USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=22 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 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot -62:sc= 0.763 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 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=-0.048) USER MOD Single : A 16 LYS NZ :NH3+ 153:sc= -0.047 (180deg=-0.271) USER MOD Single : A 17 ASN : amide:sc= -0.118 K(o=-0.12,f=-1.3) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= -0.278 K(o=-0.28,f=-3.1!) USER MOD Single : A 22 THR OG1 : rot -58:sc= 0.685 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -1.24 K(o=-1.2,f=-0.21) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ -98:sc= -0.0328 (180deg=-1.06) 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 HE2:sc= -0.666 X(o=-0.67,f=-1.1) USER MOD Single : A 59 CYS SG : rot 180:sc= -0.453 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.664 X(o=-0.66,f=-0.18) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.0188 K(o=-0.019,f=-0.69) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 161:sc= -0.0024 (180deg=-0.256) USER MOD Single : A 85 LYS NZ :NH3+ -154:sc= -0.0653 (180deg=-0.432) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.437 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.835 -57.355 -32.934 1.00 0.00 N ATOM 2 CA MET A 1 23.683 -56.394 -33.694 1.00 0.00 C ATOM 3 C MET A 1 23.658 -55.031 -33.001 1.00 0.00 C ATOM 4 O MET A 1 23.193 -54.053 -33.551 1.00 0.00 O ATOM 5 CB MET A 1 23.141 -56.252 -35.118 1.00 0.00 C ATOM 6 CG MET A 1 24.129 -56.874 -36.107 1.00 0.00 C ATOM 7 SD MET A 1 24.131 -55.914 -37.641 1.00 0.00 S ATOM 8 CE MET A 1 25.355 -56.908 -38.529 1.00 0.00 C ATOM 0 H1 MET A 1 22.852 -58.282 -33.406 1.00 0.00 H new ATOM 0 H2 MET A 1 23.203 -57.452 -31.966 1.00 0.00 H new ATOM 0 H3 MET A 1 21.857 -57.003 -32.899 1.00 0.00 H new ATOM 0 HA MET A 1 24.708 -56.764 -33.730 1.00 0.00 H new ATOM 0 HB2 MET A 1 22.171 -56.743 -35.200 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.986 -55.200 -35.356 1.00 0.00 H new ATOM 0 HG2 MET A 1 25.130 -56.892 -35.675 1.00 0.00 H new ATOM 0 HG3 MET A 1 23.852 -57.908 -36.313 1.00 0.00 H new ATOM 0 HE1 MET A 1 25.514 -56.487 -39.522 1.00 0.00 H new ATOM 0 HE2 MET A 1 26.295 -56.905 -37.978 1.00 0.00 H new ATOM 0 HE3 MET A 1 24.993 -57.932 -38.623 1.00 0.00 H new ATOM 20 N THR A 2 24.155 -54.957 -31.796 1.00 0.00 N ATOM 21 CA THR A 2 24.158 -53.655 -31.071 1.00 0.00 C ATOM 22 C THR A 2 25.492 -53.474 -30.345 1.00 0.00 C ATOM 23 O THR A 2 25.533 -53.124 -29.182 1.00 0.00 O ATOM 24 CB THR A 2 23.016 -53.635 -30.052 1.00 0.00 C ATOM 25 OG1 THR A 2 23.018 -52.390 -29.367 1.00 0.00 O ATOM 26 CG2 THR A 2 23.206 -54.772 -29.047 1.00 0.00 C ATOM 0 H THR A 2 24.558 -55.741 -31.283 1.00 0.00 H new ATOM 0 HA THR A 2 24.022 -52.843 -31.786 1.00 0.00 H new ATOM 0 HB THR A 2 22.065 -53.765 -30.569 1.00 0.00 H new ATOM 0 HG1 THR A 2 23.858 -52.290 -28.872 1.00 0.00 H new ATOM 0 HG21 THR A 2 22.392 -54.757 -28.322 1.00 0.00 H new ATOM 0 HG22 THR A 2 23.205 -55.727 -29.573 1.00 0.00 H new ATOM 0 HG23 THR A 2 24.156 -54.644 -28.529 1.00 0.00 H new ATOM 34 N VAL A 3 26.585 -53.704 -31.021 1.00 0.00 N ATOM 35 CA VAL A 3 27.913 -53.540 -30.365 1.00 0.00 C ATOM 36 C VAL A 3 28.005 -52.138 -29.758 1.00 0.00 C ATOM 37 O VAL A 3 28.472 -51.959 -28.651 1.00 0.00 O ATOM 38 CB VAL A 3 29.024 -53.721 -31.402 1.00 0.00 C ATOM 39 CG1 VAL A 3 30.372 -53.363 -30.776 1.00 0.00 C ATOM 40 CG2 VAL A 3 29.052 -55.178 -31.869 1.00 0.00 C ATOM 0 H VAL A 3 26.615 -53.998 -31.997 1.00 0.00 H new ATOM 0 HA VAL A 3 28.027 -54.288 -29.581 1.00 0.00 H new ATOM 0 HB VAL A 3 28.834 -53.068 -32.254 1.00 0.00 H new ATOM 0 HG11 VAL A 3 31.162 -53.492 -31.515 1.00 0.00 H new ATOM 0 HG12 VAL A 3 30.354 -52.326 -30.442 1.00 0.00 H new ATOM 0 HG13 VAL A 3 30.562 -54.015 -29.924 1.00 0.00 H new ATOM 0 HG21 VAL A 3 29.843 -55.308 -32.608 1.00 0.00 H new ATOM 0 HG22 VAL A 3 29.241 -55.830 -31.016 1.00 0.00 H new ATOM 0 HG23 VAL A 3 28.092 -55.435 -32.316 1.00 0.00 H new ATOM 50 N ILE A 4 27.560 -51.142 -30.475 1.00 0.00 N ATOM 51 CA ILE A 4 27.617 -49.752 -29.940 1.00 0.00 C ATOM 52 C ILE A 4 26.212 -49.149 -29.943 1.00 0.00 C ATOM 53 O ILE A 4 25.352 -49.560 -30.696 1.00 0.00 O ATOM 54 CB ILE A 4 28.539 -48.902 -30.818 1.00 0.00 C ATOM 55 CG1 ILE A 4 28.837 -47.579 -30.109 1.00 0.00 C ATOM 56 CG2 ILE A 4 27.855 -48.619 -32.156 1.00 0.00 C ATOM 57 CD1 ILE A 4 29.734 -47.839 -28.897 1.00 0.00 C ATOM 0 H ILE A 4 27.159 -51.231 -31.409 1.00 0.00 H new ATOM 0 HA ILE A 4 28.004 -49.771 -28.921 1.00 0.00 H new ATOM 0 HB ILE A 4 29.470 -49.440 -30.994 1.00 0.00 H new ATOM 0 HG12 ILE A 4 29.327 -46.889 -30.796 1.00 0.00 H new ATOM 0 HG13 ILE A 4 27.907 -47.107 -29.792 1.00 0.00 H new ATOM 0 HG21 ILE A 4 28.513 -48.014 -32.780 1.00 0.00 H new ATOM 0 HG22 ILE A 4 27.641 -49.561 -32.661 1.00 0.00 H new ATOM 0 HG23 ILE A 4 26.923 -48.081 -31.982 1.00 0.00 H new ATOM 0 HD11 ILE A 4 29.946 -46.896 -28.392 1.00 0.00 H new ATOM 0 HD12 ILE A 4 29.227 -48.514 -28.207 1.00 0.00 H new ATOM 0 HD13 ILE A 4 30.669 -48.292 -29.227 1.00 0.00 H new ATOM 69 N LYS A 5 25.969 -48.176 -29.107 1.00 