USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 882 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 168:sc= -0.0358 (180deg=-0.0784) USER MOD Single : A 1 MET N :NH3+ -100:sc= 0.0841 (180deg=-0.0801) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0.113 USER MOD Single : A 8 SER OG : rot -38:sc= 1.07 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0.0196 X(o=0.02,f=0) USER MOD Single : A 19 LYS NZ :NH3+ -166:sc= -0.0205 (180deg=-0.186) USER MOD Single : A 21 ASN : amide:sc=-0.00924 X(o=-0.0092,f=0) USER MOD Single : A 22 THR OG1 : rot -170:sc= 0.0378 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot -18:sc= 0.929! USER MOD Single : A 26 SER OG : rot -68:sc= 1.14 USER MOD Single : A 28 MET CE :methyl 148:sc= -1.71 (180deg=-3.32!) USER MOD Single : A 31 SER OG : rot 180:sc= 0.00238 USER MOD Single : A 34 SER OG : rot -104:sc= 0.723 USER MOD Single : A 36 HIS : no HD1:sc= -1.12 X(o=-1.1,f=-1.2) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 HIS : no HD1:sc= -2.31 K(o=-2.3,f=-2.9!) USER MOD Single : A 59 CYS SG : rot 180:sc= -2.68! USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.209 K(o=-0.21,f=-2.5!) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.0064) USER MOD Single : A 71 THR OG1 : rot 69:sc= 1.12 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -48.628 -21.610 -24.983 1.00 0.00 N ATOM 2 CA MET A 1 -47.431 -21.419 -25.849 1.00 0.00 C ATOM 3 C MET A 1 -46.945 -22.779 -26.355 1.00 0.00 C ATOM 4 O MET A 1 -47.214 -23.804 -25.762 1.00 0.00 O ATOM 5 CB MET A 1 -46.319 -20.747 -25.041 1.00 0.00 C ATOM 6 CG MET A 1 -46.598 -19.247 -24.938 1.00 0.00 C ATOM 7 SD MET A 1 -46.012 -18.421 -26.439 1.00 0.00 S ATOM 8 CE MET A 1 -47.622 -17.828 -27.016 1.00 0.00 C ATOM 0 H1 MET A 1 -49.488 -21.403 -25.529 1.00 0.00 H new ATOM 0 H2 MET A 1 -48.660 -22.593 -24.646 1.00 0.00 H new ATOM 0 H3 MET A 1 -48.573 -20.967 -24.168 1.00 0.00 H new ATOM 0 HA MET A 1 -47.694 -20.789 -26.699 1.00 0.00 H new ATOM 0 HB2 MET A 1 -46.262 -21.186 -24.045 1.00 0.00 H new ATOM 0 HB3 MET A 1 -45.354 -20.916 -25.519 1.00 0.00 H new ATOM 0 HG2 MET A 1 -47.666 -19.073 -24.807 1.00 0.00 H new ATOM 0 HG3 MET A 1 -46.098 -18.832 -24.063 1.00 0.00 H new ATOM 0 HE1 MET A 1 -47.477 -17.107 -27.821 1.00 0.00 H new ATOM 0 HE2 MET A 1 -48.209 -18.669 -27.384 1.00 0.00 H new ATOM 0 HE3 MET A 1 -48.150 -17.349 -26.191 1.00 0.00 H new ATOM 20 N THR A 2 -46.230 -22.795 -27.448 1.00 0.00 N ATOM 21 CA THR A 2 -45.729 -24.088 -27.991 1.00 0.00 C ATOM 22 C THR A 2 -44.448 -23.844 -28.791 1.00 0.00 C ATOM 23 O THR A 2 -44.347 -24.210 -29.945 1.00 0.00 O ATOM 24 CB THR A 2 -46.790 -24.704 -28.906 1.00 0.00 C ATOM 25 OG1 THR A 2 -47.802 -23.742 -29.168 1.00 0.00 O ATOM 26 CG2 THR A 2 -47.410 -25.925 -28.224 1.00 0.00 C ATOM 0 H THR A 2 -45.972 -21.968 -27.987 1.00 0.00 H new ATOM 0 HA THR A 2 -45.519 -24.770 -27.167 1.00 0.00 H new ATOM 0 HB THR A 2 -46.327 -25.011 -29.844 1.00 0.00 H new ATOM 0 HG1 THR A 2 -48.482 -24.134 -29.755 1.00 0.00 H new ATOM 0 HG21 THR A 2 -48.165 -26.362 -28.877 1.00 0.00 H new ATOM 0 HG22 THR A 2 -46.633 -26.663 -28.023 1.00 0.00 H new ATOM 0 HG23 THR A 2 -47.874 -25.621 -27.286 1.00 0.00 H new ATOM 34 N VAL A 3 -43.469 -23.229 -28.187 1.00 0.00 N ATOM 35 CA VAL A 3 -42.195 -22.962 -28.910 1.00 0.00 C ATOM 36 C VAL A 3 -41.176 -24.049 -28.562 1.00 0.00 C ATOM 37 O VAL A 3 -41.518 -25.083 -28.023 1.00 0.00 O ATOM 38 CB VAL A 3 -41.646 -21.597 -28.493 1.00 0.00 C ATOM 39 CG1 VAL A 3 -42.746 -20.542 -28.621 1.00 0.00 C ATOM 40 CG2 VAL A 3 -41.172 -21.665 -27.039 1.00 0.00 C ATOM 0 H VAL A 3 -43.497 -22.899 -27.222 1.00 0.00 H new ATOM 0 HA VAL A 3 -42.380 -22.965 -29.984 1.00 0.00 H new ATOM 0 HB VAL A 3 -40.810 -21.328 -29.139 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -42.354 -19.569 -28.324 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -43.086 -20.495 -29.655 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -43.583 -20.809 -27.975 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -40.780 -20.693 -26.738 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -42.010 -21.933 -26.395 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -40.388 -22.417 -26.947 1.00 0.00 H new ATOM 50 N ILE A 4 -39.928 -23.827 -28.867 1.00 0.00 N ATOM 51 CA ILE A 4 -38.893 -24.850 -28.552 1.00 0.00 C ATOM 52 C ILE A 4 -37.944 -24.309 -27.481 1.00 0.00 C ATOM 53 O ILE A 4 -36.832 -23.913 -27.767 1.00 0.00 O ATOM 54 CB ILE A 4 -38.097 -25.176 -29.817 1.00 0.00 C ATOM 55 CG1 ILE A 4 -39.065 -25.545 -30.944 1.00 0.00 C ATOM 56 CG2 ILE A 4 -37.163 -26.355 -29.542 1.00 0.00 C ATOM 57 CD1 ILE A 4 -38.284 -25.735 -32.246 1.00 0.00 C ATOM 0 H ILE A 4 -39.580 -22.982 -29.320 1.00 0.00 H new ATOM 0 HA ILE A 4 -39.379 -25.753 -28.183 1.00 0.00 H new ATOM 0 HB ILE A 4 -37.508 -24.307 -30.111 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -39.601 -26.460 -30.692 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -39.812 -24.761 -31.067 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -36.596 -26.588 -30.443 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -36.475 -26.094 -28.737 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -37.751 -27.225 -29.249 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -38.973 -25.998 -33.049 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -37.768 -24.809 -32.499 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -37.554 -26.534 -32.119 1.00 0.00 H new ATOM 69 N LYS A 5 -38.373 -24.290 -26.248 1.00 0.00 N ATOM 70 CA LYS A 5 -37.487 -23.777 -25.166 1.00 0.00 C ATOM 71 C LYS A 5 -36.111 -24.439 -25.287 1.00 0.00 C ATOM 72 O LYS A 5 -35.996 -25.536 -25.797 1.00 0.00 O ATOM 73 CB LYS A 5 -38.100 -24.106 -23.803 1.00 0.00 C ATOM 74 CG LYS A 5 -38.776 -22.858 -23.231 1.00 0.00 C ATOM 75 CD LYS A 5 -38.316 -22.640 -21.787 1.00 0.00 C ATOM 76 CE LYS A 5 -39.448 -23.017 -20.829 1.00 0.00 C ATOM 77 NZ LYS A 5 -39.368 -22.168 -19.607 1.00 0.00 N ATOM 0 H LYS A 5 -39.294 -24.606 -25.945 1.00 0.00 H new ATOM 0 HA LYS A 5 -37.381 -22.696 -25.259 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -38.827 -24.912 -23.905 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -37.327 -24.459 -23.120 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -38.527 -21.987 -23.838 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -39.860 -22.971 -23.265 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -37.433 -23.245 -21.580 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -38.031 -21.599 -21.638 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -40.413 -22.880 -21.317 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -39.374 -24.070 -20.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -40.137 -22.424 -18.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -38.452 -22.320 -19.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -39.459 -21.167 -19.873 1.00 0.00 H new ATOM 91 N PRO A 6 -35.106 -23.747 -24.815 1.00 0.00 N ATOM 92 CA PRO A 6 -33.717 -24.237 -24.857 1.00 0.00 C ATOM 93 C PRO A 6 -33.486 -25.285 -23.766 1.00 0.00 C ATOM 94 O PRO A 6 -32.888 -25.013 -22.744 1.00 0.00 O ATOM 95 CB PRO A 6 -32.885 -22.978 -24.596 1.00 0.00 C ATOM 96 CG PRO A 6 -33.819 -21.980 -23.873 1.00 0.00 C ATOM 97 CD PRO A 6 -35.261 -22.416 -24.194 1.00 0.00 C ATOM 0 HA PRO A 6 -33.460 -24.722 -25.799 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -32.014 -23.208 -23.983 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -32.515 -22.556 -25.531 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -33.641 -21.992 -22.798 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -33.637 -20.961 -24.215 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -35.872 -22.465 -23.293 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -35.748 -21.714 -24.871 1.00 0.00 H new ATOM 105 N SER A 7 -33.956 -26.485 -23.977 1.00 0.00 N ATOM 106 CA SER A 7 -33.761 -27.552 -22.951 1.00 0.00 C ATOM 107 C SER A 7 -32.265 -27.786 -22.742 1.00 0.00 C ATOM 108 O SER A 7 -31.446 -27.398 -23.551 1.00 0.00 O ATOM 109 CB SER A 7 -34.419 -28.854 -23.419 1.00 0.00 C ATOM 110 OG SER A 7 -34.942 -28.682 -24.729 1.00 0.00 O ATOM 0 H SER A 7 -34.465 -26.773 -24.813 1.00 0.00 H new ATOM 0 HA SER A 7 -34.219 -27.236 -22.014 1.00 0.00 H new ATOM 0 HB2 SER A 7 -33.690 -29.664 -23.411 1.00 0.00 H new ATOM 0 HB3 SER A 7 -35.217 -29.137 -22.733 1.00 0.00 H new ATOM 0 HG SER A 7 -35.361 -29.517 -25.026 1.00 0.00 H new ATOM 116 N SER A 8 -31.901 -28.418 -21.661 1.00 0.00 N ATOM 117 CA SER A 8 -30.457 -28.676 -21.400 1.00 0.00 C ATOM 118 C SER A 8 -30.100 -30.087 -21.871 1.00 0.00 C ATOM 119 O SER A 8 -29.132 -30.673 -21.428 1.00 0.00 O ATOM 120 CB SER A 8 -30.182 -28.550 -19.901 1.00 0.00 C ATOM 121 OG SER A 8 -28.799 -28.762 -19.657 1.00 0.00 O ATOM 0 H SER A 8 -32.541 -28.767 -20.947 1.00 0.00 H new ATOM 0 HA SER A 8 -29.851 -27.950 -21.942 1.00 0.00 H new ATOM 0 HB2 SER A 8 -30.478 -27.562 -19.547 1.00 0.00 H new ATOM 0 HB3 SER A 8 -30.776 -29.278 -19.348 1.00 0.00 H new ATOM 0 HG SER A 8 -28.466 -29.465 -20.253 1.00 0.00 H new ATOM 127 N ARG A 9 -30.876 -30.639 -22.764 1.00 0.00 N ATOM 128 CA ARG A 9 -30.583 -32.014 -23.262 1.00 0.00 C ATOM 129 C ARG A 9 -29.429 -31.970 -24.271 1.00 0.00 C ATOM 130 O ARG A 9 -28.456 -32.683 -24.124 1.00 0.00 O ATOM 131 CB ARG A 9 -31.829 -32.592 -23.935 1.00 0.00 C ATOM 132 CG ARG A 9 -32.201 -33.916 -23.265 1.00 0.00 C ATOM 133 CD ARG A 9 -31.302 -35.031 -23.803 1.00 0.00 C ATOM 134 NE ARG A 9 -32.120 -36.251 -24.053 1.00 0.00 N ATOM 135 CZ ARG A 9 -31.743 -37.116 -24.954 1.00 0.00 C ATOM 136 NH1 ARG A 9 -31.413 -36.710 -26.150 1.00 0.00 N ATOM 137 NH2 ARG A 9 -31.696 -38.387 -24.661 1.00 0.00 N ATOM 0 H ARG A 9 -31.701 -30.197 -23.171 1.00 0.00 H new ATOM 0 HA ARG A 9 -30.298 -32.645 -22.420 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -32.657 -31.888 -23.858 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -31.642 -32.749 -24.997 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -32.088 -33.833 -22.184 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -33.247 -34.153 -23.459 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -30.818 -34.709 -24.725 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -30.510 -35.251 -23.087 1.00 0.00 H new ATOM 0 HE ARG A 9 -32.975 -36.410 -23.520 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -31.450 -35.717 -26.380 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -31.118 -37.386 -26.855 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -31.954 -38.705 -23.727 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -31.401 -39.062 -25.366 1.00 0.00 H new ATOM 151 N PRO A 10 -29.571 -31.133 -25.269 1.00 0.00 N ATOM 152 CA PRO A 10 -28.550 -30.980 -26.322 1.00 0.00 C ATOM 153 C PRO A 10 -27.383 -30.128 -25.813 1.00 0.00 C ATOM 154 O PRO A 10 -27.570 -29.176 -25.081 1.00 0.00 O ATOM 155 CB PRO A 10 -29.301 -30.270 -27.451 1.00 0.00 C ATOM 156 CG PRO A 10 -30.510 -29.562 -26.794 1.00 0.00 C ATOM 157 CD PRO A 10 -30.753 -30.265 -25.445 1.00 0.00 C ATOM 0 HA PRO A 10 -28.115 -31.927 -26.641 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -28.656 -29.550 -27.954 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -29.632 -30.983 -28.206 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -30.305 -28.502 -26.647 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -31.392 -29.631 -27.431 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -30.843 -29.545 -24.632 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -31.675 -30.846 -25.459 1.00 0.00 H new ATOM 165 N ARG A 11 -26.181 -30.465 -26.193 1.00 0.00 N ATOM 166 CA ARG A 11 -25.004 -29.679 -25.727 1.00 0.00 C ATOM 167 C ARG A 11 -24.998 -29.637 -24.196 1.00 0.00 C ATOM 168 O ARG A 11 -25.271 -28.612 -23.603 1.00 0.00 O ATOM 169 CB ARG A 11 -25.089 -28.253 -26.278 1.00 0.00 C ATOM 170 CG ARG A 11 -23.844 -27.470 -25.856 1.00 0.00 C ATOM 171 CD ARG A 11 -23.143 -26.912 -27.097 1.00 0.00 C ATOM 172 NE ARG A 11 -22.682 -28.039 -27.956 1.00 0.00 N ATOM 173 CZ ARG A 11 -22.236 -27.801 -29.160 1.00 0.00 C ATOM 174 NH1 ARG A 11 -20.991 -27.450 -29.336 1.00 0.00 N ATOM 175 NH2 ARG A 11 -23.034 -27.913 -30.186 1.00 0.00 N ATOM 0 H ARG A 11 -25.963 -31.251 -26.806 1.00 0.00 H new ATOM 0 HA ARG A 11 -24.087 -30.149 -26.083 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -25.167 -28.275 -27.365 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -25.986 -27.760 -25.904 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -24.123 -26.656 -25.187 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -23.165 -28.118 -25.303 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -23.825 -26.270 -27.655 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -22.294 -26.295 -26.802 1.00 0.00 H new ATOM 0 HE ARG A 11 -22.715 -28.996 -27.604 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -20.368 -27.362 -28.533 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -20.642 -27.264 -30.276 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -24.007 -28.187 -30.048 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -22.685 -27.727 -31.126 1.00 0.00 H new ATOM 189 N PRO A 12 -24.684 -30.761 -23.604 1.00 0.00 N ATOM 190 CA PRO A 12 -24.631 -30.900 -22.138 1.00 0.00 C ATOM 191 C PRO A 12 -23.338 -30.290 -21.587 1.00 0.00 C ATOM 192 O PRO A 12 -22.285 -30.400 -22.183 1.00 0.00 O ATOM 193 CB PRO A 12 -24.658 -32.416 -21.921 1.00 0.00 C ATOM 194 CG PRO A 12 -24.160 -33.055 -23.240 1.00 0.00 C ATOM 195 CD PRO A 12 -24.354 -31.998 -24.342 1.00 0.00 C ATOM 0 HA PRO A 12 -25.447 -30.387 -21.629 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -24.018 -32.700 -21.086 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -25.665 -32.756 -21.681 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -23.112 -33.343 -23.159 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -24.722 -33.960 -23.468 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -23.451 -31.876 -24.940 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -25.154 -32.279 -25.027 1.00 0.00 H new ATOM 203 N ARG A 13 -23.411 -29.646 -20.454 1.00 0.00 N ATOM 204 CA ARG A 13 -22.187 -29.029 -19.867 1.00 0.00 C ATOM 205 C ARG A 13 -21.058 -30.063 -19.846 1.00 0.00 C ATOM 206 O ARG A 13 -21.276 -31.227 -19.575 1.00 0.00 O ATOM 207 CB ARG A 13 -22.484 -28.565 -18.439 1.00 0.00 C ATOM 208 CG ARG A 13 -23.714 -27.655 -18.444 1.00 0.00 C ATOM 209 CD ARG A 13 -23.834 -26.948 -17.093 1.00 0.00 C ATOM 210 NE ARG A 13 -22.935 -25.760 -17.070 1.00 0.00 N ATOM 211 CZ ARG A 13 -22.924 -24.931 -18.078 1.00 0.00 C ATOM 212 NH1 ARG A 13 -23.758 -23.928 -18.107 1.00 0.00 N ATOM 213 NH2 ARG A 13 -22.078 -25.105 -19.056 1.00 0.00 N ATOM 0 H ARG A 13 -24.264 -29.520 -19.910 1.00 0.00 H new ATOM 0 HA ARG A 13 -21.885 -28.173 -20.470 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -22.658 -29.426 -17.794 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -21.625 -28.031 -18.033 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -23.632 -26.920 -19.245 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -24.612 -28.241 -18.640 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -24.866 -26.640 -16.923 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -23.569 -27.633 -16.288 1.00 0.00 H new ATOM 0 HE ARG A 13 -22.328 -25.595 -16.267 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -24.419 -23.792 -17.342 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -23.749 -23.280 -18.895 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -21.426 -25.889 -19.033 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -22.069 -24.457 -19.844 1.00 0.00 H new ATOM 227 N LYS A 14 -19.854 -29.647 -20.130 1.00 0.00 N ATOM 228 CA LYS A 14 -18.715 -30.608 -20.127 1.00 0.00 C ATOM 229 C LYS A 14 -17.894 -30.427 -18.850 1.00 0.00 C ATOM 230 O LYS A 14 -17.623 -31.373 -18.137 1.00 0.00 O ATOM 231 CB LYS A 14 -17.827 -30.349 -21.345 1.00 0.00 C ATOM 232 CG LYS A 14 -18.129 -31.388 -22.424 1.00 0.00 C ATOM 233 CD LYS A 14 -17.364 -32.677 -22.118 1.00 0.00 C ATOM 234 CE LYS A 14 -17.260 -33.524 -23.388 1.00 0.00 C ATOM 235 NZ LYS A 14 -16.058 -33.107 -24.165 1.00 0.00 N ATOM 0 H LYS A 14 -19.610 -28.685 -20.364 1.00 0.00 H new ATOM 0 HA LYS A 14 -19.101 -31.627 -20.167 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -18.005 -29.345 -21.731 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.776 -30.400 -21.060 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -19.200 -31.588 -22.462 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -17.841 -31.005 -23.403 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.368 -32.441 -21.743 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -17.874 -33.238 -21.335 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -17.190 -34.580 -23.129 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -18.158 -33.403 -23.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.986 -33.682 -25.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -16.143 -32.103 -24.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -15.205 -33.244 -23.586 1.00 0.00 H new ATOM 249 N ASN A 15 -17.494 -29.220 -18.552 1.00 0.00 N ATOM 250 CA ASN A 15 -16.691 -28.989 -17.319 1.00 0.00 C ATOM 251 C ASN A 15 -16.585 -27.486 -17.045 1.00 0.00 C ATOM 252 O ASN A 15 -16.699 -27.043 -15.920 1.00 0.00 O ATOM 253 CB ASN A 15 -15.289 -29.572 -17.507 1.00 0.00 C ATOM 254 CG ASN A 15 -14.990 -30.561 -16.378 1.00 0.00 C ATOM 255 OD1 ASN A 15 -15.092 -31.757 -16.560 1.00 0.00 O ATOM 256 ND2 ASN A 15 -14.624 -30.107 -15.210 1.00 0.00 N ATOM 0 H ASN A 15 -17.688 -28.387 -19.108 1.00 0.00 H new ATOM 0 HA ASN A 15 -17.179 -29.476 -16.475 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -15.219 -30.074 -18.472 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -14.549 -28.772 -17.509 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -14.424 -30.757 -14.450 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -14.538 -29.102 -15.057 1.00 0.00 H new ATOM 263 N LYS A 16 -16.364 -26.697 -18.063 1.00 0.00 N ATOM 264 CA LYS A 16 -16.247 -25.227 -17.849 1.00 0.00 C ATOM 265 C LYS A 16 -17.193 -24.486 -18.800 1.00 0.00 C ATOM 266 O LYS A 16 -18.358 -24.297 -18.507 1.00 0.00 O ATOM 267 CB LYS A 16 -14.804 -24.787 -18.114 1.00 0.00 C ATOM 268 CG LYS A 16 -13.920 -25.198 -16.936 1.00 0.00 C ATOM 269 CD LYS A 16 -12.685 -24.296 -16.884 1.00 0.00 C ATOM 270 CE LYS A 16 -11.421 -25.158 -16.850 1.00 0.00 C ATOM 271 NZ LYS A 16 -10.426 -24.545 -15.926 1.00 0.00 N ATOM 0 H LYS A 16 -16.260 -27.006 -19.029 1.00 0.00 H new ATOM 0 HA LYS A 16 -16.517 -24.990 -16.820 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -14.437 -25.242 -19.034 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -14.762 -23.707 -18.254 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -14.479 -25.120 -16.004 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -13.618 -26.240 -17.041 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -12.666 -23.638 -17.753 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -12.726 -23.657 -16.002 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -11.665 -26.168 -16.520 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -10.999 -25.243 -17.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -9.567 -25.131 -15.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -10.185 -23.590 -16.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -10.831 -24.486 -14.970 1.00 0.00 H new ATOM 285 N ASN A 17 -16.704 -24.060 -19.934 1.00 0.00 N ATOM 286 CA ASN A 17 -17.578 -23.329 -20.895 1.00 0.00 C ATOM 287 C ASN A 17 -16.855 -23.195 -22.238 1.00 0.00 C ATOM 288 O ASN A 17 -17.223 -23.814 -23.216 1.00 0.00 O ATOM 289 CB ASN A 17 -17.888 -21.936 -20.343 1.00 0.00 C ATOM 290 CG ASN A 17 -19.371 -21.623 -20.547 1.00 0.00 C ATOM 291 OD1 ASN A 17 -19.738 -20.955 -21.493 1.00 0.00 O ATOM 292 ND2 ASN A 17 -20.246 -22.078 -19.692 1.00 0.00 N ATOM 0 H ASN A 17 -15.738 -24.187 -20.236 1.00 0.00 H new ATOM 0 HA ASN A 17 -18.508 -23.880 -21.034 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -17.638 -21.890 -19.283 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -17.275 -21.189 -20.848 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -21.237 -21.873 -19.818 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -19.939 -22.639 -18.897 1.00 0.00 H new ATOM 299 N ILE A 18 -15.826 -22.393 -22.293 1.00 0.00 N ATOM 300 CA ILE A 18 -15.081 -22.222 -23.572 1.00 0.00 C ATOM 301 C ILE A 18 -13.597 -22.514 -23.341 1.00 0.00 C ATOM 302 O ILE A 18 -12.977 -21.961 -22.454 1.00 0.00 O ATOM 303 CB ILE A 18 -15.248 -20.787 -24.072 1.00 0.00 C ATOM 304 CG1 ILE A 18 -14.426 -20.596 -25.351 1.00 0.00 C ATOM 305 CG2 ILE A 18 -14.755 -19.812 -23.002 1.00 0.00 C ATOM 306 CD1 ILE A 18 -14.880 -19.324 -26.067 1.00 0.00 C ATOM 0 H ILE A 18 -15.470 -21.849 -21.507 1.00 0.00 H new ATOM 0 HA ILE A 18 -15.475 -22.913 -24.317 1.00 0.00 H new ATOM 0 HB ILE A 18 -16.300 -20.595 -24.281 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -13.366 -20.530 -25.107 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -14.549 -21.458 -26.007 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -14.874 -18.789 -23.359 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -15.336 -19.948 -22.090 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -13.702 -20.003 -22.793 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -14.294 -19.190 -26.976 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -15.936 -19.408 -26.324 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -14.734 -18.466 -25.411 1.00 0.00 H new ATOM 318 N LYS A 19 -13.023 -23.378 -24.133 1.00 0.00 N ATOM 319 CA LYS A 19 -11.579 -23.705 -23.960 1.00 0.00 C ATOM 320 C LYS A 19 -10.786 -23.157 -25.148 1.00 0.00 C ATOM 321 O LYS A 19 -11.294 -23.037 -26.244 1.00 0.00 O ATOM 322 CB LYS A 19 -11.408 -25.225 -23.890 1.00 0.00 C ATOM 323 CG LYS A 19 -11.857 -25.727 -22.517 1.00 0.00 C ATOM 324 CD LYS A 19 -11.140 -27.039 -22.193 1.00 0.00 C ATOM 325 CE LYS A 19 -12.077 -27.951 -21.402 1.00 0.00 C ATOM 326 NZ LYS A 19 -12.015 -29.332 -21.957 1.00 0.00 N ATOM 0 H LYS A 19 -13.492 -23.872 -24.893 1.00 0.00 H new ATOM 0 HA LYS A 19 -11.211 -23.253 -23.039 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -11.995 -25.704 -24.674 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -10.366 -25.493 -24.064 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -11.634 -24.981 -21.755 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -12.936 -25.879 -22.509 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -10.827 -27.532 -23.114 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -10.237 -26.839 -21.616 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -11.792 -27.958 -20.350 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -13.098 -27.573 -21.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -12.810 -29.891 -21.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -12.073 -29.292 -22.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -11.118 -29.779 -21.677 1.00 0.00 H new ATOM 340 N VAL A 20 -9.539 -22.824 -24.941 1.00 0.00 N ATOM 341 CA VAL A 20 -8.716 -22.286 -26.061 1.00 0.00 C ATOM 342 C VAL A 20 -7.292 -22.835 -25.959 1.00 0.00 C ATOM 343 O VAL A 20 -6.377 -22.331 -26.579 1.00 0.00 O ATOM 344 CB VAL A 20 -8.679 -20.758 -25.982 1.00 0.00 C ATOM 345 CG1 VAL A 20 -10.106 -20.209 -25.950 1.00 0.00 C ATOM 346 CG2 VAL A 20 -7.942 -20.335 -24.710 1.00 0.00 C ATOM 0 H VAL A 20 -9.057 -22.902 -24.046 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.156 -22.590 -27.011 1.00 0.00 H new ATOM 0 HB VAL A 20 -8.160 -20.362 -26.855 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.076 -19.121 -25.894 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -10.632 -20.511 -26.855 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -10.628 -20.603 -25.078 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -7.914 -19.247 -24.651 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -8.462 -20.733 -23.839 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.924 -20.724 -24.733 1.00 0.00 H new ATOM 356 N ASN A 21 -7.095 -23.864 -25.181 1.00 0.00 N ATOM 357 CA ASN A 21 -5.728 -24.441 -25.041 1.00 0.00 C ATOM 358 C ASN A 21 -5.748 -25.910 -25.467 1.00 0.00 C ATOM 359 O ASN A 21 -6.697 -26.383 -26.059 1.00 0.00 O ATOM 360 CB ASN A 21 -5.277 -24.339 -23.582 1.00 0.00 C ATOM 361 CG ASN A 21 -3.912 -23.651 -23.517 1.00 0.00 C ATOM 362 OD1 ASN A 21 -3.819 -22.447 -23.642 1.00 0.00 O ATOM 363 ND2 ASN A 21 -2.842 -24.373 -23.325 1.00 0.00 N ATOM 0 H ASN A 21 -7.821 -24.330 -24.637 1.00 0.00 H new ATOM 0 HA ASN A 21 -5.034 -23.888 -25.675 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -6.008 -23.775 -23.003 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -5.217 -25.333 -23.138 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -1.926 -23.926 -23.280 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -2.921 -25.384 -23.220 1.00 0.00 H new ATOM 370 N THR A 22 -4.704 -26.637 -25.170 1.00 0.00 N ATOM 371 CA THR A 22 -4.662 -28.075 -25.559 1.00 0.00 C ATOM 372 C THR A 22 -4.831 -28.949 -24.316 1.00 0.00 C ATOM 373 O THR A 22 -4.937 -28.459 -23.209 1.00 0.00 O ATOM 374 CB THR A 22 -3.317 -28.384 -26.219 1.00 0.00 C ATOM 375 OG1 THR A 22 -2.392 -27.350 -25.914 1.00 0.00 O ATOM 376 CG2 THR A 22 -3.498 -28.481 -27.733 1.00 0.00 C ATOM 0 H THR A 22 -3.879 -26.297 -24.675 1.00 0.00 H new ATOM 0 HA THR A 22 -5.470 -28.284 -26.260 1.00 0.00 H new ATOM 0 HB THR A 22 -2.937 -29.333 -25.841 1.00 0.00 H new ATOM 0 HG1 THR A 22 -1.585 -27.462 -26.459 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.538 -28.701 -28.201 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.206 -29.277 -27.965 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.879 -27.534 -28.115 1.00 0.00 H new ATOM 384 N TYR A 23 -4.854 -30.242 -24.490 1.00 0.00 N ATOM 385 CA TYR A 23 -5.012 -31.151 -23.321 1.00 0.00 C ATOM 386 C TYR A 23 -3.656 -31.768 -22.972 1.00 0.00 C ATOM 387 O TYR A 23 -3.553 -32.946 -22.689 1.00 0.00 O ATOM 388 CB TYR A 23 -6.004 -32.263 -23.668 1.00 0.00 C ATOM 389 CG TYR A 23 -7.271 -31.658 -24.222 1.00 0.00 C ATOM 390 CD1 TYR A 23 -7.341 -31.296 -25.573 1.00 0.00 C ATOM 391 CD2 TYR A 23 -8.377 -31.459 -23.385 1.00 0.00 C ATOM 392 CE1 TYR A 23 -8.518 -30.736 -26.088 1.00 0.00 C ATOM 393 CE2 TYR A 23 -9.553 -30.899 -23.900 1.00 0.00 C ATOM 394 CZ TYR A 23 -9.623 -30.537 -25.252 1.00 0.00 C ATOM 395 OH TYR A 23 -10.782 -29.986 -25.759 1.00 0.00 O ATOM 0 H TYR A 23 -4.770 -30.708 -25.393 1.00 0.00 H new ATOM 0 HA TYR A 23 -5.386 -30.585 -22.468 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -5.564 -32.942 -24.398 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -6.229 -32.853 -22.780 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -6.488 -31.448 -26.218 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -8.323 -31.737 -22.343 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.572 -30.458 -27.130 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -10.406 -30.746 -23.255 1.00 0.00 H new ATOM 0 HH TYR A 23 -11.451 -29.918 -25.046 1.00 0.00 H new ATOM 405 N ARG A 24 -2.613 -30.983 -22.991 1.00 0.00 N ATOM 406 