USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 910 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: 1 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: 1 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: 1 29 SER OG : rot -130:sc= -1.16! USER MOD Set 2.2: 1 89 LYS NZ :NH3+ -143:sc= 1.14 (180deg=0.161) USER MOD Single : 1 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : 1 1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : 1 2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : 1 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : 1 4 SER OG : rot 180:sc= 0 USER MOD Single : 1 5 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 6 SER OG : rot 180:sc= 0 USER MOD Single : 1 -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : 1 -2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : 1 -3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : 1 -3 MET N :NH3+ -173:sc= 0 (180deg=-0.0536) USER MOD Single : 1 11 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 13 ASN : amide:sc= -0.28 K(o=-0.28,f=0.79) USER MOD Single : 1 15 TYR OH : rot 180:sc= -0.93 USER MOD Single : 1 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : 1 18 SER OG : rot 180:sc= 0 USER MOD Single : 1 19 ASN : amide:sc=-0.000726 K(o=-0.00073,f=-0.56) USER MOD Single : 1 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 23 MET CE :methyl 161:sc= -0.202 (180deg=-0.957) USER MOD Single : 1 31 GLN : amide:sc= -0.238 X(o=-0.24,f=-0.47) USER MOD Single : 1 32 THR OG1 : rot -50:sc= -3.04! USER MOD Single : 1 33 SER OG : rot 180:sc= -0.785 USER MOD Single : 1 36 SER OG : rot 180:sc= 0 USER MOD Single : 1 40 TYR OH : rot 126:sc= 0.033 USER MOD Single : 1 42 SER OG : rot -15:sc= 0.311 USER MOD Single : 1 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 50 CYS SG : rot -150:sc= -2.31 USER MOD Single : 1 57 THR OG1 : rot 180:sc= 0.00356 USER MOD Single : 1 58 THR OG1 : rot -175:sc= -2.42! USER MOD Single : 1 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 61 SER OG : rot 47:sc=0.000742 USER MOD Single : 1 68 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 74 SER OG : rot -146:sc= 0.24! USER MOD Single : 1 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 81 GLN : amide:sc= -0.222 X(o=-0.22,f=0) USER MOD Single : 1 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : 1 84 HIS : no HD1:sc= -0.351 X(o=-0.35,f=0.082) USER MOD Single : 1 88 SER OG : rot -40:sc= 0.558 USER MOD Single : 1 90 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : 1 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 105 MET CE :methyl 159:sc= -0.064 (180deg=-0.469) USER MOD Single : 1 107 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 109 THR OG1 : rot 43:sc= 0.104 USER MOD Single : 1 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET 1 -3 53.580 -28.074 8.376 1.00 0.00 N ATOM 2 CA MET 1 -3 53.058 -26.980 7.512 1.00 0.00 C ATOM 3 C MET 1 -3 52.346 -25.906 8.334 1.00 0.00 C ATOM 4 O MET 1 -3 52.481 -24.713 8.049 1.00 0.00 O ATOM 5 CB MET 1 -3 52.104 -27.549 6.458 1.00 0.00 C ATOM 6 CG MET 1 -3 52.812 -28.204 5.283 1.00 0.00 C ATOM 7 SD MET 1 -3 51.667 -28.803 4.025 1.00 0.00 S ATOM 8 CE MET 1 -3 52.809 -29.296 2.738 1.00 0.00 C ATOM 0 H1 MET 1 -3 54.158 -28.723 7.804 1.00 0.00 H new ATOM 0 H2 MET 1 -3 54.164 -27.668 9.135 1.00 0.00 H new ATOM 0 H3 MET 1 -3 52.784 -28.596 8.794 1.00 0.00 H new ATOM 0 HA MET 1 -3 53.910 -26.514 7.016 1.00 0.00 H new ATOM 0 HB2 MET 1 -3 51.450 -28.281 6.931 1.00 0.00 H new ATOM 0 HB3 MET 1 -3 51.468 -26.746 6.086 1.00 0.00 H new ATOM 0 HG2 MET 1 -3 53.498 -27.487 4.832 1.00 0.00 H new ATOM 0 HG3 MET 1 -3 53.415 -29.037 5.646 1.00 0.00 H new ATOM 0 HE1 MET 1 -3 52.251 -29.690 1.888 1.00 0.00 H new ATOM 0 HE2 MET 1 -3 53.394 -28.433 2.420 1.00 0.00 H new ATOM 0 HE3 MET 1 -3 53.478 -30.066 3.121 1.00 0.00 H new ATOM 20 N HIS 1 -2 51.591 -26.339 9.353 1.00 0.00 N ATOM 21 CA HIS 1 -2 50.853 -25.421 10.222 1.00 0.00 C ATOM 22 C HIS 1 -2 51.630 -25.121 11.500 1.00 0.00 C ATOM 23 O HIS 1 -2 52.204 -26.024 12.117 1.00 0.00 O ATOM 24 CB HIS 1 -2 49.483 -26.003 10.578 1.00 0.00 C ATOM 25 CG HIS 1 -2 48.417 -25.683 9.577 1.00 0.00 C ATOM 26 ND1 HIS 1 -2 47.628 -24.553 9.655 1.00 0.00 N ATOM 27 CD2 HIS 1 -2 48.006 -26.351 8.473 1.00 0.00 C ATOM 28 CE1 HIS 1 -2 46.780 -24.541 8.643 1.00 0.00 C ATOM 29 NE2 HIS 1 -2 46.989 -25.619 7.912 1.00 0.00 N ATOM 0 H HIS 1 -2 51.477 -27.324 9.594 1.00 0.00 H new ATOM 0 HA HIS 1 -2 50.717 -24.489 9.674 1.00 0.00 H new ATOM 0 HB2 HIS 1 -2 49.570 -27.086 10.670 1.00 0.00 H new ATOM 0 HB3 HIS 1 -2 49.179 -25.624 11.554 1.00 0.00 H new ATOM 0 HD2 HIS 1 -2 48.404 -27.285 8.103 1.00 0.00 H new ATOM 0 HE1 HIS 1 -2 46.041 -23.778 8.447 1.00 0.00 H new ATOM 0 HE2 HIS 1 -2 46.477 -25.869 7.066 1.00 0.00 H new ATOM 38 N HIS 1 -1 51.638 -23.841 11.882 1.00 0.00 N ATOM 39 CA HIS 1 -1 52.328 -23.384 13.090 1.00 0.00 C ATOM 40 C HIS 1 -1 51.386 -22.574 13.981 1.00 0.00 C ATOM 41 O HIS 1 -1 51.393 -22.730 15.205 1.00 0.00 O ATOM 42 CB HIS 1 -1 53.556 -22.546 12.722 1.00 0.00 C ATOM 43 CG HIS 1 -1 54.711 -23.358 12.223 1.00 0.00 C ATOM 44 ND1 HIS 1 -1 54.959 -23.573 10.884 1.00 0.00 N ATOM 45 CD2 HIS 1 -1 55.693 -24.006 12.894 1.00 0.00 C ATOM 46 CE1 HIS 1 -1 56.042 -24.318 10.751 1.00 0.00 C ATOM 47 NE2 HIS 1 -1 56.506 -24.593 11.956 1.00 0.00 N ATOM 0 H HIS 1 -1 51.169 -23.097 11.366 1.00 0.00 H new ATOM 0 HA HIS 1 -1 52.656 -24.263 13.645 1.00 0.00 H new ATOM 0 HB2 HIS 1 -1 53.275 -21.822 11.957 1.00 0.00 H new ATOM 0 HB3 HIS 1 -1 53.873 -21.979 13.597 1.00 0.00 H new ATOM 0 HD2 HIS 1 -1 55.814 -24.052 13.966 1.00 0.00 H new ATOM 0 HE1 HIS 1 -1 56.474 -24.646 9.817 1.00 0.00 H new ATOM 0 HE2 HIS 1 -1 57.335 -25.152 12.158 1.00 0.00 H new ATOM 56 N HIS 1 0 50.578 -21.710 13.351 1.00 0.00 N ATOM 57 CA HIS 1 0 49.619 -20.871 14.066 1.00 0.00 C ATOM 58 C HIS 1 0 48.189 -21.287 13.739 1.00 0.00 C ATOM 59 O HIS 1 0 47.875 -21.602 12.587 1.00 0.00 O ATOM 60 CB HIS 1 0 49.828 -19.397 13.710 1.00 0.00 C ATOM 61 CG HIS 1 0 51.051 -18.793 14.332 1.00 0.00 C ATOM 62 ND1 HIS 1 0 50.999 -17.933 15.408 1.00 0.00 N ATOM 63 CD2 HIS 1 0 52.363 -18.927 14.022 1.00 0.00 C ATOM 64 CE1 HIS 1 0 52.226 -17.563 15.735 1.00 0.00 C ATOM 65 NE2 HIS 1 0 53.070 -18.153 14.909 1.00 0.00 N ATOM 0 H HIS 1 0 50.574 -21.577 12.340 1.00 0.00 H new ATOM 0 HA HIS 1 0 49.785 -21.003 15.135 1.00 0.00 H new ATOM 0 HB2 HIS 1 0 49.897 -19.301 12.626 1.00 0.00 H new ATOM 0 HB3 HIS 1 0 48.953 -18.829 14.025 1.00 0.00 H new ATOM 0 HD2 HIS 1 0 52.776 -19.530 13.226 1.00 0.00 H new ATOM 0 HE1 HIS 1 0 52.492 -16.893 16.540 1.00 0.00 H new ATOM 0 HE2 HIS 1 0 54.085 -18.050 14.927 1.00 0.00 H new ATOM 74 N HIS 1 1 47.332 -21.286 14.764 1.00 0.00 N ATOM 75 CA HIS 1 1 45.927 -21.661 14.607 1.00 0.00 C ATOM 76 C HIS 1 1 45.033 -20.427 14.559 1.00 0.00 C ATOM 77 O HIS 1 1 45.242 -19.471 15.312 1.00 0.00 O ATOM 78 CB HIS 1 1 45.485 -22.577 15.752 1.00 0.00 C ATOM 79 CG HIS 1 1 46.041 -23.965 15.666 1.00 0.00 C ATOM 80 ND1 HIS 1 1 45.381 -25.003 15.039 1.00 0.00 N ATOM 81 CD2 HIS 1 1 47.199 -24.488 16.135 1.00 0.00 C ATOM 82 CE1 HIS 1 1 46.110 -26.102 15.127 1.00 0.00 C ATOM 83 NE2 HIS 1 1 47.216 -25.816 15.787 1.00 0.00 N ATOM 0 H HIS 1 1 47.591 -21.028 15.716 1.00 0.00 H new ATOM 0 HA HIS 1 1 45.829 -22.197 13.663 1.00 0.00 H new ATOM 0 HB2 HIS 1 1 45.790 -22.132 16.699 1.00 0.00 H new ATOM 0 HB3 HIS 1 1 44.396 -22.632 15.761 1.00 0.00 H new ATOM 0 HD2 HIS 1 1 47.966 -23.959 16.681 1.00 0.00 H new ATOM 0 HE1 HIS 1 1 45.845 -27.070 14.727 1.00 0.00 H new ATOM 0 HE2 HIS 1 1 47.963 -26.475 16.004 1.00 0.00 H new ATOM 92 N HIS 1 2 44.041 -20.463 13.666 1.00 0.00 N ATOM 93 CA HIS 1 2 43.095 -19.359 13.502 1.00 0.00 C ATOM 94 C HIS 1 2 41.673 -19.822 13.801 1.00 0.00 C ATOM 95 O HIS 1 2 41.294 -20.944 13.451 1.00 0.00 O ATOM 96 CB HIS 1 2 43.174 -18.789 12.084 1.00 0.00 C ATOM 97 CG HIS 1 2 44.413 -17.986 11.826 1.00 0.00 C ATOM 98 ND1 HIS 1 2 44.451 -16.610 11.921 1.00 0.00 N ATOM 99 CD2 HIS 1 2 45.663 -18.371 11.476 1.00 0.00 C ATOM 100 CE1 HIS 1 2 45.669 -16.185 11.639 1.00 0.00 C ATOM 101 NE2 HIS 1 2 46.423 -17.233 11.367 1.00 0.00 N ATOM 0 H HIS 1 2 43.872 -21.252 13.042 1.00 0.00 H new ATOM 0 HA HIS 1 2 43.363 -18.574 14.210 1.00 0.00 H new ATOM 0 HB2 HIS 1 2 43.128 -19.610 11.369 1.00 0.00 H new ATOM 0 HB3 HIS 1 2 42.301 -18.161 11.905 1.00 0.00 H new ATOM 0 HD2 HIS 1 2 45.999 -19.384 11.313 1.00 0.00 H new ATOM 0 HE1 HIS 1 2 45.993 -15.155 11.632 1.00 0.00 H new ATOM 0 HE2 HIS 1 2 47.411 -17.203 11.116 1.00 0.00 H new ATOM 110 N HIS 1 3 40.898 -18.950 14.451 1.00 0.00 N ATOM 111 CA HIS 1 3 39.513 -19.256 14.813 1.00 0.00 C ATOM 112 C HIS 1 3 38.531 -18.486 13.936 1.00 0.00 C ATOM 113 O HIS 1 3 38.766 -17.323 13.599 1.00 0.00 O ATOM 114 CB HIS 1 3 39.263 -18.927 16.285 1.00 0.00 C ATOM 115 CG HIS 1 3 39.867 -19.917 17.234 1.00 0.00 C ATOM 116 ND1 HIS 1 3 39.171 -20.996 17.737 1.00 0.00 N ATOM 117 CD2 HIS 1 3 41.108 -19.988 17.772 1.00 0.00 C ATOM 118 CE1 HIS 1 3 39.957 -21.687 18.544 1.00 0.00 C ATOM 119 NE2 HIS 1 3 41.136 -21.096 18.581 1.00 0.00 N ATOM 0 H HIS 1 3 41.209 -18.022 14.738 1.00 0.00 H new ATOM 0 HA HIS 1 3 39.354 -20.322 14.652 1.00 0.00 H new ATOM 0 HB2 HIS 1 3 39.666 -17.938 16.501 1.00 0.00 H new ATOM 0 HB3 HIS 1 3 38.188 -18.878 16.460 1.00 0.00 H new ATOM 0 HD2 HIS 1 3 41.923 -19.301 17.597 1.00 0.00 H new ATOM 0 HE1 HIS 1 3 39.681 -22.582 19.081 1.00 0.00 H new ATOM 0 HE2 HIS 1 3 41.940 -21.412 19.124 1.00 0.00 H new ATOM 128 N SER 1 4 37.427 -19.153 13.578 1.00 0.00 N ATOM 129 CA SER 1 4 36.383 -18.556 12.741 1.00 0.00 C ATOM 130 C SER 1 4 35.257 -17.981 13.597 1.00 0.00 C ATOM 131 O SER 1 4 34.929 -18.531 14.653 1.00 0.00 O ATOM 132 CB SER 1 4 35.822 -19.599 11.772 1.00 0.00 C ATOM 133 OG SER 1 4 36.838 -20.106 10.924 1.00 0.00 O ATOM 0 H SER 1 4 37.234 -20.115 13.859 1.00 0.00 H new ATOM 0 HA SER 1 4 36.831 -17.742 12.171 1.00 0.00 H new ATOM 0 HB2 SER 1 4 35.371 -20.417 12.334 1.00 0.00 H new ATOM 0 HB3 SER 1 4 35.031 -19.152 11.170 1.00 0.00 H new ATOM 0 HG SER 1 4 36.454 -20.772 10.316 1.00 0.00 H new ATOM 139 N THR 1 5 34.675 -16.869 13.133 1.00 0.00 N ATOM 140 CA THR 1 5 33.578 -16.202 13.843 1.00 0.00 C ATOM 141 C THR 1 5 32.215 -16.628 13.280 1.00 0.00 C ATOM 142 O THR 1 5 31.973 -16.517 12.074 1.00 0.00 O ATOM 143 CB THR 1 5 33.725 -14.646 13.814 1.00 0.00 C ATOM 144 OG1 THR 1 5 32.618 -14.027 14.482 1.00 0.00 O ATOM 145 CG2 THR 1 5 33.837 -14.088 12.392 1.00 0.00 C ATOM 0 H THR 1 5 34.948 -16.410 12.264 1.00 0.00 H new ATOM 0 HA THR 1 5 33.633 -16.517 14.885 1.00 0.00 H new ATOM 0 HB THR 1 5 34.654 -14.413 14.334 1.00 0.00 H new ATOM 0 HG1 THR 1 5 32.724 -13.053 14.458 1.00 0.00 H new ATOM 0 HG21 THR 1 5 33.937 -13.003 12.434 1.00 0.00 H new ATOM 0 HG22 THR 1 5 34.712 -14.514 11.902 1.00 0.00 H new ATOM 0 HG23 THR 1 5 32.942 -14.349 11.827 1.00 0.00 H new ATOM 153 N SER 1 6 31.341 -17.111 14.167 1.00 0.00 N ATOM 154 CA SER 1 6 30.001 -17.564 13.778 1.00 0.00 C ATOM 155 C SER 1 6 28.904 -16.672 14.361 1.00 0.00 C ATOM 156 O SER 1 6 27.769 -16.681 13.876 1.00 0.00 O ATOM 157 CB SER 1 6 29.785 -19.012 14.219 1.00 0.00 C ATOM 158 OG SER 1 6 30.724 -19.877 13.605 1.00 0.00 O ATOM 0 H SER 1 6 31.538 -17.199 15.164 1.00 0.00 H new ATOM 0 HA SER 1 6 29.937 -17.500 12.692 1.00 0.00 H new ATOM 0 HB2 SER 1 6 29.875 -19.083 15.303 1.00 0.00 H new ATOM 0 HB3 SER 1 6 28.774 -19.327 13.962 1.00 0.00 H new ATOM 0 HG SER 1 6 30.566 -20.797 13.904 1.00 0.00 H new ATOM 164 N VAL 1 7 29.258 -15.899 15.391 1.00 0.00 N ATOM 165 CA VAL 1 7 28.316 -14.989 16.061 1.00 0.00 C ATOM 166 C VAL 1 7 28.399 -13.590 15.431 1.00 0.00 C ATOM 167 O VAL 1 7 29.381 -12.865 15.629 1.00 0.00 O ATOM 168 CB VAL 1 7 28.578 -14.899 17.601 1.00 0.00 C ATOM 169 CG1 VAL 1 7 27.432 -14.193 18.325 1.00 0.00 C ATOM 170 CG2 VAL 1 7 28.795 -16.282 18.212 1.00 0.00 C ATOM 0 H VAL 1 7 30.199 -15.884 15.785 1.00 0.00 H new ATOM 0 HA VAL 1 7 27.314 -15.395 15.923 1.00 0.00 H new ATOM 0 HB VAL 1 7 29.487 -14.312 17.731 1.00 0.00 H new ATOM 0 HG11 VAL 1 7 27.648 -14.149 19.392 1.00 0.00 H new ATOM 0 HG12 VAL 1 7 27.323 -13.181 17.935 1.00 0.00 H new ATOM 0 HG13 VAL 1 7 26.506 -14.745 18.165 1.00 0.00 H new ATOM 0 HG21 VAL 1 7 28.974 -16.183 19.283 1.00 0.00 H new ATOM 0 HG22 VAL 1 7 27.909 -16.895 18.048 1.00 0.00 H new ATOM 0 HG23 VAL 1 7 29.657 -16.756 17.742 1.00 0.00 H new ATOM 180 N ASP 1 8 27.360 -13.233 14.666 1.00 0.00 N ATOM 181 CA ASP 1 8 27.289 -11.936 13.988 1.00 0.00 C ATOM 182 C ASP 1 8 26.648 -10.872 14.885 1.00 0.00 C ATOM 183 O ASP 1 8 25.802 -11.187 15.727 1.00 0.00 O ATOM 184 CB ASP 1 8 26.499 -12.068 12.684 1.00 0.00 C ATOM 185 CG ASP 1 8 26.965 -11.093 11.618 1.00 0.00 C ATOM 186 OD1 ASP 1 8 26.379 -9.994 11.521 1.00 0.00 O ATOM 187 OD2 ASP 1 8 27.919 -11.428 10.885 1.00 0.00 O ATOM 0 H ASP 1 8 26.551 -13.832 14.501 1.00 0.00 H new ATOM 0 HA ASP 1 8 28.307 -11.618 13.763 1.00 0.00 H new ATOM 0 HB2 ASP 1 8 26.595 -13.086 12.307 1.00 0.00 H new ATOM 0 HB3 ASP 1 8 25.441 -11.901 12.886 1.00 0.00 H new ATOM 192 N LEU 1 9 27.066 -9.614 14.688 1.00 0.00 N ATOM 193 