25.891 1.00 0.00 O ATOM 1562 CB ASP A 105 25.712 -5.256 -23.117 1.00 0.00 C ATOM 1563 CG ASP A 105 27.236 -5.139 -23.024 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.742 -3.993 -22.979 1.00 0.00 O ATOM 1565 OD2 ASP A 105 27.920 -6.187 -22.970 1.00 0.00 O ATOM 0 H ASP A 105 23.338 -5.279 -23.674 1.00 0.00 H new ATOM 0 HA ASP A 105 25.386 -3.597 -24.466 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.253 -4.736 -22.276 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.420 -6.303 -23.043 1.00 0.00 H new ATOM 1570 N GLY A 106 26.709 -4.480 -26.346 1.00 0.00 N ATOM 1571 CA GLY A 106 27.443 -4.896 -27.549 1.00 0.00 C ATOM 1572 C GLY A 106 26.572 -5.206 -28.782 1.00 0.00 C ATOM 1573 O GLY A 106 27.111 -5.634 -29.806 1.00 0.00 O ATOM 0 H GLY A 106 26.843 -3.497 -26.110 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.149 -4.109 -27.813 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.029 -5.783 -27.308 1.00 0.00 H new ATOM 1577 N GLN A 107 25.251 -4.999 -28.704 1.00 0.00 N ATOM 1578 CA GLN A 107 24.294 -5.217 -29.799 1.00 0.00 C ATOM 1579 C GLN A 107 23.886 -3.904 -30.495 1.00 0.00 C ATOM 1580 O GLN A 107 24.390 -2.822 -30.178 1.00 0.00 O ATOM 1581 CB GLN A 107 23.082 -6.021 -29.292 1.00 0.00 C ATOM 1582 CG GLN A 107 23.461 -7.357 -28.628 1.00 0.00 C ATOM 1583 CD GLN A 107 22.365 -8.404 -28.810 1.00 0.00 C ATOM 1584 OE1 GLN A 107 22.233 -9.029 -29.855 1.00 0.00 O ATOM 1585 NE2 GLN A 107 21.518 -8.619 -27.828 1.00 0.00 N ATOM 0 H GLN A 107 24.804 -4.665 -27.850 1.00 0.00 H new ATOM 0 HA GLN A 107 24.790 -5.809 -30.569 1.00 0.00 H new ATOM 0 HB2 GLN A 107 22.528 -5.414 -28.576 1.00 0.00 H new ATOM 0 HB3 GLN A 107 22.412 -6.218 -30.129 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.393 -7.726 -29.057 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.640 -7.198 -27.565 1.00 0.00 H new ATOM 0 HE21 GLN A 107 21.613 -8.107 -26.951 1.00 0.00 H new ATOM 0 HE22 GLN A 107 20.765 -9.298 -27.943 1.00 0.00 H new ATOM 1594 N SER A 108 22.999 -4.005 -31.490 1.00 0.00 N ATOM 1595 CA SER A 108 22.635 -2.893 -32.384 1.00 0.00 C ATOM 1596 C SER A 108 21.665 -1.920 -31.721 1.00 0.00 C ATOM 1597 O SER A 108 20.961 -2.264 -30.771 1.00 0.00 O ATOM 1598 CB SER A 108 22.048 -3.440 -33.700 1.00 0.00 C ATOM 1599 OG SER A 108 22.962 -4.339 -34.312 1.00 0.00 O ATOM 0 H SER A 108 22.505 -4.872 -31.703 1.00 0.00 H new ATOM 0 HA SER A 108 23.545 -2.335 -32.606 1.00 0.00 H new ATOM 0 HB2 SER A 108 21.105 -3.949 -33.501 1.00 0.00 H new ATOM 0 HB3 SER A 108 21.829 -2.616 -34.379 1.00 0.00 H new ATOM 0 HG SER A 108 22.576 -4.680 -35.146 1.00 0.00 H new ATOM 1605 N LEU A 109 21.543 -0.709 -32.268 1.00 0.00 N ATOM 1606 CA LEU A 109 20.635 0.321 -31.735 1.00 0.00 C ATOM 1607 C LEU A 109 19.165 -0.090 -31.880 1.00 0.00 C ATOM 1608 O LEU A 109 18.338 0.261 -31.046 1.00 0.00 O ATOM 1609 CB LEU A 109 20.978 1.690 -32.359 1.00 0.00 C ATOM 1610 CG LEU A 109 22.347 2.296 -31.969 1.00 0.00 C ATOM 1611 CD1 LEU A 109 22.575 2.320 -30.456 1.00 0.00 C ATOM 1612 CD2 LEU A 109 23.558 1.607 -32.606 1.00 0.00 C ATOM 0 H LEU A 109 22.067 -0.411 -33.091 1.00 0.00 H new ATOM 0 HA LEU A 109 20.785 0.421 -30.660 1.00 0.00 H new ATOM 0 HB2 LEU A 109 20.945 1.590 -33.444 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.198 2.398 -32.080 1.00 0.00 H new ATOM 0 HG LEU A 109 22.280 3.310 -32.363 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.551 2.755 -30.242 1.00 0.00 H new ATOM 0 HD12 LEU A 109 21.798 2.919 -29.980 1.00 0.00 H new ATOM 0 HD13 LEU A 109 22.538 1.303 -30.066 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.472 2.099 -32.275 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.581 0.560 -32.305 1.00 0.00 H new ATOM 0 HD23 LEU A 109 23.484 1.671 -33.692 1.00 0.00 H new ATOM 1624 N GLU A 110 18.849 -0.959 -32.843 1.00 0.00 N ATOM 1625 CA GLU A 110 17.538 -1.611 -32.957 1.00 0.00 C ATOM 1626 C GLU A 110 17.257 -2.545 -31.762 1.00 0.00 C ATOM 1627 O GLU A 110 16.107 -2.677 -31.352 1.00 0.00 O ATOM 1628 CB GLU A 110 17.480 -2.366 -34.295 1.00 0.00 C ATOM 1629 CG GLU A 110 16.086 -2.924 -34.610 1.00 0.00 C ATOM 1630 CD GLU A 110 16.050 -3.538 -36.022 1.00 0.00 C ATOM 1631 OE1 GLU A 110 16.423 -4.726 -36.189 1.00 0.00 O ATOM 1632 OE2 GLU A 110 15.639 -2.841 -36.984 1.00 0.00 O ATOM 0 H GLU A 110 19.503 -1.234 -33.576 1.00 0.00 H new ATOM 0 HA GLU A 110 16.756 -0.852 -32.936 1.00 0.00 H new ATOM 0 HB2 GLU A 110 17.786 -1.695 -35.098 1.00 0.00 H new ATOM 0 HB3 GLU A 110 18.197 -3.186 -34.274 1.00 0.00 H new ATOM 0 HG2 GLU A 110 15.817 -3.680 -33.873 1.00 0.00 H new ATOM 0 HG3 GLU A 110 15.345 -2.128 -34.535 1.00 0.00 H new ATOM 1639 N VAL A 111 18.280 -3.126 -31.117 1.00 0.00 N ATOM 1640 CA VAL A 111 18.115 -3.946 -29.905 1.00 0.00 C ATOM 1641 C VAL A 111 17.829 -3.042 -28.716 1.00 0.00 C ATOM 1642 O VAL A 111 16.913 -3.334 -27.959 1.00 0.00 O ATOM 1643 CB VAL A 111 19.303 -4.897 -29.651 1.00 0.00 C ATOM 1644 CG1 VAL A 111 19.024 -5.821 -28.457 1.00 0.00 C ATOM 1645 CG2 VAL A 111 19.535 -5.792 -30.878 1.00 0.00 C ATOM 0 H VAL A 111 19.250 -3.040 -31.422 1.00 0.00 H new ATOM 0 HA VAL A 111 17.260 -4.605 -30.057 1.00 0.00 H new ATOM 0 HB VAL A 111 20.177 -4.277 -29.449 1.00 0.00 H new ATOM 0 HG11 VAL A 111 19.877 -6.481 -28.300 1.00 0.00 H new ATOM 0 HG12 VAL A 111 18.861 -5.220 -27.562 1.00 0.00 H new ATOM 0 HG13 VAL A 111 18.136 -6.419 -28.660 1.00 0.00 H new ATOM 0 HG21 VAL A 111 20.376 -6.459 -30.688 1.00 0.00 H new ATOM 0 HG22 VAL A 111 18.640 -6.383 -31.072 1.00 0.00 H new ATOM 0 HG23 VAL A 111 19.754 -5.170 -31.746 1.00 0.00 H new ATOM 1655 N PHE A 112 18.486 -1.881 -28.599 1.00 0.00 N ATOM 1656 CA PHE A 112 18.094 -0.872 -27.598 1.00 0.00 C ATOM 1657 C PHE A 112 16.670 -0.325 -27.848 1.00 0.00 C ATOM 1658 O PHE A 112 15.913 -0.117 -26.906 1.00 0.00 O ATOM 1659 CB PHE A 112 19.115 0.275 -27.549 1.00 0.00 C ATOM 1660 CG PHE A 112 20.468 -0.065 -26.950 1.00 0.00 C ATOM 1661 CD1 PHE A 112 20.674 0.058 -25.562 1.00 0.00 C ATOM 1662 CD2 PHE A 112 21.532 -0.494 -27.765 1.00 0.00 C ATOM 1663 CE1 PHE A 112 21.921 -0.260 -24.995 1.00 0.00 C ATOM 1664 CE2 PHE A 112 22.782 -0.807 -27.202 1.00 0.00 C ATOM 1665 CZ PHE A 112 22.974 -0.697 -25.816 1.00 0.00 C ATOM 0 H PHE A 112 19.284 -1.616 -29.177 1.00 0.00 H new ATOM 0 HA PHE A 112 18.083 -1.371 -26.629 1.00 0.00 H new ATOM 0 HB2 PHE A 112 19.270 0.640 -28.564 1.00 0.00 H new ATOM 0 HB3 PHE A 112 18.682 1.096 -26.977 1.00 0.00 H new ATOM 0 HD1 PHE A 112 19.868 0.399 -24.929 1.00 0.00 H new ATOM 0 HD2 PHE A 112 21.387 -0.584 -28.832 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.069 -0.168 -23.929 1.00 0.00 H new ATOM 0 HE2 PHE A 112 23.594 -1.132 -27.836 1.00 0.00 H new ATOM 0 HZ PHE A 112 23.930 -0.948 -25.381 1.00 0.00 H new ATOM 1675 N ARG A 113 16.244 -0.148 -29.103 1.00 0.00 N ATOM 1676 CA ARG A 113 14.882 0.329 -29.433 1.00 0.00 C ATOM 1677 C ARG A 113 13.799 -0.752 -29.308 1.00 0.00 C ATOM 1678 O ARG A 113 12.634 -0.416 -29.114 1.00 0.00 O ATOM 1679 CB ARG A 113 14.882 0.941 -30.849 1.00 0.00 C ATOM 1680 CG ARG A 113 15.704 2.241 -30.936 1.00 0.00 C ATOM 1681 CD ARG A 113 16.015 2.640 -32.384 1.00 0.00 C ATOM 1682 NE ARG A 113 14.791 2.909 -33.173 1.00 0.00 N ATOM 1683 CZ ARG A 113 14.723 3.128 -34.477 1.00 0.00 C ATOM 1684 NH1 ARG A 113 15.786 3.147 -35.231 1.00 0.00 N ATOM 1685 NH2 ARG A 113 13.573 3.330 -35.055 1.00 0.00 N ATOM 0 H ARG A 113 16.825 -0.328 -29.921 1.00 0.00 H new ATOM 0 HA ARG A 113 14.623 1.087 -28.694 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.284 0.214 -31.554 1.00 0.00 H new ATOM 0 HB3 ARG A 113 13.855 1.145 -31.152 1.00 0.00 H new ATOM 0 HG2 ARG A 113 15.156 3.048 -30.449 1.00 0.00 H new ATOM 0 HG3 ARG A 113 16.638 2.115 -30.388 1.00 0.00 H new ATOM 0 HD2 ARG A 113 16.647 3.528 -32.385 1.00 0.00 H new ATOM 0 HD3 ARG A 113 16.584 1.843 -32.863 1.00 0.00 H new ATOM 0 HE ARG A 113 13.910 2.927 -32.659 1.00 0.00 H new ATOM 0 HH11 ARG A 113 16.706 2.990 -34.819 1.00 0.00 H new ATOM 0 HH12 ARG A 113 15.698 3.319 -36.233 1.00 0.00 H new ATOM 0 HH21 ARG A 113 12.716 3.320 -34.502 1.00 0.00 H new ATOM 0 HH22 ARG A 113 13.530 3.498 -36.060 1.00 0.00 H new ATOM 1699 N THR A 114 14.171 -2.034 -29.348 1.00 0.00 N ATOM 1700 CA THR A 114 13.249 -3.166 -29.143 1.00 0.00 C ATOM 1701 C THR A 114 13.197 -3.593 -27.672 1.00 0.00 C ATOM 1702 O THR A 114 12.114 -3.844 -27.143 1.00 0.00 O ATOM 1703 CB THR A 114 13.571 -4.344 -30.089 1.00 0.00 C ATOM 1704 OG1 THR A 114 13.710 -3.885 -31.418 1.00 0.00 O ATOM 1705 CG2 THR A 114 12.437 -5.370 -30.149 1.00 0.00 C ATOM 0 H THR A 114 15.133 -2.324 -29.526 1.00 0.00 H new ATOM 0 HA THR A 114 12.248 -2.824 -29.404 1.00 0.00 H new ATOM 0 HB THR A 114 14.484 -4.791 -29.695 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.442 -3.235 -31.465 1.00 0.00 H new ATOM 0 HG21 THR A 114 12.713 -6.178 -30.827 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.261 -5.777 -29.153 1.00 0.00 H new ATOM 0 HG23 THR A 114 11.529 -4.888 -30.510 1.00 0.00 H new ATOM 1713 N VAL A 115 14.325 -3.610 -26.949 1.00 0.00 N ATOM 1714 CA VAL A 115 14.376 -3.894 -25.493 1.00 0.00 C ATOM 1715 C VAL A 115 13.547 -2.903 -24.696 1.00 0.00 C ATOM 1716 O VAL A 115 12.797 -3.303 -23.816 1.00 0.00 O ATOM 1717 CB VAL A 115 15.831 -3.955 -24.962 1.00 0.00 C ATOM 1718 CG1 VAL A 115 16.510 -2.613 -24.718 1.00 0.00 C ATOM 1719 CG2 VAL A 115 15.869 -4.752 -23.665 1.00 0.00 C ATOM 0 H VAL A 115 15.242 -3.426 -27.355 1.00 0.00 H new ATOM 0 HA VAL A 115 13.936 -4.882 -25.354 1.00 0.00 H new ATOM 0 HB VAL A 115 16.393 -4.431 -25.765 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.522 -2.779 -24.348 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.552 -2.052 -25.651 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.942 -2.047 -23.979 1.00 0.00 H new ATOM 0 HG21 VAL A 115 16.893 -4.794 -23.293 1.00 0.00 H new ATOM 0 HG22 VAL A 115 15.233 -4.270 -22.923 1.00 0.00 H new ATOM 0 HG23 VAL A 115 15.508 -5.764 -23.849 1.00 0.00 H new ATOM 1729 N ARG A 116 13.629 -1.617 -25.038 1.00 0.00 N ATOM 1730 CA ARG A 116 13.002 -0.531 -24.257 1.00 0.00 C ATOM 1731 C ARG A 116 11.477 -0.669 -24.134 1.00 0.00 C ATOM 1732 O ARG A 116 10.938 -0.592 -23.038 1.00 0.00 O ATOM 1733 CB ARG A 116 13.488 0.822 -24.809 1.00 0.00 C ATOM 1734 CG ARG A 116 12.824 1.300 -26.100 1.00 0.00 C ATOM 1735 CD ARG A 116 13.518 2.578 -26.585 1.00 0.00 C ATOM 1736 NE ARG A 116 12.870 3.102 -27.805 1.00 0.00 N ATOM 1737 CZ ARG A 116 13.240 4.165 -28.500 1.00 0.00 C ATOM 1738 NH1 ARG A 116 14.272 4.881 -28.179 1.00 0.00 N ATOM 1739 NH2 ARG A 116 12.585 4.539 -29.555 1.00 0.00 N ATOM 0 H ARG A 116 14.131 -1.290 -25.864 1.00 0.00 H new ATOM 0 HA ARG A 116 13.327 -0.600 -23.219 1.00 0.00 H new ATOM 0 HB2 ARG A 116 13.333 1.581 -24.042 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.563 0.757 -24.980 1.00 0.00 H new ATOM 0 HG2 ARG A 116 12.889 0.525 -26.864 1.00 0.00 H new ATOM 0 HG3 ARG A 116 11.765 1.491 -25.928 1.00 0.00 H new ATOM 0 HD2 ARG A 116 13.487 3.333 -25.800 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.569 2.371 -26.787 1.00 0.00 H new ATOM 0 HE ARG A 116 12.055 2.593 -28.146 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.832 4.632 -27.364 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.524 5.694 -28.742 1.00 0.00 H new ATOM 0 HH21 ARG A 116 11.769 4.011 -29.862 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.886 5.362 -30.077 1.00 0.00 H new ATOM 1753 N GLY A 117 10.798 -1.013 -25.230 1.00 0.00 N ATOM 1754 CA GLY A 117 9.351 -1.280 -25.234 1.00 0.00 C ATOM 1755 C GLY A 117 8.987 -2.593 -24.534 1.00 0.00 C ATOM 1756 O GLY A 117 7.968 -2.660 -23.851 1.00 0.00 O ATOM 0 H GLY A 117 11.235 -1.116 -26.146 1.00 0.00 H new ATOM 0 HA2 GLY A 117 8.833 -0.456 -24.743 1.00 0.00 H new ATOM 0 HA3 GLY A 117 8.995 -1.312 -26.264 1.00 0.00 H new ATOM 1760 N GLN A 118 9.868 -3.603 -24.597 1.00 0.00 N ATOM 1761 CA GLN A 118 9.691 -4.860 -23.854 1.00 0.00 C ATOM 1762 C GLN A 118 9.832 -4.660 -22.346 1.00 0.00 C ATOM 1763 O GLN A 118 9.052 -5.231 -21.588 1.00 0.00 O ATOM 1764 CB GLN A 118 10.677 -5.923 -24.360 1.00 0.00 C ATOM 1765 CG GLN A 118 10.314 -6.482 -25.740 1.00 0.00 C ATOM 1766 CD GLN A 118 11.482 -7.298 -26.282 1.00 0.00 C ATOM 1767 OE1 GLN A 118 11.510 -8.519 -26.253 1.00 0.00 O ATOM 1768 NE2 GLN A 118 12.505 -6.619 -26.742 1.00 0.00 N ATOM 0 H GLN A 118 10.718 -3.572 -25.160 1.00 0.00 H new ATOM 0 HA GLN A 118 8.674 -5.209 -24.035 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.676 -5.490 -24.403 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.716 -6.743 -23.643 1.00 0.00 H new ATOM 0 HG2 GLN A 118 9.423 -7.106 -25.668 1.00 0.00 H new ATOM 0 HG3 GLN A 118 10.078 -5.667 -26.424 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.473 -5.600 -26.763 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.333 -7.110 -27.079 1.00 0.00 H new ATOM 1777 N VAL A 119 10.772 -3.820 -21.909 1.00 0.00 N ATOM 1778 CA VAL A 119 10.876 -3.369 -20.508 1.00 0.00 C ATOM 1779 C VAL A 119 9.614 -2.608 -20.112 1.00 0.00 C ATOM 1780 O VAL A 119 8.991 -2.970 -19.121 1.00 0.00 O ATOM 1781 CB VAL A 119 12.128 -2.494 -20.296 1.00 0.00 C ATOM 1782 CG1 VAL A 119 12.164 -1.850 -18.909 1.00 0.00 C ATOM 1783 CG2 VAL A 119 13.410 -3.317 -20.424 1.00 0.00 C ATOM 0 H VAL A 119 11.491 -3.427 -22.517 1.00 0.00 H new ATOM 0 HA VAL A 119 10.975 -4.247 -19.870 1.00 0.00 H new ATOM 0 HB VAL A 119 12.072 -1.725 -21.066 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.065 -1.245 -18.812 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.286 -1.217 -18.779 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.166 -2.629 -18.146 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.274 -2.671 -20.269 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.410 -4.109 -19.675 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.461 -3.759 -21.419 1.00 0.00 H new ATOM 1793 N LYS A 120 9.194 -1.607 -20.898 1.00 0.00 N ATOM 1794 CA LYS A 120 8.008 -0.774 -20.623 1.00 0.00 C ATOM 1795 C LYS A 120 6.736 -1.596 -20.482 1.00 0.00 C ATOM 1796 O LYS A 120 6.050 -1.421 -19.492 1.00 0.00 O ATOM 1797 CB LYS A 120 7.910 0.297 -21.727 1.00 0.00 C ATOM 1798 CG LYS A 120 6.825 1.360 -21.487 1.00 0.00 C ATOM 1799 CD LYS A 120 5.482 1.073 -22.183 1.00 0.00 C ATOM 1800 CE LYS A 120 4.577 2.306 -22.045 1.00 0.00 C ATOM 1801 NZ LYS A 120 3.241 2.090 -22.667 1.00 0.00 N ATOM 0 H LYS A 120 9.675 -1.346 -21.759 1.00 0.00 H new ATOM 0 HA LYS A 120 8.122 -0.284 -19.656 1.00 0.00 H new ATOM 0 HB2 LYS A 120 8.875 0.795 -21.820 1.00 0.00 H new ATOM 0 HB3 LYS A 120 7.713 -0.197 -22.679 1.00 0.00 H new ATOM 0 HG2 LYS A 120 6.652 1.448 -20.414 1.00 0.00 H new ATOM 0 HG3 LYS A 120 7.198 2.325 -21.830 1.00 0.00 H new ATOM 0 HD2 LYS A 120 5.645 0.841 -23.235 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.004 0.202 -21.735 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.451 2.547 -20.989 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.060 3.164 -22.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 2.787 3.009 -22.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.355 1.582 -23.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.646 1.528 -22.025 1.00 0.00 H new ATOM 1815 N GLU A 121 6.436 -2.541 -21.366 1.00 0.00 N ATOM 1816 CA GLU A 121 5.216 -3.366 -21.221 1.00 0.00 C ATOM 1817 C GLU A 121 5.291 -4.323 -20.019 1.00 0.00 C ATOM 1818 O GLU A 121 4.268 -4.660 -19.417 1.00 0.00 O ATOM 1819 CB GLU A 121 4.898 -4.094 -22.540 1.00 0.00 C ATOM 1820 CG GLU A 121 5.849 -5.259 -22.854 1.00 0.00 C ATOM 1821 CD GLU A 121 5.619 -5.930 -24.227 1.00 0.00 C ATOM 1822 OE1 GLU A 121 4.625 -5.629 -24.931 1.00 0.00 O ATOM 1823 OE2 GLU A 121 6.448 -6.803 -24.591 1.00 0.00 O ATOM 0 H GLU A 121 7.004 -2.762 -22.184 1.00 0.00 H new ATOM 0 HA GLU A 121 4.384 -2.695 -21.005 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.877 -4.473 -22.497 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.937 -3.375 -23.359 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.875 -4.894 -22.811 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.746 -6.014 -22.074 1.00 0.00 H new ATOM 1830 N ARG A 122 6.508 -4.723 -19.620 1.00 0.00 N ATOM 1831 CA ARG A 122 6.759 -5.545 -18.422 1.00 0.00 C ATOM 1832 C ARG A 122 6.577 -4.739 -17.137 1.00 0.00 C ATOM 1833 O ARG A 122 5.757 -5.127 -16.308 1.00 0.00 O ATOM 1834 CB ARG A 122 8.109 -6.273 -18.556 1.00 0.00 C ATOM 1835 CG ARG A 122 7.948 -7.459 -19.521 1.00 0.00 C ATOM 1836 CD ARG A 122 9.277 -8.024 -20.039 1.00 0.00 C ATOM 1837 NE ARG A 122 9.036 -9.069 -21.065 1.00 0.00 N ATOM 1838 CZ ARG A 122 8.510 -8.912 -22.270 1.00 0.00 C ATOM 1839 NH1 ARG A 122 8.220 -7.734 -22.737 1.00 0.00 N ATOM 1840 NH2 ARG A 122 8.256 -9.933 -23.031 1.00 0.00 N ATOM 0 H ARG A 