CA ARG A 24 -1.264 -31.526 -22.663 1.00 0.00 C ATOM 407 C ARG A 24 -1.099 -31.606 -21.144 1.00 0.00 C ATOM 408 O ARG A 24 -1.222 -32.660 -20.551 1.00 0.00 O ATOM 409 CB ARG A 24 -0.189 -30.604 -23.244 1.00 0.00 C ATOM 410 CG ARG A 24 0.168 -31.065 -24.659 1.00 0.00 C ATOM 411 CD ARG A 24 1.399 -30.302 -25.150 1.00 0.00 C ATOM 412 NE ARG A 24 1.230 -28.849 -24.867 1.00 0.00 N ATOM 413 CZ ARG A 24 1.521 -27.967 -25.786 1.00 0.00 C ATOM 414 NH1 ARG A 24 2.509 -28.185 -26.612 1.00 0.00 N ATOM 415 NH2 ARG A 24 0.826 -26.867 -25.877 1.00 0.00 N ATOM 0 H ARG A 24 -2.637 -29.989 -23.219 1.00 0.00 H new ATOM 0 HA ARG A 24 -1.161 -32.523 -23.092 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -0.550 -29.576 -23.265 1.00 0.00 H new ATOM 0 HB3 ARG A 24 0.698 -30.618 -22.611 1.00 0.00 H new ATOM 0 HG2 ARG A 24 0.366 -32.137 -24.664 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -0.672 -30.892 -25.332 1.00 0.00 H new ATOM 0 HD2 ARG A 24 2.294 -30.678 -24.655 1.00 0.00 H new ATOM 0 HD3 ARG A 24 1.536 -30.461 -26.220 1.00 0.00 H new ATOM 0 HE ARG A 24 0.887 -28.543 -23.956 1.00 0.00 H new ATOM 0 HH11 ARG A 24 3.054 -29.044 -26.540 1.00 0.00 H new ATOM 0 HH12 ARG A 24 2.736 -27.496 -27.329 1.00 0.00 H new ATOM 0 HH21 ARG A 24 0.056 -26.696 -25.231 1.00 0.00 H new ATOM 0 HH22 ARG A 24 1.053 -26.178 -26.594 1.00 0.00 H new ATOM 429 N THR A 25 -0.820 -30.501 -20.510 1.00 0.00 N ATOM 430 CA THR A 25 -0.644 -30.515 -19.030 1.00 0.00 C ATOM 431 C THR A 25 -1.617 -29.520 -18.390 1.00 0.00 C ATOM 432 O THR A 25 -1.543 -28.329 -18.620 1.00 0.00 O ATOM 433 CB THR A 25 0.792 -30.118 -18.683 1.00 0.00 C ATOM 434 OG1 THR A 25 0.890 -28.702 -18.622 1.00 0.00 O ATOM 435 CG2 THR A 25 1.743 -30.651 -19.757 1.00 0.00 C ATOM 0 H THR A 25 -0.706 -29.589 -20.952 1.00 0.00 H new ATOM 0 HA THR A 25 -0.846 -31.516 -18.650 1.00 0.00 H new ATOM 0 HB THR A 25 1.063 -30.542 -17.716 1.00 0.00 H new ATOM 0 HG1 THR A 25 0.126 -28.301 -19.087 1.00 0.00 H new ATOM 0 HG21 THR A 25 2.766 -30.368 -19.510 1.00 0.00 H new ATOM 0 HG22 THR A 25 1.668 -31.737 -19.803 1.00 0.00 H new ATOM 0 HG23 THR A 25 1.473 -30.228 -20.724 1.00 0.00 H new ATOM 443 N SER A 26 -2.528 -30.000 -17.588 1.00 0.00 N ATOM 444 CA SER A 26 -3.504 -29.082 -16.933 1.00 0.00 C ATOM 445 C SER A 26 -2.768 -28.189 -15.932 1.00 0.00 C ATOM 446 O SER A 26 -2.587 -28.546 -14.784 1.00 0.00 O ATOM 447 CB SER A 26 -4.564 -29.905 -16.201 1.00 0.00 C ATOM 448 OG SER A 26 -4.928 -29.238 -14.999 1.00 0.00 O ATOM 0 H SER A 26 -2.639 -30.987 -17.358 1.00 0.00 H new ATOM 0 HA SER A 26 -3.985 -28.461 -17.689 1.00 0.00 H new ATOM 0 HB2 SER A 26 -5.440 -30.039 -16.836 1.00 0.00 H new ATOM 0 HB3 SER A 26 -4.178 -30.899 -15.976 1.00 0.00 H new ATOM 0 HG SER A 26 -4.174 -29.257 -14.373 1.00 0.00 H new ATOM 454 N ALA A 27 -2.340 -27.032 -16.356 1.00 0.00 N ATOM 455 CA ALA A 27 -1.615 -26.122 -15.425 1.00 0.00 C ATOM 456 C ALA A 27 -1.789 -24.672 -15.882 1.00 0.00 C ATOM 457 O ALA A 27 -1.281 -24.270 -16.909 1.00 0.00 O ATOM 458 CB ALA A 27 -0.127 -26.478 -15.423 1.00 0.00 C ATOM 0 H ALA A 27 -2.461 -26.678 -17.305 1.00 0.00 H new ATOM 0 HA ALA A 27 -2.021 -26.236 -14.420 1.00 0.00 H new ATOM 0 HB1 ALA A 27 0.405 -25.813 -14.742 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -0.000 -27.510 -15.096 1.00 0.00 H new ATOM 0 HB3 ALA A 27 0.276 -26.365 -16.430 1.00 0.00 H new ATOM 464 N MET A 28 -2.500 -23.882 -15.124 1.00 0.00 N ATOM 465 CA MET A 28 -2.701 -22.457 -15.512 1.00 0.00 C ATOM 466 C MET A 28 -1.701 -21.583 -14.754 1.00 0.00 C ATOM 467 O MET A 28 -1.100 -20.683 -15.307 1.00 0.00 O ATOM 468 CB MET A 28 -4.128 -22.030 -15.161 1.00 0.00 C ATOM 469 CG MET A 28 -5.093 -22.555 -16.226 1.00 0.00 C ATOM 470 SD MET A 28 -5.184 -24.361 -16.120 1.00 0.00 S ATOM 471 CE MET A 28 -5.586 -24.463 -14.359 1.00 0.00 C ATOM 0 H MET A 28 -2.950 -24.162 -14.253 1.00 0.00 H new ATOM 0 HA MET A 28 -2.545 -22.342 -16.585 1.00 0.00 H new ATOM 0 HB2 MET A 28 -4.405 -22.418 -14.181 1.00 0.00 H new ATOM 0 HB3 MET A 28 -4.190 -20.943 -15.102 1.00 0.00 H new ATOM 0 HG2 MET A 28 -6.082 -22.121 -16.081 1.00 0.00 H new ATOM 0 HG3 MET A 28 -4.755 -22.255 -17.218 1.00 0.00 H new ATOM 0 HE1 MET A 28 -6.217 -25.333 -14.180 1.00 0.00 H new ATOM 0 HE2 MET A 28 -4.667 -24.556 -13.781 1.00 0.00 H new ATOM 0 HE3 MET A 28 -6.116 -23.561 -14.054 1.00 0.00 H new ATOM 481 N ASP A 29 -1.514 -21.849 -13.493 1.00 0.00 N ATOM 482 CA ASP A 29 -0.548 -21.047 -12.689 1.00 0.00 C ATOM 483 C ASP A 29 -0.826 -19.552 -12.871 1.00 0.00 C ATOM 484 O ASP A 29 -1.747 -19.158 -13.560 1.00 0.00 O ATOM 485 CB ASP A 29 0.876 -21.359 -13.152 1.00 0.00 C ATOM 486 CG ASP A 29 1.813 -21.372 -11.943 1.00 0.00 C ATOM 487 OD1 ASP A 29 1.338 -21.646 -10.853 1.00 0.00 O ATOM 488 OD2 ASP A 29 2.989 -21.105 -12.127 1.00 0.00 O ATOM 0 H ASP A 29 -1.990 -22.591 -12.980 1.00 0.00 H new ATOM 0 HA ASP A 29 -0.659 -21.304 -11.636 1.00 0.00 H new ATOM 0 HB2 ASP A 29 0.903 -22.325 -13.657 1.00 0.00 H new ATOM 0 HB3 ASP A 29 1.207 -20.613 -13.874 1.00 0.00 H new ATOM 493 N LEU A 30 -0.032 -18.719 -12.254 1.00 0.00 N ATOM 494 CA LEU A 30 -0.237 -17.247 -12.382 1.00 0.00 C ATOM 495 C LEU A 30 1.088 -16.530 -12.104 1.00 0.00 C ATOM 496 O LEU A 30 1.499 -16.383 -10.970 1.00 0.00 O ATOM 497 CB LEU A 30 -1.293 -16.788 -11.370 1.00 0.00 C ATOM 498 CG LEU A 30 -1.236 -15.266 -11.212 1.00 0.00 C ATOM 499 CD1 LEU A 30 -1.174 -14.606 -12.591 1.00 0.00 C ATOM 500 CD2 LEU A 30 -2.487 -14.782 -10.474 1.00 0.00 C ATOM 0 H LEU A 30 0.753 -18.996 -11.664 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.578 -17.009 -13.390 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.285 -17.091 -11.704 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.120 -17.269 -10.407 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.347 -14.997 -10.641 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -1.134 -13.523 -12.475 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -0.283 -14.948 -13.118 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -2.061 -14.876 -13.164 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.447 -13.699 -10.361 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.375 -15.055 -11.045 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -2.532 -15.248 -9.489 1.00 0.00 H new ATOM 512 N SER A 31 1.759 -16.082 -13.130 1.00 0.00 N ATOM 513 CA SER A 31 3.055 -15.376 -12.920 1.00 0.00 C ATOM 514 C SER A 31 2.920 -13.917 -13.364 1.00 0.00 C ATOM 515 O SER A 31 2.059 -13.588 -14.156 1.00 0.00 O ATOM 516 CB SER A 31 4.148 -16.060 -13.742 1.00 0.00 C ATOM 517 OG SER A 31 3.546 -16.914 -14.705 1.00 0.00 O ATOM 0 H SER A 31 1.467 -16.174 -14.103 1.00 0.00 H new ATOM 0 HA SER A 31 3.320 -15.411 -11.863 1.00 0.00 H new ATOM 0 HB2 SER A 31 4.767 -15.313 -14.238 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.804 -16.635 -13.089 1.00 0.00 H new ATOM 0 HG SER A 31 4.244 -17.353 -15.235 1.00 0.00 H new ATOM 523 N PRO A 32 3.779 -13.083 -12.835 1.00 0.00 N ATOM 524 CA PRO A 32 3.789 -11.644 -13.152 1.00 0.00 C ATOM 525 C PRO A 32 4.440 -11.402 -14.517 1.00 0.00 C ATOM 526 O PRO A 32 5.234 -12.195 -14.985 1.00 0.00 O ATOM 527 CB PRO A 32 4.629 -11.034 -12.027 1.00 0.00 C ATOM 528 CG PRO A 32 5.509 -12.179 -11.470 1.00 0.00 C ATOM 529 CD PRO A 32 4.820 -13.497 -11.872 1.00 0.00 C ATOM 0 HA PRO A 32 2.791 -11.210 -13.213 1.00 0.00 H new ATOM 0 HB2 PRO A 32 5.246 -10.217 -12.402 1.00 0.00 H new ATOM 0 HB3 PRO A 32 3.991 -10.620 -11.247 1.00 0.00 H new ATOM 0 HG2 PRO A 32 6.517 -12.128 -11.881 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.602 -12.105 -10.386 1.00 0.00 H new ATOM 0 HD2 PRO A 32 5.526 -14.194 -12.324 1.00 0.00 H new ATOM 0 HD3 PRO A 32 4.386 -13.999 -11.008 1.00 0.00 H new ATOM 537 N GLY A 33 4.109 -10.317 -15.161 1.00 0.00 N ATOM 538 CA GLY A 33 4.707 -10.028 -16.495 1.00 0.00 C ATOM 539 C GLY A 33 3.819 -10.623 -17.589 1.00 0.00 C ATOM 540 O GLY A 33 4.258 -10.871 -18.693 1.00 0.00 O ATOM 0 H GLY A 33 3.450 -9.617 -14.821 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.805 -8.952 -16.636 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.710 -10.450 -16.555 1.00 0.00 H new ATOM 544 N SER A 34 2.570 -10.853 -17.288 1.00 0.00 N ATOM 545 CA SER A 34 1.653 -11.433 -18.309 1.00 0.00 C ATOM 546 C SER A 34 0.505 -10.458 -18.580 1.00 0.00 C ATOM 547 O SER A 34 0.152 -9.649 -17.742 1.00 0.00 O ATOM 548 CB SER A 34 1.084 -12.755 -17.792 1.00 0.00 C ATOM 549 OG SER A 34 0.668 -12.591 -16.442 1.00 0.00 O ATOM 0 H SER A 34 2.146 -10.664 -16.380 1.00 0.00 H new ATOM 0 HA SER A 34 2.206 -11.610 -19.232 1.00 0.00 H new ATOM 0 HB2 SER A 34 0.242 -13.068 -18.409 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.837 -13.540 -17.860 1.00 0.00 H new ATOM 0 HG SER A 34 1.322 -13.011 -15.845 1.00 0.00 H new ATOM 555 N VAL A 35 -0.083 -10.533 -19.741 1.00 0.00 N ATOM 556 CA VAL A 35 -1.211 -9.617 -20.070 1.00 0.00 C ATOM 557 C VAL A 35 -2.532 -10.371 -19.903 1.00 0.00 C ATOM 558 O VAL A 35 -2.689 -11.476 -20.385 1.00 0.00 O ATOM 559 CB VAL A 35 -1.076 -9.141 -21.516 1.00 0.00 C ATOM 560 CG1 VAL A 35 0.026 -8.085 -21.604 1.00 0.00 C ATOM 561 CG2 VAL A 35 -0.713 -10.329 -22.410 1.00 0.00 C ATOM 0 H VAL A 35 0.169 -11.191 -20.478 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.192 -8.755 -19.403 1.00 0.00 H new ATOM 0 HB VAL A 35 -2.021 -8.710 -21.847 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.123 -7.745 -22.635 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.229 -7.239 -20.966 1.00 0.00 H new ATOM 0 HG13 VAL A 35 0.971 -8.517 -21.274 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -0.616 -9.992 -23.442 1.00 0.00 H new ATOM 0 HG22 VAL A 35 0.232 -10.758 -22.078 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.496 -11.084 -22.347 1.00 0.00 H new ATOM 571 N HIS A 36 -3.484 -9.791 -19.224 1.00 0.00 N ATOM 572 CA HIS A 36 -4.787 -10.492 -19.035 1.00 0.00 C ATOM 573 C HIS A 36 -5.926 -9.474 -18.996 1.00 0.00 C ATOM 574 O HIS A 36 -5.707 -8.279 -18.969 1.00 0.00 O ATOM 575 CB HIS A 36 -4.762 -11.271 -17.717 1.00 0.00 C ATOM 576 CG HIS A 36 -5.296 -12.658 -17.947 1.00 0.00 C ATOM 577 ND1 HIS A 36 -6.549 -13.050 -17.504 1.00 0.00 N ATOM 578 CD2 HIS A 36 -4.761 -13.754 -18.576 1.00 0.00 C ATOM 579 CE1 HIS A 36 -6.725 -14.334 -17.869 1.00 0.00 C ATOM 580 NE2 HIS A 36 -5.665 -14.811 -18.525 1.00 0.00 N ATOM 0 H HIS A 36 -3.418 -8.868 -18.794 1.00 0.00 H new ATOM 0 HA HIS A 36 -4.945 -11.179 -19.866 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -3.744 -11.321 -17.330 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -5.363 -10.758 -16.967 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -3.786 -13.791 -19.040 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -7.615 -14.908 -17.657 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -5.544 -15.749 -18.907 1.00 0.00 H new ATOM 588 N GLU A 37 -7.145 -9.942 -18.986 1.00 0.00 N ATOM 589 CA GLU A 37 -8.302 -9.007 -18.941 1.00 0.00 C ATOM 590 C GLU A 37 -8.796 -8.900 -17.499 1.00 0.00 C ATOM 591 O GLU A 37 -8.537 -9.759 -16.680 1.00 0.00 O ATOM 592 CB GLU A 37 -9.429 -9.535 -19.832 1.00 0.00 C ATOM 593 CG GLU A 37 -9.905 -10.888 -19.306 1.00 0.00 C ATOM 594 CD GLU A 37 -9.142 -12.008 -20.014 1.00 0.00 C ATOM 595 OE1 GLU A 37 -9.086 -11.981 -21.232 1.00 0.00 O ATOM 596 OE2 GLU A 37 -8.627 -12.874 -19.326 1.00 0.00 O ATOM 0 H GLU A 37 -7.388 -10.932 -19.007 1.00 0.00 H new ATOM 0 HA GLU A 37 -7.995 -8.025 -19.301 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -10.257 -8.827 -19.846 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.078 -9.635 -20.859 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.745 -10.948 -18.230 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -10.976 -11.000 -19.475 1.00 0.00 H new ATOM 603 N GLY A 38 -9.492 -7.848 -17.177 1.00 0.00 N ATOM 604 CA GLY A 38 -9.985 -7.683 -15.782 1.00 0.00 C ATOM 605 C GLY A 38 -11.095 -6.633 -15.751 1.00 0.00 C ATOM 606 O GLY A 38 -11.424 -6.034 -16.754 1.00 0.00 O ATOM 0 H GLY A 38 -9.741 -7.095 -17.818 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -10.360 -8.634 -15.403 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.166 -7.380 -15.130 1.00 0.00 H new ATOM 610 N ILE A 39 -11.672 -6.406 -14.603 1.00 0.00 N ATOM 611 CA ILE A 39 -12.758 -5.394 -14.505 1.00 0.00 C ATOM 612 C ILE A 39 -12.148 -4.074 -14.037 1.00 0.00 C ATOM 613 O ILE A 39 -11.126 -4.056 -13.378 1.00 0.00 O ATOM 614 CB ILE A 39 -13.804 -5.868 -13.494 1.00 0.00 C ATOM 615 CG1 ILE A 39 -14.022 -7.374 -13.657 1.00 0.00 C ATOM 616 CG2 ILE A 39 -15.123 -5.134 -13.738 1.00 0.00 C ATOM 617 CD1 ILE A 39 -14.785 -7.915 -12.446 1.00 0.00 C ATOM 0 H ILE A 39 -11.438 -6.878 -13.730 1.00 0.00 H new ATOM 0 HA ILE A 39 -13.237 -5.259 -15.474 1.00 0.00 H new ATOM 0 HB ILE A 39 -13.454 -5.656 -12.484 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -14.581 -7.574 -14.571 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -13.063 -7.883 -13.752 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -15.867 -5.473 -13.017 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -14.969 -4.061 -13.623 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -15.475 -5.344 -14.748 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -14.940 -8.988 -12.563 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -14.209 -7.728 -11.540 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -15.751 -7.415 -12.371 1.00 0.00 H new ATOM 629 N VAL A 40 -12.740 -2.968 -14.390 1.00 0.00 N ATOM 630 CA VAL A 40 -12.154 -1.659 -13.980 1.00 0.00 C ATOM 631 C VAL A 40 -12.866 -1.111 -12.743 1.00 0.00 C ATOM 632 O VAL A 40 -14.040 -1.339 -12.530 1.00 0.00 O ATOM 633 CB VAL A 40 -12.294 -0.661 -15.130 1.00 0.00 C ATOM 634 CG1 VAL A 40 -11.529 0.619 -14.791 1.00 0.00 C ATOM 635 CG2 VAL A 40 -11.716 -1.278 -16.406 1.00 0.00 C ATOM 0 H VAL A 40 -13.597 -2.912 -14.940 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.101 -1.807 -13.739 1.00 0.00 H new ATOM 0 HB VAL A 40 -13.347 -0.423 -15.282 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -11.629 1.330 -15.611 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -11.937 1.056 -13.880 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -10.475 0.384 -14.641 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -11.814 -0.570 -17.229 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -10.663 -1.512 -16.252 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.260 -2.192 -16.647 1.00 0.00 H new ATOM 645 N TYR A 41 -12.154 -0.381 -11.930 1.00 0.00 N ATOM 646 CA TYR A 41 -12.766 0.201 -10.705 1.00 0.00 C ATOM 647 C TYR A 41 -12.046 1.508 -10.364 1.00 0.00 C ATOM 648 O TYR A 41 -10.835 1.571 -10.354 1.00 0.00 O ATOM 649 CB TYR A 41 -12.616 -0.784 -9.545 1.00 0.00 C ATOM 650 CG TYR A 41 -13.928 -0.901 -8.809 1.00 0.00 C ATOM 651 CD1 TYR A 41 -15.094 -1.241 -9.506 1.00 0.00 C ATOM 652 CD2 TYR A 41 -13.978 -0.673 -7.427 1.00 0.00 C ATOM 653 CE1 TYR A 41 -16.312 -1.352 -8.821 1.00 0.00 C ATOM 654 CE2 TYR A 41 -15.196 -0.785 -6.743 1.00 0.00 C ATOM 655 CZ TYR A 41 -16.363 -1.125 -7.441 1.00 0.00 C ATOM 656 OH TYR A 41 -17.561 -1.235 -6.765 1.00 0.00 O ATOM 0 H TYR A 41 -11.167 -0.162 -12.064 1.00 0.00 H new ATOM 0 HA TYR A 41 -13.825 0.397 -10.876 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -12.310 -1.760 -9.921 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -11.835 -0.445 -8.865 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -15.055 -1.418 -10.571 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -13.079 -0.411 -6.890 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -17.212 -1.613 -9.359 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -15.235 -0.609 -5.678 1.00 0.00 H new ATOM 0 HH TYR A 41 -17.419 -1.046 -5.814 1.00 0.00 H new ATOM 666 N PHE A 42 -12.774 2.555 -10.091 1.00 0.00 N ATOM 667 CA PHE A 42 -12.110 3.849 -9.762 1.00 0.00 C ATOM 668 C PHE A 42 -12.337 4.186 -8.287 1.00 0.00 C ATOM 669 O PHE A 42 -13.441 4.469 -7.867 1.00 0.00 O ATOM 670 CB PHE A 42 -12.695 4.961 -10.635 1.00 0.00 C ATOM 671 CG PHE A 42 -11.909 6.235 -10.426 1.00 0.00 C ATOM 672 CD1 PHE A 42 -10.568 6.305 -10.826 1.00 0.00 C ATOM 673 CD2 PHE A 42 -12.524 7.346 -9.834 1.00 0.00 C ATOM 674 CE1 PHE A 42 -9.840 7.488 -10.633 1.00 0.00 C ATOM 675 CE2 PHE A 42 -11.797 8.528 -9.641 1.00 0.00 C ATOM 676 CZ PHE A 42 -10.455 8.599 -10.040 1.00 0.00 C ATOM 0 H PHE A 42 -13.794 2.572 -10.081 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.040 3.762 -9.951 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -12.662 4.669 -11.685 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -13.743 5.122 -10.382 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.095 5.448 -11.283 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -13.558 7.291 -9.527 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.806 7.543 -10.941 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -12.271 9.385 -9.185 1.00 0.00 H new ATOM 0 HZ PHE A 42 -9.895 9.510 -9.890 1.00 0.00 H new ATOM 686 N LYS A 43 -11.296 4.162 -7.499 1.00 0.00 N ATOM 687 CA LYS A 43 -11.450 4.485 -6.053 1.00 0.00 C ATOM 688 C LYS A 43 -10.077 4.792 -5.448 1.00 0.00 C ATOM 689 O LYS A 43 -9.052 4.447 -6.000 1.00 0.00 O ATOM 690 CB LYS A 43 -12.074 3.294 -5.325 1.00 0.00 C ATOM 691 CG LYS A 43 -12.893 3.796 -4.134 1.00 0.00 C ATOM 692 CD LYS A 43 -12.434 3.085 -2.859 1.00 0.00 C ATOM 693 CE LYS A 43 -13.650 2.521 -2.121 1.00 0.00 C ATOM 694 NZ LYS A 43 -14.212 3.565 -1.217 1.00 0.00 N ATOM 0 H LYS A 43 -10.347 3.933 -7.794 1.00 0.00 H new ATOM 0 HA LYS A 43 -12.097 5.355 -5.944 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.711 2.731 -6.007 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.294 2.614 -4.983 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -12.772 4.874 -4.025 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -13.953 3.610 -4.305 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -11.742 2.281 -3.108 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.896 3.781 -2.216 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.406 2.200 -2.837 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -13.363 1.642 -1.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -15.038 3.182 -0.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -13.490 3.851 -0.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -14.501 4.392 -1.778 1.00 0.00 H new ATOM 708 N ASP A 44 -10.053 5.439 -4.314 1.00 0.00 N ATOM 709 CA ASP A 44 -8.751 5.771 -3.670 1.00 0.00 C ATOM 710 C ASP A 44 -8.013 6.819 -4.506 1.00 0.00 C ATOM 711 O ASP A 44 -6.876 7.154 -4.234 1.00 0.00 O ATOM 712 CB ASP A 44 -7.895 4.505 -3.565 1.00 0.00 C ATOM 713 CG ASP A 44 -7.800 4.069 -2.101 1.00 0.00 C ATOM 714 OD1 ASP A 44 -8.446 4.692 -1.274 1.00 0.00 O ATOM 715 OD2 ASP A 44 -7.084 3.119 -1.831 1.00 0.00 O ATOM 0 H ASP A 44 -10.880 5.752 -3.806 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.934 6.170 -2.673 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -8.333 3.707 -4.165 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -6.898 4.694 -3.964 1.00 0.00 H new ATOM 720 N GLY A 45 -8.649 7.344 -5.517 1.00 0.00 N ATOM 721 CA GLY A 45 -7.981 8.374 -6.363 1.00 0.00 C ATOM 722 C GLY A 45 -7.194 7.693 -7.482 1.00 0.00 C ATOM 723 O GLY A 45 -6.769 8.325 -8.430 1.00 0.00 O ATOM 0 H GLY A 45 -9.601 7.105 -5.794 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -8.725 9.048 -6.787 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -7.312 8.981 -5.753 1.00 0.00 H new ATOM 727 N ILE A 46 -6.993 6.408 -7.384 1.00 0.00 N ATOM 728 CA ILE A 46 -6.231 5.689 -8.443 1.00 0.00 C ATOM 729 C ILE A 46 -7.172 4.730 -9.175 1.00 0.00 C ATOM 730 O ILE A 46 -8.378 4.876 -9.127 1.00 0.00 O ATOM 731 CB ILE A 46 -5.087 4.898 -7.804 1.00 0.00 C ATOM 732 CG1 ILE A 46 -4.601 5.624 -6.545 1.00 0.00 C ATOM 733 CG2 ILE A 46 -3.930 4.779 -8.797 1.00 0.00 C ATOM 734 CD1 ILE A 46 -3.984 6.969 -6.936 1.00 0.00 C ATOM 0 H ILE A 46 -7.324 5.824 -6.616 1.00 0.00 H new ATOM 0 HA ILE A 46 -5.818 6.408 -9.150 1.00 0.00 H new ATOM 0 HB ILE A 46 -5.443 3.903 -7.537 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -5.433 5.780 -5.858 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -3.866 5.013 -6.021 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.116 4.216 -8.341 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -4.272 4.262 -9.694 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.577 5.775 -9.065 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.639 7.485 -6.040 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.141 6.801 -7.606 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -4.733 7.580 -7.441 1.00 0.00 H new ATOM 746 N PHE A 47 -6.638 3.751 -9.851 1.00 0.00 N ATOM 747 CA PHE A 47 -7.514 2.792 -10.577 1.00 0.00 C ATOM 748 C PHE A 47 -7.474 1.435 -9.874 1.00 0.00 C ATOM 749 O PHE A 47 -6.705 1.223 -8.958 1.00 0.00 O ATOM 750 CB PHE A 47 -7.021 2.643 -12.017 1.00 0.00 C ATOM 751 CG PHE A 47 -7.458 3.842 -12.825 1.00 0.00 C ATOM 752 CD1 PHE A 47 -7.030 5.126 -12.462 1.00 0.00 C ATOM 753 CD2 PHE A 47 -8.290 3.668 -13.938 1.00 0.00 C ATOM 754 CE1 PHE A 47 -7.435 6.238 -13.214 1.00 0.00 C ATOM 755 CE2 PHE A 47 -8.695 4.780 -14.689 1.00 0.00 C ATOM 756 CZ PHE A 47 -8.268 6.064 -14.327 1.00 0.00 C ATOM 0 H PHE A 47 -5.637 3.575 -9.932 1.00 0.00 H new ATOM 0 HA PHE A 47 -8.538 3.164 -10.584 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.935 2.556 -12.034 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -7.421 1.729 -12.457 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -6.388 5.259 -11.603 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -8.619 2.678 -14.217 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -7.105 7.228 -12.935 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -9.337 4.647 -15.547 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.581 6.920 -14.906 1.00 0.00 H new ATOM 766 N LYS A 48 -8.302 0.515 -10.288 1.00 0.00 N ATOM 767 CA LYS A 48 -8.314 -0.824 -9.635 1.00 0.00 C ATOM 768 C LYS A 48 -8.790 -1.880 -10.633 1.00 0.00 C ATOM 769 O LYS A 48 -9.603 -1.614 -11.497 1.00 0.00 O ATOM 770 CB LYS A 48 -9.263 -0.796 -8.436 1.00 0.00 C ATOM 771 CG LYS A 48 -8.480 -1.105 -7.158 1.00 0.00 C ATOM 772 CD LYS A 48 -9.346 -1.954 -6.224 1.00 0.00 C ATOM 773 CE LYS A 48 -10.694 -1.265 -6.013 1.00 0.00 C ATOM 774 NZ LYS A 48 -10.852 -0.914 -4.573 1.00 0.00 N ATOM 0 H LYS A 48 -8.970 0.633 -11.050 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.307 -1.071 -9.300 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -9.737 0.182 -8.357 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.060 -1.527 -8.572 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.560 -1.636 -7.402 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -8.191 -0.178 -6.662 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -9.495 -2.946 -6.651 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.842 -2.091 -5.267 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.755 -0.366 -6.626 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -11.504 -1.922 -6.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -11.769 -0.445 -4.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -10.811 -1.780 -3.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -10.086 -0.272 -4.286 1.00 0.00 H new ATOM 788 N VAL A 49 -8.290 -3.080 -10.516 1.00 0.00 N ATOM 789 CA VAL A 49 -8.708 -4.161 -11.450 1.00 0.00 C ATOM 790 C VAL A 49 -9.301 -5.320 -10.647 1.00 0.00 C ATOM 791 O VAL A 49 -8.658 -5.884 -9.785 1.00 0.00 O ATOM 792 CB VAL A 49 -7.490 -4.651 -12.235 1.00 0.00 C ATOM 793 CG1 VAL A 49 -7.954 -5.357 -13.510 1.00 0.00 C ATOM 794 CG2 VAL A 49 -6.610 -3.456 -12.606 1.00 0.00 C ATOM 0 H VAL A 49 -7.608 -3.358 -9.811 1.00 0.00 H new ATOM 0 HA VAL A 49 -9.457 -3.779 -12.144 1.00 0.00 H new ATOM 0 HB VAL A 49 -6.919 -5.348 -11.622 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -7.086 -5.706 -14.069 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -8.582 -6.208 -13.247 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -8.525 -4.661 -14.124 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -5.741 -3.804 -13.165 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.182 -2.760 -13.219 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.279 -2.952 -11.698 1.00 0.00 H new ATOM 804 N ARG A 50 -10.525 -5.680 -10.923 1.00 0.00 N ATOM 805 CA ARG A 50 -11.158 -6.802 -10.173 1.00 0.00 C ATOM 806 C ARG A 50 -11.066 -8.082 -11.004 1.00 0.00 C ATOM 807 O ARG A 50 -11.548 -8.143 -12.117 1.00 0.00 O ATOM 808 CB ARG A 50 -12.630 -6.472 -9.912 1.00 0.00 C ATOM 809 CG ARG A 50 -13.192 -7.430 -8.859 1.00 0.00 C ATOM 810 CD ARG A 50 -14.491 -6.855 -8.290 1.00 0.00 C ATOM 811 NE ARG A 50 -15.076 -7.816 -7.314 1.00 0.00 N ATOM 812 CZ ARG A 50 -15.687 -8.888 -7.738 1.00 0.00 C ATOM 813 NH1 ARG A 50 -16.868 -8.792 -8.286 1.00 0.00 N ATOM 814 NH2 ARG A 50 -15.118 -10.056 -7.613 1.00 0.00 N ATOM 0 H ARG A 50 -11.113 -5.246 -11.634 1.00 0.00 H new ATOM 0 HA ARG A 50 -10.642 -6.944 -9.224 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -12.727 -5.442 -9.570 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.201 -6.556 -10.836 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -13.378 -8.408 -9.303 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -12.465 -7.576 -8.060 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -14.295 -5.900 -7.803 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -15.199 -6.663 -9.096 1.00 0.00 H new ATOM 0 HE ARG A 50 -14.999 -7.636 -6.313 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -17.313 -7.879 -8.383 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -17.346 -9.630 -8.618 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -14.196 -10.131 -7.184 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -15.596 -10.894 -7.944 1.00 0.00 H new ATOM 828 N LEU A 51 -10.451 -9.109 -10.479 1.00 0.00 N ATOM 829 CA LEU A 51 -10.338 -10.374 -11.259 1.00 0.00 C ATOM 830 C LEU A 51 -11.536 -11.276 -10.952 1.00 0.00 C ATOM 831 O LEU A 51 -11.482 -12.124 -10.084 1.00 0.00 O ATOM 832 CB LEU A 51 -9.040 -11.095 -10.889 1.00 0.00 C ATOM 833 CG LEU A 51 -8.210 -11.327 -12.153 1.00 0.00 C ATOM 834 CD1 LEU A 51 -9.079 -11.991 -13.222 1.00 0.00 C ATOM 835 CD2 LEU A 51 -7.699 -9.982 -12.677 1.00 0.00 C ATOM 0 H LEU A 51 -10.026 -9.126 -9.552 1.00 0.00 H new ATOM 0 HA LEU A 51 -10.327 -10.141 -12.324 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -8.473 -10.501 -10.172 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.264 -12.047 -10.408 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.365 -11.975 -11.919 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.486 -12.156 -14.122 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -9.447 -12.947 -12.850 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -9.924 -11.344 -13.457 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -7.107 -10.144 -13.578 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -8.546 -9.337 -12.910 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -7.080 -9.507 -11.916 1.00 0.00 H new ATOM 847 N LEU A 52 -12.618 -11.097 -11.661 1.00 0.00 N ATOM 848 CA LEU A 52 -13.823 -11.940 -11.416 1.00 0.00 C ATOM 849 C LEU A 52 -13.465 -13.412 -11.634 1.00 0.00 C ATOM 850 O LEU A 52 -12.460 -13.735 -12.237 1.00 0.00 O ATOM 851 CB LEU A 52 -14.932 -11.536 -12.389 1.00 0.00 C ATOM 852 CG LEU A 52 -16.291 -11.643 -11.693 1.00 0.00 C ATOM 853 CD1 LEU A 52 -16.393 -10.574 -10.603 1.00 0.00 C ATOM 854 CD2 LEU A 52 -17.404 -11.429 -12.721 1.00 0.00 C ATOM 0 H LEU A 52 -12.719 -10.402 -12.401 1.00 0.00 H new ATOM 0 HA LEU A 52 -14.167 -11.796 -10.392 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -14.770 -10.516 -12.737 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -14.911 -12.180 -13.268 1.00 0.00 H new ATOM 0 HG LEU A 52 -16.393 -12.630 -11.243 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -17.361 -10.651 -10.108 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -15.598 -10.723 -9.872 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -16.292 -9.586 -11.052 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -18.374 -11.505 -12.229 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -17.301 -10.441 -13.169 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -17.332 -12.189 -13.499 1.00 0.00 H new ATOM 866 N GLY A 53 -14.278 -14.308 -11.145 1.00 0.00 N ATOM 867 CA GLY A 53 -13.982 -15.758 -11.320 1.00 0.00 C ATOM 868 C GLY A 53 -13.139 -16.249 -10.142 1.00 0.00 C ATOM 869 O GLY A 53 -13.223 -17.391 -9.737 1.00 0.00 O ATOM 0 H GLY A 53 -15.134 -14.099 -10.632 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -14.911 -16.326 -11.379 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -13.449 -15.921 -12.256 1.00 0.00 H new ATOM 873 N TYR A 54 -12.326 -15.391 -9.587 1.00 0.00 N ATOM 874 CA TYR A 54 -11.477 -15.804 -8.434 1.00 0.00 C ATOM 875 C TYR A 54 -12.163 -15.397 -7.128 1.00 0.00 C ATOM 876 O TYR A 54 -12.028 -16.053 -6.115 1.00 0.00 O ATOM 877 CB TYR A 54 -10.116 -15.113 -8.532 1.00 0.00 C ATOM 878 CG TYR A 54 -9.026 -16.092 -8.166 1.00 0.00 C ATOM 879 CD1 TYR A 54 -8.792 -16.407 -6.822 1.00 0.00 C ATOM 880 CD2 TYR A 54 -8.250 -16.685 -9.171 1.00 0.00 C ATOM 881 CE1 TYR A 54 -7.780 -17.315 -6.481 1.00 0.00 C ATOM 882 CE2 TYR A 54 -7.238 -17.593 -8.831 1.00 0.00 C ATOM 883 CZ TYR A 54 -7.004 -17.908 -7.485 1.00 0.00 C ATOM 884 OH TYR A 54 -6.008 -18.802 -7.149 1.00 0.00 O ATOM 0 H TYR A 54 -12.213 -14.421 -9.883 1.00 0.00 H new ATOM 0 HA TYR A 54 -11.338 -16.885 -8.451 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -9.958 -14.739 -9.543 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -10.085 -14.252 -7.865 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -9.391 -15.950 -6.048 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -8.432 -16.442 -10.208 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -7.599 -17.557 -5.444 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.639 -18.050 -9.605 1.00 0.00 H new ATOM 0 HH TYR A 54 -5.566 -19.121 -7.964 1.00 0.00 H new ATOM 894 N GLU A 55 -12.897 -14.319 -7.146 1.00 0.00 N ATOM 895 CA GLU A 55 -13.591 -13.867 -5.908 1.00 0.00 C ATOM 896 C GLU A 55 -12.569 -13.690 -4.784 1.00 0.00 C ATOM 897 O GLU A 55 -12.341 -14.582 -3.991 1.00 0.00 O ATOM 898 CB GLU A 55 -14.628 -14.913 -5.491 1.00 0.00 C ATOM 899 CG GLU A 55 -15.420 -14.395 -4.288 1.00 0.00 C ATOM 900 CD GLU A 55 -16.879 -14.176 -4.692 1.00 0.00 C ATOM 901 OE1 GLU A 55 -17.116 -13.885 -5.852 1.00 0.00 O ATOM 902 OE2 GLU A 55 -17.737 -14.306 -3.833 1.00 0.00 O ATOM 0 H GLU A 55 -13.046 -13.731 -7.966 1.00 0.00 H new ATOM 0 HA GLU A 55 -14.089 -12.917 -6.100 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.303 -15.123 -6.321 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -14.133 -15.851 -5.238 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -15.363 -15.109 -3.467 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -14.987 -13.461 -3.929 1.00 0.00 H new ATOM 909 N GLY A 56 -11.949 -12.544 -4.708 1.00 0.00 N ATOM 910 CA GLY A 56 -10.943 -12.311 -3.634 1.00 0.00 C ATOM 911 C GLY A 56 -9.671 -11.723 -4.244 1.00 0.00 C ATOM 912 O GLY A 56 -8.798 -11.247 -3.546 1.00 0.00 O ATOM 0 H GLY A 56 -12.096 -11.759 -5.343 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.347 -11.631 -2.884 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -10.715 -13.248 -3.125 1.00 0.00 H new ATOM 916 N HIS A 57 -9.558 -11.752 -5.544 1.00 0.00 N ATOM 917 CA HIS A 57 -8.341 -11.195 -6.198 1.00 0.00 C ATOM 918 C HIS A 57 -8.552 -9.707 -6.490 1.00 0.00 C ATOM 919 O HIS A 57 -9.111 -9.333 -7.508 1.00 0.00 O ATOM 920 CB HIS A 57 -8.075 -11.944 -7.504 1.00 0.00 C ATOM 921 CG HIS A 57 -7.212 -13.143 -7.221 1.00 0.00 C ATOM 922 ND1 HIS A 57 -6.572 -13.850 -8.227 1.00 0.00 N ATOM 923 CD2 HIS A 57 -6.874 -13.772 -6.048 1.00 0.00 C ATOM 924 CE1 HIS A 57 -5.887 -14.852 -7.646 1.00 0.00 C ATOM 925 NE2 HIS A 57 -6.037 -14.849 -6.318 1.00 0.00 N ATOM 0 H HIS A 57 -10.256 -12.137 -6.181 1.00 0.00 H new ATOM 0 HA HIS A 57 -7.485 -11.314 -5.534 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -9.016 -12.257 -7.955 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -7.581 -11.287 -8.220 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -7.208 -13.475 -5.065 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -5.289 -15.571 -8.187 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -5.626 -15.498 -5.647 1.00 0.00 H new ATOM 933 N GLU A 58 -8.106 -8.857 -5.604 1.00 0.00 N ATOM 934 CA GLU A 58 -8.275 -7.393 -5.820 1.00 0.00 C ATOM 935 C GLU A 58 -6.931 -6.788 -6.225 1.00 0.00 C ATOM 936 O GLU A 58 -6.007 -6.714 -5.436 1.00 0.00 O ATOM 937 CB GLU A 58 -8.759 -6.738 -4.525 1.00 0.00 C ATOM 938 CG GLU A 58 -9.823 -5.686 -4.852 1.00 0.00 C ATOM 939 CD GLU A 58 -11.124 -6.031 -4.125 1.00 0.00 C ATOM 940 OE1 GLU A 58 -11.253 -7.162 -3.687 1.00 0.00 O ATOM 941 OE2 GLU A 58 -11.969 -5.157 -4.020 1.00 0.00 O ATOM 0 H GLU A 58 -7.631 -9.115 -4.739 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.008 -7.221 -6.608 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.172 -7.493 -3.855 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.921 -6.274 -4.004 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -9.477 -4.698 -4.550 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.994 -5.649 -5.928 1.00 0.00 H new ATOM 948 N CYS A 59 -6.811 -6.356 -7.448 1.00 0.00 N ATOM 949 CA CYS A 59 -5.526 -5.760 -7.903 1.00 0.00 C ATOM 950 C CYS A 59 -5.638 -4.235 -7.894 1.00 0.00 C ATOM 951 O CYS A 59 -6.716 -3.679 -7.972 1.00 0.00 O ATOM 952 CB CYS A 59 -5.219 -6.238 -9.323 1.00 0.00 C ATOM 953 SG CYS A 59 -5.677 -7.982 -9.487 1.00 0.00 S ATOM 0 H CYS A 59 -7.548 -6.390 -8.153 1.00 0.00 H new ATOM 0 HA CYS A 59 -4.725 -6.069 -7.232 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -5.769 -5.637 -10.047 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -4.159 -6.108 -9.541 1.00 0.00 H new ATOM 0 HG CYS A 59 -5.418 -8.387 -10.695 1.00 0.00 H new ATOM 959 N ILE A 60 -4.530 -3.554 -7.808 1.00 0.00 N ATOM 960 CA ILE A 60 -4.564 -2.067 -7.805 1.00 0.00 C ATOM 961 C ILE A 60 -3.963 -1.565 -9.115 1.00 0.00 C ATOM 962 O ILE A 60 -2.857 -1.913 -9.473 1.00 0.00 O ATOM 963 CB ILE A 60 -3.744 -1.538 -6.627 1.00 0.00 C ATOM 964 CG1 ILE A 60 -2.278 -1.937 -6.809 1.00 0.00 C ATOM 965 CG2 ILE A 60 -4.277 -2.138 -5.324 1.00 0.00 C ATOM 966 CD1 ILE A 60 -1.477 -0.726 -7.292 1.00 0.00 C ATOM 0 H ILE A 60 -3.599 -3.966 -7.739 1.00 0.00 H new ATOM 0 HA ILE A 60 -5.592 -1.716 -7.708 1.00 0.00 H new ATOM 0 HB ILE A 60 -3.824 -0.452 -6.586 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.870 -2.304 -5.867 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -2.198 -2.751 -7.530 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -3.693 -1.761 -4.484 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.322 -1.856 -5.194 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.196 -3.224 -5.364 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.432 -1.009 -7.422 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -1.880 -0.379 -8.243 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.547 0.074 -6.555 1.00 0.00 H new ATOM 978 N LEU A 61 -4.681 -0.762 -9.842 1.00 0.00 N ATOM 979 CA LEU A 61 -4.145 -0.261 -11.135 1.00 0.00 C ATOM 980 C LEU A 61 -3.560 1.138 -10.939 1.00 0.00 C ATOM 981 O LEU A 61 -4.272 2.097 -10.704 1.00 0.00 O ATOM 982 CB LEU A 61 -5.276 -0.211 -12.162 1.00 0.00 C ATOM 983 CG LEU A 61 -4.697 0.076 -13.546 1.00 0.00 C ATOM 984 CD1 LEU A 61 -3.705 -1.026 -13.925 1.00 0.00 C ATOM 985 CD2 LEU A 61 -5.833 0.114 -14.570 1.00 0.00 C ATOM 0 H LEU A 61 -5.614 -0.431 -9.599 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.360 -0.928 -11.491 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.815 -1.158 -12.171 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -5.995 0.562 -11.890 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.182 1.037 -13.534 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.292 -0.820 -14.913 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.897 -1.056 -13.194 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -4.218 -1.988 -13.939 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.424 0.319 -15.559 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -6.345 -0.848 -14.581 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.540 0.899 -14.300 1.00 0.00 H new ATOM 997 N LEU A 62 -2.262 1.257 -11.026 1.00 0.00 N ATOM 998 CA LEU A 62 -1.621 2.590 -10.838 1.00 0.00 C ATOM 999 C LEU A 62 -0.989 3.049 -12.153 1.00 0.00 C ATOM 1000 O LEU A 62 -1.063 4.206 -12.518 1.00 0.00 O ATOM 1001 CB LEU A 62 -0.535 2.482 -9.765 1.00 0.00 C ATOM 1002 CG LEU A 62 -0.411 3.812 -9.024 1.00 0.00 C ATOM 1003 CD1 LEU A 62 0.190 3.569 -7.638 1.00 0.00 C ATOM 1004 CD2 LEU A 62 0.501 4.754 -9.815 1.00 0.00 C ATOM 0 H LEU A 62 -1.619 0.489 -11.219 1.00 0.00 H new ATOM 0 HA LEU A 62 -2.375 3.313 -10.528 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.781 1.685 -9.063 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.418 2.220 -10.224 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.398 4.263 -8.920 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.279 4.518 -7.109 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.457 2.898 -7.073 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.177 3.118 -7.743 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.590 5.703 -9.287 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.488 4.303 -9.919 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.076 4.927 -10.803 1.00 0.00 H new ATOM 1016 N ASP A 63 -0.363 2.154 -12.865 1.00 0.00 N ATOM 1017 CA ASP A 63 0.278 2.542 -14.153 1.00 0.00 C ATOM 1018 C ASP A 63 -0.789 3.024 -15.136 1.00 0.00 C ATOM 1019 O ASP A 63 -0.635 4.044 -15.779 1.00 0.00 O ATOM 1020 CB ASP A 63 1.010 1.336 -14.744 1.00 0.00 C ATOM 1021 CG ASP A 63 2.472 1.702 -15.003 1.00 0.00 C ATOM 1022 OD1 ASP A 63 3.076 2.299 -14.128 1.00 0.00 O ATOM 1023 OD2 ASP A 63 2.962 1.381 -16.074 1.00 0.00 O ATOM 0 H ASP A 63 -0.267 1.171 -12.611 1.00 0.00 H new ATOM 0 HA ASP A 63 0.991 3.347 -13.972 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.952 0.490 -14.059 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.532 1.027 -15.673 1.00 0.00 H new ATOM 1028 N TYR A 64 -1.870 2.304 -15.264 1.00 0.00 N ATOM 1029 CA TYR A 64 -2.936 2.735 -16.214 1.00 0.00 C ATOM 1030 C TYR A 64 -3.228 4.226 -16.017 1.00 0.00 C ATOM 1031 O TYR A 64 -3.620 4.917 -16.936 1.00 0.00 O ATOM 1032 CB TYR A 64 -4.212 1.932 -15.955 1.00 0.00 C ATOM 1033 CG TYR A 64 -5.275 2.342 -16.946 1.00 0.00 C ATOM 1034 CD1 TYR A 64 -5.940 3.566 -16.792 1.00 0.00 C ATOM 1035 CD2 TYR A 64 -5.597 1.500 -18.020 1.00 0.00 C ATOM 1036 CE1 TYR A 64 -6.926 3.949 -17.710 1.00 0.00 C ATOM 1037 CE2 TYR A 64 -6.584 1.884 -18.938 1.00 0.00 C ATOM 1038 CZ TYR A 64 -7.248 3.107 -18.784 1.00 0.00 C ATOM 1039 OH TYR A 64 -8.219 3.485 -19.688 1.00 0.00 O ATOM 0 H TYR A 64 -2.061 1.441 -14.755 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.597 2.561 -17.235 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -4.008 0.865 -16.045 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -4.563 2.104 -14.937 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -5.692 4.214 -15.965 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -5.085 0.557 -18.140 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -7.438 4.892 -17.591 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -6.833 1.236 -19.765 1.00 0.00 H new ATOM 0 HH TYR A 64 -8.319 2.789 -20.371 1.00 0.00 H new ATOM 1049 N LEU A 65 -3.041 4.726 -14.826 1.00 0.00 N ATOM 1050 CA LEU A 65 -3.311 6.169 -14.570 1.00 0.00 C ATOM 1051 C LEU A 65 -2.516 7.027 -15.557 1.00 0.00 C ATOM 1052 O LEU A 65 -3.070 7.630 -16.456 1.00 0.00 O ATOM 1053 CB LEU A 65 -2.894 6.519 -13.140 1.00 0.00 C ATOM 1054 CG LEU A 65 -3.491 7.872 -12.748 1.00 0.00 C ATOM 1055 CD1 LEU A 65 -3.850 7.860 -11.261 1.00 0.00 C ATOM 1056 CD2 LEU A 65 -2.465 8.976 -13.011 1.00 0.00 C ATOM 0 H LEU A 65 -2.712 4.197 -14.018 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.375 6.365 -14.699 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.236 5.746 -12.451 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.807 6.554 -13.066 1.00 0.00 H new ATOM 0 HG LEU A 65 -4.388 8.057 -13.339 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.275 8.824 -10.982 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.579 7.072 -11.069 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.952 7.675 -10.671 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.889 9.941 -12.732 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.569 8.789 -12.419 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -2.205 8.986 -14.069 1.00 0.00 H new ATOM 1068 N