CA LEU 1 9 26.550 -8.478 15.461 1.00 0.00 C ATOM 194 C LEU 1 9 25.311 -7.875 14.790 1.00 0.00 C ATOM 195 O LEU 1 9 25.142 -7.985 13.571 1.00 0.00 O ATOM 196 CB LEU 1 9 27.637 -7.405 15.611 1.00 0.00 C ATOM 197 CG LEU 1 9 27.559 -6.557 16.888 1.00 0.00 C ATOM 198 CD1 LEU 1 9 28.379 -7.187 18.007 1.00 0.00 C ATOM 199 CD2 LEU 1 9 28.031 -5.136 16.615 1.00 0.00 C ATOM 0 H LEU 1 9 27.767 -9.357 13.993 1.00 0.00 H new ATOM 0 HA LEU 1 9 26.264 -8.841 16.448 1.00 0.00 H new ATOM 0 HB2 LEU 1 9 28.611 -7.893 15.579 1.00 0.00 H new ATOM 0 HB3 LEU 1 9 27.586 -6.739 14.750 1.00 0.00 H new ATOM 0 HG LEU 1 9 26.518 -6.520 17.209 1.00 0.00 H new ATOM 0 HD11 LEU 1 9 28.309 -6.569 18.902 1.00 0.00 H new ATOM 0 HD12 LEU 1 9 27.994 -8.184 18.223 1.00 0.00 H new ATOM 0 HD13 LEU 1 9 29.422 -7.260 17.697 1.00 0.00 H new ATOM 0 HD21 LEU 1 9 27.969 -4.549 17.532 1.00 0.00 H new ATOM 0 HD22 LEU 1 9 29.064 -5.156 16.267 1.00 0.00 H new ATOM 0 HD23 LEU 1 9 27.399 -4.683 15.851 1.00 0.00 H new ATOM 211 N GLY 1 10 24.448 -7.248 15.600 1.00 0.00 N ATOM 212 CA GLY 1 10 23.232 -6.631 15.085 1.00 0.00 C ATOM 213 C GLY 1 10 22.885 -5.338 15.801 1.00 0.00 C ATOM 214 O GLY 1 10 21.925 -5.294 16.575 1.00 0.00 O ATOM 0 H GLY 1 10 24.574 -7.158 16.608 1.00 0.00 H new ATOM 0 HA2 GLY 1 10 23.353 -6.431 14.020 1.00 0.00 H new ATOM 0 HA3 GLY 1 10 22.403 -7.331 15.186 1.00 0.00 H new ATOM 218 N THR 1 11 23.673 -4.289 15.536 1.00 0.00 N ATOM 219 CA THR 1 11 23.464 -2.972 16.153 1.00 0.00 C ATOM 220 C THR 1 11 23.069 -1.925 15.111 1.00 0.00 C ATOM 221 O THR 1 11 22.479 -0.895 15.448 1.00 0.00 O ATOM 222 CB THR 1 11 24.732 -2.491 16.893 1.00 0.00 C ATOM 223 OG1 THR 1 11 25.849 -2.453 15.994 1.00 0.00 O ATOM 224 CG2 THR 1 11 25.053 -3.410 18.060 1.00 0.00 C ATOM 0 H THR 1 11 24.466 -4.327 14.895 1.00 0.00 H new ATOM 0 HA THR 1 11 22.652 -3.087 16.871 1.00 0.00 H new ATOM 0 HB THR 1 11 24.541 -1.488 17.274 1.00 0.00 H new ATOM 0 HG1 THR 1 11 26.646 -2.145 16.475 1.00 0.00 H new ATOM 0 HG21 THR 1 11 25.949 -3.054 18.568 1.00 0.00 H new ATOM 0 HG22 THR 1 11 24.217 -3.415 18.760 1.00 0.00 H new ATOM 0 HG23 THR 1 11 25.223 -4.421 17.691 1.00 0.00 H new ATOM 232 N GLU 1 12 23.404 -2.208 13.849 1.00 0.00 N ATOM 233 CA GLU 1 12 23.115 -1.306 12.734 1.00 0.00 C ATOM 234 C GLU 1 12 22.005 -1.854 11.829 1.00 0.00 C ATOM 235 O GLU 1 12 21.128 -1.106 11.384 1.00 0.00 O ATOM 236 CB GLU 1 12 24.414 -1.055 11.939 1.00 0.00 C ATOM 237 CG GLU 1 12 24.225 -0.343 10.607 1.00 0.00 C ATOM 238 CD GLU 1 12 25.537 -0.014 9.921 1.00 0.00 C ATOM 239 OE1 GLU 1 12 26.032 -0.863 9.150 1.00 0.00 O ATOM 240 OE2 GLU 1 12 26.068 1.091 10.156 1.00 0.00 O ATOM 0 H GLU 1 12 23.882 -3.066 13.574 1.00 0.00 H new ATOM 0 HA GLU 1 12 22.748 -0.361 13.134 1.00 0.00 H new ATOM 0 HB2 GLU 1 12 25.092 -0.465 12.556 1.00 0.00 H new ATOM 0 HB3 GLU 1 12 24.901 -2.013 11.756 1.00 0.00 H new ATOM 0 HG2 GLU 1 12 23.624 -0.970 9.948 1.00 0.00 H new ATOM 0 HG3 GLU 1 12 23.665 0.578 10.770 1.00 0.00 H new ATOM 247 N ASN 1 13 22.068 -3.152 11.567 1.00 0.00 N ATOM 248 CA ASN 1 13 21.109 -3.846 10.700 1.00 0.00 C ATOM 249 C ASN 1 13 19.749 -4.115 11.388 1.00 0.00 C ATOM 250 O ASN 1 13 18.903 -4.828 10.834 1.00 0.00 O ATOM 251 CB ASN 1 13 21.744 -5.157 10.226 1.00 0.00 C ATOM 252 CG ASN 1 13 21.226 -5.645 8.910 1.00 0.00 C ATOM 253 OD1 ASN 1 13 20.058 -5.468 8.553 1.00 0.00 O ATOM 254 ND2 ASN 1 13 22.119 -6.266 8.180 1.00 0.00 N ATOM 0 H ASN 1 13 22.789 -3.763 11.950 1.00 0.00 H new ATOM 0 HA ASN 1 13 20.888 -3.197 9.853 1.00 0.00 H new ATOM 0 HB2 ASN 1 13 22.823 -5.020 10.152 1.00 0.00 H new ATOM 0 HB3 ASN 1 13 21.572 -5.925 10.980 1.00 0.00 H new ATOM 0 HD21 ASN 1 13 21.863 -6.633 7.263 1.00 0.00 H new ATOM 0 HD22 ASN 1 13 23.071 -6.382 8.528 1.00 0.00 H new ATOM 261 N LEU 1 14 19.536 -3.532 12.579 1.00 0.00 N ATOM 262 CA LEU 1 14 18.277 -3.710 13.321 1.00 0.00 C ATOM 263 C LEU 1 14 17.181 -2.760 12.810 1.00 0.00 C ATOM 264 O LEU 1 14 17.479 -1.710 12.234 1.00 0.00 O ATOM 265 CB LEU 1 14 18.494 -3.534 14.844 1.00 0.00 C ATOM 266 CG LEU 1 14 19.231 -2.258 15.307 1.00 0.00 C ATOM 267 CD1 LEU 1 14 18.261 -1.092 15.452 1.00 0.00 C ATOM 268 CD2 LEU 1 14 19.951 -2.506 16.625 1.00 0.00 C ATOM 0 H LEU 1 14 20.217 -2.935 13.048 1.00 0.00 H new ATOM 0 HA LEU 1 14 17.938 -4.731 13.145 1.00 0.00 H new ATOM 0 HB2 LEU 1 14 17.518 -3.556 15.329 1.00 0.00 H new ATOM 0 HB3 LEU 1 14 19.051 -4.397 15.208 1.00 0.00 H new ATOM 0 HG LEU 1 14 19.968 -2.001 14.546 1.00 0.00 H new ATOM 0 HD11 LEU 1 14 18.804 -0.205 15.779 1.00 0.00 H new ATOM 0 HD12 LEU 1 14 17.786 -0.893 14.492 1.00 0.00 H new ATOM 0 HD13 LEU 1 14 17.498 -1.343 16.189 1.00 0.00 H new ATOM 0 HD21 LEU 1 14 20.465 -1.596 16.936 1.00 0.00 H new ATOM 0 HD22 LEU 1 14 19.226 -2.792 17.387 1.00 0.00 H new ATOM 0 HD23 LEU 1 14 20.678 -3.308 16.497 1.00 0.00 H new ATOM 280 N TYR 1 15 15.919 -3.143 13.045 1.00 0.00 N ATOM 281 CA TYR 1 15 14.750 -2.358 12.615 1.00 0.00 C ATOM 282 C TYR 1 15 14.407 -1.257 13.626 1.00 0.00 C ATOM 283 O TYR 1 15 14.856 -1.302 14.775 1.00 0.00 O ATOM 284 CB TYR 1 15 13.541 -3.280 12.419 1.00 0.00 C ATOM 285 CG TYR 1 15 13.454 -3.881 11.034 1.00 0.00 C ATOM 286 CD1 TYR 1 15 14.115 -5.064 10.725 1.00 0.00 C ATOM 287 CD2 TYR 1 15 12.719 -3.259 10.034 1.00 0.00 C ATOM 288 CE1 TYR 1 15 14.044 -5.609 9.457 1.00 0.00 C ATOM 289 CE2 TYR 1 15 12.642 -3.799 8.764 1.00 0.00 C ATOM 290 CZ TYR 1 15 13.307 -4.973 8.481 1.00 0.00 C ATOM 291 OH TYR 1 15 13.234 -5.511 7.217 1.00 0.00 O ATOM 0 H TYR 1 15 15.678 -4.003 13.537 1.00 0.00 H new ATOM 0 HA TYR 1 15 15.001 -1.879 11.669 1.00 0.00 H new ATOM 0 HB2 TYR 1 15 13.586 -4.085 13.153 1.00 0.00 H new ATOM 0 HB3 TYR 1 15 12.629 -2.717 12.619 1.00 0.00 H new ATOM 0 HD1 TYR 1 15 14.693 -5.565 11.487 1.00 0.00 H new ATOM 0 HD2 TYR 1 15 12.199 -2.338 10.252 1.00 0.00 H new ATOM 0 HE1 TYR 1 15 14.563 -6.529 9.232 1.00 0.00 H new ATOM 0 HE2 TYR 1 15 12.064 -3.304 7.998 1.00 0.00 H new ATOM 0 HH TYR 1 15 12.674 -4.940 6.650 1.00 0.00 H new ATOM 301 N PHE 1 16 13.631 -0.259 13.174 1.00 0.00 N ATOM 302 CA PHE 1 16 13.210 0.854 14.017 1.00 0.00 C ATOM 303 C PHE 1 16 11.774 1.277 13.694 1.00 0.00 C ATOM 304 O PHE 1 16 10.975 1.516 14.604 1.00 0.00 O ATOM 305 CB PHE 1 16 14.160 2.050 13.860 1.00 0.00 C ATOM 306 CG PHE 1 16 14.483 2.725 15.162 1.00 0.00 C ATOM 307 CD1 PHE 1 16 15.581 2.325 15.908 1.00 0.00 C ATOM 308 CD2 PHE 1 16 13.685 3.748 15.647 1.00 0.00 C ATOM 309 CE1 PHE 1 16 15.876 2.934 17.113 1.00 0.00 C ATOM 310 CE2 PHE 1 16 13.976 4.362 16.849 1.00 0.00 C ATOM 311 CZ PHE 1 16 15.072 3.954 17.584 1.00 0.00 C ATOM 0 H PHE 1 16 13.283 -0.208 12.217 1.00 0.00 H new ATOM 0 HA PHE 1 16 13.245 0.515 15.052 1.00 0.00 H new ATOM 0 HB2 PHE 1 16 15.086 1.712 13.394 1.00 0.00 H new ATOM 0 HB3 PHE 1 16 13.710 2.777 13.183 1.00 0.00 H new ATOM 0 HD1 PHE 1 16 16.213 1.529 15.543 1.00 0.00 H new ATOM 0 HD2 PHE 1 16 12.825 4.069 15.078 1.00 0.00 H new ATOM 0 HE1 PHE 1 16 16.734 2.613 17.686 1.00 0.00 H new ATOM 0 HE2 PHE 1 16 13.347 5.161 17.214 1.00 0.00 H new ATOM 0 HZ PHE 1 16 15.300 4.432 18.525 1.00 0.00 H new ATOM 321 N GLN 1 17 11.450 1.342 12.391 1.00 0.00 N ATOM 322 CA GLN 1 17 10.110 1.734 11.925 1.00 0.00 C ATOM 323 C GLN 1 17 9.150 0.539 11.931 1.00 0.00 C ATOM 324 O GLN 1 17 9.585 -0.614 11.858 1.00 0.00 O ATOM 325 CB GLN 1 17 10.191 2.336 10.517 1.00 0.00 C ATOM 326 CG GLN 1 17 10.781 3.739 10.480 1.00 0.00 C ATOM 327 CD GLN 1 17 10.831 4.316 9.079 1.00 0.00 C ATOM 328 OE1 GLN 1 17 9.882 4.957 8.625 1.00 0.00 O ATOM 329 NE2 GLN 1 17 11.942 4.094 8.386 1.00 0.00 N ATOM 0 H GLN 1 17 12.103 1.126 11.638 1.00 0.00 H new ATOM 0 HA GLN 1 17 9.722 2.486 12.613 1.00 0.00 H new ATOM 0 HB2 GLN 1 17 10.794 1.682 9.887 1.00 0.00 H new ATOM 0 HB3 GLN 1 17 9.191 2.361 10.085 1.00 0.00 H new ATOM 0 HG2 GLN 1 17 10.188 4.395 11.118 1.00 0.00 H new ATOM 0 HG3 GLN 1 17 11.789 3.716 10.895 1.00 0.00 H new ATOM 0 HE21 GLN 1 17 12.704 3.558 8.801 1.00 0.00 H new ATOM 0 HE22 GLN 1 17 12.034 4.460 7.438 1.00 0.00 H new ATOM 338 N SER 1 18 7.848 0.830 12.029 1.00 0.00 N ATOM 339 CA SER 1 18 6.813 -0.208 12.056 1.00 0.00 C ATOM 340 C SER 1 18 5.906 -0.156 10.818 1.00 0.00 C ATOM 341 O SER 1 18 5.096 -1.065 10.605 1.00 0.00 O ATOM 342 CB SER 1 18 5.969 -0.067 13.326 1.00 0.00 C ATOM 343 OG SER 1 18 6.772 -0.181 14.488 1.00 0.00 O ATOM 0 H SER 1 18 7.485 1.781 12.091 1.00 0.00 H new ATOM 0 HA SER 1 18 7.318 -1.174 12.051 1.00 0.00 H new ATOM 0 HB2 SER 1 18 5.462 0.898 13.324 1.00 0.00 H new ATOM 0 HB3 SER 1 18 5.195 -0.834 13.339 1.00 0.00 H new ATOM 0 HG SER 1 18 6.210 -0.086 15.285 1.00 0.00 H new ATOM 349 N ASN 1 19 6.050 0.901 10.009 1.00 0.00 N ATOM 350 CA ASN 1 19 5.233 1.074 8.801 1.00 0.00 C ATOM 351 C ASN 1 19 5.964 0.610 7.534 1.00 0.00 C ATOM 352 O ASN 1 19 5.329 0.393 6.498 1.00 0.00 O ATOM 353 CB ASN 1 19 4.803 2.541 8.656 1.00 0.00 C ATOM 354 CG ASN 1 19 3.808 2.978 9.687 1.00 0.00 C ATOM 355 OD1 ASN 1 19 2.943 2.218 10.130 1.00 0.00 O ATOM 356 ND2 ASN 1 19 3.937 4.227 10.072 1.00 0.00 N ATOM 0 H ASN 1 19 6.724 1.649 10.169 1.00 0.00 H new ATOM 0 HA ASN 1 19 4.350 0.446 8.915 1.00 0.00 H new ATOM 0 HB2 ASN 1 19 5.685 3.178 8.721 1.00 0.00 H new ATOM 0 HB3 ASN 1 19 4.375 2.689 7.664 1.00 0.00 H new ATOM 0 HD21 ASN 1 19 3.303 4.613 10.771 1.00 0.00 H new ATOM 0 HD22 ASN 1 19 4.671 4.811 9.672 1.00 0.00 H new ATOM 363 N ALA 1 20 7.294 0.450 7.626 1.00 0.00 N ATOM 364 CA ALA 1 20 8.121 0.008 6.492 1.00 0.00 C ATOM 365 C ALA 1 20 8.089 -1.515 6.329 1.00 0.00 C ATOM 366 O ALA 1 20 7.918 -2.242 7.312 1.00 0.00 O ATOM 367 CB ALA 1 20 9.555 0.487 6.675 1.00 0.00 C ATOM 0 H ALA 1 20 7.823 0.622 8.481 1.00 0.00 H new ATOM 0 HA ALA 1 20 7.706 0.447 5.585 1.00 0.00 H new ATOM 0 HB1 ALA 1 20 10.160 0.155 5.831 1.00 0.00 H new ATOM 0 HB2 ALA 1 20 9.571 1.576 6.727 1.00 0.00 H new ATOM 0 HB3 ALA 1 20 9.962 0.073 7.598 1.00 0.00 H new ATOM 373 N GLY 1 21 8.248 -1.980 5.082 1.00 0.00 N ATOM 374 CA GLY 1 21 8.241 -3.412 4.803 1.00 0.00 C ATOM 375 C GLY 1 21 7.010 -3.884 4.039 1.00 0.00 C ATOM 376 O GLY 1 21 6.872 -5.083 3.778 1.00 0.00 O ATOM 0 H GLY 1 21 8.381 -1.388 4.262 1.00 0.00 H new ATOM 0 HA2 GLY 1 21 9.132 -3.665 4.229 1.00 0.00 H new ATOM 0 HA3 GLY 1 21 8.303 -3.957 5.745 1.00 0.00 H new ATOM 380 N LYS 1 22 6.109 -2.949 3.692 1.00 0.00 N ATOM 381 CA LYS 1 22 4.890 -3.269 2.951 1.00 0.00 C ATOM 382 C LYS 1 22 5.137 -3.468 1.460 1.00 0.00 C ATOM 383 O LYS 1 22 6.173 -3.065 0.924 1.00 0.00 O ATOM 384 CB LYS 1 22 3.874 -2.148 3.125 1.00 0.00 C ATOM 385 CG LYS 1 22 2.922 -2.357 4.278 1.00 0.00 C ATOM 386 CD LYS 1 22 2.427 -1.025 4.796 1.00 0.00 C ATOM 387 CE LYS 1 22 1.485 -1.184 5.978 1.00 0.00 C ATOM 388 NZ LYS 1 22 0.941 0.129 6.429 1.00 0.00 N ATOM 0 H LYS 1 22 6.209 -1.959 3.918 1.00 0.00 H new ATOM 0 HA LYS 1 22 4.516 -4.208 3.358 1.00 0.00 H new ATOM 0 HB2 LYS 1 22 4.406 -1.208 3.272 1.00 0.00 H new ATOM 0 HB3 LYS 1 22 3.298 -2.047 2.205 1.00 0.00 H new ATOM 0 HG2 LYS 1 22 2.078 -2.966 3.956 1.00 0.00 H new ATOM 0 HG3 LYS 1 22 3.422 -2.903 5.078 1.00 0.00 H new ATOM 0 HD2 LYS 1 22 3.279 -0.413 5.092 1.00 0.00 H new ATOM 0 HD3 LYS 1 22 1.915 -0.493 3.994 1.00 0.00 H new ATOM 0 HE2 LYS 1 22 0.662 -1.843 5.702 1.00 0.00 H new ATOM 0 HE3 LYS 1 22 2.013 -1.662 6.803 1.00 0.00 H new ATOM 0 HZ1 LYS 1 22 0.303 -0.019 7.237 1.00 0.00 H new ATOM 0 HZ2 LYS 1 22 1.725 0.749 6.716 1.00 0.00 H new ATOM 0 HZ3 LYS 1 22 0.416 0.573 5.649 1.00 0.00 H new ATOM 402 N MET 1 23 4.155 -4.100 0.820 1.00 0.00 N ATOM 403 CA MET 1 23 4.158 -4.361 -0.596 1.00 0.00 C ATOM 404 C MET 1 23 2.838 -3.879 -1.198 1.00 0.00 C ATOM 405 O MET 1 23 1.807 -3.821 -0.522 1.00 0.00 O ATOM 406 CB MET 1 23 4.389 -5.848 -0.876 1.00 0.00 C ATOM 407 CG MET 1 23 5.586 -6.106 -1.773 1.00 0.00 C ATOM 408 SD MET 1 23 5.881 -7.859 -2.066 1.00 0.00 S ATOM 409 CE MET 1 23 7.338 -8.110 -1.057 1.00 0.00 C ATOM 0 H MET 1 23 3.321 -4.448 1.293 1.00 0.00 H new ATOM 0 HA MET 1 23 4.978 -3.816 -1.063 1.00 0.00 H new ATOM 0 HB2 MET 1 23 4.531 -6.372 0.069 1.00 0.00 H new ATOM 0 HB3 MET 1 23 3.497 -6.267 -1.341 1.00 0.00 H new ATOM 0 HG2 MET 1 23 5.432 -5.604 -2.728 1.00 0.00 H new ATOM 0 HG3 MET 1 23 6.474 -5.664 -1.321 1.00 0.00 H new ATOM 0 HE1 MET 1 23 7.459 -9.173 -0.850 1.00 0.00 H new ATOM 0 HE2 MET 1 23 8.216 -7.742 -1.588 1.00 0.00 H new ATOM 0 HE3 MET 1 23 7.228 -7.568 -0.118 1.00 0.00 H new ATOM 419 N PHE 1 24 2.922 -3.510 -2.456 1.00 0.00 N ATOM 420 CA PHE 1 24 1.813 -2.991 -3.258 1.00 0.00 C ATOM 421 C PHE 1 24 1.610 -3.924 -4.461 1.00 0.00 C ATOM 422 O PHE 1 24 2.449 -3.976 -5.369 1.00 0.00 O ATOM 423 CB PHE 1 24 2.154 -1.545 -3.706 1.00 0.00 C ATOM 424 CG PHE 1 24 1.186 -0.856 -4.660 1.00 0.00 C ATOM 425 CD1 PHE 1 24 1.664 0.108 -5.536 1.00 0.00 C ATOM 426 CD2 PHE 1 24 -0.174 -1.148 -4.682 1.00 0.00 C ATOM 427 CE1 PHE 1 24 0.817 0.761 -6.409 1.00 0.00 C ATOM 428 CE2 PHE 1 24 -1.022 -0.497 -5.557 1.00 0.00 C ATOM 429 CZ PHE 1 24 -0.527 0.457 -6.419 1.00 0.00 C ATOM 0 H PHE 1 24 3.796 -3.561 -2.979 1.00 0.00 H new ATOM 0 HA PHE 1 24 0.887 -2.958 -2.684 1.00 0.00 H new ATOM 0 HB2 PHE 1 24 2.241 -0.928 -2.812 1.00 0.00 H new ATOM 0 HB3 PHE 1 24 3.136 -1.562 -4.178 1.00 0.00 H new ATOM 0 HD1 PHE 1 24 2.716 0.352 -5.535 1.00 0.00 H new ATOM 0 HD2 PHE 1 24 -0.571 -1.892 -4.007 1.00 0.00 H new ATOM 0 HE1 PHE 1 24 1.207 1.509 -7.083 1.00 0.00 H new ATOM 0 HE2 PHE 1 24 -2.075 -0.736 -5.565 1.00 0.00 H new ATOM 0 HZ PHE 1 24 -1.191 0.966 -7.102 1.00 0.00 H new ATOM 439 N ILE 1 25 0.506 -4.666 -4.444 1.00 0.00 N ATOM 440 CA ILE 1 25 0.180 -5.616 -5.488 1.00 0.00 C ATOM 441 C ILE 1 25 -0.808 -5.005 -6.474 1.00 0.00 C ATOM 442 O ILE 1 25 -1.935 -4.657 -6.113 1.00 0.00 O ATOM 443 CB ILE 1 25 -0.417 -6.900 -4.890 1.00 0.00 C ATOM 444 CG1 ILE 1 25 0.054 -7.124 -3.425 1.00 0.00 C ATOM 445 CG2 ILE 1 25 -0.124 -8.116 -5.783 1.00 0.00 C ATOM 446 CD1 ILE 1 25 1.516 -7.528 -3.238 1.00 0.00 C ATOM 0 H ILE 1 25 -0.188 -4.620 -3.698 1.00 0.00 H new ATOM 0 HA ILE 1 25 1.102 -5.867 -6.013 1.00 0.00 H new ATOM 0 HB ILE 1 25 -1.500 -6.777 -4.856 1.00 0.00 H new ATOM 0 HG12 ILE 1 25 -0.121 -6.205 -2.865 1.00 0.00 H new ATOM 0 HG13 ILE 1 25 -0.574 -7.895 -2.978 1.00 0.00 H new ATOM 0 HG21 ILE 1 25 -0.558 -9.010 -5.335 1.00 0.00 H new ATOM 0 HG22 ILE 1 25 -0.560 -7.956 -6.769 1.00 0.00 H new ATOM 0 HG23 ILE 1 25 0.954 -8.246 -5.879 1.00 0.00 H new ATOM 0 HD11 ILE 1 25 1.725 -7.655 -2.176 1.00 0.00 H new ATOM 0 HD12 ILE 1 25 1.704 -8.466 -3.760 1.00 0.00 H new ATOM 0 HD13 ILE 1 25 2.163 -6.751 -3.645 1.00 0.00 H new ATOM 458 N GLY 1 26 -0.347 -4.868 -7.707 1.00 0.00 N ATOM 459 CA GLY 1 26 -1.153 -4.305 -8.765 1.00 0.00 C ATOM 460 C GLY 1 26 -1.679 -5.312 -9.758 1.00 0.00 C ATOM 461 O GLY 1 26 -1.155 -6.414 -9.877 1.00 0.00 O ATOM 0 H GLY 1 26 0.592 -5.144 -7.996 1.00 0.00 H new ATOM 0 HA2 GLY 1 26 -1.997 -3.778 -8.320 1.00 0.00 H new ATOM 0 HA3 GLY 1 26 -0.560 -3.563 -9.300 1.00 0.00 H new ATOM 465 N GLY 1 27 -2.764 -4.917 -10.433 1.00 0.00 N ATOM 466 CA GLY 1 27 -3.392 -5.738 -11.469 1.00 0.00 C ATOM 467 C GLY 1 27 -4.145 -6.963 -10.965 1.00 0.00 C ATOM 468 O GLY 1 27 -4.377 -7.889 -11.746 1.00 0.00 O ATOM 0 H GLY 1 27 -3.228 -4.023 -10.276 1.00 0.00 H new ATOM 0 HA2 GLY 1 27 -4.085 -5.114 -12.033 1.00 0.00 H new ATOM 0 HA3 GLY 1 27 -2.620 -6.068 -12.165 1.00 0.00 H new ATOM 472 N LEU 1 28 -4.549 -6.970 -9.679 1.00 0.00 N ATOM 473 CA LEU 1 28 -5.277 -8.098 -9.076 1.00 0.00 C ATOM 474 C LEU 1 28 -6.542 -8.438 -9.886 1.00 0.00 C ATOM 475 O LEU 1 28 -6.965 -7.652 -10.740 1.00 0.00 O ATOM 476 CB LEU 1 28 -5.676 -7.766 -7.623 1.00 0.00 C ATOM 477 CG LEU 1 28 -4.546 -7.327 -6.680 1.00 0.00 C ATOM 478 CD1 LEU 1 28 -5.131 -6.700 -5.426 1.00 0.00 C ATOM 479 CD2 LEU 1 28 -3.654 -8.503 -6.304 1.00 0.00 C ATOM 0 H LEU 1 28 -4.380 -6.198 -9.035 1.00 0.00 H new ATOM 0 HA LEU 1 28 -4.612 -8.962 -9.083 1.00 0.00 H new ATOM 0 HB2 LEU 1 28 -6.425 -6.974 -7.648 1.00 0.00 H new ATOM 0 HB3 LEU 1 28 -6.156 -8.645 -7.193 1.00 0.00 H new ATOM 0 HG LEU 1 28 -3.935 -6.591 -7.203 1.00 0.00 H new ATOM 0 HD11 LEU 1 28 -4.323 -6.391 -4.763 1.00 0.00 H new ATOM 0 HD12 LEU 1 28 -5.729 -5.830 -5.699 1.00 0.00 H new ATOM 0 HD13 LEU 1 28 -5.762 -7.428 -4.916 1.00 0.00 H new ATOM 0 HD21 LEU 1 28 -2.864 -8.161 -5.636 1.00 0.00 H new ATOM 0 HD22 LEU 1 28 -4.249 -9.265 -5.801 1.00 0.00 H new ATOM 0 HD23 LEU 1 28 -3.210 -8.925 -7.205 1.00 0.00 H new ATOM 491 N SER 1 29 -7.159 -9.583 -9.587 1.00 0.00 N ATOM 492 CA SER 1 29 -8.335 -10.029 -10.287 1.00 0.00 C ATOM 493 C SER 1 29 -9.587 -9.723 -9.471 1.00 0.00 C ATOM 494 O SER 1 29 -9.519 -9.283 -8.319 1.00 0.00 O ATOM 495 CB SER 1 29 -8.217 -11.532 -10.572 1.00 0.00 C ATOM 496 OG SER 1 29 -9.066 -11.917 -11.640 1.00 0.00 O ATOM 0 H SER 1 29 -6.847 -10.217 -8.851 1.00 0.00 H new ATOM 0 HA SER 1 29 -8.418 -9.497 -11.235 1.00 0.00 H new ATOM 0 HB2 SER 1 29 -7.184 -11.779 -10.817 1.00 0.00 H new ATOM 0 HB3 SER 1 29 -8.475 -12.097 -9.676 1.00 0.00 H new ATOM 0 HG SER 1 29 -9.596 -12.696 -11.372 1.00 0.00 H new ATOM 502 N TRP 1 30 -10.717 -9.995 -10.094 1.00 0.00 N ATOM 503 CA TRP 1 30 -12.047 -9.787 -9.539 1.00 0.00 C ATOM 504 C TRP 1 30 -12.366 -10.812 -8.440 1.00 0.00 C ATOM 505 O TRP 1 30 -13.297 -10.635 -7.649 1.00 0.00 O ATOM 506 CB TRP 1 30 -13.067 -9.911 -10.689 1.00 0.00 C ATOM 507 CG TRP 1 30 -13.120 -11.282 -11.338 1.00 0.00 C ATOM 508 CD1 TRP 1 30 -12.059 -12.001 -11.814 1.00 0.00 C ATOM 509 CD2 TRP 1 30 -14.282 -12.094 -11.576 1.00 0.00 C ATOM 510 NE1 TRP 1 30 -12.480 -13.203 -12.303 1.00 0.00 N ATOM 511 CE2 TRP 1 30 -13.834 -13.284 -12.181 1.00 0.00 C ATOM 512 CE3 TRP 1 30 -15.653 -11.941 -11.336 1.00 0.00 C ATOM 513 CZ2 TRP 1 30 -14.695 -14.306 -12.549 1.00 0.00 C ATOM 514 CZ3 TRP 1 30 -16.511 -12.961 -11.704 1.00 0.00 C ATOM 515 CH2 TRP 1 30 -16.028 -14.132 -12.305 1.00 0.00 C ATOM 0 H TRP 1 30 -10.738 -10.382 -11.037 1.00 0.00 H new ATOM 0 HA TRP 1 30 -12.096 -8.799 -9.082 1.00 0.00 H new ATOM 0 HB2 TRP 1 30 -14.058 -9.665 -10.307 1.00 0.00 H new ATOM 0 HB3 TRP 1 30 -12.827 -9.171 -11.452 1.00 0.00 H new ATOM 0 HD1 TRP 1 30 -11.033 -11.665 -11.804 1.00 0.00 H new ATOM 0 HE1 TRP 1 30 -11.877 -13.925 -12.697 1.00 0.00 H new ATOM 0 HE3 TRP 1 30 -16.033 -11.043 -10.872 1.00 0.00 H new ATOM 0 HZ2 TRP 1 30 -14.325 -15.209 -13.013 1.00 0.00 H new ATOM 0 HZ3 TRP 1 30 -17.571 -12.854 -11.526 1.00 0.00 H new ATOM 0 HH2 TRP 1 30 -16.723 -14.911 -12.580 1.00 0.00 H new ATOM 526 N GLN 1 31 -11.562 -11.876 -8.421 1.00 0.00 N ATOM 527 CA GLN 1 31 -11.712 -12.978 -7.482 1.00 0.00 C ATOM 528 C GLN 1 31 -10.769 -12.856 -6.298 1.00 0.00 C ATOM 529 O GLN 1 31 -11.050 -13.381 -5.217 1.00 0.00 O ATOM 530 CB GLN 1 31 -11.426 -14.282 -8.212 1.00 0.00 C ATOM 531 CG GLN 1 31 -12.489 -14.668 -9.227 1.00 0.00 C ATOM 532 CD GLN 1 31 -12.218 -16.014 -9.859 1.00 0.00 C ATOM 533 OE1 GLN 1 31 -11.614 -16.105 -10.929 1.00 0.00 O ATOM 534 NE2 GLN 1 31 -12.655 -17.069 -9.189 1.00 0.00 N ATOM 0 H GLN 1 31 -10.781 -11.994 -9.066 1.00 0.00 H new ATOM 0 HA GLN 1 31 -12.731 -12.956 -7.096 1.00 0.00 H new ATOM 0 HB2 GLN 1 31 -10.466 -14.199 -8.721 1.00 0.00 H new ATOM 0 HB3 GLN 1 31 -11.330 -15.083 -7.479 1.00 0.00 H new ATOM 0 HG2 GLN 1 31 -13.464 -14.688 -8.739 1.00 0.00 H new ATOM 0 HG3 GLN 1 31 -12.538 -13.907 -10.006 1.00 0.00 H new ATOM 0 HE21 GLN 1 31 -13.151 -16.943 -8.306 1.00 0.00 H new ATOM 0 HE22 GLN 1 31 -12.496 -18.008 -9.555 1.00 0.00 H new ATOM 543 N THR 1 32 -9.659 -12.149 -6.509 1.00 0.00 N ATOM 544 CA THR 1 32 -8.647 -11.959 -5.478 1.00 0.00 C ATOM 545 C THR 1 32 -9.139 -11.072 -4.319 1.00 0.00 C ATOM 546 O THR 1 32 -9.397 -9.877 -4.486 1.00 0.00 O ATOM 547 CB THR 1 32 -7.377 -11.363 -6.089 1.00 0.00 C ATOM 548 OG1 THR 1 32 -7.228 -11.804 -7.445 1.00 0.00 O ATOM 549 CG2 THR 1 32 -6.136 -11.756 -5.293 1.00 0.00 C ATOM 0 H THR 1 32 -9.439 -11.695 -7.396 1.00 0.00 H new ATOM 0 HA THR 1 32 -8.430 -12.942 -5.061 1.00 0.00 H new ATOM 0 HB THR 1 32 -7.476 -10.278 -6.061 1.00 0.00 H new ATOM 0 HG1 THR 1 32 -7.324 -12.778 -7.485 1.00 0.00 H new ATOM 0 HG21 THR 1 32 -5.253 -11.315 -5.755 1.00 0.00 H new ATOM 0 HG22 THR 1 32 -6.230 -11.392 -4.270 1.00 0.00 H new ATOM 0 HG23 THR 1 32 -6.038 -12.842 -5.285 1.00 0.00 H new ATOM 557 N SER 1 33 -9.255 -11.709 -3.155 1.00 0.00 N ATOM 558 CA SER 1 33 -9.672 -11.068 -1.907 1.00 0.00 C ATOM 559 C SER 1 33 -8.444 -10.843 -1.020 1.00 0.00 C ATOM 560 O SER 1 33 -7.422 -11.498 -1.242 1.00 0.00 O ATOM 561 CB SER 1 33 -10.699 -11.955 -1.188 1.00 0.00 C ATOM 562 OG SER 1 33 -10.228 -13.285 -1.054 1.00 0.00 O ATOM 0 H SER 1 33 -9.058 -12.704 -3.050 1.00 0.00 H new ATOM 0 HA SER 1 33 -10.135 -10.105 -2.123 1.00 0.00 H new ATOM 0 HB2 SER 1 33 -10.912 -11.542 -0.202 1.00 0.00 H new ATOM 0 HB3 SER 1 33 -11.636 -11.953 -1.744 1.00 0.00 H new ATOM 0 HG SER 1 33 -10.902 -13.826 -0.591 1.00 0.00 H new ATOM 568 N PRO 1 34 -8.485 -9.913 -0.010 1.00 0.00 N ATOM 569 CA PRO 1 34 -7.333 -9.681 0.893 1.00 0.00 C ATOM 570 C PRO 1 34 -6.867 -10.961 1.590 1.00 0.00 C ATOM 571 O PRO 1 34 -5.701 -11.087 1.974 1.00 0.00 O ATOM 572 CB PRO 1 34 -7.852 -8.652 1.911 1.00 0.00 C ATOM 573 CG PRO 1 34 -9.338 -8.655 1.756 1.00 0.00 C ATOM 574 CD PRO 1 34 -9.602 -8.997 0.320 1.00 0.00 C ATOM 0 HA PRO 1 34 -6.458 -9.331 0.344 1.00 0.00 H new ATOM 0 HB2 PRO 1 34 -7.562 -8.923 2.926 1.00 0.00 H new ATOM 0 HB3 PRO 1 34 -7.439 -7.663 1.715 1.00 0.00 H new ATOM 0 HG2 PRO 1 34 -9.798 -9.385 2.422 1.00 0.00 H new ATOM 0 HG3 PRO 1 34 -9.759 -7.682 2.009 1.00 0.00 H new ATOM 0 HD2 PRO 1 34 -10.571 -9.478 0.190 1.00 0.00 H new ATOM 0 HD3 PRO 1 34 -9.599 -8.110 -0.314 1.00 0.00 H new ATOM 582 N ASP 1 35 -7.804 -11.899 1.730 1.00 0.00 N ATOM 583 CA ASP 1 35 -7.548 -13.208 2.330 1.00 0.00 C ATOM 584 C ASP 1 35 -6.896 -14.130 1.312 1.00 0.00 C ATOM 585 O ASP 1 35 -6.072 -14.979 1.653 1.00 0.00 O ATOM 586 CB ASP 1 35 -8.837 -13.812 2.818 1.00 0.00 C ATOM 587 CG ASP 1 35 -9.106 -13.523 4.281 1.00 0.00 C ATOM 588 OD1 ASP 1 35 -8.871 -14.420 5.117 1.00 0.00 O ATOM 589 OD2 ASP 1 35 -9.549 -12.397 4.592 1.00 0.00 O ATOM 0 H ASP 1 35 -8.770 -11.770 1.428 1.00 0.00 H new ATOM 0 HA ASP 1 35 -6.873 -13.082 3.176 1.00 0.00 H new ATOM 0 HB2 ASP 1 35 -9.662 -13.427 2.219 1.00 0.00 H new ATOM 0 HB3 ASP 1 35 -8.808 -14.891 2.665 1.00 0.00 H new ATOM 594 N SER 1 36 -7.305 -13.936 0.054 1.00 0.00 N ATOM 595 CA SER 1 36 -6.782 -14.686 -1.088 1.00 0.00 C ATOM 596 C SER 1 36 -5.347 -14.252 -1.352 1.00 0.00 C ATOM 597 O SER 1 36 -4.505 -15.062 -1.743 1.00 0.00 O ATOM 598 CB SER 1 36 -7.647 -14.455 -2.332 1.00 0.00 C ATOM 599 OG SER 1 36 -7.274 -15.327 -3.387 1.00 0.00 O ATOM 0 H SER 1 36 -8.014 -13.248 -0.200 1.00 0.00 H new ATOM 0 HA SER 1 36 -6.805 -15.751 -0.858 1.00 0.00 H new ATOM 0 HB2 SER 1 36 -8.696 -14.611 -2.082 1.00 0.00 H new ATOM 0 HB3 SER 1 36 -7.548 -13.420 -2.660 1.00 0.00 H new ATOM 0 HG SER 1 36 -7.843 -15.159 -4.167 1.00 0.00 H new ATOM 605 N LEU 1 37 -5.086 -12.948 -1.125 1.00 0.00 N ATOM 606 CA LEU 1 37 -3.791 -12.361 -1.277 1.00 0.00 C ATOM 607 C LEU 1 37 -2.873 -12.810 -0.143 1.00 0.00 C ATOM 608 O LEU 1 37 -1.700 -13.111 -0.365 1.00 0.00 O ATOM 609 CB LEU 1 37 -3.998 -10.859 -1.251 1.00 0.00 C ATOM 610 CG LEU 1 37 -3.759 -10.123 -2.566 1.00 0.00 C ATOM 611 CD1 LEU 1 37 -4.284 -8.708 -2.467 1.00 0.00 C ATOM 612 CD2 LEU 1 37 -2.289 -10.104 -2.947 1.00 0.00 C ATOM 0 H LEU 1 37 -5.800 -12.284 -0.826 1.00 0.00 H new ATOM 0 HA LEU 1 37 -3.317 -12.669 -2.209 1.00 0.00 H new ATOM 0 HB2 LEU 1 37 -5.020 -10.660 -0.928 1.00 0.00 H new ATOM 0 HB3 LEU 1 37 -3.336 -10.435 -0.496 1.00 0.00 H new ATOM 0 HG LEU 1 37 -4.295 -10.661 -3.348 1.00 0.00 H new ATOM 0 HD11 LEU 1 37 -4.110 -8.189 -3.409 1.00 0.00 H new ATOM 0 HD12 LEU 1 37 -5.353 -8.731 -2.257 1.00 0.00 H new ATOM 0 HD13 LEU 1 37 -3.768 -8.184 -1.663 1.00 0.00 H new ATOM 0 HD21 LEU 1 37 -2.164 -9.570 -3.889 1.00 0.00 H new ATOM 0 HD22 LEU 1 37 -1.717 -9.601 -2.167 1.00 0.00 H new ATOM 0 HD23 LEU 1 37 -1.929 -11.127 -3.059 1.00 0.00 H new ATOM 624 N ARG 1 38 -3.442 -12.868 1.076 1.00 0.00 N ATOM 625 CA ARG 1 38 -2.729 -13.317 2.259 1.00 0.00 C ATOM 626 C ARG 1 38 -2.417 -14.803 2.109 1.00 0.00 C ATOM 627 O ARG 1 38 -1.311 -15.241 2.406 1.00 0.00 O ATOM 628 CB ARG 1 38 -3.556 -13.069 3.530 1.00 0.00 C ATOM 629 CG ARG 1 38 -2.700 -12.805 4.769 1.00 0.00 C ATOM 630 CD ARG 1 38 -3.323 -13.378 6.036 1.00 0.00 C ATOM 631 NE ARG 1 38 -4.496 -12.618 6.482 1.00 0.00 N ATOM 632 CZ ARG 1 38 -5.314 -12.998 7.473 1.00 0.00 C ATOM 633 NH1 ARG 1 38 -5.103 -14.133 8.138 1.00 0.00 N ATOM 634 NH2 ARG 1 38 -6.344 -12.233 7.805 1.00 0.00 N ATOM 0 H ARG 1 38 -4.410 -12.602 1.255 1.00 0.00 H new ATOM 0 HA ARG 1 38 -1.802 -12.751 2.355 1.00 0.00 H new ATOM 0 HB2 ARG 1 38 -4.216 -12.217 3.365 1.00 0.00 H new ATOM 0 HB3 ARG 1 38 -4.193 -13.934 3.715 1.00 0.00 H new ATOM 0 HG2 ARG 1 38 -1.711 -13.240 4.624 1.00 0.00 H new ATOM 0 HG3 ARG 1 38 -2.561 -11.731 4.889 1.00 0.00 H new ATOM 0 HD2 ARG 1 38 -3.612 -14.414 5.858 1.00 0.00 H new ATOM 0 HD3 ARG 1 38 -2.577 -13.387 6.831 1.00 0.00 H new ATOM 0 HE ARG 1 38 -4.703 -11.740 6.005 1.00 0.00 H new ATOM 0 HH11 ARG 1 38 -4.310 -14.726 7.895 1.00 0.00 H new ATOM 0 HH12 ARG 1 38 -5.735 -14.409 8.890 1.00 0.00 H new ATOM 0 HH21 ARG 1 38 -6.512 -11.359 7.307 1.00 0.00 H new ATOM 0 HH22 ARG 1 38 -6.969 -12.518 8.559 1.00 0.00 H new ATOM 648 N ASP 1 39 -3.416 -15.561 1.611 1.00 0.00 N ATOM 649 CA ASP 1 39 -3.273 -16.994 1.368 1.00 0.00 C ATOM 650 C ASP 1 39 -2.271 -17.284 0.240 1.00 0.00 C ATOM 651 O ASP 1 39 -1.459 -18.206 0.355 1.00 0.00 O ATOM 652 CB ASP 1 39 -4.629 -17.612 1.025 1.00 0.00 C ATOM 653 CG ASP 1 39 -5.346 -18.148 2.248 1.00 0.00 C ATOM 654 OD1 ASP 1 39 -6.121 -17.387 2.865 1.00 0.00 O ATOM 655 OD2 ASP 1 39 -5.133 -19.331 2.590 1.00 0.00 O ATOM 0 H ASP 1 39 -4.335 -15.191 1.370 1.00 0.00 H new ATOM 0 HA ASP 1 39 -2.889 -17.443 2.284 1.00 0.00 H new ATOM 0 HB2 ASP 1 39 -5.254 -16.863 0.540 1.00 0.00 H new ATOM 0 HB3 ASP 1 39 -4.486 -18.420 0.308 1.00 0.00 H new ATOM 660 N TYR 1 40 -2.310 -16.465 -0.834 1.00 0.00 N ATOM 661 CA TYR 1 40 -1.422 -16.633 -1.984 1.00 0.00 C ATOM 662 C TYR 1 40 0.019 -16.233 -1.643 1.00 0.00 C ATOM 663 O TYR 1 40 0.955 -16.995 -1.874 1.00 0.00 O ATOM 664 CB TYR 1 40 -1.934 -15.807 -3.175 1.00 0.00 C ATOM 665 CG TYR 1 40 -1.553 -16.385 -4.521 1.00 0.00 C ATOM 666 