0.00 N ATOM 70 CA LYS A 5 24.619 -47.551 -29.066 1.00 0.00 C ATOM 71 C LYS A 5 24.597 -46.317 -29.973 1.00 0.00 C ATOM 72 O LYS A 5 25.629 -45.870 -30.433 1.00 0.00 O ATOM 73 CB LYS A 5 24.289 -47.137 -27.632 1.00 0.00 C ATOM 74 CG LYS A 5 23.167 -48.026 -27.091 1.00 0.00 C ATOM 75 CD LYS A 5 23.757 -49.083 -26.156 1.00 0.00 C ATOM 76 CE LYS A 5 22.829 -50.298 -26.109 1.00 0.00 C ATOM 77 NZ LYS A 5 21.922 -50.185 -24.932 1.00 0.00 N ATOM 0 H LYS A 5 26.648 -47.788 -28.452 1.00 0.00 H new ATOM 0 HA LYS A 5 23.878 -48.270 -29.415 1.00 0.00 H new ATOM 0 HB2 LYS A 5 25.175 -47.227 -27.003 1.00 0.00 H new ATOM 0 HB3 LYS A 5 23.984 -46.091 -27.605 1.00 0.00 H new ATOM 0 HG2 LYS A 5 22.435 -47.421 -26.556 1.00 0.00 H new ATOM 0 HG3 LYS A 5 22.641 -48.508 -27.915 1.00 0.00 H new ATOM 0 HD2 LYS A 5 24.746 -49.381 -26.504 1.00 0.00 H new ATOM 0 HD3 LYS A 5 23.883 -48.669 -25.155 1.00 0.00 H new ATOM 0 HE2 LYS A 5 22.245 -50.359 -27.027 1.00 0.00 H new ATOM 0 HE3 LYS A 5 23.415 -51.215 -26.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 21.291 -51.011 -24.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 22.488 -50.147 -24.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 21.354 -49.318 -25.014 1.00 0.00 H new ATOM 91 N PRO A 6 23.415 -45.806 -30.203 1.00 0.00 N ATOM 92 CA PRO A 6 23.214 -44.621 -31.055 1.00 0.00 C ATOM 93 C PRO A 6 23.571 -43.346 -30.286 1.00 0.00 C ATOM 94 O PRO A 6 22.961 -43.018 -29.287 1.00 0.00 O ATOM 95 CB PRO A 6 21.718 -44.663 -31.380 1.00 0.00 C ATOM 96 CG PRO A 6 21.053 -45.507 -30.266 1.00 0.00 C ATOM 97 CD PRO A 6 22.169 -46.361 -29.636 1.00 0.00 C ATOM 0 HA PRO A 6 23.839 -44.622 -31.948 1.00 0.00 H new ATOM 0 HB2 PRO A 6 21.298 -43.657 -31.408 1.00 0.00 H new ATOM 0 HB3 PRO A 6 21.546 -45.108 -32.360 1.00 0.00 H new ATOM 0 HG2 PRO A 6 20.588 -44.864 -29.518 1.00 0.00 H new ATOM 0 HG3 PRO A 6 20.266 -46.140 -30.677 1.00 0.00 H new ATOM 0 HD2 PRO A 6 22.160 -46.289 -28.548 1.00 0.00 H new ATOM 0 HD3 PRO A 6 22.053 -47.415 -29.886 1.00 0.00 H new ATOM 105 N SER A 7 24.556 -42.624 -30.744 1.00 0.00 N ATOM 106 CA SER A 7 24.955 -41.373 -30.041 1.00 0.00 C ATOM 107 C SER A 7 23.932 -40.274 -30.332 1.00 0.00 C ATOM 108 O SER A 7 23.029 -40.446 -31.128 1.00 0.00 O ATOM 109 CB SER A 7 26.333 -40.930 -30.536 1.00 0.00 C ATOM 110 OG SER A 7 27.255 -40.970 -29.454 1.00 0.00 O ATOM 0 H SER A 7 25.102 -42.847 -31.576 1.00 0.00 H new ATOM 0 HA SER A 7 24.994 -41.556 -28.967 1.00 0.00 H new ATOM 0 HB2 SER A 7 26.670 -41.583 -31.341 1.00 0.00 H new ATOM 0 HB3 SER A 7 26.278 -39.921 -30.945 1.00 0.00 H