ASN A 66 -1.223 7.093 -15.394 1.00 0.00 N ATOM 1069 CA ASN A 66 -0.393 7.917 -16.320 1.00 0.00 C ATOM 1070 C ASN A 66 -0.811 9.384 -16.206 1.00 0.00 C ATOM 1071 O ASN A 66 -1.968 9.695 -16.007 1.00 0.00 O ATOM 1072 CB ASN A 66 -0.596 7.437 -17.759 1.00 0.00 C ATOM 1073 CG ASN A 66 0.743 7.464 -18.500 1.00 0.00 C ATOM 1074 OD1 ASN A 66 1.673 8.121 -18.075 1.00 0.00 O ATOM 1075 ND2 ASN A 66 0.882 6.772 -19.597 1.00 0.00 N ATOM 0 H ASN A 66 -0.704 6.612 -14.659 1.00 0.00 H new ATOM 0 HA ASN A 66 0.659 7.815 -16.052 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -1.005 6.427 -17.762 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -1.318 8.075 -18.268 1.00 0.00 H new ATOM 0 HD21 ASN A 66 1.771 6.783 -20.097 1.00 0.00 H new ATOM 0 HD22 ASN A 66 0.102 6.220 -19.954 1.00 0.00 H new ATOM 1082 N TYR A 67 0.122 10.289 -16.325 1.00 0.00 N ATOM 1083 CA TYR A 67 -0.222 11.735 -16.218 1.00 0.00 C ATOM 1084 C TYR A 67 -0.932 12.192 -17.493 1.00 0.00 C ATOM 1085 O TYR A 67 -0.809 11.581 -18.537 1.00 0.00 O ATOM 1086 CB TYR A 67 1.058 12.548 -16.025 1.00 0.00 C ATOM 1087 CG TYR A 67 1.390 12.622 -14.554 1.00 0.00 C ATOM 1088 CD1 TYR A 67 0.553 13.329 -13.682 1.00 0.00 C ATOM 1089 CD2 TYR A 67 2.534 11.981 -14.060 1.00 0.00 C ATOM 1090 CE1 TYR A 67 0.859 13.397 -12.316 1.00 0.00 C ATOM 1091 CE2 TYR A 67 2.841 12.049 -12.694 1.00 0.00 C ATOM 1092 CZ TYR A 67 2.003 12.757 -11.823 1.00 0.00 C ATOM 1093 OH TYR A 67 2.304 12.822 -10.477 1.00 0.00 O ATOM 0 H TYR A 67 1.108 10.089 -16.492 1.00 0.00 H new ATOM 0 HA TYR A 67 -0.883 11.888 -15.365 1.00 0.00 H new ATOM 0 HB2 TYR A 67 1.880 12.087 -16.572 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.929 13.551 -16.431 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.329 13.822 -14.062 1.00 0.00 H new ATOM 0 HD2 TYR A 67 3.179 11.434 -14.732 1.00 0.00 H new ATOM 0 HE1 TYR A 67 0.213 13.943 -11.644 1.00 0.00 H new ATOM 0 HE2 TYR A 67 3.723 11.556 -12.313 1.00 0.00 H new ATOM 0 HH TYR A 67 3.130 12.324 -10.302 1.00 0.00 H new ATOM 1103 N ARG A 68 -1.676 13.262 -17.417 1.00 0.00 N ATOM 1104 CA ARG A 68 -2.396 13.756 -18.623 1.00 0.00 C ATOM 1105 C ARG A 68 -2.753 15.232 -18.440 1.00 0.00 C ATOM 1106 O ARG A 68 -3.035 15.683 -17.348 1.00 0.00 O ATOM 1107 CB ARG A 68 -3.678 12.943 -18.813 1.00 0.00 C ATOM 1108 CG ARG A 68 -4.010 12.849 -20.306 1.00 0.00 C ATOM 1109 CD ARG A 68 -4.473 11.428 -20.651 1.00 0.00 C ATOM 1110 NE ARG A 68 -5.070 10.784 -19.446 1.00 0.00 N ATOM 1111 CZ ARG A 68 -6.365 10.766 -19.288 1.00 0.00 C ATOM 1112 NH1 ARG A 68 -7.059 11.856 -19.469 1.00 0.00 N ATOM 1113 NH2 ARG A 68 -6.964 9.658 -18.947 1.00 0.00 N ATOM 0 H ARG A 68 -1.816 13.815 -16.571 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.757 13.645 -19.499 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.553 11.944 -18.394 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -4.502 13.413 -18.276 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -4.791 13.566 -20.559 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -3.133 13.109 -20.899 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -5.205 11.460 -21.458 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -3.630 10.838 -21.010 1.00 0.00 H new ATOM 0 HE ARG A 68 -4.465 10.357 -18.744 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.589 12.722 -19.734 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -8.071 11.842 -19.346 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -6.420 8.807 -18.804 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -7.976 9.643 -18.823 1.00 0.00 H new ATOM 1127 N GLN A 69 -2.745 15.990 -19.504 1.00 0.00 N ATOM 1128 CA GLN A 69 -3.087 17.436 -19.393 1.00 0.00 C ATOM 1129 C GLN A 69 -4.492 17.669 -19.951 1.00 0.00 C ATOM 1130 O GLN A 69 -4.661 18.116 -21.068 1.00 0.00 O ATOM 1131 CB GLN A 69 -2.076 18.263 -20.191 1.00 0.00 C ATOM 1132 CG GLN A 69 -2.171 17.896 -21.672 1.00 0.00 C ATOM 1133 CD GLN A 69 -0.766 17.695 -22.239 1.00 0.00 C ATOM 1134 OE1 GLN A 69 -0.066 16.780 -21.851 1.00 0.00 O ATOM 1135 NE2 GLN A 69 -0.319 18.517 -23.148 1.00 0.00 N ATOM 0 H GLN A 69 -2.516 15.669 -20.445 1.00 0.00 H new ATOM 0 HA GLN A 69 -3.056 17.739 -18.346 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -2.273 19.326 -20.056 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -1.067 18.076 -19.823 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -2.758 16.986 -21.795 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -2.687 18.684 -22.221 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -0.906 19.285 -23.474 1.00 0.00 H new ATOM 0 HE22 GLN A 69 0.617 18.392 -23.533 1.00 0.00 H new ATOM 1144 N ASP A 70 -5.502 17.365 -19.184 1.00 0.00 N ATOM 1145 CA ASP A 70 -6.895 17.565 -19.673 1.00 0.00 C ATOM 1146 C ASP A 70 -7.879 17.310 -18.530 1.00 0.00 C ATOM 1147 O ASP A 70 -7.757 16.347 -17.798 1.00 0.00 O ATOM 1148 CB ASP A 70 -7.175 16.588 -20.817 1.00 0.00 C ATOM 1149 CG ASP A 70 -7.172 15.158 -20.277 1.00 0.00 C ATOM 1150 OD1 ASP A 70 -6.565 14.938 -19.241 1.00 0.00 O ATOM 1151 OD2 ASP A 70 -7.775 14.305 -20.908 1.00 0.00 O ATOM 0 H ASP A 70 -5.423 16.987 -18.240 1.00 0.00 H new ATOM 0 HA ASP A 70 -7.013 18.588 -20.030 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.138 16.813 -21.275 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -6.419 16.696 -21.595 1.00 0.00 H new ATOM 1156 N THR A 71 -8.851 18.165 -18.368 1.00 0.00 N ATOM 1157 CA THR A 71 -9.840 17.968 -17.270 1.00 0.00 C ATOM 1158 C THR A 71 -11.256 17.985 -17.852 1.00 0.00 C ATOM 1159 O THR A 71 -11.895 19.016 -17.926 1.00 0.00 O ATOM 1160 CB THR A 71 -9.694 19.097 -16.246 1.00 0.00 C ATOM 1161 OG1 THR A 71 -10.202 20.304 -16.799 1.00 0.00 O ATOM 1162 CG2 THR A 71 -8.219 19.279 -15.890 1.00 0.00 C ATOM 0 H THR A 71 -9.003 18.991 -18.947 1.00 0.00 H new ATOM 0 HA THR A 71 -9.659 17.010 -16.783 1.00 0.00 H new ATOM 0 HB THR A 71 -10.254 18.845 -15.345 1.00 0.00 H new ATOM 0 HG1 THR A 71 -11.174 20.234 -16.900 1.00 0.00 H new ATOM 0 HG21 THR A 71 -8.117 20.083 -15.161 1.00 0.00 H new ATOM 0 HG22 THR A 71 -7.830 18.353 -15.466 1.00 0.00 H new ATOM 0 HG23 THR A 71 -7.656 19.531 -16.789 1.00 0.00 H new ATOM 1170 N LEU A 72 -11.751 16.849 -18.266 1.00 0.00 N ATOM 1171 CA LEU A 72 -13.123 16.801 -18.843 1.00 0.00 C ATOM 1172 C LEU A 72 -13.464 15.362 -19.237 1.00 0.00 C ATOM 1173 O LEU A 72 -14.074 15.116 -20.258 1.00 0.00 O ATOM 1174 CB LEU A 72 -13.184 17.696 -20.082 1.00 0.00 C ATOM 1175 CG LEU A 72 -14.357 18.670 -19.955 1.00 0.00 C ATOM 1176 CD1 LEU A 72 -13.853 20.103 -20.138 1.00 0.00 C ATOM 1177 CD2 LEU A 72 -15.398 18.355 -21.032 1.00 0.00 C ATOM 0 H LEU A 72 -11.264 15.954 -18.229 1.00 0.00 H new ATOM 0 HA LEU A 72 -13.841 17.153 -18.102 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -12.250 18.248 -20.191 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -13.300 17.086 -20.978 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.810 18.568 -18.969 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -14.689 20.797 -20.048 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -13.110 20.328 -19.373 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -13.401 20.206 -21.124 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -16.235 19.048 -20.943 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -14.944 18.458 -22.018 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -15.757 17.334 -20.903 1.00 0.00 H new ATOM 1189 N ASP A 73 -13.071 14.409 -18.436 1.00 0.00 N ATOM 1190 CA ASP A 73 -13.373 12.987 -18.767 1.00 0.00 C ATOM 1191 C ASP A 73 -14.516 12.488 -17.879 1.00 0.00 C ATOM 1192 O ASP A 73 -14.342 11.601 -17.067 1.00 0.00 O ATOM 1193 CB ASP A 73 -12.128 12.130 -18.524 1.00 0.00 C ATOM 1194 CG ASP A 73 -10.984 12.629 -19.408 1.00 0.00 C ATOM 1195 OD1 ASP A 73 -11.140 12.603 -20.617 1.00 0.00 O ATOM 1196 OD2 ASP A 73 -9.970 13.029 -18.860 1.00 0.00 O ATOM 0 H ASP A 73 -12.555 14.553 -17.568 1.00 0.00 H new ATOM 0 HA ASP A 73 -13.666 12.913 -19.814 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -11.839 12.180 -17.474 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -12.344 11.085 -18.746 1.00 0.00 H new ATOM 1201 N ARG A 74 -15.683 13.054 -18.023 1.00 0.00 N ATOM 1202 CA ARG A 74 -16.833 12.612 -17.185 1.00 0.00 C ATOM 1203 C ARG A 74 -17.347 11.263 -17.693 1.00 0.00 C ATOM 1204 O ARG A 74 -17.834 10.448 -16.934 1.00 0.00 O ATOM 1205 CB ARG A 74 -17.954 13.652 -17.268 1.00 0.00 C ATOM 1206 CG ARG A 74 -18.447 13.980 -15.857 1.00 0.00 C ATOM 1207 CD ARG A 74 -19.706 14.847 -15.941 1.00 0.00 C ATOM 1208 NE ARG A 74 -19.531 15.880 -17.000 1.00 0.00 N ATOM 1209 CZ ARG A 74 -19.899 17.112 -16.776 1.00 0.00 C ATOM 1210 NH1 ARG A 74 -19.090 17.934 -16.166 1.00 0.00 N ATOM 1211 NH2 ARG A 74 -21.076 17.522 -17.165 1.00 0.00 N ATOM 0 H ARG A 74 -15.890 13.803 -18.684 1.00 0.00 H new ATOM 0 HA ARG A 74 -16.510 12.509 -16.149 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -17.591 14.556 -17.758 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -18.776 13.270 -17.873 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -18.662 13.060 -15.313 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -17.669 14.504 -15.302 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -20.573 14.226 -16.164 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -19.895 15.325 -14.980 1.00 0.00 H new ATOM 0 HE ARG A 74 -19.124 15.625 -17.900 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -18.170 17.614 -15.864 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -19.378 18.897 -15.991 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -21.707 16.880 -17.644 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -21.364 18.485 -16.990 1.00 0.00 H new ATOM 1225 N LEU A 75 -17.244 11.021 -18.971 1.00 0.00 N ATOM 1226 CA LEU A 75 -17.727 9.724 -19.525 1.00 0.00 C ATOM 1227 C LEU A 75 -16.975 8.569 -18.858 1.00 0.00 C ATOM 1228 O LEU A 75 -17.561 7.583 -18.457 1.00 0.00 O ATOM 1229 CB LEU A 75 -17.474 9.692 -21.035 1.00 0.00 C ATOM 1230 CG LEU A 75 -18.421 8.686 -21.691 1.00 0.00 C ATOM 1231 CD1 LEU A 75 -19.522 9.436 -22.442 1.00 0.00 C ATOM 1232 CD2 LEU A 75 -17.635 7.816 -22.674 1.00 0.00 C ATOM 0 H LEU A 75 -16.847 11.665 -19.655 1.00 0.00 H new ATOM 0 HA LEU A 75 -18.794 9.621 -19.330 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -17.628 10.683 -21.461 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -16.439 9.416 -21.235 1.00 0.00 H new ATOM 0 HG LEU A 75 -18.870 8.055 -20.924 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -20.197 8.719 -22.910 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -20.081 10.058 -21.743 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -19.074 10.067 -23.210 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -18.308 7.098 -23.143 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -17.187 8.448 -23.441 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -16.850 7.282 -22.139 1.00 0.00 H new ATOM 1244 N LYS A 76 -15.681 8.683 -18.738 1.00 0.00 N ATOM 1245 CA LYS A 76 -14.888 7.594 -18.100 1.00 0.00 C ATOM 1246 C LYS A 76 -15.579 7.136 -16.813 1.00 0.00 C ATOM 1247 O LYS A 76 -15.420 6.013 -16.381 1.00 0.00 O ATOM 1248 CB LYS A 76 -13.486 8.112 -17.766 1.00 0.00 C ATOM 1249 CG LYS A 76 -12.769 7.102 -16.868 1.00 0.00 C ATOM 1250 CD LYS A 76 -11.351 7.596 -16.574 1.00 0.00 C ATOM 1251 CE LYS A 76 -11.419 8.872 -15.733 1.00 0.00 C ATOM 1252 NZ LYS A 76 -10.434 9.862 -16.254 1.00 0.00 N ATOM 0 H LYS A 76 -15.137 9.485 -19.055 1.00 0.00 H new ATOM 0 HA LYS A 76 -14.814 6.753 -18.789 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -12.917 8.268 -18.682 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -13.553 9.077 -17.264 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -13.320 6.972 -15.937 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -12.732 6.128 -17.356 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -10.790 6.827 -16.043 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -10.822 7.790 -17.507 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.425 9.290 -15.768 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.205 8.644 -14.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.479 10.730 -15.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -9.476 9.461 -16.