CD1 TYR 1 40 -2.273 -17.439 -5.069 1.00 0.00 C ATOM 667 CD2 TYR 1 40 -0.471 -15.887 -5.235 1.00 0.00 C ATOM 668 CE1 TYR 1 40 -1.926 -17.981 -6.291 1.00 0.00 C ATOM 669 CE2 TYR 1 40 -0.119 -16.423 -6.460 1.00 0.00 C ATOM 670 CZ TYR 1 40 -0.848 -17.470 -6.982 1.00 0.00 C ATOM 671 OH TYR 1 40 -0.499 -18.007 -8.199 1.00 0.00 O ATOM 0 H TYR 1 40 -2.955 -15.679 -0.919 1.00 0.00 H new ATOM 0 HA TYR 1 40 -1.421 -17.689 -2.254 1.00 0.00 H new ATOM 0 HB2 TYR 1 40 -3.020 -15.733 -3.115 1.00 0.00 H new ATOM 0 HB3 TYR 1 40 -1.540 -14.793 -3.100 1.00 0.00 H new ATOM 0 HD1 TYR 1 40 -3.118 -17.841 -4.530 1.00 0.00 H new ATOM 0 HD2 TYR 1 40 0.104 -15.069 -4.827 1.00 0.00 H new ATOM 0 HE1 TYR 1 40 -2.496 -18.801 -6.703 1.00 0.00 H new ATOM 0 HE2 TYR 1 40 0.723 -16.023 -7.005 1.00 0.00 H new ATOM 0 HH TYR 1 40 -0.465 -17.296 -8.873 1.00 0.00 H new ATOM 681 N PHE 1 41 0.170 -15.032 -1.068 1.00 0.00 N ATOM 682 CA PHE 1 41 1.459 -14.472 -0.702 1.00 0.00 C ATOM 683 C PHE 1 41 2.112 -15.167 0.501 1.00 0.00 C ATOM 684 O PHE 1 41 3.339 -15.144 0.633 1.00 0.00 O ATOM 685 CB PHE 1 41 1.294 -12.980 -0.511 1.00 0.00 C ATOM 686 CG PHE 1 41 1.406 -12.232 -1.815 1.00 0.00 C ATOM 687 CD1 PHE 1 41 0.367 -12.264 -2.739 1.00 0.00 C ATOM 688 CD2 PHE 1 41 2.558 -11.536 -2.141 1.00 0.00 C ATOM 689 CE1 PHE 1 41 0.485 -11.614 -3.956 1.00 0.00 C ATOM 690 CE2 PHE 1 41 2.675 -10.880 -3.351 1.00 0.00 C ATOM 691 CZ PHE 1 41 1.639 -10.920 -4.261 1.00 0.00 C ATOM 0 H PHE 1 41 -0.616 -14.421 -0.845 1.00 0.00 H new ATOM 0 HA PHE 1 41 2.164 -14.654 -1.513 1.00 0.00 H new ATOM 0 HB2 PHE 1 41 0.324 -12.777 -0.058 1.00 0.00 H new ATOM 0 HB3 PHE 1 41 2.052 -12.616 0.183 1.00 0.00 H new ATOM 0 HD1 PHE 1 41 -0.540 -12.801 -2.505 1.00 0.00 H new ATOM 0 HD2 PHE 1 41 3.378 -11.506 -1.438 1.00 0.00 H new ATOM 0 HE1 PHE 1 41 -0.327 -11.650 -4.668 1.00 0.00 H new ATOM 0 HE2 PHE 1 41 3.578 -10.336 -3.585 1.00 0.00 H new ATOM 0 HZ PHE 1 41 1.730 -10.410 -5.209 1.00 0.00 H new ATOM 701 N SER 1 42 1.287 -15.787 1.386 1.00 0.00 N ATOM 702 CA SER 1 42 1.795 -16.512 2.579 1.00 0.00 C ATOM 703 C SER 1 42 2.652 -17.680 2.136 1.00 0.00 C ATOM 704 O SER 1 42 3.402 -18.283 2.909 1.00 0.00 O ATOM 705 CB SER 1 42 0.650 -17.023 3.463 1.00 0.00 C ATOM 706 OG SER 1 42 -0.275 -17.793 2.715 1.00 0.00 O ATOM 0 H SER 1 42 0.271 -15.799 1.295 1.00 0.00 H new ATOM 0 HA SER 1 42 2.388 -15.813 3.168 1.00 0.00 H new ATOM 0 HB2 SER 1 42 1.056 -17.627 4.275 1.00 0.00 H new ATOM 0 HB3 SER 1 42 0.136 -16.178 3.921 1.00 0.00 H new ATOM 0 HG SER 1 42 -0.131 -17.638 1.758 1.00 0.00 H new ATOM 712 N LYS 1 43 2.501 -17.952 0.855 1.00 0.00 N ATOM 713 CA LYS 1 43 3.190 -19.019 0.158 1.00 0.00 C ATOM 714 C LYS 1 43 4.630 -18.620 -0.202 1.00 0.00 C ATOM 715 O LYS 1 43 5.442 -19.468 -0.580 1.00 0.00 O ATOM 716 CB LYS 1 43 2.398 -19.374 -1.094 1.00 0.00 C ATOM 717 CG LYS 1 43 1.250 -20.347 -0.846 1.00 0.00 C ATOM 718 CD LYS 1 43 1.448 -21.649 -1.604 1.00 0.00 C ATOM 719 CE LYS 1 43 0.327 -22.636 -1.321 1.00 0.00 C ATOM 720 NZ LYS 1 43 0.494 -23.902 -2.087 1.00 0.00 N ATOM 0 H LYS 1 43 1.875 -17.419 0.251 1.00 0.00 H new ATOM 0 HA LYS 1 43 3.257 -19.888 0.813 1.00 0.00 H new ATOM 0 HB2 LYS 1 43 1.997 -18.459 -1.530 1.00 0.00 H new ATOM 0 HB3 LYS 1 43 3.076 -19.807 -1.830 1.00 0.00 H new ATOM 0 HG2 LYS 1 43 1.172 -20.555 0.221 1.00 0.00 H new ATOM 0 HG3 LYS 1 43 0.310 -19.887 -1.151 1.00 0.00 H new ATOM 0 HD2 LYS 1 43 1.493 -21.445 -2.674 1.00 0.00 H new ATOM 0 HD3 LYS 1 43 2.404 -22.092 -1.324 1.00 0.00 H new ATOM 0 HE2 LYS 1 43 0.300 -22.858 -0.254 1.00 0.00 H new ATOM 0 HE3 LYS 1 43 -0.630 -22.181 -1.576 1.00 0.00 H new ATOM 0 HZ1 LYS 1 43 -0.291 -24.548 -1.866 1.00 0.00 H new ATOM 0 HZ2 LYS 1 43 0.494 -23.694 -3.106 1.00 0.00 H new ATOM 0 HZ3 LYS 1 43 1.395 -24.350 -1.825 1.00 0.00 H new ATOM 734 N PHE 1 44 4.922 -17.320 -0.072 1.00 0.00 N ATOM 735 CA PHE 1 44 6.251 -16.763 -0.344 1.00 0.00 C ATOM 736 C PHE 1 44 6.996 -16.518 0.968 1.00 0.00 C ATOM 737 O PHE 1 44 8.217 -16.677 1.048 1.00 0.00 O ATOM 738 CB PHE 1 44 6.122 -15.454 -1.108 1.00 0.00 C ATOM 739 CG PHE 1 44 6.573 -15.532 -2.537 1.00 0.00 C ATOM 740 CD1 PHE 1 44 5.665 -15.797 -3.548 1.00 0.00 C ATOM 741 CD2 PHE 1 44 7.906 -15.344 -2.869 1.00 0.00 C ATOM 742 CE1 PHE 1 44 6.074 -15.873 -4.863 1.00 0.00 C ATOM 743 CE2 PHE 1 44 8.322 -15.419 -4.184 1.00 0.00 C ATOM 744 CZ PHE 1 44 7.403 -15.684 -5.183 1.00 0.00 C ATOM 0 H PHE 1 44 4.240 -16.623 0.226 1.00 0.00 H new ATOM 0 HA PHE 1 44 6.812 -17.477 -0.947 1.00 0.00 H new ATOM 0 HB2 PHE 1 44 5.081 -15.133 -1.084 1.00 0.00 H new ATOM 0 HB3 PHE 1 44 6.704 -14.688 -0.596 1.00 0.00 H new ATOM 0 HD1 PHE 1 44 4.624 -15.946 -3.304 1.00 0.00 H new ATOM 0 HD2 PHE 1 44 8.626 -15.137 -2.091 1.00 0.00 H new ATOM 0 HE1 PHE 1 44 5.355 -16.080 -5.642 1.00 0.00 H new ATOM 0 HE2 PHE 1 44 9.363 -15.271 -4.432 1.00 0.00 H new ATOM 0 HZ PHE 1 44 7.725 -15.743 -6.212 1.00 0.00 H new ATOM 754 N GLY 1 45 6.221 -16.136 1.988 1.00 0.00 N ATOM 755 CA GLY 1 45 6.720 -15.866 3.305 1.00 0.00 C ATOM 756 C GLY 1 45 5.571 -15.672 4.259 1.00 0.00 C ATOM 757 O GLY 1 45 4.443 -16.089 3.974 1.00 0.00 O ATOM 0 H GLY 1 45 5.213 -16.009 1.901 1.00 0.00 H new ATOM 0 HA2 GLY 1 45 7.348 -16.691 3.641 1.00 0.00 H new ATOM 0 HA3 GLY 1 45 7.346 -14.974 3.290 1.00 0.00 H new ATOM 761 N GLU 1 46 5.849 -15.035 5.379 1.00 0.00 N ATOM 762 CA GLU 1 46 4.851 -14.767 6.371 1.00 0.00 C ATOM 763 C GLU 1 46 4.391 -13.328 6.278 1.00 0.00 C ATOM 764 O GLU 1 46 5.191 -12.390 6.228 1.00 0.00 O ATOM 765 CB GLU 1 46 5.337 -15.080 7.780 1.00 0.00 C ATOM 766 CG GLU 1 46 4.183 -15.194 8.767 1.00 0.00 C ATOM 767 CD GLU 1 46 4.607 -15.737 10.118 1.00 0.00 C ATOM 768 OE1 GLU 1 46 4.783 -16.967 10.236 1.00 0.00 O ATOM 769 OE2 GLU 1 46 4.760 -14.931 11.061 1.00 0.00 O ATOM 0 H GLU 1 46 6.779 -14.691 5.619 1.00 0.00 H new ATOM 0 HA GLU 1 46 4.008 -15.428 6.168 1.00 0.00 H new ATOM 0 HB2 GLU 1 46 5.900 -16.013 7.771 1.00 0.00 H new ATOM 0 HB3 GLU 1 46 6.021 -14.298 8.110 1.00 0.00 H new ATOM 0 HG2 GLU 1 46 3.730 -14.212 8.903 1.00 0.00 H new ATOM 0 HG3 GLU 1 46 3.415 -15.843 8.346 1.00 0.00 H new ATOM 776 N ILE 1 47 3.089 -13.207 6.285 1.00 0.00 N ATOM 777 CA ILE 1 47 2.404 -11.921 6.188 1.00 0.00 C ATOM 778 C ILE 1 47 1.875 -11.462 7.541 1.00 0.00 C ATOM 779 O ILE 1 47 1.355 -12.252 8.336 1.00 0.00 O ATOM 780 CB ILE 1 47 1.273 -11.956 5.131 1.00 0.00 C ATOM 781 CG1 ILE 1 47 1.880 -12.227 3.767 1.00 0.00 C ATOM 782 CG2 ILE 1 47 0.464 -10.656 5.088 1.00 0.00 C ATOM 783 CD1 ILE 1 47 1.165 -13.292 2.947 1.00 0.00 C ATOM 0 H ILE 1 47 2.456 -14.003 6.359 1.00 0.00 H new ATOM 0 HA ILE 1 47 3.143 -11.190 5.858 1.00 0.00 H new ATOM 0 HB ILE 1 47 0.582 -12.751 5.411 1.00 0.00 H new ATOM 0 HG12 ILE 1 47 1.889 -11.297 3.198 1.00 0.00 H new ATOM 0 HG13 ILE 1 47 2.919 -12.529 3.901 1.00 0.00 H new ATOM 0 HG21 ILE 1 47 -0.315 -10.737 4.330 1.00 0.00 H new ATOM 0 HG22 ILE 1 47 0.006 -10.480 6.061 1.00 0.00 H new ATOM 0 HG23 ILE 1 47 1.124 -9.824 4.842 1.00 0.00 H new ATOM 0 HD11 ILE 1 47 1.671 -13.415 1.990 1.00 0.00 H new ATOM 0 HD12 ILE 1 47 1.178 -14.238 3.489 1.00 0.00 H new ATOM 0 HD13 ILE 1 47 0.133 -12.987 2.775 1.00 0.00 H new ATOM 795 N ARG 1 48 2.054 -10.167 7.776 1.00 0.00 N ATOM 796 CA ARG 1 48 1.612 -9.489 8.982 1.00 0.00 C ATOM 797 C ARG 1 48 0.158 -9.038 8.835 1.00 0.00 C ATOM 798 O ARG 1 48 -0.657 -9.206 9.746 1.00 0.00 O ATOM 799 CB ARG 1 48 2.500 -8.263 9.189 1.00 0.00 C ATOM 800 CG ARG 1 48 2.719 -7.881 10.640 1.00 0.00 C ATOM 801 CD ARG 1 48 3.749 -6.770 10.768 1.00 0.00 C ATOM 802 NE ARG 1 48 3.987 -6.397 12.166 1.00 0.00 N ATOM 803 CZ ARG 1 48 4.501 -5.225 12.565 1.00 0.00 C ATOM 804 NH1 ARG 1 48 4.839 -4.285 11.683 1.00 0.00 N ATOM 805 NH2 ARG 1 48 4.680 -4.995 13.858 1.00 0.00 N ATOM 0 H ARG 1 48 2.522 -9.547 7.115 1.00 0.00 H new ATOM 0 HA ARG 1 48 1.682 -10.167 9.833 1.00 0.00 H new ATOM 0 HB2 ARG 1 48 3.469 -8.450 8.726 1.00 0.00 H new ATOM 0 HB3 ARG 1 48 2.055 -7.416 8.667 1.00 0.00 H new ATOM 0 HG2 ARG 1 48 1.775 -7.558 11.080 1.00 0.00 H new ATOM 0 HG3 ARG 1 48 3.050 -8.754 11.202 1.00 0.00 H new ATOM 0 HD2 ARG 1 48 4.687 -7.091 10.314 1.00 0.00 H new ATOM 0 HD3 ARG 1 48 3.409 -5.896 10.213 1.00 0.00 H new ATOM 0 HE ARG 1 48 3.744 -7.078 12.886 1.00 0.00 H new ATOM 0 HH11 ARG 1 48 4.708 -4.451 10.685 1.00 0.00 H new ATOM 0 HH12 ARG 1 48 5.229 -3.399 12.006 1.00 0.00 H new ATOM 0 HH21 ARG 1 48 4.427 -5.708 14.543 1.00 0.00 H new ATOM 0 HH22 ARG 1 48 5.071 -4.105 14.168 1.00 0.00 H new ATOM 819 N GLU 1 49 -0.143 -8.485 7.650 1.00 0.00 N ATOM 820 CA GLU 1 49 -1.459 -7.958 7.316 1.00 0.00 C ATOM 821 C GLU 1 49 -1.571 -7.804 5.803 1.00 0.00 C ATOM 822 O GLU 1 49 -0.567 -7.715 5.105 1.00 0.00 O ATOM 823 CB GLU 1 49 -1.691 -6.590 7.995 1.00 0.00 C ATOM 824 CG GLU 1 49 -3.156 -6.264 8.272 1.00 0.00 C ATOM 825 CD GLU 1 49 -3.654 -6.857 9.577 1.00 0.00 C ATOM 826 OE1 GLU 1 49 -3.996 -8.058 9.591 1.00 0.00 O ATOM 827 OE2 GLU 1 49 -3.699 -6.120 10.584 1.00 0.00 O ATOM 0 H GLU 1 49 0.535 -8.394 6.893 1.00 0.00 H new ATOM 0 HA GLU 1 49 -2.217 -8.654 7.676 1.00 0.00 H new ATOM 0 HB2 GLU 1 49 -1.142 -6.568 8.936 1.00 0.00 H new ATOM 0 HB3 GLU 1 49 -1.271 -5.808 7.362 1.00 0.00 H new ATOM 0 HG2 GLU 1 49 -3.284 -5.182 8.298 1.00 0.00 H new ATOM 0 HG3 GLU 1 49 -3.768 -6.638 7.451 1.00 0.00 H new ATOM 834 N CYS 1 50 -2.801 -7.784 5.321 1.00 0.00 N ATOM 835 CA CYS 1 50 -3.104 -7.617 3.920 1.00 0.00 C ATOM 836 C CYS 1 50 -4.282 -6.676 3.772 1.00 0.00 C ATOM 837 O CYS 1 50 -5.173 -6.624 4.627 1.00 0.00 O ATOM 838 CB CYS 1 50 -3.381 -8.955 3.230 1.00 0.00 C ATOM 839 SG CYS 1 50 -3.807 -8.821 1.476 1.00 0.00 S ATOM 0 H CYS 1 50 -3.629 -7.886 5.908 1.00 0.00 H new ATOM 0 HA CYS 1 50 -2.232 -7.187 3.428 1.00 0.00 H new ATOM 0 HB2 CYS 1 50 -2.501 -9.590 3.330 1.00 0.00 H new ATOM 0 HB3 CYS 1 50 -4.196 -9.456 3.752 1.00 0.00 H new ATOM 0 HG CYS 1 50 -4.590 -9.804 1.143 1.00 0.00 H new ATOM 845 N MET 1 51 -4.269 -5.945 2.671 1.00 0.00 N ATOM 846 CA MET 1 51 -5.287 -4.950 2.369 1.00 0.00 C ATOM 847 C MET 1 51 -5.556 -4.838 0.871 1.00 0.00 C ATOM 848 O MET 1 51 -4.640 -4.824 0.049 1.00 0.00 O ATOM 849 CB MET 1 51 -4.865 -3.595 2.933 1.00 0.00 C ATOM 850 CG MET 1 51 -5.840 -2.446 2.676 1.00 0.00 C ATOM 851 SD MET 1 51 -5.345 -0.909 3.486 1.00 0.00 S ATOM 852 CE MET 1 51 -4.063 -0.320 2.379 1.00 0.00 C ATOM 0 H MET 1 51 -3.547 -6.025 1.955 1.00 0.00 H new ATOM 0 HA MET 1 51 -6.216 -5.272 2.839 1.00 0.00 H new ATOM 0 HB2 MET 1 51 -4.725 -3.696 4.009 1.00 0.00 H new ATOM 0 HB3 MET 1 51 -3.897 -3.329 2.509 1.00 0.00 H new ATOM 0 HG2 MET 1 51 -5.918 -2.276 1.602 1.00 0.00 H new ATOM 0 HG3 MET 1 51 -6.832 -2.732 3.026 1.00 0.00 H new ATOM 0 HE1 MET 1 51 -3.664 0.623 2.753 1.00 0.00 H new ATOM 0 HE2 MET 1 51 -3.262 -1.057 2.326 1.00 0.00 H new ATOM 0 HE3 MET 1 51 -4.483 -0.168 1.385 1.00 0.00 H new ATOM 862 N VAL 1 52 -6.840 -4.785 0.566 1.00 0.00 N ATOM 863 CA VAL 1 52 -7.355 -4.612 -0.788 1.00 0.00 C ATOM 864 C VAL 1 52 -8.336 -3.441 -0.787 1.00 0.00 C ATOM 865 O VAL 1 52 -9.297 -3.409 -0.013 1.00 0.00 O ATOM 866 CB VAL 1 52 -8.030 -5.889 -1.316 1.00 0.00 C ATOM 867 CG1 VAL 1 52 -8.589 -5.724 -2.729 1.00 0.00 C ATOM 868 CG2 VAL 1 52 -7.054 -7.047 -1.282 1.00 0.00 C ATOM 0 H VAL 1 52 -7.576 -4.863 1.268 1.00 0.00 H new ATOM 0 HA VAL 1 52 -6.521 -4.403 -1.458 1.00 0.00 H new ATOM 0 HB VAL 1 52 -8.875 -6.094 -0.658 1.00 0.00 H new ATOM 0 HG11 VAL 1 52 -9.053 -6.657 -3.048 1.00 0.00 H new ATOM 0 HG12 VAL 1 52 -9.333 -4.928 -2.735 1.00 0.00 H new ATOM 0 HG13 VAL 1 52 -7.780 -5.469 -3.413 1.00 0.00 H new ATOM 0 HG21 VAL 1 52 -7.543 -7.946 -1.658 1.00 0.00 H new ATOM 0 HG22 VAL 1 52 -6.192 -6.814 -1.907 1.00 0.00 H new ATOM 0 HG23 VAL 1 52 -6.724 -7.215 -0.257 1.00 0.00 H new ATOM 878 N MET 1 53 -8.058 -2.493 -1.666 1.00 0.00 N ATOM 879 CA MET 1 53 -8.855 -1.266 -1.819 1.00 0.00 C ATOM 880 C MET 1 53 -10.156 -1.513 -2.585 1.00 0.00 C ATOM 881 O MET 1 53 -10.140 -1.895 -3.761 1.00 0.00 O ATOM 882 CB MET 1 53 -8.031 -0.179 -2.524 1.00 0.00 C ATOM 883 CG MET 1 53 -7.135 0.624 -1.591 1.00 0.00 C ATOM 884 SD MET 1 53 -8.047 1.492 -0.300 1.00 0.00 S ATOM 885 CE MET 1 53 -6.720 2.408 0.481 1.00 0.00 C ATOM 0 H MET 1 53 -7.265 -2.545 -2.306 1.00 0.00 H new ATOM 0 HA MET 1 53 -9.122 -0.929 -0.817 1.00 0.00 H new ATOM 0 HB2 MET 1 53 -7.413 -0.646 -3.291 1.00 0.00 H new ATOM 0 HB3 MET 1 53 -8.711 0.503 -3.034 1.00 0.00 H new ATOM 0 HG2 MET 1 53 -6.411 -0.046 -1.127 1.00 0.00 H new ATOM 0 HG3 MET 1 53 -6.569 1.349 -2.176 1.00 0.00 H new ATOM 0 HE1 MET 1 53 -7.121 2.999 1.304 1.00 0.00 H new ATOM 0 HE2 MET 1 53 -5.974 1.712 0.864 1.00 0.00 H new ATOM 0 HE3 MET 1 53 -6.257 3.071 -0.249 1.00 0.00 H new ATOM 895 N ARG 1 54 -11.277 -1.288 -1.894 1.00 0.00 N ATOM 896 CA ARG 1 54 -12.608 -1.471 -2.467 1.00 0.00 C ATOM 897 C ARG 1 54 -13.522 -0.308 -2.083 1.00 0.00 C ATOM 898 O ARG 1 54 -13.310 0.338 -1.051 1.00 0.00 O ATOM 899 CB ARG 1 54 -13.205 -2.804 -2.004 1.00 0.00 C ATOM 900 CG ARG 1 54 -12.728 -3.990 -2.826 1.00 0.00 C ATOM 901 CD ARG 1 54 -13.266 -5.307 -2.286 1.00 0.00 C ATOM 902 NE ARG 1 54 -12.752 -6.458 -3.039 1.00 0.00 N ATOM 903 CZ ARG 1 54 -13.094 -7.734 -2.813 