122 7.360 -4.482 -20.127 1.00 0.00 H new ATOM 0 HA ARG A 122 6.006 -6.330 -18.347 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.871 -5.587 -18.927 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.445 -6.625 -17.581 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.399 -8.254 -19.016 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.343 -7.144 -20.371 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.879 -7.221 -20.465 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.847 -8.445 -19.211 1.00 0.00 H new ATOM 0 HE ARG A 122 9.307 -10.019 -20.812 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.397 -6.904 -22.172 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.815 -7.640 -23.669 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.462 -10.877 -22.704 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.851 -9.791 -23.956 1.00 0.00 H new ATOM 1854 N VAL A 123 7.215 -3.568 -17.006 1.00 0.00 N ATOM 1855 CA VAL A 123 6.919 -2.638 -15.899 1.00 0.00 C ATOM 1856 C VAL A 123 5.458 -2.181 -15.884 1.00 0.00 C ATOM 1857 O VAL A 123 4.864 -2.176 -14.817 1.00 0.00 O ATOM 1858 CB VAL A 123 7.892 -1.445 -15.840 1.00 0.00 C ATOM 1859 CG1 VAL A 123 9.329 -1.907 -15.580 1.00 0.00 C ATOM 1860 CG2 VAL A 123 7.914 -0.518 -17.033 1.00 0.00 C ATOM 0 H VAL A 123 7.937 -3.240 -17.648 1.00 0.00 H new ATOM 0 HA VAL A 123 7.078 -3.213 -14.987 1.00 0.00 H new ATOM 0 HB VAL A 123 7.488 -0.863 -15.012 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.989 -1.040 -15.544 1.00 0.00 H new ATOM 0 HG12 VAL A 123 9.374 -2.437 -14.629 1.00 0.00 H new ATOM 0 HG13 VAL A 123 9.648 -2.573 -16.382 1.00 0.00 H new ATOM 0 HG21 VAL A 123 8.640 0.277 -16.863 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.193 -1.079 -17.925 1.00 0.00 H new ATOM 0 HG23 VAL A 123 6.925 -0.082 -17.173 1.00 0.00 H new ATOM 1870 N GLU A 124 4.827 -1.877 -17.021 1.00 0.00 N ATOM 1871 CA GLU A 124 3.447 -1.415 -17.063 1.00 0.00 C ATOM 1872 C GLU A 124 2.463 -2.472 -16.558 1.00 0.00 C ATOM 1873 O GLU A 124 1.675 -2.178 -15.663 1.00 0.00 O ATOM 1874 CB GLU A 124 3.100 -1.002 -18.501 1.00 0.00 C ATOM 1875 CG GLU A 124 1.946 -0.018 -18.507 1.00 0.00 C ATOM 1876 CD GLU A 124 1.263 0.040 -19.884 1.00 0.00 C ATOM 1877 OE1 GLU A 124 1.880 0.550 -20.851 1.00 0.00 O ATOM 1878 OE2 GLU A 124 0.103 -0.423 -20.011 1.00 0.00 O ATOM 0 H GLU A 124 5.265 -1.946 -17.939 1.00 0.00 H new ATOM 0 HA GLU A 124 3.356 -0.559 -16.394 1.00 0.00 H new ATOM 0 HB2 GLU A 124 3.971 -0.552 -18.977 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.837 -1.884 -19.085 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.217 -0.306 -17.750 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.310 0.974 -18.238 1.00 0.00 H new ATOM 1885 N ASN A 125 2.533 -3.714 -17.058 1.00 0.00 N ATOM 1886 CA ASN A 125 1.591 -4.754 -16.622 1.00 0.00 C ATOM 1887 C ASN A 125 1.855 -5.203 -15.171 1.00 0.00 C ATOM 1888 O ASN A 125 0.906 -5.520 -14.455 1.00 0.00 O ATOM 1889 CB ASN A 125 1.509 -5.906 -17.646 1.00 0.00 C ATOM 1890 CG ASN A 125 2.445 -7.064 -17.349 1.00 0.00 C ATOM 1891 OD1 ASN A 125 2.147 -7.950 -16.562 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.607 -7.084 -17.953 1.00 0.00 N ATOM 0 H ASN A 125 3.217 -4.019 -17.750 1.00 0.00 H new ATOM 0 HA ASN A 125 0.592 -4.320 -16.597 1.00 0.00 H new ATOM 0 HB2 ASN A 125 0.485 -6.279 -17.677 1.00 0.00 H new ATOM 0 HB3 ASN A 125 1.736 -5.514 -18.637 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.266 -7.840 -17.767 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.853 -6.343 -18.610 1.00 0.00 H new ATOM 1899 N LEU A 126 3.113 -5.143 -14.710 1.00 0.00 N ATOM 1900 CA LEU A 126 3.473 -5.328 -13.299 1.00 0.00 C ATOM 1901 C LEU A 126 2.862 -4.225 -12.433 1.00 0.00 C ATOM 1902 O LEU A 126 2.207 -4.511 -11.440 1.00 0.00 O ATOM 1903 CB LEU A 126 5.011 -5.417 -13.187 1.00 0.00 C ATOM 1904 CG LEU A 126 5.654 -5.590 -11.793 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.787 -4.286 -11.006 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.936 -6.621 -10.921 1.00 0.00 C ATOM 0 H LEU A 126 3.916 -4.963 -15.313 1.00 0.00 H new ATOM 0 HA LEU A 126 3.058 -6.261 -12.918 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.338 -6.253 -13.806 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.426 -4.512 -13.630 1.00 0.00 H new ATOM 0 HG LEU A 126 6.655 -5.955 -12.022 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.247 -4.490 -10.039 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.410 -3.586 -11.564 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.799 -3.851 -10.854 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.438 -6.694 -9.956 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.902 -6.312 -10.770 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.956 -7.592 -11.415 1.00 0.00 H new ATOM 1918 N ILE A 127 3.031 -2.960 -12.808 1.00 0.00 N ATOM 1919 CA ILE A 127 2.566 -1.837 -11.985 1.00 0.00 C ATOM 1920 C ILE A 127 1.034 -1.770 -11.975 1.00 0.00 C ATOM 1921 O ILE A 127 0.437 -1.603 -10.911 1.00 0.00 O ATOM 1922 CB ILE A 127 3.242 -0.536 -12.466 1.00 0.00 C ATOM 1923 CG1 ILE A 127 4.754 -0.607 -12.151 1.00 0.00 C ATOM 1924 CG2 ILE A 127 2.647 0.734 -11.830 1.00 0.00 C ATOM 1925 CD1 ILE A 127 5.619 0.399 -12.922 1.00 0.00 C ATOM 0 H ILE A 127 3.487 -2.682 -13.677 1.00 0.00 H new ATOM 0 HA ILE A 127 2.859 -1.983 -10.945 1.00 0.00 H new ATOM 0 HB ILE A 127 3.065 -0.462 -13.539 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.896 -0.444 -11.083 1.00 0.00 H new ATOM 0 HG13 ILE A 127 5.110 -1.614 -12.370 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.169 1.611 -12.212 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.588 0.804 -12.080 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.762 0.687 -10.747 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.664 0.275 -12.636 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.513 0.225 -13.993 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.296 1.413 -12.686 1.00 0.00 H new ATOM 1937 N ALA A 128 0.386 -1.990 -13.120 1.00 0.00 N ATOM 1938 CA ALA A 128 -1.072 -1.942 -13.265 1.00 0.00 C ATOM 1939 C ALA A 128 -1.819 -3.013 -12.445 1.00 0.00 C ATOM 1940 O ALA A 128 -2.967 -2.785 -12.053 1.00 0.00 O ATOM 1941 CB ALA A 128 -1.397 -2.049 -14.762 1.00 0.00 C ATOM 0 H ALA A 128 0.869 -2.211 -13.991 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.426 -0.996 -12.856 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.477 -2.016 -14.903 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.936 -1.217 -15.295 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -1.009 -2.990 -15.152 1.00 0.00 H new ATOM 1947 N LYS A 129 -1.172 -4.152 -12.148 