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -10.658 10.087 -17.244 1.00 0.00 H new ATOM 1266 N GLU A 77 -16.338 7.998 -16.194 1.00 0.00 N ATOM 1267 CA GLU A 77 -17.030 7.609 -14.932 1.00 0.00 C ATOM 1268 C GLU A 77 -17.940 6.404 -15.188 1.00 0.00 C ATOM 1269 O GLU A 77 -17.854 5.397 -14.513 1.00 0.00 O ATOM 1270 CB GLU A 77 -17.870 8.784 -14.427 1.00 0.00 C ATOM 1271 CG GLU A 77 -18.209 8.571 -12.951 1.00 0.00 C ATOM 1272 CD GLU A 77 -18.570 9.911 -12.308 1.00 0.00 C ATOM 1273 OE1 GLU A 77 -17.947 10.900 -12.657 1.00 0.00 O ATOM 1274 OE2 GLU A 77 -19.463 9.925 -11.477 1.00 0.00 O ATOM 0 H GLU A 77 -16.509 8.954 -16.507 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.285 7.343 -14.182 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -17.322 9.718 -14.554 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -18.785 8.869 -15.013 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -19.042 7.875 -12.856 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.360 8.125 -12.433 1.00 0.00 H new ATOM 1281 N ARG A 78 -18.814 6.498 -16.153 1.00 0.00 N ATOM 1282 CA ARG A 78 -19.730 5.358 -16.443 1.00 0.00 C ATOM 1283 C ARG A 78 -18.954 4.219 -17.111 1.00 0.00 C ATOM 1284 O ARG A 78 -19.312 3.064 -17.000 1.00 0.00 O ATOM 1285 CB ARG A 78 -20.845 5.828 -17.378 1.00 0.00 C ATOM 1286 CG ARG A 78 -22.146 5.981 -16.586 1.00 0.00 C ATOM 1287 CD ARG A 78 -22.079 7.252 -15.737 1.00 0.00 C ATOM 1288 NE ARG A 78 -23.211 8.152 -16.099 1.00 0.00 N ATOM 1289 CZ ARG A 78 -24.280 8.188 -15.351 1.00 0.00 C ATOM 1290 NH1 ARG A 78 -24.236 8.757 -14.177 1.00 0.00 N ATOM 1291 NH2 ARG A 78 -25.392 7.654 -15.775 1.00 0.00 N ATOM 0 H ARG A 78 -18.933 7.314 -16.753 1.00 0.00 H new ATOM 0 HA ARG A 78 -20.160 4.998 -15.508 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -20.573 6.778 -17.837 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -20.982 5.111 -18.187 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -22.995 6.030 -17.267 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -22.300 5.111 -15.947 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -22.127 6.998 -14.678 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -21.129 7.761 -15.900 1.00 0.00 H new ATOM 0 HE ARG A 78 -23.150 8.739 -16.931 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -23.366 9.173 -13.844 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -25.071 8.785 -13.592 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -25.427 7.208 -16.692 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -26.227 7.682 -15.190 1.00 0.00 H new ATOM 1305 N LEU A 79 -17.893 4.533 -17.803 1.00 0.00 N ATOM 1306 CA LEU A 79 -17.102 3.463 -18.475 1.00 0.00 C ATOM 1307 C LEU A 79 -16.452 2.574 -17.414 1.00 0.00 C ATOM 1308 O LEU A 79 -16.282 1.384 -17.602 1.00 0.00 O ATOM 1309 CB LEU A 79 -16.014 4.099 -19.344 1.00 0.00 C ATOM 1310 CG LEU A 79 -16.098 3.534 -20.763 1.00 0.00 C ATOM 1311 CD1 LEU A 79 -15.199 4.352 -21.693 1.00 0.00 C ATOM 1312 CD2 LEU A 79 -15.634 2.076 -20.759 1.00 0.00 C ATOM 0 H LEU A 79 -17.540 5.481 -17.932 1.00 0.00 H new ATOM 0 HA LEU A 79 -17.760 2.863 -19.103 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -16.137 5.182 -19.365 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -15.031 3.898 -18.919 1.00 0.00 H new ATOM 0 HG LEU A 79 -17.128 3.587 -21.115 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -15.259 3.949 -22.704 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.528 5.391 -21.696 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.168 4.299 -21.342 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -15.694 1.672 -21.770 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -14.604 2.023 -20.407 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -16.274 1.492 -20.097 1.00 0.00 H new ATOM 1324 N VAL A 80 -16.089 3.143 -16.298 1.00 0.00 N ATOM 1325 CA VAL A 80 -15.455 2.334 -15.224 1.00 0.00 C ATOM 1326 C VAL A 80 -16.221 1.024 -15.059 1.00 0.00 C ATOM 1327 O VAL A 80 -17.354 0.899 -15.480 1.00 0.00 O ATOM 1328 CB VAL A 80 -15.492 3.109 -13.909 1.00 0.00 C ATOM 1329 CG1 VAL A 80 -14.638 2.386 -12.868 1.00 0.00 C ATOM 1330 CG2 VAL A 80 -14.941 4.520 -14.130 1.00 0.00 C ATOM 0 H VAL A 80 -16.205 4.134 -16.085 1.00 0.00 H new ATOM 0 HA VAL A 80 -14.420 2.124 -15.492 1.00 0.00 H new ATOM 0 HB VAL A 80 -16.521 3.173 -13.555 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -14.664 2.939 -11.929 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -15.031 1.382 -12.709 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -13.609 2.321 -13.223 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -14.968 5.072 -13.191 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -13.912 4.457 -14.485 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -15.550 5.036 -14.872 1.00 0.00 H new ATOM 1340 N GLY A 81 -15.615 0.049 -14.445 1.00 0.00 N ATOM 1341 CA GLY A 81 -16.311 -1.253 -14.252 1.00 0.00 C ATOM 1342 C GLY A 81 -16.121 -2.126 -15.494 1.00 0.00 C ATOM 1343 O GLY A 81 -15.772 -3.286 -15.398 1.00 0.00 O ATOM 0 H GLY A 81 -14.668 0.096 -14.068 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -15.915 -1.762 -13.373 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.373 -1.086 -14.072 1.00 0.00 H new ATOM 1347 N ARG A 82 -16.353 -1.577 -16.658 1.00 0.00 N ATOM 1348 CA ARG A 82 -16.196 -2.371 -17.911 1.00 0.00 C ATOM 1349 C ARG A 82 -14.920 -3.215 -17.844 1.00 0.00 C ATOM 1350 O ARG A 82 -14.104 -3.060 -16.957 1.00 0.00 O ATOM 1351 CB ARG A 82 -16.120 -1.421 -19.109 1.00 0.00 C ATOM 1352 CG ARG A 82 -17.531 -0.961 -19.482 1.00 0.00 C ATOM 1353 CD ARG A 82 -18.229 -2.057 -20.290 1.00 0.00 C ATOM 1354 NE ARG A 82 -19.649 -2.173 -19.850 1.00 0.00 N ATOM 1355 CZ ARG A 82 -19.929 -2.637 -18.663 1.00 0.00 C ATOM 1356 NH1 ARG A 82 -19.331 -3.712 -18.226 1.00 0.00 N ATOM 1357 NH2 ARG A 82 -20.806 -2.026 -17.914 1.00 0.00 N ATOM 0 H ARG A 82 -16.645 -0.609 -16.794 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.054 -3.035 -18.023 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -15.497 -0.560 -18.866 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -15.653 -1.923 -19.956 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.103 -0.739 -18.581 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -17.483 -0.040 -20.064 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -18.185 -1.823 -21.354 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -17.716 -3.008 -20.151 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.402 -1.890 -20.477 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -18.646 -4.188 -18.812 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -19.549 -4.076 -17.298 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -21.272 -1.186 -18.257 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -21.025 -2.389 -16.986 1.00 0.00 H new ATOM 1371 N VAL A 83 -14.740 -4.108 -18.778 1.00 0.00 N ATOM 1372 CA VAL A 83 -13.523 -4.964 -18.763 1.00 0.00 C ATOM 1373 C VAL A 83 -12.470 -4.376 -19.701 1.00 0.00 C ATOM 1374 O VAL A 83 -12.781 -3.833 -20.742 1.00 0.00 O ATOM 1375 CB VAL A 83 -13.884 -6.373 -19.233 1.00 0.00 C ATOM 1376 CG1 VAL A 83 -14.595 -6.295 -20.585 1.00 0.00 C ATOM 1377 CG2 VAL A 83 -12.607 -7.204 -19.378 1.00 0.00 C ATOM 0 H VAL A 83 -15.384 -4.281 -19.550 1.00 0.00 H new ATOM 0 HA VAL A 83 -13.126 -5.006 -17.749 1.00 0.00 H new ATOM 0 HB VAL A 83 -14.544 -6.841 -18.502 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -14.852 -7.300 -20.919 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -15.504 -5.702 -20.484 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -13.936 -5.827 -21.316 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -12.863 -8.209 -19.713 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -11.948 -6.735 -20.109 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -12.099 -7.261 -18.415 1.00 0.00 H new ATOM 1387 N ILE A 84 -11.225 -4.474 -19.331 1.00 0.00 N ATOM 1388 CA ILE A 84 -10.145 -3.917 -20.185 1.00 0.00 C ATOM 1389 C ILE A 84 -8.901 -4.801 -20.072 1.00 0.00 C ATOM 1390 O ILE A 84 -8.857 -5.728 -19.287 1.00 0.00 O ATOM 1391 CB ILE A 84 -9.817 -2.500 -19.710 1.00 0.00 C ATOM 1392 CG1 ILE A 84 -9.710 -2.489 -18.183 1.00 0.00 C ATOM 1393 CG2 ILE A 84 -10.934 -1.547 -20.140 1.00 0.00 C ATOM 1394 CD1 ILE A 84 -8.484 -3.292 -17.746 1.00 0.00 C ATOM 0 H ILE A 84 -10.909 -4.919 -18.469 1.00 0.00 H new ATOM 0 HA ILE A 84 -10.470 -3.888 -21.225 1.00 0.00 H new ATOM 0 HB ILE A 84 -8.872 -2.180 -20.149 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -9.633 -1.464 -17.822 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.612 -2.915 -17.743 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -10.701 -0.537 -19.802 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -11.021 -1.555 -21.227 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -11.877 -1.869 -19.698 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -8.411 -3.282 -16.658 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -8.580 -4.321 -18.094 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -7.586 -2.847 -18.174 1.00 0.00 H new ATOM 1406 N LYS A 85 -7.890 -4.525 -20.848 1.00 0.00 N ATOM 1407 CA LYS A 85 -6.653 -5.352 -20.777 1.00 0.00 C ATOM 1408 C LYS A 85 -5.576 -4.594 -20.000 1.00 0.00 C ATOM 1409 O LYS A 85 -5.441 -3.393 -20.119 1.00 0.00 O ATOM 1410 CB LYS A 85 -6.148 -5.638 -22.193 1.00 0.00 C ATOM 1411 CG LYS A 85 -6.027 -4.323 -22.962 1.00 0.00 C ATOM 1412 CD LYS A 85 -5.327 -4.576 -24.298 1.00 0.00 C ATOM 1413 CE LYS A 85 -4.851 -3.244 -24.882 1.00 0.00 C ATOM 1414 NZ LYS A 85 -5.994 -2.560 -25.549 1.00 0.00 N ATOM 0 H LYS A 85 -7.867 -3.764 -21.527 1.00 0.00 H new ATOM 0 HA LYS A 85 -6.875 -6.292 -20.271 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -5.181 -6.139 -22.152 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -6.834 -6.311 -22.707 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.016 -3.897 -23.132 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -5.464 -3.597 -22.376 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -4.480 -5.247 -24.156 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.010 -5.067 -24.992 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -4.445 -2.612 -24.092 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -4.047 -3.415 -25.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -5.672 -1.654 -25.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -6.361 -3.163 -26.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.747 -2.385 -24.854 1.00 0.00 H new ATOM 1428 N THR A 86 -4.810 -5.286 -19.202 1.00 0.00 N ATOM 1429 CA THR A 86 -3.744 -4.604 -18.417 1.00 0.00 C ATOM 1430 C THR A 86 -2.620 -5.596 -18.115 1.00 0.00 C ATOM 1431 O THR A 86 -2.721 -6.773 -18.414 1.00 0.00 O ATOM 1432 CB THR A 86 -4.330 -4.084 -17.105 1.00 0.00 C ATOM 1433 OG1 THR A 86 -5.600 -4.684 -16.886 1.00 0.00 O ATOM 1434 CG2 THR A 86 -4.489 -2.565 -17.180 1.00 0.00 C ATOM 0 H THR A 86 -4.877 -6.294 -19.060 1.00 0.00 H new ATOM 0 HA THR A 86 -3.347 -3.769 -18.994 1.00 0.00 H new ATOM 0 HB THR A 86 -3.660 -4.336 -16.283 1.00 0.00 H new ATOM 0 HG1 THR A 86 -5.977 -4.353 -16.044 1.00 0.00 H new ATOM 0 HG21 THR A 86 -4.907 -2.196 -16.243 1.00 0.00 H new ATOM 0 HG22 THR A 86 -3.515 -2.105 -17.349 1.00 0.00 H new ATOM 0 HG23 THR A 86 -5.158 -2.309 -18.002 1.00 0.00 H new ATOM 1442 N ARG A 87 -1.550 -5.134 -17.525 1.00 0.00 N ATOM 1443 CA ARG A 87 -0.423 -6.051 -17.205 1.00 0.00 C ATOM 1444 C ARG A 87 -0.502 -6.456 -15.733 1.00 0.00 C ATOM 1445 O ARG A 87 -1.002 -5.722 -14.903 1.00 0.00 O ATOM 1446 CB ARG A 87 0.907 -5.340 -17.464 1.00 0.00 C ATOM 1447 CG ARG A 87 0.742 -4.340 -18.609 1.00 0.00 C ATOM 1448 CD ARG A 87 0.242 -5.069 -19.857 1.00 0.00 C ATOM 1449 NE ARG A 87 0.556 -4.255 -21.065 1.00 0.00 N ATOM 1450 CZ ARG A 87 -0.259 -4.261 -22.083 1.00 0.00 C ATOM 1451 NH1 ARG A 87 -1.435 -3.705 -21.979 1.00 0.00 N ATOM 1452 NH2 ARG A 87 0.102 -4.820 -23.206 1.00 0.00 N ATOM 0 H ARG A 87 -1.410 -4.161 -17.252 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.488 -6.939 -17.834 1.00 0.00 H new ATOM 0 HB2 ARG A 87 1.236 -4.824 -16.562 1.00 0.00 H new ATOM 0 HB3 ARG A 87 1.678 -6.069 -17.713 1.00 0.00 H new ATOM 0 HG2 ARG A 87 0.037 -3.559 -18.325 1.00 0.00 H new ATOM 0 HG3 ARG A 87 1.693 -3.850 -18.818 1.00 0.00 H new ATOM 0 HD2 ARG A 87 0.714 -6.049 -19.933 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -0.833 -5.237 -19.787 1.00 0.00 H new ATOM 0 HE ARG A 87 1.407 -3.694 -21.096 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -1.716 -3.266 -21.102 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -2.073 -3.709 -22.775 1.00 0.00 H new ATOM 0 HH21 ARG A 87 1.022 -5.253 -23.288 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -0.536 -4.824 -24.002 1.00 0.00 H new ATOM 1466 N VAL A 88 -0.004 -7.616 -15.401 1.00 0.00 N ATOM 1467 CA VAL A 88 -0.048 -8.063 -13.981 1.00 0.00 C ATOM 1468 C VAL A 88 1.295 -7.758 -13.322 1.00 0.00 C ATOM 1469 O VAL A 88 2.329 -8.233 -13.745 1.00 0.00 O ATOM 1470 CB VAL A 88 -0.311 -9.568 -13.926 1.00 0.00 C ATOM 1471 CG1 VAL A 88 -0.144 -10.061 -12.488 1.00 0.00 C ATOM 1472 CG2 VAL A 88 -1.738 -9.853 -14.399 1.00 0.00 C ATOM 0 H VAL A 88 0.430 -8.272 -16.051 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.846 -7.539 -13.455 1.00 0.00 H new ATOM 0 HB VAL A 88 0.397 -10.085 -14.573 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -0.331 -11.134 -12.447 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.872 -9.857 -12.149 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -0.853 -9.544 -11.841 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.927 -10.926 -14.360 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -2.446 -9.336 -13.751 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.859 -9.500 -15.423 1.00 0.00 H new ATOM 1482 N VAL A 89 1.286 -6.957 -12.294 1.00 0.00 N ATOM 1483 CA VAL A 89 2.563 -6.610 -11.616 1.00 0.00 C ATOM 1484 C VAL A 89 2.945 -7.713 -10.627 1.00 0.00 C ATOM 1485 O VAL A 89 4.110 -7.998 -10.423 1.00 0.00 O ATOM 1486 CB VAL A 89 2.395 -5.288 -10.870 1.00 0.00 C ATOM 1487 CG1 VAL A 89 3.630 -5.025 -10.008 1.00 0.00 C ATOM 1488 CG2 VAL A 89 2.236 -4.155 -11.885 1.00 0.00 C ATOM 0 H VAL A 89 0.451 -6.529 -11.895 1.00 0.00 H new ATOM 0 HA VAL A 89 3.352 -6.513 -12.361 1.00 0.00 H new ATOM 0 HB VAL A 89 1.513 -5.339 -10.232 1.00 0.00 H new ATOM 0 HG11 VAL A 89 3.508 -4.081 -9.476 1.00 0.00 H new ATOM 0 HG12 VAL A 89 3.750 -5.834 -9.288 1.00 0.00 H new ATOM 0 HG13 VAL A 89 4.513 -4.972 -10.644 1.00 0.00 H new ATOM 0 HG21 VAL A 89 2.116 -3.209 -11.358 1.00 0.00 H new ATOM 0 HG22 VAL A 89 3.122 -4.107 -12.519 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.357 -4.341 -12.503 1.00 0.00 H new ATOM 1498 N ARG A 90 1.980 -8.337 -10.009 1.00 0.00 N ATOM 1499 CA ARG A 90 2.299 -9.419 -9.034 1.00 0.00 C ATOM 1500 C ARG A 90 1.028 -9.834 -8.288 1.00 0.00 C ATOM 1501 O ARG A 90 0.569 -9.147 -7.397 1.00 0.00 O ATOM 1502 CB