1.00 0.00 C ATOM 904 NH1 ARG 1 54 -13.961 -8.054 -1.853 1.00 0.00 N ATOM 905 NH2 ARG 1 54 -12.564 -8.696 -3.556 1.00 0.00 N ATOM 0 H ARG 1 54 -11.285 -0.974 -0.923 1.00 0.00 H new ATOM 0 HA ARG 1 54 -12.520 -1.490 -3.553 1.00 0.00 H new ATOM 0 HB2 ARG 1 54 -12.946 -2.967 -0.958 1.00 0.00 H new ATOM 0 HB3 ARG 1 54 -14.292 -2.746 -2.058 1.00 0.00 H new ATOM 0 HG2 ARG 1 54 -13.045 -3.865 -3.861 1.00 0.00 H new ATOM 0 HG3 ARG 1 54 -11.638 -4.016 -2.827 1.00 0.00 H new ATOM 0 HD2 ARG 1 54 -12.991 -5.408 -1.236 1.00 0.00 H new ATOM 0 HD3 ARG 1 54 -14.355 -5.300 -2.332 1.00 0.00 H new ATOM 0 HE ARG 1 54 -12.086 -6.273 -3.789 1.00 0.00 H new ATOM 0 HH11 ARG 1 54 -14.376 -7.322 -1.276 1.00 0.00 H new ATOM 0 HH12 ARG 1 54 -14.210 -9.031 -1.695 1.00 0.00 H new ATOM 0 HH21 ARG 1 54 -11.900 -8.463 -4.294 1.00 0.00 H new ATOM 0 HH22 ARG 1 54 -12.820 -9.669 -3.389 1.00 0.00 H new ATOM 919 N ASP 1 55 -14.547 -0.062 -2.907 1.00 0.00 N ATOM 920 CA ASP 1 55 -15.481 1.009 -2.691 1.00 0.00 C ATOM 921 C ASP 1 55 -16.767 0.488 -2.043 1.00 0.00 C ATOM 922 O ASP 1 55 -17.462 -0.328 -2.644 1.00 0.00 O ATOM 923 CB ASP 1 55 -15.801 1.670 -4.015 1.00 0.00 C ATOM 924 CG ASP 1 55 -14.811 2.760 -4.378 1.00 0.00 C ATOM 925 OD1 ASP 1 55 -13.766 2.436 -4.982 1.00 0.00 O ATOM 926 OD2 ASP 1 55 -15.077 3.937 -4.056 1.00 0.00 O ATOM 0 H ASP 1 55 -14.739 -0.614 -3.743 1.00 0.00 H new ATOM 0 HA ASP 1 55 -15.031 1.737 -2.016 1.00 0.00 H new ATOM 0 HB2 ASP 1 55 -15.809 0.915 -4.801 1.00 0.00 H new ATOM 0 HB3 ASP 1 55 -16.804 2.095 -3.972 1.00 0.00 H new ATOM 931 N PRO 1 56 -17.103 0.919 -0.794 1.00 0.00 N ATOM 932 CA PRO 1 56 -18.344 0.483 -0.115 1.00 0.00 C ATOM 933 C PRO 1 56 -19.623 0.942 -0.837 1.00 0.00 C ATOM 934 O PRO 1 56 -20.723 0.504 -0.493 1.00 0.00 O ATOM 935 CB PRO 1 56 -18.265 1.149 1.267 1.00 0.00 C ATOM 936 CG PRO 1 56 -16.839 1.548 1.446 1.00 0.00 C ATOM 937 CD PRO 1 56 -16.296 1.808 0.069 1.00 0.00 C ATOM 0 HA PRO 1 56 -18.406 -0.605 -0.085 1.00 0.00 H new ATOM 0 HB2 PRO 1 56 -18.923 2.016 1.321 1.00 0.00 H new ATOM 0 HB3 PRO 1 56 -18.580 0.460 2.051 1.00 0.00 H new ATOM 0 HG2 PRO 1 56 -16.760 2.439 2.069 1.00 0.00 H new ATOM 0 HG3 PRO 1 56 -16.274 0.760 1.944 1.00 0.00 H new ATOM 0 HD2 PRO 1 56 -16.408 2.854 -0.216 1.00 0.00 H new ATOM 0 HD3 PRO 1 56 -15.234 1.573 0.005 1.00 0.00 H new ATOM 945 N THR 1 57 -19.461 1.831 -1.833 1.00 0.00 N ATOM 946 CA THR 1 57 -20.579 2.369 -2.606 1.00 0.00 C ATOM 947 C THR 1 57 -21.025 1.428 -3.729 1.00 0.00 C ATOM 948 O THR 1 57 -22.225 1.218 -3.929 1.00 0.00 O ATOM 949 CB THR 1 57 -20.236 3.745 -3.218 1.00 0.00 C ATOM 950 OG1 THR 1 57 -18.956 3.694 -3.861 1.00 0.00 O ATOM 951 CG2 THR 1 57 -20.233 4.836 -2.154 1.00 0.00 C ATOM 0 H THR 1 57 -18.551 2.192 -2.119 1.00 0.00 H new ATOM 0 HA THR 1 57 -21.400 2.477 -1.897 1.00 0.00 H new ATOM 0 HB THR 1 57 -21.003 3.985 -3.954 1.00 0.00 H new ATOM 0 HG1 THR 1 57 -18.749 4.571 -4.247 1.00 0.00 H new ATOM 0 HG21 THR 1 57 -19.988 5.793 -2.615 1.00 0.00 H new ATOM 0 HG22 THR 1 57 -21.219 4.897 -1.693 1.00 0.00 H new ATOM 0 HG23 THR 1 57 -19.490 4.599 -1.392 1.00 0.00 H new ATOM 959 N THR 1 58 -20.046 0.872 -4.454 1.00 0.00 N ATOM 960 CA THR 1 58 -20.314 -0.042 -5.574 1.00 0.00 C ATOM 961 C THR 1 58 -19.812 -1.463 -5.299 1.00 0.00 C ATOM 962 O THR 1 58 -20.158 -2.399 -6.023 1.00 0.00 O ATOM 963 CB THR 1 58 -19.682 0.485 -6.880 1.00 0.00 C ATOM 964 OG1 THR 1 58 -18.279 0.710 -6.694 1.00 0.00 O ATOM 965 CG2 THR 1 58 -20.346 1.785 -7.313 1.00 0.00 C ATOM 0 H THR 1 58 -19.054 1.040 -4.284 1.00 0.00 H new ATOM 0 HA THR 1 58 -21.397 -0.084 -5.686 1.00 0.00 H new ATOM 0 HB THR 1 58 -19.832 -0.266 -7.656 1.00 0.00 H new ATOM 0 HG1 THR 1 58 -17.903 1.117 -7.502 1.00 0.00 H new ATOM 0 HG21 THR 1 58 -19.886 2.139 -8.235 1.00 0.00 H new ATOM 0 HG22 THR 1 58 -21.409 1.612 -7.481 1.00 0.00 H new ATOM 0 HG23 THR 1 58 -20.219 2.536 -6.533 1.00 0.00 H new ATOM 973 N LYS 1 59 -18.989 -1.611 -4.237 1.00 0.00 N ATOM 974 CA LYS 1 59 -18.407 -2.909 -3.790 1.00 0.00 C ATOM 975 C LYS 1 59 -17.513 -3.557 -4.861 1.00 0.00 C ATOM 976 O LYS 1 59 -17.102 -4.716 -4.729 1.00 0.00 O ATOM 977 CB LYS 1 59 -19.514 -3.897 -3.360 1.00 0.00 C ATOM 978 CG LYS 1 59 -20.696 -3.245 -2.654 1.00 0.00 C ATOM 979 CD LYS 1 59 -20.475 -3.117 -1.151 1.00 0.00 C ATOM 980 CE LYS 1 59 -21.637 -2.403 -0.479 1.00 0.00 C ATOM 981 NZ LYS 1 59 -21.446 -2.292 0.994 1.00 0.00 N ATOM 0 H LYS 1 59 -18.703 -0.825 -3.654 1.00 0.00 H new ATOM 0 HA LYS 1 59 -17.777 -2.681 -2.930 1.00 0.00 H new ATOM 0 HB2 LYS 1 59 -19.878 -4.423 -4.242 1.00 0.00 H new ATOM 0 HB3 LYS 1 59 -19.079 -4.646 -2.699 1.00 0.00 H new ATOM 0 HG2 LYS 1 59 -20.869 -2.256 -3.079 1.00 0.00 H new ATOM 0 HG3 LYS 1 59 -21.595 -3.833 -2.838 1.00 0.00 H new ATOM 0 HD2 LYS 1 59 -20.353 -4.108 -0.714 1.00 0.00 H new ATOM 0 HD3 LYS 1 59 -19.551 -2.570 -0.963 1.00 0.00 H new ATOM 0 HE2 LYS 1 59 -21.746 -1.406 -0.907 1.00 0.00 H new ATOM 0 HE3 LYS 1 59 -22.562 -2.942 -0.685 1.00 0.00 H new ATOM 0 HZ1 LYS 1 59 -22.260 -1.799 1.413 1.00 0.00 H new ATOM 0 HZ2 LYS 1 59 -21.367 -3.243 1.407 1.00 0.00 H new ATOM 0 HZ3 LYS 1 59 -20.577 -1.756 1.192 1.00 0.00 H new ATOM 995 N ARG 1 60 -17.191 -2.780 -5.894 1.00 0.00 N ATOM 996 CA ARG 1 60 -16.345 -3.252 -6.996 1.00 0.00 C ATOM 997 C ARG 1 60 -14.896 -2.789 -6.825 1.00 0.00 C ATOM 998 O ARG 1 60 -14.643 -1.612 -6.552 1.00 0.00 O ATOM 999 CB ARG 1 60 -16.920 -2.805 -8.356 1.00 0.00 C ATOM 1000 CG ARG 1 60 -16.966 -1.292 -8.594 1.00 0.00 C ATOM 1001 CD ARG 1 60 -17.572 -0.948 -9.950 1.00 0.00 C ATOM 1002 NE ARG 1 60 -18.991 -1.320 -10.041 1.00 0.00 N ATOM 1003 CZ ARG 1 60 -19.746 -1.193 -11.142 1.00 0.00 C ATOM 1004 NH1 ARG 1 60 -19.239 -0.700 -12.271 1.00 0.00 N ATOM 1005 NH2 ARG 1 60 -21.017 -1.571 -11.111 1.00 0.00 N ATOM 0 H ARG 1 60 -17.504 -1.814 -5.993 1.00 0.00 H new ATOM 0 HA ARG 1 60 -16.342 -4.342 -6.974 1.00 0.00 H new ATOM 0 HB2 ARG 1 60 -16.326 -3.261 -9.148 1.00 0.00 H new ATOM 0 HB3 ARG 1 60 -17.932 -3.200 -8.449 1.00 0.00 H new ATOM 0 HG2 ARG 1 60 -17.550 -0.818 -7.805 1.00 0.00 H new ATOM 0 HG3 ARG 1 60 -15.957 -0.884 -8.533 1.00 0.00 H new ATOM 0 HD2 ARG 1 60 -17.468 0.122 -10.131 1.00 0.00 H new ATOM 0 HD3 ARG 1 60 -17.014 -1.460 -10.734 1.00 0.00 H new ATOM 0 HE ARG 1 60 -19.434 -1.703 -9.206 1.00 0.00 H new ATOM 0 HH11 ARG 1 60 -18.261 -0.412 -12.308 1.00 0.00 H new ATOM 0 HH12 ARG 1 60 -19.829 -0.611 -13.099 1.00 0.00 H new ATOM 0 HH21 ARG 1 60 -21.414 -1.955 -10.254 1.00 0.00 H new ATOM 0 HH22 ARG 1 60 -21.597 -1.477 -11.945 1.00 0.00 H new ATOM 1019 N SER 1 61 -13.958 -3.729 -6.993 1.00 0.00 N ATOM 1020 CA SER 1 61 -12.525 -3.446 -6.863 1.00 0.00 C ATOM 1021 C SER 1 61 -11.935 -2.957 -8.190 1.00 0.00 C ATOM 1022 O SER 1 61 -12.499 -3.214 -9.258 1.00 0.00 O ATOM 1023 CB SER 1 61 -11.783 -4.703 -6.399 1.00 0.00 C ATOM 1024 OG SER 1 61 -10.468 -4.393 -5.967 1.00 0.00 O ATOM 0 H SER 1 61 -14.170 -4.700 -7.221 1.00 0.00 H new ATOM 0 HA SER 1 61 -12.403 -2.656 -6.122 1.00 0.00 H new ATOM 0 HB2 SER 1 61 -12.334 -5.174 -5.585 1.00 0.00 H new ATOM 0 HB3 SER 1 61 -11.740 -5.425 -7.215 1.00 0.00 H new ATOM 0 HG SER 1 61 -10.495 -3.619 -5.366 1.00 0.00 H new ATOM 1030 N ARG 1 62 -10.804 -2.248 -8.105 1.00 0.00 N ATOM 1031 CA ARG 1 62 -10.120 -1.724 -9.293 1.00 0.00 C ATOM 1032 C ARG 1 62 -8.971 -2.645 -9.722 1.00 0.00 C ATOM 1033 O ARG 1 62 -8.391 -2.465 -10.798 1.00 0.00 O ATOM 1034 CB ARG 1 62 -9.597 -0.307 -9.035 1.00 0.00 C ATOM 1035 CG ARG 1 62 -10.686 0.758 -9.044 1.00 0.00 C ATOM 1036 CD ARG 1 62 -10.114 2.144 -8.791 1.00 0.00 C ATOM 1037 NE ARG 1 62 -11.162 3.169 -8.739 1.00 0.00 N ATOM 1038 CZ ARG 1 62 -10.942 4.480 -8.559 1.00 0.00 C ATOM 1039 NH1 ARG 1 62 -9.707 4.958 -8.411 1.00 0.00 N ATOM 1040 NH2 ARG 1 62 -11.970 5.319 -8.525 1.00 0.00 N ATOM 0 H ARG 1 62 -10.342 -2.023 -7.224 1.00 0.00 H new ATOM 0 HA ARG 1 62 -10.846 -1.686 -10.105 1.00 0.00 H new ATOM 0 HB2 ARG 1 62 -9.089 -0.287 -8.071 1.00 0.00 H new ATOM 0 HB3 ARG 1 62 -8.853 -0.060 -9.793 1.00 0.00 H new ATOM 0 HG2 ARG 1 62 -11.200 0.746 -10.005 1.00 0.00 H new ATOM 0 HG3 ARG 1 62 -11.430 0.526 -8.282 1.00 0.00 H new ATOM 0 HD2 ARG 1 62 -9.561 2.142 -7.851 1.00 0.00 H new ATOM 0 HD3 ARG 1 62 -9.403 2.392 -9.579 1.00 0.00 H new ATOM 0 HE ARG 1 62 -12.129 2.862 -8.848 1.00 0.00 H new ATOM 0 HH11 ARG 1 62 -8.909 4.324 -8.434 1.00 0.00 H new ATOM 0 HH12 ARG 1 62 -9.560 5.958 -8.275 1.00 0.00 H new ATOM 0 HH21 ARG 1 62 -12.920 4.966 -8.635 1.00 0.00 H new ATOM 0 HH22 ARG 1 62 -11.809 6.317 -8.388 1.00 0.00 H new ATOM 1054 N GLY 1 63 -8.658 -3.631 -8.869 1.00 0.00 N ATOM 1055 CA GLY 1 63 -7.596 -4.586 -9.156 1.00 0.00 C ATOM 1056 C GLY 1 63 -6.241 -4.175 -8.605 1.00 0.00 C ATOM 1057 O GLY 1 63 -5.230 -4.291 -9.302 1.00 0.00 O ATOM 0 H GLY 1 63 -9.129 -3.782 -7.977 1.00 0.00 H new ATOM 0 HA2 GLY 1 63 -7.869 -5.556 -8.740 1.00 0.00 H new ATOM 0 HA3 GLY 1 63 -7.516 -4.714 -10.236 1.00 0.00 H new ATOM 1061 N PHE 1 64 -6.222 -3.669 -7.359 1.00 0.00 N ATOM 1062 CA PHE 1 64 -4.976 -3.249 -6.699 1.00 0.00 C ATOM 1063 C PHE 1 64 -5.100 -3.357 -5.172 1.00 0.00 C ATOM 1064 O PHE 1 64 -6.170 -3.103 -4.613 1.00 0.00 O ATOM 1065 CB PHE 1 64 -4.561 -1.826 -7.162 1.00 0.00 C ATOM 1066 CG PHE 1 64 -5.166 -0.669 -6.406 1.00 0.00 C ATOM 1067 CD1 PHE 1 64 -4.713 -0.362 -5.142 1.00 0.00 C ATOM 1068 CD2 PHE 1 64 -6.153 0.118 -6.972 1.00 0.00 C ATOM 1069 CE1 PHE 1 64 -5.231 0.706 -4.440 1.00 0.00 C ATOM 1070 CE2 PHE 1 64 -6.684 1.189 -6.277 1.00 0.00 C ATOM 1071 CZ PHE 1 64 -6.222 1.484 -5.007 1.00 0.00 C ATOM 0 H PHE 1 64 -7.058 -3.541 -6.789 1.00 0.00 H new ATOM 0 HA PHE 1 64 -4.177 -3.927 -6.998 1.00 0.00 H new ATOM 0 HB2 PHE 1 64 -3.476 -1.748 -7.094 1.00 0.00 H new ATOM 0 HB3 PHE 1 64 -4.823 -1.720 -8.215 1.00 0.00 H new ATOM 0 HD1 PHE 1 64 -3.939 -0.968 -4.693 1.00 0.00 H new ATOM 0 HD2 PHE 1 64 -6.512 -0.106 -7.966 1.00 0.00 H new ATOM 0 HE1 PHE 1 64 -4.863 0.933 -3.450 1.00 0.00 H new ATOM 0 HE2 PHE 1 64 -7.458 1.794 -6.725 1.00 0.00 H new ATOM 0 HZ PHE 1 64 -6.634 2.319 -4.461 1.00 0.00 H new ATOM 1081 N GLY 1 65 -3.992 -3.738 -4.514 1.00 0.00 N ATOM 1082 CA GLY 1 65 -3.958 -3.873 -3.090 1.00 0.00 C ATOM 1083 C GLY 1 65 -2.537 -3.858 -2.577 1.00 0.00 C ATOM 1084 O GLY 1 65 -1.609 -3.534 -3.315 1.00 0.00 O ATOM 0 H GLY 1 65 -3.108 -3.955 -4.974 1.00 0.00 H new ATOM 0 HA2 GLY 1 65 -4.522 -3.061 -2.631 1.00 0.00 H new ATOM 0 HA3 GLY 1 65 -4.444 -4.804 -2.798 1.00 0.00 H new ATOM 1088 N PHE 1 66 -2.392 -4.172 -1.301 1.00 0.00 N ATOM 1089 CA PHE 1 66 -1.144 -4.217 -0.610 1.00 0.00 C ATOM 1090 C PHE 1 66 -1.064 -5.474 0.243 1.00 0.00 C ATOM 1091 O PHE 1 66 -2.061 -6.177 0.440 1.00 0.00 O ATOM 1092 CB PHE 1 66 -1.046 -2.997 0.277 1.00 0.00 C ATOM 1093 CG PHE 1 66 -0.922 -1.693 -0.460 1.00 0.00 C ATOM 1094 CD1 PHE 1 66 -2.052 -1.081 -0.977 1.00 0.00 C ATOM 1095 CD2 PHE 1 66 0.309 -1.082 -0.633 1.00 0.00 C ATOM 1096 CE1 PHE 1 66 -1.960 0.119 -1.655 1.00 0.00 C ATOM 1097 CE2 PHE 1 66 0.408 0.121 -1.311 1.00 0.00 C ATOM 1098 CZ PHE 1 66 -0.728 0.722 -1.821 1.00 0.00 C ATOM 0 H PHE 1 66 -3.184 -4.411 -0.705 1.00 0.00 H new ATOM 0 HA PHE 1 66 -0.324 -4.230 -1.328 1.00 0.00 H new ATOM 0 HB2 PHE 1 66 -1.929 -2.956 0.914 1.00 0.00 H new ATOM 0 HB3 PHE 1 66 -0.184 -3.111 0.934 1.00 0.00 H new ATOM 0 HD1 PHE 1 66 -3.017 -1.548 -0.848 1.00 0.00 H new ATOM 0 HD2 PHE 1 66 1.199 -1.548 -0.236 1.00 0.00 H new ATOM 0 HE1 PHE 1 66 -2.849 0.585 -2.054 1.00 0.00 H new ATOM 0 HE2 PHE 1 66 1.372 0.590 -1.441 1.00 0.00 H new ATOM 0 HZ PHE 1 66 -0.652 1.661 -2.348 1.00 0.00 H new ATOM 1108 N VAL 1 67 0.136 -5.738 0.734 1.00 0.00 N ATOM 1109 CA VAL 1 67 0.428 -6.884 1.592 1.00 0.00 C ATOM 1110 C VAL 1 67 1.607 -6.516 2.445 1.00 0.00 C ATOM 1111 O VAL 1 67 2.621 -6.006 1.959 1.00 0.00 O ATOM 1112 CB VAL 1 67 0.721 -8.218 0.823 1.00 0.00 C ATOM 1113 CG1 VAL 1 67 1.197 -9.329 1.770 1.00 0.00 C ATOM 1114 CG2 VAL 1 67 -0.499 -8.711 0.051 1.00 0.00 C ATOM 0 H VAL 1 67 0.951 -5.154 0.547 1.00 0.00 H new ATOM 0 HA VAL 1 67 -0.465 -7.090 2.181 1.00 0.00 H new ATOM 0 HB VAL 1 67 1.517 -7.988 0.115 1.00 0.00 H new ATOM 0 HG11 VAL 1 67 1.389 -10.237 1.198 1.00 0.00 H new ATOM 0 HG12 VAL 1 67 2.113 -9.014 2.269 1.00 0.00 H new ATOM 0 HG13 VAL 1 67 0.427 -9.526 2.516 1.00 0.00 H new ATOM 0 HG21 VAL 1 67 -0.252 -9.638 -0.467 1.00 0.00 H new ATOM 0 HG22 VAL 1 67 -1.320 -8.891 0.745 1.00 0.00 H new ATOM 0 HG23 VAL 1 67 -0.798 -7.957 -0.677 1.00 0.00 H new ATOM 1124 N THR 1 68 1.453 -6.795 3.711 1.00 0.00 N ATOM 1125 CA THR 1 68 2.447 -6.486 4.687 1.00 0.00 C ATOM 1126 C THR 1 68 3.158 -7.726 5.168 1.00 0.00 C ATOM 1127 O THR 1 68 2.616 -8.511 5.947 1.00 0.00 O ATOM 1128 CB THR 1 68 1.823 -5.751 5.854 1.00 0.00 C ATOM 1129 OG1 THR 1 68 0.763 -4.913 5.364 1.00 0.00 O ATOM 1130 CG2 THR 1 68 2.884 -4.938 6.587 1.00 0.00 C ATOM 0 H THR 1 68 0.622 -7.248 4.092 1.00 0.00 H new ATOM 0 HA THR 1 68 3.189 -5.842 4.215 1.00 0.00 H new ATOM 0 HB THR 1 68 1.405 -6.463 6.566 1.00 0.00 H new ATOM 0 HG1 THR 1 68 0.352 -4.434 6.114 1.00 0.00 H new ATOM 0 HG21 THR 1 68 2.425 -4.413 7.425 1.00 0.00 H new ATOM 0 HG22 THR 1 68 3.661 -5.605 6.959 1.00 0.00 H new ATOM 0 HG23 THR 1 68 