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.739 -5.216 -11.297 1.00 0.00 C ATOM 1949 C LYS A 129 -1.446 -5.060 -9.796 1.00 0.00 C ATOM 1950 O LYS A 129 -2.114 -5.725 -9.001 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.387 -6.614 -11.848 1.00 0.00 C ATOM 1952 CG LYS A 129 0.054 -7.069 -11.582 1.00 0.00 C ATOM 1953 CD LYS A 129 0.333 -8.436 -12.219 1.00 0.00 C ATOM 1954 CE LYS A 129 1.804 -8.824 -12.007 1.00 0.00 C ATOM 1955 NZ LYS A 129 2.094 -10.178 -12.561 1.00 0.00 N ATOM 0 H LYS A 129 -0.236 -4.364 -12.493 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.822 -5.104 -11.355 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.069 -7.343 -11.411 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.561 -6.619 -12.924 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.750 -6.331 -11.980 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.228 -7.124 -10.507 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.318 -9.191 -11.779 1.00 0.00 H new ATOM 0 HD3 LYS A 129 0.107 -8.403 -13.285 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.449 -8.087 -12.486 1.00 0.00 H new ATOM 0 HE3 LYS A 129 2.037 -8.807 -10.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 3.060 -10.461 -12.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.415 -10.864 -12.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 2.009 -10.155 -13.597 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.491 -4.201 -9.393 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.130 -4.012 -7.962 1.00 0.00 C ATOM 1971 C ILE A 130 -0.505 -2.644 -7.367 1.00 0.00 C ATOM 1972 O ILE A 130 -0.552 -2.514 -6.140 1.00 0.00 O ATOM 1973 CB ILE A 130 1.351 -4.369 -7.686 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.344 -3.302 -8.188 1.00 0.00 C ATOM 1975 CG2 ILE A 130 1.670 -5.758 -8.266 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.811 -3.614 -7.861 1.00 0.00 C ATOM 0 H ILE A 130 0.050 -3.622 -10.035 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.760 -4.725 -7.430 1.00 0.00 H new ATOM 0 HB ILE A 130 1.480 -4.394 -6.604 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.237 -3.199 -9.268 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.081 -2.340 -7.749 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.713 -6.004 -8.069 1.00 0.00 H new ATOM 0 HG22 ILE A 130 1.027 -6.504 -7.799 1.00 0.00 H new ATOM 0 HG23 ILE A 130 1.496 -5.752 -9.342 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.447 -2.817 -8.247 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.935 -3.687 -6.781 1.00 0.00 H new ATOM 0 HD13 ILE A 130 4.094 -4.560 -8.323 1.00 0.00 H new ATOM 1988 N SER A 131 -0.759 -1.632 -8.205 1.00 0.00 N ATOM 1989 CA SER A 131 -1.150 -0.270 -7.781 1.00 0.00 C ATOM 1990 C SER A 131 -2.538 -0.217 -7.123 1.00 0.00 C ATOM 1991 O SER A 131 -2.666 0.432 -6.058 1.00 0.00 O ATOM 1992 CB SER A 131 -1.107 0.700 -8.958 1.00 0.00 C ATOM 1993 OG SER A 131 0.205 0.723 -9.487 1.00 0.00 O ATOM 1994 OXT SER A 131 -3.501 -0.800 -7.677 1.00 0.00 O ATOM 0 H SER A 131 -0.699 -1.732 -9.218 1.00 0.00 H new ATOM 0 HA SER A 131 -0.421 0.029 -7.028 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.817 0.393 -9.726 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.400 1.699 -8.634 1.00 0.00 H new ATOM 0 HG SER A 131 0.360 -0.089 -10.013 1.00 0.00 H new TER 2000 SER A 131