ARG A 90 3.333 -8.909 -8.028 1.00 0.00 C ATOM 1503 CG ARG A 90 4.541 -9.847 -8.016 1.00 0.00 C ATOM 1504 CD ARG A 90 5.660 -9.226 -7.177 1.00 0.00 C ATOM 1505 NE ARG A 90 6.901 -9.131 -7.996 1.00 0.00 N ATOM 1506 CZ ARG A 90 7.838 -10.030 -7.866 1.00 0.00 C ATOM 1507 NH1 ARG A 90 7.556 -11.193 -7.344 1.00 0.00 N ATOM 1508 NH2 ARG A 90 9.054 -9.767 -8.257 1.00 0.00 N ATOM 0 H ARG A 90 0.986 -8.145 -10.136 1.00 0.00 H new ATOM 0 HA ARG A 90 2.701 -10.279 -9.570 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.646 -7.899 -8.293 1.00 0.00 H new ATOM 0 HB3 ARG A 90 2.892 -8.855 -7.033 1.00 0.00 H new ATOM 0 HG2 ARG A 90 4.258 -10.816 -7.605 1.00 0.00 H new ATOM 0 HG3 ARG A 90 4.889 -10.022 -9.034 1.00 0.00 H new ATOM 0 HD2 ARG A 90 5.363 -8.236 -6.831 1.00 0.00 H new ATOM 0 HD3 ARG A 90 5.843 -9.832 -6.290 1.00 0.00 H new ATOM 0 HE ARG A 90 7.018 -8.364 -8.658 1.00 0.00 H new ATOM 0 HH11 ARG A 90 6.605 -11.398 -7.039 1.00 0.00 H new ATOM 0 HH12 ARG A 90 8.287 -11.897 -7.242 1.00 0.00 H new ATOM 0 HH21 ARG A 90 9.273 -8.858 -8.665 1.00 0.00 H new ATOM 0 HH22 ARG A 90 9.786 -10.470 -8.155 1.00 0.00 H new ATOM 1522 N ALA A 91 0.460 -10.953 -8.641 1.00 0.00 N ATOM 1523 CA ALA A 91 -0.778 -11.410 -7.947 1.00 0.00 C ATOM 1524 C ALA A 91 -0.396 -12.336 -6.791 1.00 0.00 C ATOM 1525 O ALA A 91 0.007 -13.464 -6.995 1.00 0.00 O ATOM 1526 CB ALA A 91 -1.668 -12.166 -8.935 1.00 0.00 C ATOM 0 H ALA A 91 0.798 -11.571 -9.379 1.00 0.00 H new ATOM 0 HA ALA A 91 -1.320 -10.547 -7.560 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.573 -12.500 -8.428 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.937 -11.507 -9.760 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.129 -13.031 -9.322 1.00 0.00 H new ATOM 1532 N ASP A 92 -0.517 -11.870 -5.578 1.00 0.00 N ATOM 1533 CA ASP A 92 -0.158 -12.724 -4.412 1.00 0.00 C ATOM 1534 C ASP A 92 -1.104 -12.424 -3.248 1.00 0.00 C ATOM 1535 O ASP A 92 -1.020 -11.388 -2.618 1.00 0.00 O ATOM 1536 CB ASP A 92 1.282 -12.427 -3.988 1.00 0.00 C ATOM 1537 CG ASP A 92 2.005 -13.738 -3.678 1.00 0.00 C ATOM 1538 OD1 ASP A 92 2.298 -14.466 -4.612 1.00 0.00 O ATOM 1539 OD2 ASP A 92 2.254 -13.992 -2.510 1.00 0.00 O ATOM 0 H ASP A 92 -0.849 -10.934 -5.345 1.00 0.00 H new ATOM 0 HA ASP A 92 -0.247 -13.774 -4.690 1.00 0.00 H new ATOM 0 HB2 ASP A 92 1.803 -11.892 -4.782 1.00 0.00 H new ATOM 0 HB3 ASP A 92 1.288 -11.780 -3.111 1.00 0.00 H new ATOM 1544 N GLY A 93 -2.003 -13.322 -2.954 1.00 0.00 N ATOM 1545 CA GLY A 93 -2.953 -13.087 -1.830 1.00 0.00 C ATOM 1546 C GLY A 93 -4.106 -12.202 -2.308 1.00 0.00 C ATOM 1547 O GLY A 93 -4.192 -11.850 -3.468 1.00 0.00 O ATOM 0 H GLY A 93 -2.121 -14.209 -3.444 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.339 -14.038 -1.462 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -2.436 -12.610 -0.997 1.00 0.00 H new ATOM 1551 N LEU A 94 -4.993 -11.840 -1.421 1.00 0.00 N ATOM 1552 CA LEU A 94 -6.141 -10.979 -1.823 1.00 0.00 C ATOM 1553 C LEU A 94 -5.616 -9.656 -2.385 1.00 0.00 C ATOM 1554 O LEU A 94 -6.331 -8.920 -3.035 1.00 0.00 O ATOM 1555 CB LEU A 94 -7.018 -10.700 -0.601 1.00 0.00 C ATOM 1556 CG LEU A 94 -7.838 -11.946 -0.265 1.00 0.00 C ATOM 1557 CD1 LEU A 94 -7.052 -12.831 0.703 1.00 0.00 C ATOM 1558 CD2 LEU A 94 -9.157 -11.525 0.387 1.00 0.00 C ATOM 0 H LEU A 94 -4.972 -12.103 -0.436 1.00 0.00 H new ATOM 0 HA LEU A 94 -6.729 -11.489 -2.586 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.396 -10.421 0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.681 -9.858 -0.801 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.043 -12.503 -1.179 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.638 -13.719 0.942 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.111 -13.130 0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.846 -12.276 1.618 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.743 -12.412 0.627 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.950 -10.968 1.301 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.719 -10.895 -0.302 1.00 0.00 H new ATOM 1570 N TYR A 95 -4.373 -9.348 -2.137 1.00 0.00 N ATOM 1571 CA TYR A 95 -3.803 -8.071 -2.654 1.00 0.00 C ATOM 1572 C TYR A 95 -3.005 -8.348 -3.930 1.00 0.00 C ATOM 1573 O TYR A 95 -2.205 -9.260 -3.987 1.00 0.00 O ATOM 1574 CB TYR A 95 -2.870 -7.469 -1.602 1.00 0.00 C ATOM 1575 CG TYR A 95 -3.547 -6.304 -0.921 1.00 0.00 C ATOM 1576 CD1 TYR A 95 -4.835 -6.453 -0.390 1.00 0.00 C ATOM 1577 CD2 TYR A 95 -2.884 -5.074 -0.817 1.00 0.00 C ATOM 1578 CE1 TYR A 95 -5.459 -5.372 0.248 1.00 0.00 C ATOM 1579 CE2 TYR A 95 -3.508 -3.993 -0.181 1.00 0.00 C ATOM 1580 CZ TYR A 95 -4.796 -4.142 0.351 1.00 0.00 C ATOM 1581 OH TYR A 95 -5.411 -3.078 0.978 1.00 0.00 O ATOM 0 H TYR A 95 -3.727 -9.925 -1.599 1.00 0.00 H new ATOM 0 HA TYR A 95 -4.613 -7.375 -2.871 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -2.602 -8.226 -0.865 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -1.943 -7.139 -2.071 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.347 -7.400 -0.472 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -1.892 -4.959 -1.227 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -6.451 -5.487 0.660 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -2.997 -3.045 -0.101 1.00 0.00 H new ATOM 0 HH TYR A 95 -4.814 -2.301 0.964 1.00 0.00 H new ATOM 1591 N VAL A 96 -3.211 -7.564 -4.953 1.00 0.00 N ATOM 1592 CA VAL A 96 -2.455 -7.785 -6.218 1.00 0.00 C ATOM 1593 C VAL A 96 -2.017 -6.438 -6.796 1.00 0.00 C ATOM 1594 O VAL A 96 -2.664 -5.431 -6.601 1.00 0.00 O ATOM 1595 CB VAL A 96 -3.350 -8.501 -7.231 1.00 0.00 C ATOM 1596 CG1 VAL A 96 -2.572 -8.729 -8.528 1.00 0.00 C ATOM 1597 CG2 VAL A 96 -3.790 -9.849 -6.659 1.00 0.00 C ATOM 0 H VAL A 96 -3.867 -6.783 -4.968 1.00 0.00 H new ATOM 0 HA VAL A 96 -1.577 -8.396 -6.010 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.228 -7.888 -7.436 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.210 -9.239 -9.250 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.257 -7.769 -8.937 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -1.694 -9.342 -8.323 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.428 -10.360 -7.380 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -2.912 -10.461 -6.454 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -4.344 -9.688 -5.734 1.00 0.00 H new ATOM 1607 N ASP A 97 -0.927 -6.417 -7.513 1.00 0.00 N ATOM 1608 CA ASP A 97 -0.453 -5.139 -8.113 1.00 0.00 C ATOM 1609 C ASP A 97 -0.842 -5.118 -9.594 1.00 0.00 C ATOM 1610 O ASP A 97 -0.866 -6.141 -10.249 1.00 0.00 O ATOM 1611 CB ASP A 97 1.068 -5.044 -7.972 1.00 0.00 C ATOM 1612 CG ASP A 97 1.442 -5.041 -6.488 1.00 0.00 C ATOM 1613 OD1 ASP A 97 0.650 -5.527 -5.697 1.00 0.00 O ATOM 1614 OD2 ASP A 97 2.514 -4.555 -6.169 1.00 0.00 O ATOM 0 H ASP A 97 -0.344 -7.231 -7.709 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.910 -4.292 -7.602 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.544 -5.885 -8.477 1.00 0.00 H new ATOM 0 HB3 ASP A 97 1.433 -4.136 -8.452 1.00 0.00 H new ATOM 1619 N LEU A 98 -1.165 -3.972 -10.127 1.00 0.00 N ATOM 1620 CA LEU A 98 -1.570 -3.917 -11.560 1.00 0.00 C ATOM 1621 C LEU A 98 -0.950 -2.704 -12.249 1.00 0.00 C ATOM 1622 O LEU A 98 -0.918 -1.610 -11.714 1.00 0.00 O ATOM 1623 CB LEU A 98 -3.093 -3.815 -11.658 1.00 0.00 C ATOM 1624 CG LEU A 98 -3.627 -4.950 -12.532 1.00 0.00 C ATOM 1625 CD1 LEU A 98 -3.244 -4.688 -13.989 1.00 0.00 C ATOM 1626 CD2 LEU A 98 -3.019 -6.279 -12.076 1.00 0.00 C ATOM 0 H LEU A 98 -1.166 -3.078 -9.637 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.220 -4.825 -12.051 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.536 -3.869 -10.664 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.377 -2.852 -12.082 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.712 -5.000 -12.441 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.623 -5.495 -14.616 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -3.677 -3.742 -14.315 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -2.159 -4.640 -14.077 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.401 -7.087 -12.700 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.934 -6.233 -12.166 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -3.289 -6.465 -11.036 1.00 0.00 H new ATOM 1638 N ARG A 99 -0.471 -2.894 -13.448 1.00 0.00 N ATOM 1639 CA ARG A 99 0.135 -1.766 -14.197 1.00 0.00 C ATOM 1640 C ARG A 99 -0.155 -1.943 -15.689 1.00 0.00 C ATOM 1641 O ARG A 99 0.116 -2.976 -16.270 1.00 0.00 O ATOM 1642 CB ARG A 99 1.645 -1.743 -13.958 1.00 0.00 C ATOM 1643 CG ARG A 99 1.931 -1.100 -12.598 1.00 0.00 C ATOM 1644 CD ARG A 99 3.329 -0.481 -12.608 1.00 0.00 C ATOM 1645 NE ARG A 99 4.013 -0.780 -11.317 1.00 0.00 N ATOM 1646 CZ ARG A 99 5.308 -0.650 -11.219 1.00 0.00 C ATOM 1647 NH1 ARG A 99 5.877 0.484 -11.526 1.00 0.00 N ATOM 1648 NH2 ARG A 99 6.035 -1.656 -10.815 1.00 0.00 N ATOM 0 H ARG A 99 -0.475 -3.787 -13.940 1.00 0.00 H new ATOM 0 HA ARG A 99 -0.291 -0.824 -13.853 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.045 -2.757 -13.985 1.00 0.00 H new ATOM 0 HB3 ARG A 99 2.142 -1.183 -14.750 1.00 0.00 H new ATOM 0 HG2 ARG A 99 1.185 -0.335 -12.382 1.00 0.00 H new ATOM 0 HG3 ARG A 99 1.859 -1.848 -11.808 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.909 -0.880 -13.440 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.260 0.597 -12.755 1.00 0.00 H new ATOM 0 HE ARG A 99 3.469 -1.086 -10.510 1.00 0.00 H new ATOM 0 HH11 ARG A 99 5.309 1.270 -11.843 1.00 0.00 H new ATOM 0 HH12 ARG A 99 6.889 0.584 -11.449 1.00 0.00 H new ATOM 0 HH21 ARG A 99 5.591 -2.543 -10.576 1.00 0.00 H new ATOM 0 HH22 ARG A 99 7.047 -1.555 -10.738 1.00 0.00 H new ATOM 1662 N ARG A 100 -0.715 -0.943 -16.310 1.00 0.00 N ATOM 1663 CA ARG A 100 -1.032 -1.050 -17.761 1.00 0.00 C ATOM 1664 C ARG A 100 0.178 -0.604 -18.584 1.00 0.00 C ATOM 1665 O ARG A 100 1.070 0.056 -18.088 1.00 0.00 O ATOM 1666 CB ARG A 100 -2.229 -0.153 -18.085 1.00 0.00 C ATOM 1667 CG ARG A 100 -2.806 -0.542 -19.448 1.00 0.00 C ATOM 1668 CD ARG A 100 -2.450 0.532 -20.478 1.00 0.00 C ATOM 1669 NE ARG A 100 -3.696 1.187 -20.964 1.00 0.00 N ATOM 1670 CZ ARG A 100 -3.707 2.467 -21.216 1.00 0.00 C ATOM 1671 NH1 ARG A 100 -2.582 3.108 -21.390 1.00 0.00 N ATOM 1672 NH2 ARG A 100 -4.841 3.107 -21.294 1.00 0.00 N ATOM 0 H ARG A 100 -0.967 -0.056 -15.875 1.00 0.00 H new ATOM 0 HA ARG A 100 -1.274 -2.084 -18.006 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -2.992 -0.254 -17.313 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -1.921 0.893 -18.094 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -2.408 -1.507 -19.761 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -3.888 -0.650 -19.379 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -1.787 1.273 -20.032 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -1.912 0.085 -21.314 1.00 0.00 H new ATOM 0 HE ARG A 100 -4.542 0.634 -21.100 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -1.695 2.608 -21.329 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -2.590 4.109 -21.587 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -5.719 2.607 -21.158 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -4.849 4.108 -21.491 1.00 0.00 H new ATOM 1686 N PHE A 101 0.215 -0.958 -19.840 1.00 0.00 N ATOM 1687 CA PHE A 101 1.365 -0.552 -20.696 1.00 0.00 C ATOM 1688 C PHE A 101 2.660 -1.145 -20.134 1.00 0.00 C ATOM 1689 O PHE A 101 2.921 -1.083 -18.949 1.00 0.00 O ATOM 1690 CB PHE A 101 1.473 0.974 -20.716 1.00 0.00 C ATOM 1691 CG PHE A 101 2.255 1.406 -21.933 1.00 0.00 C ATOM 1692 CD1 PHE A 101 1.773 1.110 -23.215 1.00 0.00 C ATOM 1693 CD2 PHE A 101 3.461 2.103 -21.782 1.00 0.00 C ATOM 1694 CE1 PHE A 101 2.497 1.510 -24.346 1.00 0.00 C ATOM 1695 CE2 PHE A 101 4.185 2.505 -22.913 1.00 0.00 C ATOM 1696 CZ PHE A 101 3.703 2.208 -24.195 1.00 0.00 C ATOM 0 H PHE A 101 -0.502 -1.511 -20.310 1.00 0.00 H new ATOM 0 HA PHE A 101 1.207 -0.921 -21.710 1.00 0.00 H new ATOM 0 HB2 PHE A 101 0.478 1.420 -20.732 1.00 0.00 H new ATOM 0 HB3 PHE A 101 1.965 1.327 -19.810 1.00 0.00 H new ATOM 0 HD1 PHE A 101 0.843 0.573 -23.331 1.00 0.00 H new ATOM 0 HD2 PHE A 101 3.833 2.331 -20.794 1.00 0.00 H new ATOM 0 HE1 PHE A 101 2.126 1.281 -25.334 1.00 0.00 H new ATOM 0 HE2 PHE A 101 5.114 3.043 -22.796 1.00 0.00 H new ATOM 0 HZ PHE A 101 4.261 2.517 -25.067 1.00 0.00 H new ATOM 1706 N PHE A 102 3.474 -1.718 -20.979 1.00 0.00 N ATOM 1707 CA PHE A 102 4.754 -2.311 -20.498 1.00 0.00 C ATOM 1708 C PHE A 102 5.517 -2.908 -21.683 1.00 0.00 C ATOM 1709 O PHE A 102 6.069 -2.140 -22.454 1.00 0.00 O ATOM 1710 CB PHE A 102 4.458 -3.412 -19.477 1.00 0.00 C ATOM 1711 CG PHE A 102 5.640 -3.568 -18.551 1.00 0.00 C ATOM 1712 CD1 PHE A 102 6.841 -4.108 -19.032 1.00 0.00 C ATOM 1713 CD2 PHE A 102 5.537 -3.174 -17.210 1.00 0.00 C ATOM 1714 CE1 PHE A 102 7.938 -4.253 -18.173 1.00 0.00 C ATOM 1715 CE2 PHE A 102 6.635 -3.318 -16.352 1.00 0.00 C ATOM 1716 CZ PHE A 102 7.835 -3.857 -16.832 1.00 0.00 C ATOM 1717 OXT PHE A 102 5.537 -4.122 -21.798 1.00 0.00 O ATOM 0 H PHE A 102 3.307 -1.801 -21.982 1.00 0.00 H new ATOM 0 HA PHE A 102 5.358 -1.534 -20.029 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.564 -3.162 -18.905 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.256 -4.353 -19.989 1.00 0.00 H new ATOM 0 HD1 PHE A 102 6.920 -4.412 -20.065 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.612 -2.760 -16.838 1.00 0.00 H new ATOM 0 HE1 PHE A 102 8.863 -4.670 -18.544 1.00 0.00 H new ATOM 0 HE2 PHE A 102 6.556 -3.013 -15.319 1.00 0.00 H new ATOM 0 HZ PHE A 102 8.681 -3.968 -16.170 1.00 0.00 H new TER 1727 PHE A 102