3.325 -4.214 5.902 1.00 0.00 H new ATOM 1138 N PHE 1 69 4.382 -7.871 4.693 1.00 0.00 N ATOM 1139 CA PHE 1 69 5.220 -8.995 5.049 1.00 0.00 C ATOM 1140 C PHE 1 69 5.943 -8.786 6.379 1.00 0.00 C ATOM 1141 O PHE 1 69 6.657 -7.795 6.560 1.00 0.00 O ATOM 1142 CB PHE 1 69 6.219 -9.255 3.941 1.00 0.00 C ATOM 1143 CG PHE 1 69 5.657 -10.121 2.863 1.00 0.00 C ATOM 1144 CD1 PHE 1 69 5.165 -9.561 1.703 1.00 0.00 C ATOM 1145 CD2 PHE 1 69 5.604 -11.498 3.020 1.00 0.00 C ATOM 1146 CE1 PHE 1 69 4.632 -10.359 0.709 1.00 0.00 C ATOM 1147 CE2 PHE 1 69 5.075 -12.299 2.034 1.00 0.00 C ATOM 1148 CZ PHE 1 69 4.590 -11.733 0.877 1.00 0.00 C ATOM 0 H PHE 1 69 4.820 -7.212 4.050 1.00 0.00 H new ATOM 0 HA PHE 1 69 4.573 -9.863 5.175 1.00 0.00 H new ATOM 0 HB2 PHE 1 69 6.537 -8.305 3.512 1.00 0.00 H new ATOM 0 HB3 PHE 1 69 7.107 -9.729 4.359 1.00 0.00 H new ATOM 0 HD1 PHE 1 69 5.197 -8.490 1.570 1.00 0.00 H new ATOM 0 HD2 PHE 1 69 5.982 -11.947 3.927 1.00 0.00 H new ATOM 0 HE1 PHE 1 69 4.249 -9.912 -0.197 1.00 0.00 H new ATOM 0 HE2 PHE 1 69 5.040 -13.370 2.168 1.00 0.00 H new ATOM 0 HZ PHE 1 69 4.177 -12.360 0.101 1.00 0.00 H new ATOM 1158 N ALA 1 70 5.747 -9.737 7.303 1.00 0.00 N ATOM 1159 CA ALA 1 70 6.361 -9.683 8.630 1.00 0.00 C ATOM 1160 C ALA 1 70 7.810 -10.158 8.652 1.00 0.00 C ATOM 1161 O ALA 1 70 8.458 -10.190 9.706 1.00 0.00 O ATOM 1162 CB ALA 1 70 5.523 -10.460 9.637 1.00 0.00 C ATOM 0 H ALA 1 70 5.162 -10.558 7.150 1.00 0.00 H new ATOM 0 HA ALA 1 70 6.385 -8.631 8.914 1.00 0.00 H new ATOM 0 HB1 ALA 1 70 5.994 -10.409 10.619 1.00 0.00 H new ATOM 0 HB2 ALA 1 70 4.524 -10.026 9.691 1.00 0.00 H new ATOM 0 HB3 ALA 1 70 5.450 -11.501 9.323 1.00 0.00 H new ATOM 1168 N ASP 1 71 8.300 -10.496 7.481 1.00 0.00 N ATOM 1169 CA ASP 1 71 9.651 -10.973 7.303 1.00 0.00 C ATOM 1170 C ASP 1 71 10.389 -10.172 6.238 1.00 0.00 C ATOM 1171 O ASP 1 71 9.838 -9.939 5.157 1.00 0.00 O ATOM 1172 CB ASP 1 71 9.633 -12.437 6.881 1.00 0.00 C ATOM 1173 CG ASP 1 71 10.924 -13.195 7.180 1.00 0.00 C ATOM 1174 OD1 ASP 1 71 11.275 -14.092 6.385 1.00 0.00 O ATOM 1175 OD2 ASP 1 71 11.574 -12.901 8.207 1.00 0.00 O ATOM 0 H ASP 1 71 7.764 -10.446 6.615 1.00 0.00 H new ATOM 0 HA ASP 1 71 10.168 -10.856 8.255 1.00 0.00 H new ATOM 0 HB2 ASP 1 71 8.807 -12.938 7.385 1.00 0.00 H new ATOM 0 HB3 ASP 1 71 9.433 -12.492 5.811 1.00 0.00 H new ATOM 1180 N PRO 1 72 11.643 -9.722 6.518 1.00 0.00 N ATOM 1181 CA PRO 1 72 12.453 -9.008 5.525 1.00 0.00 C ATOM 1182 C PRO 1 72 12.983 -9.944 4.457 1.00 0.00 C ATOM 1183 O PRO 1 72 13.426 -9.510 3.389 1.00 0.00 O ATOM 1184 CB PRO 1 72 13.624 -8.456 6.314 1.00 0.00 C ATOM 1185 CG PRO 1 72 13.308 -8.670 7.755 1.00 0.00 C ATOM 1186 CD PRO 1 72 12.360 -9.829 7.809 1.00 0.00 C ATOM 0 HA PRO 1 72 11.865 -8.244 5.016 1.00 0.00 H new ATOM 0 HB2 PRO 1 72 14.549 -8.964 6.041 1.00 0.00 H new ATOM 0 HB3 PRO 1 72 13.768 -7.396 6.103 1.00 0.00 H new ATOM 0 HG2 PRO 1 72 14.213 -8.881 8.325 1.00 0.00 H new ATOM 0 HG3 PRO 1 72 12.858 -7.778 8.191 1.00 0.00 H new ATOM 0 HD2 PRO 1 72 12.886 -10.779 7.903 1.00 0.00 H new ATOM 0 HD3 PRO 1 72 11.680 -9.757 8.658 1.00 0.00 H new ATOM 1194 N ALA 1 73 12.924 -11.236 4.773 1.00 0.00 N ATOM 1195 CA ALA 1 73 13.406 -12.282 3.879 1.00 0.00 C ATOM 1196 C ALA 1 73 12.427 -12.557 2.750 1.00 0.00 C ATOM 1197 O ALA 1 73 12.827 -12.917 1.639 1.00 0.00 O ATOM 1198 CB ALA 1 73 13.709 -13.555 4.653 1.00 0.00 C ATOM 0 H ALA 1 73 12.542 -11.584 5.652 1.00 0.00 H new ATOM 0 HA ALA 1 73 14.331 -11.923 3.427 1.00 0.00 H new ATOM 0 HB1 ALA 1 73 14.067 -14.322 3.966 1.00 0.00 H new ATOM 0 HB2 ALA 1 73 14.475 -13.352 5.402 1.00 0.00 H new ATOM 0 HB3 ALA 1 73 12.803 -13.905 5.147 1.00 0.00 H new ATOM 1204 N SER 1 74 11.143 -12.365 3.049 1.00 0.00 N ATOM 1205 CA SER 1 74 10.069 -12.576 2.073 1.00 0.00 C ATOM 1206 C SER 1 74 10.090 -11.508 0.987 1.00 0.00 C ATOM 1207 O SER 1 74 9.731 -11.765 -0.164 1.00 0.00 O ATOM 1208 CB SER 1 74 8.713 -12.623 2.758 1.00 0.00 C ATOM 1209 OG SER 1 74 7.782 -13.329 1.962 1.00 0.00 O ATOM 0 H SER 1 74 10.817 -12.061 3.967 1.00 0.00 H new ATOM 0 HA SER 1 74 10.242 -13.540 1.595 1.00 0.00 H new ATOM 0 HB2 SER 1 74 8.807 -13.104 3.732 1.00 0.00 H new ATOM 0 HB3 SER 1 74 8.354 -11.610 2.937 1.00 0.00 H new ATOM 0 HG SER 1 74 6.892 -12.934 2.072 1.00 0.00 H new ATOM 1215 N VAL 1 75 10.521 -10.308 1.383 1.00 0.00 N ATOM 1216 CA VAL 1 75 10.641 -9.159 0.485 1.00 0.00 C ATOM 1217 C VAL 1 75 11.773 -9.407 -0.506 1.00 0.00 C ATOM 1218 O VAL 1 75 11.720 -8.968 -1.653 1.00 0.00 O ATOM 1219 CB VAL 1 75 10.911 -7.837 1.268 1.00 0.00 C ATOM 1220 CG1 VAL 1 75 10.692 -6.602 0.394 1.00 0.00 C ATOM 1221 CG2 VAL 1 75 10.047 -7.738 2.522 1.00 0.00 C ATOM 0 H VAL 1 75 10.798 -10.106 2.343 1.00 0.00 H new ATOM 0 HA VAL 1 75 9.695 -9.045 -0.044 1.00 0.00 H new ATOM 0 HB VAL 1 75 11.959 -7.867 1.567 1.00 0.00 H new ATOM 0 HG11 VAL 1 75 10.891 -5.703 0.978 1.00 0.00 H new ATOM 0 HG12 VAL 1 75 11.368 -6.636 -0.460 1.00 0.00 H new ATOM 0 HG13 VAL 1 75 9.661 -6.585 0.041 1.00 0.00 H new ATOM 0 HG21 VAL 1 75 10.264 -6.804 3.040 1.00 0.00 H new ATOM 0 HG22 VAL 1 75 8.994 -7.761 2.241 1.00 0.00 H new ATOM 0 HG23 VAL 1 75 10.265 -8.578 3.182 1.00 0.00 H new ATOM 1231 N ASP 1 76 12.779 -10.139 -0.028 1.00 0.00 N ATOM 1232 CA ASP 1 76 13.940 -10.522 -0.816 1.00 0.00 C ATOM 1233 C ASP 1 76 13.544 -11.580 -1.843 1.00 0.00 C ATOM 1234 O ASP 1 76 13.955 -11.539 -3.007 1.00 0.00 O ATOM 1235 CB ASP 1 76 15.016 -11.071 0.117 1.00 0.00 C ATOM 1236 CG ASP 1 76 16.424 -10.867 -0.413 1.00 0.00 C ATOM 1237 OD1 ASP 1 76 16.933 -11.773 -1.105 1.00 0.00 O ATOM 1238 OD2 ASP 1 76 17.014 -9.803 -0.136 1.00 0.00 O ATOM 0 H ASP 1 76 12.806 -10.485 0.931 1.00 0.00 H new ATOM 0 HA ASP 1 76 14.329 -9.652 -1.345 1.00 0.00 H new ATOM 0 HB2 ASP 1 76 14.927 -10.587 1.090 1.00 0.00 H new ATOM 0 HB3 ASP 1 76 14.844 -12.136 0.274 1.00 0.00 H new ATOM 1243 N LYS 1 77 12.722 -12.513 -1.366 1.00 0.00 N ATOM 1244 CA LYS 1 77 12.191 -13.621 -2.166 1.00 0.00 C ATOM 1245 C LYS 1 77 11.281 -13.132 -3.293 1.00 0.00 C ATOM 1246 O LYS 1 77 11.389 -13.595 -4.432 1.00 0.00 O ATOM 1247 CB LYS 1 77 11.432 -14.614 -1.275 1.00 0.00 C ATOM 1248 CG LYS 1 77 12.309 -15.353 -0.274 1.00 0.00 C ATOM 1249 CD LYS 1 77 11.586 -16.557 0.306 1.00 0.00 C ATOM 1250 CE LYS 1 77 12.475 -17.343 1.254 1.00 0.00 C ATOM 1251 NZ LYS 1 77 11.774 -18.536 1.805 1.00 0.00 N ATOM 0 H LYS 1 77 12.400 -12.523 -0.398 1.00 0.00 H new ATOM 0 HA LYS 1 77 13.044 -14.124 -2.622 1.00 0.00 H new ATOM 0 HB2 LYS 1 77 10.655 -14.076 -0.732 1.00 0.00 H new ATOM 0 HB3 LYS 1 77 10.931 -15.344 -1.910 1.00 0.00 H new ATOM 0 HG2 LYS 1 77 13.228 -15.678 -0.762 1.00 0.00 H new ATOM 0 HG3 LYS 1 77 12.597 -14.676 0.530 1.00 0.00 H new ATOM 0 HD2 LYS 1 77 10.693 -16.225 0.836 1.00 0.00 H new ATOM 0 HD3 LYS 1 77 11.253 -17.207 -0.504 1.00 0.00 H new ATOM 0 HE2 LYS 1 77 13.376 -17.661 0.729 1.00 0.00 H new ATOM 0 HE3 LYS 1 77 12.794 -16.698 2.073 1.00 0.00 H new ATOM 0 HZ1 LYS 1 77 12.412 -19.047 2.448 1.00 0.00 H new ATOM 0 HZ2 LYS 1 77 10.928 -18.231 2.327 1.00 0.00 H new ATOM 0 HZ3 LYS 1 77 11.492 -19.164 1.025 1.00 0.00 H new ATOM 1265 N VAL 1 78 10.421 -12.162 -2.967 1.00 0.00 N ATOM 1266 CA VAL 1 78 9.471 -11.581 -3.927 1.00 0.00 C ATOM 1267 C VAL 1 78 10.192 -10.637 -4.906 1.00 0.00 C ATOM 1268 O VAL 1 78 9.784 -10.505 -6.063 1.00 0.00 O ATOM 1269 CB VAL 1 78 8.293 -10.844 -3.207 1.00 0.00 C ATOM 1270 CG1 VAL 1 78 7.322 -10.198 -4.198 1.00 0.00 C ATOM 1271 CG2 VAL 1 78 7.526 -11.804 -2.302 1.00 0.00 C ATOM 0 H VAL 1 78 10.362 -11.757 -2.033 1.00 0.00 H new ATOM 0 HA VAL 1 78 9.039 -12.404 -4.497 1.00 0.00 H new ATOM 0 HB VAL 1 78 8.742 -10.053 -2.606 1.00 0.00 H new ATOM 0 HG11 VAL 1 78 6.522 -9.699 -3.651 1.00 0.00 H new ATOM 0 HG12 VAL 1 78 7.855 -9.468 -4.807 1.00 0.00 H new ATOM 0 HG13 VAL 1 78 6.896 -10.966 -4.843 1.00 0.00 H new ATOM 0 HG21 VAL 1 78 6.712 -11.270 -1.812 1.00 0.00 H new ATOM 0 HG22 VAL 1 78 7.118 -12.619 -2.899 1.00 0.00 H new ATOM 0 HG23 VAL 1 78 8.200 -12.210 -1.547 1.00 0.00 H new ATOM 1281 N LEU 1 79 11.255 -9.981 -4.415 1.00 0.00 N ATOM 1282 CA LEU 1 79 12.059 -9.059 -5.185 1.00 0.00 C ATOM 1283 C LEU 1 79 12.803 -9.756 -6.331 1.00 0.00 C ATOM 1284 O LEU 1 79 13.014 -9.163 -7.392 1.00 0.00 O ATOM 1285 CB LEU 1 79 13.052 -8.447 -4.203 1.00 0.00 C ATOM 1286 CG LEU 1 79 13.255 -6.927 -4.231 1.00 0.00 C ATOM 1287 CD1 LEU 1 79 13.906 -6.465 -5.532 1.00 0.00 C ATOM 1288 CD2 LEU 1 79 11.944 -6.179 -3.977 1.00 0.00 C ATOM 0 H LEU 1 79 11.574 -10.088 -3.452 1.00 0.00 H new ATOM 0 HA LEU 1 79 11.426 -8.305 -5.654 1.00 0.00 H new ATOM 0 HB2 LEU 1 79 12.738 -8.723 -3.196 1.00 0.00 H new ATOM 0 HB3 LEU 1 79 14.021 -8.916 -4.374 1.00 0.00 H new ATOM 0 HG LEU 1 79 13.939 -6.684 -3.418 1.00 0.00 H new ATOM 0 HD11 LEU 1 79 14.032 -5.383 -5.511 1.00 0.00 H new ATOM 0 HD12 LEU 1 79 14.880 -6.942 -5.641 1.00 0.00 H new ATOM 0 HD13 LEU 1 79 13.271 -6.740 -6.374 1.00 0.00 H new ATOM 0 HD21 LEU 1 79 12.127 -5.105 -4.004 1.00 0.00 H new ATOM 0 HD22 LEU 1 79 11.219 -6.443 -4.747 1.00 0.00 H new ATOM 0 HD23 LEU 1 79 11.551 -6.455 -2.999 1.00 0.00 H new ATOM 1300 N GLY 1 80 13.188 -11.021 -6.095 1.00 0.00 N ATOM 1301 CA GLY 1 80 13.890 -11.807 -7.094 1.00 0.00 C ATOM 1302 C GLY 1 80 12.976 -12.386 -8.160 1.00 0.00 C ATOM 1303 O GLY 1 80 13.439 -12.776 -9.236 1.00 0.00 O ATOM 0 H GLY 1 80 13.020 -11.512 -5.217 1.00 0.00 H new ATOM 0 HA2 GLY 1 80 14.644 -11.182 -7.573 1.00 0.00 H new ATOM 0 HA3 GLY 1 80 14.419 -12.621 -6.599 1.00 0.00 H new ATOM 1307 N GLN 1 81 11.683 -12.450 -7.845 1.00 0.00 N ATOM 1308 CA GLN 1 81 10.678 -12.960 -8.752 1.00 0.00 C ATOM 1309 C GLN 1 81 9.951 -11.805 -9.471 1.00 0.00 C ATOM 1310 O GLN 1 81 9.076 -11.163 -8.877 1.00 0.00 O ATOM 1311 CB GLN 1 81 9.706 -13.813 -7.947 1.00 0.00 C ATOM 1312 CG GLN 1 81 10.280 -15.168 -7.566 1.00 0.00 C ATOM 1313 CD GLN 1 81 9.988 -16.241 -8.597 1.00 0.00 C ATOM 1314 OE1 GLN 1 81 10.737 -16.417 -9.558 1.00 0.00 O ATOM 1315 NE2 GLN 1 81 8.894 -16.968 -8.400 1.00 0.00 N ATOM 0 H GLN 1 81 11.310 -12.146 -6.946 1.00 0.00 H new ATOM 0 HA GLN 1 81 11.144 -13.569 -9.527 1.00 0.00 H new ATOM 0 HB2 GLN 1 81 9.424 -13.276 -7.041 1.00 0.00 H new ATOM 0 HB3 GLN 1 81 8.795 -13.961 -8.527 1.00 0.00 H new ATOM 0 HG2 GLN 1 81 11.359 -15.078 -7.438 1.00 0.00 H new ATOM 0 HG3 GLN 1 81 9.869 -15.474 -6.604 1.00 0.00 H new ATOM 0 HE21 GLN 1 81 8.301 -16.788 -7.590 1.00 0.00 H new ATOM 0 HE22 GLN 1 81 8.647 -17.706 -9.059 1.00 0.00 H new ATOM 1324 N PRO 1 82 10.314 -11.493 -10.759 1.00 0.00 N ATOM 1325 CA PRO 1 82 9.678 -10.401 -11.517 1.00 0.00 C ATOM 1326 C PRO 1 82 8.314 -10.775 -12.108 1.00 0.00 C ATOM 1327 O PRO 1 82 7.411 -9.935 -12.155 1.00 0.00 O ATOM 1328 CB PRO 1 82 10.671 -10.103 -12.656 1.00 0.00 C ATOM 1329 CG PRO 1 82 11.836 -11.026 -12.461 1.00 0.00 C ATOM 1330 CD PRO 1 82 11.367 -12.141 -11.570 1.00 0.00 C ATOM 0 HA PRO 1 82 9.478 -9.553 -10.862 1.00 0.00 H new ATOM 0 HB2 PRO 1 82 10.206 -10.266 -13.628 1.00 0.00 H new ATOM 0 HB3 PRO 1 82 10.992 -9.062 -12.627 1.00 0.00 H new ATOM 0 HG2 PRO 1 82 12.183 -11.417 -13.418 1.00 0.00 H new ATOM 0 HG3 PRO 1 82 12.675 -10.498 -12.009 1.00 0.00 H new ATOM 0 HD2 PRO 1 82 10.975 -12.980 -12.145 1.00 0.00 H new ATOM 0 HD3 PRO 1 82 12.174 -12.529 -10.949 1.00 0.00 H new ATOM 1338 N HIS 1 83 8.165 -12.037 -12.536 1.00 0.00 N ATOM 1339 CA HIS 1 83 6.920 -12.509 -13.137 1.00 0.00 C ATOM 1340 C HIS 1 83 5.981 -13.095 -12.080 1.00 0.00 C ATOM 1341 O HIS 1 83 6.384 -13.942 -11.277 1.00 0.00 O ATOM 1342 CB HIS 1 83 7.230 -13.553 -14.212 1.00 0.00 C ATOM 1343 CG HIS 1 83 6.189 -13.630 -15.287 1.00 0.00 C ATOM 1344 ND1 HIS 1 83 6.078 -12.688 -16.289 1.00 0.00 N ATOM 1345 CD2 HIS 1 83 5.197 -14.526 -15.506 1.00 0.00 C ATOM 1346 CE1 HIS 1 83 5.063 -12.999 -17.075 1.00 0.00 C ATOM 1347 NE2 HIS 1 83 4.513 -14.110 -16.622 1.00 0.00 N ATOM 0 H HIS 1 83 8.895 -12.746 -12.475 1.00 0.00 H new ATOM 0 HA HIS 1 83 6.414 -11.659 -13.595 1.00 0.00 H new ATOM 0 HB2 HIS 1 83 8.193 -13.321 -14.666 1.00 0.00 H new ATOM 0 HB3 HIS 1 83 7.327 -14.531 -13.740 1.00 0.00 H new ATOM 0 HD2 HIS 1 83 4.984 -15.404 -14.914 1.00 0.00 H new ATOM 0 HE1 HIS 1 83 4.739 -12.440 -17.940 1.00 0.00 H new ATOM 0 HE2 HIS 1 83 3.709 -14.584 -17.034 1.00 0.00 H new ATOM 1356 N HIS 1 84 4.730 -12.616 -12.089 1.00 0.00 N ATOM 1357 CA HIS 1 84 3.698 -13.062 -11.166 1.00 0.00 C ATOM 1358 C HIS 1 84 2.382 -13.190 -11.918 1.00 0.00 C ATOM 1359 O HIS 1 84 1.915 -12.226 -12.536 1.00 0.00 O ATOM 1360 CB HIS 1 84 3.555 -12.077 -10.011 1.00 0.00 C ATOM 1361 CG HIS 1 84 3.545 -12.736 -8.668 1.00 0.00 C ATOM 1362 ND1 HIS 1 84 4.685 -12.928 -7.918 1.00 0.00 N ATOM 1363 CD2 HIS 1 84 2.529 -13.265 -7.946 1.00 0.00 C ATOM 1364 CE1 HIS 1 84 4.372 -13.546 -6.794 1.00 0.00 C ATOM 1365 NE2 HIS 1 84 3.070 -13.761 -6.787 1.00 0.00 N ATOM 0 H HIS 1 84 4.411 -11.903 -12.745 1.00 0.00 H new ATOM 0 HA HIS 1 84 3.976 -14.031 -10.752 1.00 0.00 H new ATOM 0 HB2 HIS 1 84 4.376 -11.361 -10.050 1.00 0.00 H new ATOM 0 HB3 HIS 1 84 2.632 -11.512 -10.137 1.00 0.00 H new ATOM 0 HD2 HIS 1 84 1.487 -13.292 -8.230 1.00 0.00 H new ATOM 0 HE1 HIS 1 84 5.063 -13.827 -6.014 1.00 0.00 H new ATOM 0 HE2 HIS 1 84 2.550 -14.222 -6.040 1.00 0.00 H new ATOM 1374 N GLU 1 85 1.797 -14.378 -11.863 1.00 0.00 N ATOM 1375 CA GLU 1 85 0.570 -14.660 -12.538 1.00 0.00 C ATOM 1376 C GLU 1 85 -0.522 -15.012 -11.548 1.00 0.00 C ATOM 1377 O GLU 1 85 -0.324 -15.789 -10.608 1.00 0.00 O ATOM 1378 CB GLU 1 85 0.771 -15.798 -13.542 1.00 0.00 C ATOM 1379 CG GLU 1 85 -0.057 -15.655 -14.809 1.00 0.00 C ATOM 1380 CD GLU 1 85 0.251 -16.734 -15.830 1.00 0.00 C ATOM 1381 OE1 GLU 1 85 1.169 -16.528 -16.652 1.00 0.00 O ATOM 1382 OE2 GLU 1 85 -0.423 -17.784 -15.805 1.00 0.00 O ATOM 0 H GLU 1 85 2.175 -15.169 -11.341 1.00 0.00 H new ATOM 0 HA GLU 1 85 0.260 -13.765 -13.078 1.00 0.00 H new ATOM 0 HB2 GLU 1 85 1.826 -15.849 -13.813 1.00 0.00 H new ATOM 0 HB3 GLU 1 85 0.520 -16.743 -13.060 1.00 0.00 H new ATOM 0 HG2 GLU 1 85 -1.116 -15.693 -14.553 1.00 0.00 H new ATOM 0 HG3 GLU 1 85 0.129 -14.677 -15.252 1.00 0.00 H new ATOM 1389 N LEU 1 86 -1.665 -14.408 -11.796 1.00 0.00 N ATOM 1390 CA LEU 1 86 -2.865 -14.575 -11.031 1.00 0.00 C ATOM 1391 C LEU 1 86 -4.032 -14.541 -12.000 1.00 0.00 C ATOM 1392 O LEU 1 86 -4.114 -13.666 -12.862 1.00 0.00 O ATOM 1393 CB LEU 1 86 -2.998 -13.449 -10.002 1.00 0.00 C ATOM 1394 CG LEU 1 86 -4.379 -13.290 -9.363 1.00 0.00 C ATOM 1395 CD1 LEU 1 86 -4.597 -14.287 -8.232 1.00 0.00 C ATOM 1396 CD2 LEU 1 86 -4.577 -11.864 -8.877 1.00 0.00 C ATOM 0 H LEU 1 86 -1.779 -13.759 -12.574 1.00 0.00 H new ATOM 0 HA LEU 1 86 -2.845 -15.521 -10.490 1.00 0.00 H new ATOM 0 HB2 LEU 1 86 -2.269 -13.619 -9.209 1.00 0.00 H new ATOM 0 HB3 LEU 1 86 -2.731 -12.509 -10.484 1.00 0.00 H new ATOM 0 HG LEU 1 86 -5.126 -13.504 -10.128 1.00 0.00 H new ATOM 0 HD11 LEU 1 86 -5.589 -14.141 -7.805 1.00 0.00 H new ATOM 0 HD12 LEU 1 86 -4.515 -15.302 -8.621 1.00 0.00 H new ATOM 0 HD13 LEU 1 86 -3.843 -14.132 -7.460 1.00 0.00 H new ATOM 0 HD21 LEU 1 86 -5.564 -11.767 -8.425 1.00 0.00 H new ATOM 0 HD22 LEU 1 86 -3.814 -11.623 -8.137 1.00 0.00 H new ATOM 0 HD23 LEU 1 86 -4.495 -11.178 -9.720 1.00 0.00 H new ATOM 1408 N ASP 1 87 -4.928 -15.501 -11.828 1.00 0.00 N ATOM 1409 CA ASP 1 87 -6.138 -15.674 -12.650 1.00 0.00 C ATOM 1410 C ASP 1 87 -5.811 -15.698 -14.142 1.00 0.00 C ATOM 1411 O ASP 1 87 -6.553 -15.193 -14.996 1.00 0.00 O ATOM 1412 CB ASP 1 87 -7.095 -14.565 -12.302 1.00 0.00 C ATOM 1413 CG ASP 1 87 -8.521 -14.801 -12.776 1.00 0.00 C ATOM 1414 OD1 ASP 1 87 -8.852 -14.376 -13.901 1.00 0.00 O ATOM 1415 OD2 ASP 1 87 -9.302 -15.418 -12.021 1.00 0.00 O ATOM 0 H ASP 1 87 -4.840 -16.205 -11.096 1.00 0.00 H new ATOM 0 HA ASP 1 87 -6.598 -16.638 -12.434 1.00 0.00 H new ATOM 0 HB2 ASP 1 87 -7.101 -14.431 -11.220 1.00 0.00 H new ATOM 0 HB3 ASP 1 87 -6.729 -13.635 -12.736 1.00 0.00 H new ATOM 1420 N SER 1 88 -4.676 -16.323 -14.409 1.00 0.00 N ATOM 1421 CA SER 1 88 -4.107 -16.505 -15.762 1.00 0.00 C ATOM 1422 C SER 1 88 -3.599 -15.176 -16.361 1.00 0.00 C ATOM 1423 O SER 1 88 -3.241 -15.120 -17.545 1.00 0.00 O ATOM 1424 CB SER 1 88 -5.118 -17.182 -16.713 1.00 0.00 C ATOM 1425 OG SER 1 88 -4.499 -17.581 -17.925 1.00 0.00 O ATOM 0 H SER 1 88 -4.097 -16.735 -13.678 1.00 0.00 H new ATOM 0 HA SER 1 88 -3.247 -17.166 -15.654 1.00 0.00 H new ATOM 0 HB2 SER 1 88 -5.556 -18.051 -16.222 1.00 0.00 H new ATOM 0 HB3 SER 1 88 -5.935 -16.493 -16.929 1.00 0.00 H new ATOM 0 HG SER 1 88 -3.866 -16.890 -18.212 1.00 0.00 H new ATOM 1431 N LYS 1 89 -3.552 -14.117 -15.534 1.00 0.00 N ATOM 1432 CA LYS 1 89 -3.078 -12.818 -15.972 1.00 0.00 C ATOM 1433 C LYS 1 89 -1.941 -12.342 -15.090 1.00 0.00 C ATOM 1434 O LYS 1 89 -1.836 -12.697 -13.915 1.00 0.00 O ATOM 1435 CB LYS 1 89 -4.191 -11.751 -16.032 1.00 0.00 C ATOM 1436 CG LYS 1 89 -5.288 -11.871 -14.980 1.00 0.00 C ATOM 1437 CD LYS 1 89 -6.211 -10.665 -15.014 1.00 0.00 C ATOM 1438 CE LYS 1 89 -7.356 -10.805 -14.022 1.00 0.00 C ATOM 1439 NZ LYS 1 89 -8.409 -11.736 -14.513 1.00 0.00 N ATOM 0 H LYS 1 89 -3.841 -14.149 -14.556 1.00 0.00 H new ATOM 0 HA LYS 1 89 -2.718 -12.951 -16.992 1.00 0.00 H new ATOM 0 HB2 LYS 1 89 -3.730 -10.768 -15.937 1.00 0.00 H new ATOM 0 HB3 LYS 1 89 -4.654 -11.792 -17.018 1.00 0.00 H new ATOM 0 HG2 LYS 1 89 -5.865 -12.780 -15.153 1.00 0.00 H new ATOM 0 HG3 LYS 1 89 -4.839 -11.962 -13.991 1.00 0.00 H new ATOM 0 HD2 LYS 1 89 -5.641 -9.764 -14.787 1.00 0.00 H new ATOM 0 HD3 LYS 1 89 -6.613 -10.543 -16.020 1.00 0.00 H new ATOM 0 HE2 LYS 1 89 -6.968 -11.166 -13.070 1.00 0.00 H new ATOM 0 HE3 LYS 1 89 -7.796 -9.825 -13.836 1.00 0.00 H new ATOM 0 HZ1 LYS 1 89 -9.345 -11.381 -14.231 1.00 0.00 H new ATOM 0 HZ2 LYS 1 89 -8.361 -11.799 -15.550 1.00 0.00 H new ATOM 0 HZ3 LYS 1 89 -8.258 -12.679 -14.102 1.00 0.00 H new ATOM 1453 N THR 1 90 -1.107 -11.530 -15.701 1.00 0.00 N ATOM 1454 CA THR 1 90 0.083 -10.950 -15.072 1.00 0.00 C ATOM 1455 C THR 1 90 -0.266 -9.727 -14.208 1.00 0.00 C ATOM 1456 O THR 1 90 -0.922 -8.792 -14.677 1.00 0.00 O ATOM 1457 CB THR 1 90 1.121 -10.539 -16.147 1.00 0.00 C ATOM 1458 OG1 THR 1 90 1.144 -11.508 -17.205 1.00 0.00 O ATOM 1459 CG2 THR 1 90 2.525 -10.416 -15.558 1.00 0.00 C ATOM 0 H THR 1 90 -1.231 -11.241 -16.671 1.00 0.00 H new ATOM 0 HA THR 1 90 0.509 -11.717 -14.425 1.00 0.00 H new ATOM 0 HB THR 1 90 0.820 -9.565 -16.534 1.00 0.00 H new ATOM 0 HG1 THR 1 90 1.801 -11.239 -17.880 1.00 0.00 H new ATOM 0 HG21 THR 1 90 3.224 -10.126 -16.342 1.00 0.00 H new ATOM 0 HG22 THR 1 90 2.525 -9.659 -14.774 1.00 0.00 H new ATOM 0 HG23 THR 1 90 2.828 -11.375 -15.137 1.00 0.00 H new ATOM 1467 N ILE 1 91 0.188 -9.758 -12.949 1.00 0.00 N ATOM 1468 CA ILE 1 91 -0.046 -8.665 -11.996 1.00 0.00 C ATOM 1469 C ILE 1 91 1.294 -8.011 -11.609 1.00 0.00 C ATOM 1470 O ILE 1 91 2.354 -8.557 -11.938 1.00 0.00 O ATOM 1471 CB ILE 1 91 -0.876 -9.145 -10.764 1.00 0.00 C ATOM 1472 CG1 ILE 1 91 -0.159 -10.197 -9.915 1.00 0.00 C ATOM 1473 CG2 ILE 1 91 -2.215 -9.699 -11.249 1.00 0.00 C ATOM 1474 CD1 ILE 1 91 -0.862 -10.496 -8.596 1.00 0.00 C ATOM 0 H ILE 1 91 0.724 -10.535 -12.564 1.00 0.00 H new ATOM 0 HA ILE 1 91 -0.655 -7.898 -12.475 1.00 0.00 H new ATOM 0 HB ILE 1 91 -1.021 -8.278 -10.120 1.00 0.00 H new ATOM 0 HG12 ILE 1 91 -0.074 -11.119 -10.489 1.00 0.00 H new ATOM 0 HG13 ILE 1 91 0.855 -9.856 -9.708 1.00 0.00 H new ATOM 0 HG21 ILE 1 91 -2.800 -10.036 -10.394 1.00 0.00 H new ATOM 0 HG22 ILE 1 91 -2.762 -8.918 -11.778 1.00 0.00 H new ATOM 0 HG23 ILE 1 91 -2.039 -10.538 -11.922 1.00 0.00 H new ATOM 0 HD11 ILE 1 91 -0.299 -11.250 -8.046 1.00 0.00 H new ATOM 0 HD12 ILE 1 91 -0.924 -9.584 -8.002 1.00 0.00 H new ATOM 0 HD13 ILE 1 91 -1.867 -10.868 -8.795 1.00 0.00 H new ATOM 1486 N ASP 1 92 1.267 -6.850 -10.929 1.00 0.00 N ATOM 1487 CA ASP 1 92 2.512 -6.160 -10.603 1.00 0.00 C ATOM 1488 C ASP 1 92 2.793 -6.037 -9.086 1.00 0.00 C ATOM 1489 O ASP 1 92 2.342 -5.074 -8.450 1.00 0.00 O ATOM 1490 CB ASP 1 92 2.483 -4.776 -11.261 1.00 0.00 C ATOM 1491 CG ASP 1 92 3.868 -4.186 -11.473 1.00 0.00 C ATOM 1492 OD1 ASP 1 92 4.389 -4.284 -12.604 1.00 0.00 O ATOM 1493 OD2 ASP 1 92 4.430 -3.629 -10.508 1.00 0.00 O ATOM 0 H ASP 1 92 0.418 -6.386 -10.606 1.00 0.00 H new ATOM 0 HA ASP 1 92 3.331 -6.765 -10.992 1.00 0.00 H new ATOM 0 HB2 ASP 1 92 1.975 -4.848 -12.222 1.00 0.00 H new ATOM 0 HB3 ASP 1 92 1.897 -4.098 -10.641 1.00 0.00 H new ATOM 1498 N PRO 1 93 3.508 -7.029 -8.464 1.00 0.00 N ATOM 1499 CA PRO 1 93 3.893 -6.951 -7.048 1.00 0.00 C ATOM 1500 C PRO 1 93 5.180 -6.132 -6.860 1.00 0.00 C ATOM 1501 O PRO 1 93 6.211 -6.444 -7.468 1.00 0.00 O ATOM 1502 CB PRO 1 93 4.114 -8.424 -6.641 1.00 0.00 C ATOM 1503 CG PRO 1 93 3.876 -9.247 -7.874 1.00 0.00 C ATOM 1504 CD PRO 1 93 3.949 -8.311 -9.050 1.00 0.00 C ATOM 0 HA PRO 1 93 3.138 -6.452 -6.441 1.00 0.00 H new ATOM 0 HB2 PRO 1 93 5.125 -8.575 -6.263 1.00 0.00 H new ATOM 0 HB3 PRO 1 93 3.430 -8.713 -5.843 1.00 0.00 H new ATOM 0 HG2 PRO 1 93 4.624 -10.035 -7.962 1.00 0.00 H new ATOM 0 HG3 PRO 1 93 2.902 -9.735 -7.830 1.00 0.00 H new ATOM 0 HD2 PRO 1 93 4.959 -8.246 -9.455 1.00 0.00 H new ATOM 0 HD3 PRO 1 93 3.299 -8.630 -9.864 1.00 0.00 H new ATOM 1512 N LYS 1 94 5.116 -5.084 -6.020 1.00 0.00 N ATOM 1513 CA LYS 1 94 6.284 -4.212 -5.769 1.00 0.00 C ATOM 1514 C LYS 1 94 6.275 -3.622 -4.351 1.00 0.00 C ATOM 1515 O LYS 1 94 5.213 -3.433 -3.768 1.00 0.00 O ATOM 1516 CB LYS 1 94 6.361 -3.080 -6.825 1.00 0.00 C ATOM 1517 CG LYS 1 94 5.118 -2.190 -6.916 1.00 0.00 C ATOM 1518 CD LYS 1 94 4.963 -1.585 -8.305 1.00 0.00 C ATOM 1519 CE LYS 1 94 4.434 -0.161 -8.241 1.00 0.00 C ATOM 1520 NZ LYS 1 94 5.494 0.809 -7.842 1.00 0.00 N ATOM 0 H LYS 1 94 4.276 -4.819 -5.506 1.00 0.00 H new ATOM 0 HA LYS 1 94 7.173 -4.837 -5.855 1.00 0.00 H new ATOM 0 HB2 LYS 1 94 7.223 -2.452 -6.599 1.00 0.00 H new ATOM 0 HB3 LYS 1 94 6.540 -3.528 -7.802 1.00 0.00 H new ATOM 0 HG2 LYS 1 94 4.232 -2.776 -6.673 1.00 0.00 H new ATOM 0 HG3 LYS 1 94 5.186 -1.392 -6.176 1.00 0.00 H new ATOM 0 HD2 LYS 1 94 5.926 -1.593 -8.815 1.00 0.00 H new ATOM 0 HD3 LYS 1 94 4.284 -2.199 -8.896 1.00 0.00 H new ATOM 0 HE2 LYS 1 94 4.032 0.121 -9.214 1.00 0.00 H new ATOM 0 HE3 LYS 1 94 3.610 -0.112 -7.529 1.00 0.00 H new ATOM 0 HZ1 LYS 1 94 5.093 1.768 -7.810 1.00 0.00 H new ATOM 0 HZ2 LYS 1 94 5.861 0.556 -6.902 1.00 0.00 H new ATOM 0 HZ3 LYS 1 94 6.269 0.781 -8.535 1.00 0.00 H new ATOM 1534 N VAL 1 95 7.472 -3.287 -3.833 1.00 0.00 N ATOM 1535 CA VAL 1 95 7.627 -2.720 -2.474 1.00 0.00 C ATOM 1536 C VAL 1 95 7.228 -1.229 -2.434 1.00 0.00 C ATOM 1537 O VAL 1 95 7.687 -0.437 -3.261 1.00 0.00 O ATOM 1538 CB VAL 1 95 9.069 -2.892 -1.935 1.00 0.00 C ATOM 1539 CG1 VAL 1 95 9.146 -2.621 -0.433 1.00 0.00 C ATOM 1540 CG2 VAL 1 95 9.619 -4.287 -2.236 1.00 0.00 C ATOM 0 H VAL 1 95 8.352 -3.399 -4.336 1.00 0.00 H new ATOM 0 HA VAL 1 95 6.952 -3.281 -1.827 1.00 0.00 H new ATOM 0 HB VAL 1 95 9.684 -2.156 -2.452 1.00 0.00 H new ATOM 0 HG11 VAL 1 95 10.173 -2.752 -0.092 1.00 0.00 H new ATOM 0 HG12 VAL 1 95 8.824 -1.600 -0.231 1.00 0.00 H new ATOM 0 HG13 VAL 1 95 8.496 -3.318 0.096 1.00 0.00 H new ATOM 0 HG21 VAL 1 95 10.632 -4.371 -1.843 1.00 0.00 H new ATOM 0 HG22 VAL 1 95 8.984 -5.038 -1.766 1.00 0.00 H new ATOM 0 HG23 VAL 1 95 9.633 -4.448 -3.314 1.00 0.00 H new ATOM 1550 N ALA 1 96 6.369 -0.875 -1.465 1.00 0.00 N ATOM 1551 CA ALA 1 96 5.873 0.488 -1.299 1.00 0.00 C ATOM 1552 C ALA 1 96 6.612 1.264 -0.204 1.00 0.00 C ATOM 1553 O ALA 1 96 7.199 0.669 0.703 1.00 0.00 O ATOM 1554 CB ALA 1 96 4.385 0.460 -0.989 1.00 0.00 C ATOM 0 H ALA 1 96 6.002 -1.532 -0.776 1.00 0.00 H new ATOM 0 HA ALA 1 96 6.056 1.008 -2.239 1.00 0.00 H new ATOM 0 HB1 ALA 1 96 4.020 1.480 -0.866 1.00 0.00 H new ATOM 0 HB2 ALA 1 96 3.851 -0.020 -1.809 1.00 0.00 H new ATOM 0 HB3 ALA 1 96 4.215 -0.100 -0.069 1.00 0.00 H new ATOM 1560 N PHE 1 97 6.577 2.601 -0.321 1.00 0.00 N ATOM 1561 CA PHE 1 97 7.195 3.505 0.641 1.00 0.00 C ATOM 1562 C PHE 1 97 6.116 4.331 1.372 1.00 0.00 C ATOM 1563 O PHE 1 97 5.310 4.993 0.707 1.00 0.00 O ATOM 1564 CB PHE 1 97 8.160 4.432 -0.091 1.00 0.00 C ATOM 1565 CG PHE 1 97 9.588 3.988 0.006 1.00 0.00 C ATOM 1566 CD1 PHE 1 97 10.100 3.078 -0.903 1.00 0.00 C ATOM 1567 CD2 PHE 1 97 10.412 4.465 1.011 1.00 0.00 C ATOM 1568 CE1 PHE 1 97 11.410 2.649 -0.812 1.00 0.00 C ATOM 1569 CE2 PHE 1 97 11.724 4.043 1.108 1.00 0.00 C ATOM 1570 CZ PHE 1 97 12.223 3.132 0.195 1.00 0.00 C ATOM 0 H PHE 1 97 6.114 3.080 -1.093 1.00 0.00 H new ATOM 0 HA PHE 1 97 7.741 2.923 1.383 1.00 0.00 H new ATOM 0 HB2 PHE 1 97 7.874 4.489 -1.141 1.00 0.00 H new ATOM 0 HB3 PHE 1 97 8.070 5.438 0.319 1.00 0.00 H new ATOM 0 HD1 PHE 1 97 9.468 2.699 -1.692 1.00 0.00 H new ATOM 0 HD2 PHE 1 97 10.025 5.175 1.727 1.00 0.00 H new ATOM 0 HE1 PHE 1 97 11.798 1.938 -1.526 1.00 0.00 H new ATOM 0 HE2 PHE 1 97 12.358 4.424 1.895 1.00 0.00 H new ATOM 0 HZ PHE 1 97 13.248 2.798 0.269 1.00 0.00 H new ATOM 1580 N PRO 1 98 6.057 4.308 2.745 1.00 0.00 N ATOM 1581 CA PRO 1 98 5.053 5.079 3.513 1.00 0.00 C ATOM 1582 C PRO 1 98 5.330 6.583 3.518 1.00 0.00 C ATOM 1583 O PRO 1 98 6.478 7.010 3.675 1.00 0.00 O ATOM 1584 CB PRO 1 98 5.164 4.522 4.943 1.00 0.00 C ATOM 1585 CG PRO 1 98 6.021 3.306 4.838 1.00 0.00 C ATOM 1586 CD PRO 1 98 6.920 3.530 3.659 1.00 0.00 C ATOM 0 HA PRO 1 98 4.062 4.972 3.072 1.00 0.00 H new ATOM 0 HB2 PRO 1 98 5.607 5.256 5.616 1.00 0.00 H new ATOM 0 HB3 PRO 1 98 4.181 4.275 5.344 1.00 0.00 H new ATOM 0 HG2 PRO 1 98 6.602 3.159 5.748 1.00 0.00 H new ATOM 0 HG3 PRO 1 98 5.413 2.412 4.700 1.00 0.00 H new ATOM 0 HD2 PRO 1 98 7.821 4.079 3.933 1.00 0.00 H new ATOM 0 HD3 PRO 1 98 7.244 2.591 3.211 1.00 0.00 H new ATOM 1594 N ARG 1 99 4.263 7.372 3.337 1.00 0.00 N ATOM 1595 CA ARG 1 99 4.357 8.837 3.312 1.00 0.00 C ATOM 1596 C ARG 1 99 3.253 9.470 4.157 1.00 0.00 C ATOM 1597 O ARG 1 99 2.124 8.973 4.187 1.00 0.00 O ATOM 1598 CB ARG 1 99 4.279 9.351 1.871 1.00 0.00 C ATOM 1599 CG ARG 1 99 5.541 9.076 1.061 1.00 0.00 C ATOM 1600 CD ARG 1 99 5.309 9.240 -0.434 1.00 0.00 C ATOM 1601 NE ARG 1 99 5.160 10.647 -0.827 1.00 0.00 N ATOM 1602 CZ ARG 1 99 4.997 11.071 -2.087 1.00 0.00 C ATOM 1603 NH1 ARG 1 99 4.961 10.210 -3.103 1.00 0.00 N ATOM 1604 NH2 ARG 1 99 4.872 12.368 -2.330 1.00 0.00 N ATOM 0 H ARG 1 99 3.316 7.016 3.205 1.00 0.00 H new ATOM 0 HA ARG 1 99 5.319 9.122 3.738 1.00 0.00 H new ATOM 0 HB2 ARG 1 99 3.428 8.886 1.373 1.00 0.00 H new ATOM 0 HB3 ARG 1 99 4.092 10.425 1.886 1.00 0.00 H new ATOM 0 HG2 ARG 1 99 6.332 9.754 1.381 1.00 0.00 H new ATOM 0 HG3 ARG 1 99 5.888 8.063 1.265 1.00 0.00 H new ATOM 0 HD2 ARG 1 99 6.144 8.800 -0.979 1.00 0.00 H new ATOM 0 HD3 ARG 1 99 4.414 8.688 -0.723 1.00 0.00 H new ATOM 0 HE ARG 1 99 5.182 11.351 -0.089 1.00 0.00 H new ATOM 0 HH11 ARG 1 99 5.058 9.210 -2.928 1.00 0.00 H new ATOM 0 HH12 ARG 1 99 4.836 10.551 -4.056 1.00 0.00 H new ATOM 0 HH21 ARG 1 99 4.900 13.036 -1.560 1.00 0.00 H new ATOM 0 HH22 ARG 1 99 4.748 12.698 -3.287 1.00 0.00 H new ATOM 1618 N ARG 1 100 3.600 10.562 4.846 1.00 0.00 N ATOM 1619 CA ARG 1 100 2.658 11.283 5.709 1.00 0.00 C ATOM 1620 C ARG 1 100 2.585 12.762 5.335 1.00 0.00 C ATOM 1621 O ARG 1 100 3.618 13.418 5.180 1.00 0.00 O ATOM 1622 CB ARG 1 100 3.083 11.149 7.174 1.00 0.00 C ATOM 1623 CG ARG 1 100 2.734 9.803 7.802 1.00 0.00 C ATOM 1624 CD ARG 1 100 1.390 9.844 8.515 1.00 0.00 C ATOM 1625 NE ARG 1 100 1.122 8.602 9.248 1.00 0.00 N ATOM 1626 CZ ARG 1 100 0.207 8.469 10.219 1.00 0.00 C ATOM 1627 NH1 ARG 1 100 -0.552 9.498 10.596 1.00 0.00 N ATOM 1628 NH2 ARG 1 100 0.059 7.298 10.822 1.00 0.00 N ATOM 0 H ARG 1 100 4.535 10.969 4.822 1.00 0.00 H new ATOM 0 HA ARG 1 100 1.671 10.842 5.569 1.00 0.00 H new ATOM 0 HB2 ARG 1 100 4.160 11.303 7.244 1.00 0.00 H new ATOM 0 HB3 ARG 1 100 2.609 11.942 7.753 1.00 0.00 H new ATOM 0 HG2 ARG 1 100 2.712 9.036 7.028 1.00 0.00 H new ATOM 0 HG3 ARG 1 100 3.513 9.519 8.510 1.00 0.00 H new ATOM 0 HD2 ARG 1 100 1.372 10.685 9.208 1.00 0.00 H new ATOM 0 HD3 ARG 1 100 0.597 10.014 7.786 1.00 0.00 H new ATOM 0 HE ARG 1 100 1.672 7.779 9.001 1.00 0.00 H new ATOM 0 HH11 ARG 1 100 -0.442 10.406 10.144 1.00 0.00 H new ATOM 0 HH12 ARG 1 100 -1.243 9.378 11.337 1.00 0.00 H new ATOM 0 HH21 ARG 1 100 0.639 6.506 10.547 1.00 0.00 H new ATOM 0 HH22 ARG 1 100 -0.635 7.189 11.562 1.00 0.00 H new ATOM 1642 N ALA 1 101 1.351 13.275 5.180 1.00 0.00 N ATOM 1643 CA ALA 1 101 1.119 14.675 4.836 1.00 0.00 C ATOM 1644 C ALA 1 101 -0.256 15.155 5.307 1.00 0.00 C ATOM 1645 O ALA 1 101 -1.109 14.353 5.697 1.00 0.00 O ATOM 1646 CB ALA 1 101 1.260 14.903 3.332 1.00 0.00 C ATOM 0 H ALA 1 101 0.497 12.729 5.290 1.00 0.00 H new ATOM 0 HA ALA 1 101 1.880 15.258 5.355 1.00 0.00 H new ATOM 0 HB1 ALA 1 101 1.082 15.954 3.105 1.00 0.00 H new ATOM 0 HB2 ALA 1 101 2.266 14.629 3.015 1.00 0.00 H new ATOM 0 HB3 ALA 1 101 0.533 14.289 2.801 1.00 0.00 H new ATOM 1652 N GLN 1 102 -0.453 16.490 5.250 1.00 0.00 N ATOM 1653 CA GLN 1 102 -1.709 17.175 5.649 1.00 0.00 C ATOM 1654 C GLN 1 102 -2.091 16.947 7.130 1.00 0.00 C ATOM 1655 O GLN 1 102 -1.792 15.890 7.691 1.00 0.00 O ATOM 1656 CB GLN 1 102 -2.881 16.777 4.737 1.00 0.00 C ATOM 1657 CG GLN 1 102 -2.857 17.470 3.383 1.00 0.00 C ATOM 1658 CD GLN 1 102 -3.994 17.033 2.482 1.00 0.00 C ATOM 1659 OE1 GLN 1 102 -3.865 16.073 1.722 1.00 0.00 O ATOM 1660 NE2 GLN 1 102 -5.117 17.738 2.560 1.00 0.00 N ATOM 0 H GLN 1 102 0.265 17.135 4.921 1.00 0.00 H new ATOM 0 HA GLN 1 102 -1.508 18.240 5.531 1.00 0.00 H new ATOM 0 HB2 GLN 1 102 -2.863 15.698 4.585 1.00 0.00 H new ATOM 0 HB3 GLN 1 102 -3.819 17.012 5.240 1.00 0.00 H new ATOM 0 HG2 GLN 1 102 -2.910 18.549 3.531 1.00 0.00 H new ATOM 0 HG3 GLN 1 102 -1.908 17.262 2.890 1.00 0.00 H new ATOM 0 HE21 GLN 1 102 -5.181 18.526 3.204 1.00 0.00 H new ATOM 0 HE22 GLN 1 102 -5.916 17.491 1.976 1.00 0.00 H new ATOM 1669 N PRO 1 103 -2.763 17.949 7.786 1.00 0.00 N ATOM 1670 CA PRO 1 103 -3.183 17.838 9.199 1.00 0.00 C ATOM 1671 C PRO 1 103 -4.450 16.982 9.400 1.00 0.00 C ATOM 1672 O PRO 1 103 -5.054 16.522 8.427 1.00 0.00 O ATOM 1673 CB PRO 1 103 -3.439 19.300 9.594 1.00 0.00 C ATOM 1674 CG PRO 1 103 -3.858 19.979 8.333 1.00 0.00 C ATOM 1675 CD PRO 1 103 -3.142 19.271 7.210 1.00 0.00 C ATOM 0 HA PRO 1 103 -2.431 17.334 9.806 1.00 0.00 H new ATOM 0 HB2 PRO 1 103 -4.215 19.372 10.356 1.00 0.00 H new ATOM 0 HB3 PRO 1 103 -2.541 19.759 10.009 1.00 0.00 H new ATOM 0 HG2 PRO 1 103 -4.939 19.922 8.202 1.00 0.00 H new ATOM 0 HG3 PRO 1 103 -3.595 21.037 8.356 1.00 0.00 H new ATOM 0 HD2 PRO 1 103 -3.787 19.155 6.339 1.00 0.00 H new ATOM 0 HD3 PRO 1 103 -2.264 19.829 6.885 1.00 0.00 H new ATOM 1683 N LYS 1 104 -4.838 16.787 10.673 1.00 0.00 N ATOM 1684 CA LYS 1 104 -6.027 15.996 11.033 1.00 0.00 C ATOM 1685 C LYS 1 104 -7.298 16.852 10.997 1.00 0.00 C ATOM 1686 O LYS 1 104 -7.237 18.074 11.159 1.00 0.00 O ATOM 1687 CB LYS 1 104 -5.868 15.386 12.432 1.00 0.00 C ATOM 1688 CG LYS 1 104 -4.854 14.254 12.511 1.00 0.00 C ATOM 1689 CD LYS 1 104 -4.730 13.722 13.934 1.00 0.00 C ATOM 1690 CE LYS 1 104 -3.720 12.586 14.031 1.00 0.00 C ATOM 1691 NZ LYS 1 104 -2.316 13.068 13.900 1.00 0.00 N ATOM 0 H LYS 1 104 -4.340 17.171 11.476 1.00 0.00 H new ATOM 0 HA LYS 1 104 -6.120 15.198 10.297 1.00 0.00 H new ATOM 0 HB2 LYS 1 104 -5.572 16.172 13.127 1.00 0.00 H new ATOM 0 HB3 LYS 1 104 -6.837 15.014 12.765 1.00 0.00 H new ATOM 0 HG2 LYS 1 104 -5.154 13.447 11.843 1.00 0.00 H new ATOM 0 HG3 LYS 1 104 -3.882 14.608 12.167 1.00 0.00 H new ATOM 0 HD2 LYS 1 104 -4.430 14.532 14.599 1.00 0.00 H new ATOM 0 HD3 LYS 1 104 -5.704 13.372 14.277 1.00 0.00 H new ATOM 0 HE2 LYS 1 104 -3.840 12.076 14.987 1.00 0.00 H new ATOM 0 HE3 LYS 1 104 -3.925 11.853 13.251 1.00 0.00 H new ATOM 0 HZ1 LYS 1 104 -1.664 12.261 13.972 1.00 0.00 H new ATOM 0 HZ2 LYS 1 104 -2.193 13.531 12.977 1.00 0.00 H new ATOM 0 HZ3 LYS 1 104 -2.110 13.748 14.659 1.00 0.00 H new ATOM 1705 N MET 1 105 -8.443 16.190 10.784 1.00 0.00 N ATOM 1706 CA MET 1 105 -9.749 16.860 10.726 1.00 0.00 C ATOM 1707 C MET 1 105 -10.410 16.922 12.108 1.00 0.00 C ATOM 1708 O MET 1 105 -10.036 16.174 13.020 1.00 0.00 O ATOM 1709 CB MET 1 105 -10.671 16.136 9.736 1.00 0.00 C ATOM 1710 CG MET 1 105 -10.278 16.317 8.276 1.00 0.00 C ATOM 1711 SD MET 1 105 -10.868 17.873 7.573 1.00 0.00 S ATOM 1712 CE MET 1 105 -9.393 18.890 7.641 1.00 0.00 C ATOM 0 H MET 1 105 -8.490 15.180 10.648 1.00 0.00 H new ATOM 0 HA MET 1 105 -9.584 17.882 10.385 1.00 0.00 H new ATOM 0 HB2 MET 1 105 -10.675 15.072 9.971 1.00 0.00 H new ATOM 0 HB3 MET 1 105 -11.690 16.497 9.874 1.00 0.00 H new ATOM 0 HG2 MET 1 105 -9.192 16.275 8.190 1.00 0.00 H new ATOM 0 HG3 MET 1 105 -10.677 15.487 7.693 1.00 0.00 H new ATOM 0 HE1 MET 1 105 -9.484 19.711 6.929 1.00 0.00 H new ATOM 0 HE2 MET 1 105 -9.275 19.293 8.647 1.00 0.00 H new ATOM 0 HE3 MET 1 105 -8.522 18.285 7.388 1.00 0.00 H new ATOM 1722 N VAL 1 106 -11.382 17.832 12.251 1.00 0.00 N ATOM 1723 CA VAL 1 106 -12.119 18.017 13.504 1.00 0.00 C ATOM 1724 C VAL 1 106 -13.419 17.192 13.480 1.00 0.00 C ATOM 1725 O VAL 1 106 -13.847 16.728 12.418 1.00 0.00 O ATOM 1726 CB VAL 1 106 -12.443 19.525 13.754 1.00 0.00 C ATOM 1727 CG1 VAL 1 106 -12.763 19.798 15.222 1.00 0.00 C ATOM 1728 CG2 VAL 1 106 -11.296 20.427 13.301 1.00 0.00 C ATOM 0 H VAL 1 106 -11.678 18.458 11.502 1.00 0.00 H new ATOM 0 HA VAL 1 106 -11.488 17.668 14.321 1.00 0.00 H new ATOM 0 HB VAL 1 106 -13.326 19.756 13.158 1.00 0.00 H new ATOM 0 HG11 VAL 1 106 -12.983 20.857 15.356 1.00 0.00 H new ATOM 0 HG12 VAL 1 106 -13.629 19.207 15.522 1.00 0.00 H new ATOM 0 HG13 VAL 1 106 -11.906 19.525 15.838 1.00 0.00 H new ATOM 0 HG21 VAL 1 106 -11.556 21.469 13.490 1.00 0.00 H new ATOM 0 HG22 VAL 1 106 -10.392 20.172 13.855 1.00 0.00 H new ATOM 0 HG23 VAL 1 106 -11.120 20.284 12.235 1.00 0.00 H new ATOM 1738 N THR 1 107 -14.037 17.019 14.655 1.00 0.00 N ATOM 1739 CA THR 1 107 -15.269 16.263 14.782 1.00 0.00 C ATOM 1740 C THR 1 107 -16.483 17.198 14.882 1.00 0.00 C ATOM 1741 O THR 1 107 -17.506 16.961 14.234 1.00 0.00 O ATOM 1742 CB THR 1 107 -15.224 15.325 16.018 1.00 0.00 C ATOM 1743 OG1 THR 1 107 -13.916 14.753 16.153 1.00 0.00 O ATOM 1744 CG2 THR 1 107 -16.250 14.199 15.910 1.00 0.00 C ATOM 0 H THR 1 107 -13.691 17.401 15.535 1.00 0.00 H new ATOM 0 HA THR 1 107 -15.370 15.653 13.884 1.00 0.00 H new ATOM 0 HB THR 1 107 -15.464 15.928 16.894 1.00 0.00 H new ATOM 0 HG1 THR 1 107 -13.896 14.164 16.936 1.00 0.00 H new ATOM 0 HG21 THR 1 107 -16.188 13.564 16.794 1.00 0.00 H new ATOM 0 HG22 THR 1 107 -17.251 14.624 15.839 1.00 0.00 H new ATOM 0 HG23 THR 1 107 -16.045 13.604 15.020 1.00 0.00 H new ATOM 1752 N ARG 1 108 -16.358 18.252 15.699 1.00 0.00 N ATOM 1753 CA ARG 1 108 -17.434 19.228 15.888 1.00 0.00 C ATOM 1754 C ARG 1 108 -17.248 20.438 14.972 1.00 0.00 C ATOM 1755 O ARG 1 108 -16.195 21.081 14.987 1.00 0.00 O ATOM 1756 CB ARG 1 108 -17.494 19.682 17.350 1.00 0.00 C ATOM 1757 CG ARG 1 108 -18.307 18.758 18.244 1.00 0.00 C ATOM 1758 CD ARG 1 108 -18.328 19.253 19.683 1.00 0.00 C ATOM 1759 NE ARG 1 108 -19.510 18.775 20.411 1.00 0.00 N ATOM 1760 CZ ARG 1 108 -19.573 18.607 21.740 1.00 0.00 C ATOM 1761 NH1 ARG 1 108 -18.525 18.869 22.519 1.00 0.00 N ATOM 1762 NH2 ARG 1 108 -20.699 18.176 22.291 1.00 0.00 N ATOM 0 H ARG 1 108 -15.517 18.449 16.241 1.00 0.00 H new ATOM 0 HA ARG 1 108 -18.375 18.743 15.628 1.00 0.00 H new ATOM 0 HB2 ARG 1 108 -16.479 19.752 17.742 1.00 0.00 H new ATOM 0 HB3 ARG 1 108 -17.922 20.684 17.393 1.00 0.00 H new ATOM 0 HG2 ARG 1 108 -19.327 18.689 17.867 1.00 0.00 H new ATOM 0 HG3 ARG 1 108 -17.886 17.753 18.210 1.00 0.00 H new ATOM 0 HD2 ARG 1 108 -17.426 18.917 20.195 1.00 0.00 H new ATOM 0 HD3 ARG 1 108 -18.313 20.343 19.692 1.00 0.00 H new ATOM 0 HE ARG 1 108 -20.344 18.555 19.866 1.00 0.00 H new ATOM 0 HH11 ARG 1 108 -17.654 19.204 22.107 1.00 0.00 H new ATOM 0 HH12 ARG 1 108 -18.593 18.735 23.528 1.00 0.00 H new ATOM 0 HH21 ARG 1 108 -21.509 17.975 21.705 1.00 0.00 H new ATOM 0 HH22 ARG 1 108 -20.755 18.046 23.301 1.00 0.00 H new ATOM 1776 N THR 1 109 -18.281 20.730 14.174 1.00 0.00 N ATOM 1777 CA THR 1 109 -18.254 21.860 13.241 1.00 0.00 C ATOM 1778 C THR 1 109 -19.015 23.060 13.802 1.00 0.00 C ATOM 1779 O THR 1 109 -20.203 22.954 14.121 1.00 0.00 O ATOM 1780 CB THR 1 109 -18.857 21.487 11.868 1.00 0.00 C ATOM 1781 OG1 THR 1 109 -20.114 20.821 12.045 1.00 0.00 O ATOM 1782 CG2 THR 1 109 -17.911 20.594 11.073 1.00 0.00 C ATOM 0 H THR 1 109 -19.150 20.196 14.157 1.00 0.00 H new ATOM 0 HA THR 1 109 -17.205 22.123 13.108 1.00 0.00 H new ATOM 0 HB THR 1 109 -19.010 22.410 11.308 1.00 0.00 H new ATOM 0 HG1 THR 1 109 -20.632 21.279 12.740 1.00 0.00 H new ATOM 0 HG21 THR 1 109 -18.364 20.349 10.112 1.00 0.00 H new ATOM 0 HG22 THR 1 109 -16.969 21.118 10.908 1.00 0.00 H new ATOM 0 HG23 THR 1 109 -17.723 19.676 11.630 1.00 0.00 H new ATOM 1790 N LYS 1 110 -18.315 24.195 13.920 1.00 0.00 N ATOM 1791 CA LYS 1 110 -18.900 25.429 14.430 1.00 0.00 C ATOM 1792 C LYS 1 110 -19.475 26.279 13.298 1.00 0.00 C ATOM 1793 O LYS 1 110 -18.930 26.300 12.191 1.00 0.00 O ATOM 1794 CB LYS 1 110 -17.860 26.239 15.210 1.00 0.00 C ATOM 1795 CG LYS 1 110 -17.604 25.721 16.617 1.00 0.00 C ATOM 1796 CD LYS 1 110 -16.602 26.595 17.356 1.00 0.00 C ATOM 1797 CE LYS 1 110 -16.430 26.151 18.800 1.00 0.00 C ATOM 1798 NZ LYS 1 110 -15.446 27.000 19.528 1.00 0.00 N ATOM 0 H LYS 1 110 -17.331 24.278 13.664 1.00 0.00 H new ATOM 0 HA LYS 1 110 -19.713 25.153 15.102 1.00 0.00 H new ATOM 0 HB2 LYS 1 110 -16.921 26.236 14.656 1.00 0.00 H new ATOM 0 HB3 LYS 1 110 -18.191 27.276 15.270 1.00 0.00 H new ATOM 0 HG2 LYS 1 110 -18.542 25.691 17.172 1.00 0.00 H new ATOM 0 HG3 LYS 1 110 -17.230 24.698 16.568 1.00 0.00 H new ATOM 0 HD2 LYS 1 110 -15.639 26.557 16.846 1.00 0.00 H new ATOM 0 HD3 LYS 1 110 -16.935 27.633 17.331 1.00 0.00 H new ATOM 0 HE2 LYS 1 110 -17.393 26.192 19.310 1.00 0.00 H new ATOM 0 HE3 LYS 1 110 -16.101 25.112 18.824 1.00 0.00 H new ATOM 0 HZ1 LYS 1 110 -15.357 26.665 20.509 1.00 0.00 H new ATOM 0 HZ2 LYS 1 110 -14.521 26.941 19.057 1.00 0.00 H new ATOM 0 HZ3 LYS 1 110 -15.772 27.988 19.528 1.00 0.00 H new ATOM 1812 N LYS 1 111 -20.580 26.978 13.593 1.00 0.00 N ATOM 1813 CA LYS 1 111 -21.251 27.839 12.624 1.00 0.00 C ATOM 1814 C LYS 1 111 -20.624 29.235 12.585 1.00 0.00 C ATOM 1815 O LYS 1 111 -20.642 29.929 13.626 1.00 0.00 O ATOM 1816 CB LYS 1 111 -22.747 27.938 12.946 1.00 0.00 C ATOM 1817 CG LYS 1 111 -23.558 26.745 12.464 1.00 0.00 C ATOM 1818 CD LYS 1 111 -24.988 26.799 12.977 1.00 0.00 C ATOM 1819 CE LYS 1 111 -25.863 25.752 12.306 1.00 0.00 C ATOM 1820 NZ LYS 1 111 -27.223 25.694 12.908 1.00 0.00 N ATOM 1821 OXT LYS 1 111 -20.118 29.623 11.511 1.00 0.00 O ATOM 0 H LYS 1 111 -21.028 26.959 14.509 1.00 0.00 H new ATOM 0 HA LYS 1 111 -21.128 27.390 11.639 1.00 0.00 H new ATOM 0 HB2 LYS 1 111 -22.871 28.038 14.024 1.00 0.00 H new ATOM 0 HB3 LYS 1 111 -23.148 28.845 12.493 1.00 0.00 H new ATOM 0 HG2 LYS 1 111 -23.562 26.723 11.374 1.00 0.00 H new ATOM 0 HG3 LYS 1 111 -23.085 25.822 12.800 1.00 0.00 H new ATOM 0 HD2 LYS 1 111 -24.994 26.642 14.056 1.00 0.00 H new ATOM 0 HD3 LYS 1 111 -25.403 27.791 12.796 1.00 0.00 H new ATOM 0 HE2 LYS 1 111 -25.946 25.976 11.243 1.00 0.00 H new ATOM 0 HE3 LYS 1 111 -25.388 24.775 12.389 1.00 0.00 H new ATOM 0 HZ1 LYS 1 111 -27.787 24.968 12.422 1.00 0.00 H new ATOM 0 HZ2 LYS 1 111 -27.146 25.455 13.917 1.00 0.00 H new ATOM 0 HZ3 LYS 1 111 -27.687 26.619 12.806 1.00 0.00 H new TER 1835 LYS 1 111