new ATOM 0 HG SER A 7 28.140 -40.688 -29.768 1.00 0.00 H new ATOM 116 N SER A 8 24.066 -39.144 -29.693 1.00 0.00 N ATOM 117 CA SER A 8 23.102 -38.034 -29.933 1.00 0.00 C ATOM 118 C SER A 8 23.837 -36.695 -29.851 1.00 0.00 C ATOM 119 O SER A 8 24.436 -36.364 -28.847 1.00 0.00 O ATOM 120 CB SER A 8 22.001 -38.079 -28.873 1.00 0.00 C ATOM 121 OG SER A 8 21.207 -39.241 -29.072 1.00 0.00 O ATOM 0 H SER A 8 24.801 -38.942 -29.015 1.00 0.00 H new ATOM 0 HA SER A 8 22.658 -38.144 -30.922 1.00 0.00 H new ATOM 0 HB2 SER A 8 22.440 -38.091 -27.876 1.00 0.00 H new ATOM 0 HB3 SER A 8 21.381 -37.185 -28.938 1.00 0.00 H new ATOM 0 HG SER A 8 20.501 -39.275 -28.393 1.00 0.00 H new ATOM 127 N ARG A 9 23.800 -35.924 -30.903 1.00 0.00 N ATOM 128 CA ARG A 9 24.500 -34.608 -30.886 1.00 0.00 C ATOM 129 C ARG A 9 23.722 -33.606 -31.746 1.00 0.00 C ATOM 130 O ARG A 9 24.029 -33.422 -32.907 1.00 0.00 O ATOM 131 CB ARG A 9 25.911 -34.776 -31.450 1.00 0.00 C ATOM 132 CG ARG A 9 26.847 -33.755 -30.799 1.00 0.00 C ATOM 133 CD ARG A 9 27.642 -33.027 -31.883 1.00 0.00 C ATOM 134 NE ARG A 9 28.141 -34.013 -32.881 1.00 0.00 N ATOM 135 CZ ARG A 9 29.312 -34.566 -32.723 1.00 0.00 C ATOM 136 NH1 ARG A 9 29.474 -35.510 -31.837 1.00 0.00 N ATOM 137 NH2 ARG A 9 30.321 -34.173 -33.450 1.00 0.00 N ATOM 0 H ARG A 9 23.316 -36.148 -31.773 1.00 0.00 H new ATOM 0 HA ARG A 9 24.559 -34.239 -29.862 1.00 0.00 H new ATOM 0 HB2 ARG A 9 26.271 -35.787 -31.261 1.00 0.00 H new ATOM 0 HB3 ARG A 9 25.901 -34.638 -32.531 1.00 0.00 H new ATOM 0 HG2 ARG A 9 26.270 -33.039 -30.213 1.00 0.00 H new ATOM 0 HG3 ARG A 9 27.526 -34.257 -30.110 1.00 0.00 H new ATOM 0 HD2 ARG A 9 27.013 -32.284 -32.373 1.00 0.00 H new ATOM 0 HD3 ARG A 9 28.479 -32.491 -31.436 1.00 0.00 H new ATOM 0 HE ARG A 9 27.567 -34.256 -33.688 1.00 0.00 H new ATOM 0 HH11 ARG A 9 28.685 -35.816 -31.268 1.00 0.00 H new ATOM 0 HH12 ARG A 9 30.390 -35.942 -31.714 1.00 0.00 H new ATOM 0 HH21 ARG A 9 30.194 -33.434 -34.141 1.00 0.00 H new ATOM 0 HH22 ARG A 9 31.237 -34.605 -33.327 1.00 0.00 H new ATOM 151 N PRO A 10 22.738 -32.988 -31.145 1.00 0.00 N ATOM 152 CA PRO A 10 21.892 -31.994 -31.826 1.00 0.00 C ATOM 153 C PRO A 10 22.622 -30.652 -31.927 1.00 0.00 C ATOM 154 O PRO A 10 23.807 -30.558 -31.678 1.00 0.00 O ATOM 155 CB PRO A 10 20.665 -31.883 -30.916 1.00 0.00 C ATOM 156 CG PRO A 10 21.116 -32.366 -29.516 1.00 0.00 C ATOM 157 CD PRO A 10 22.377 -33.224 -29.732 1.00 0.00 C ATOM 0 HA PRO A 10 21.634 -32.276 -32.847 1.00 0.00 H new ATOM 0 HB2 PRO A 10 20.303 -30.856 -30.875 1.00 0.00 H new ATOM 0 HB3 PRO A 10 19.845 -32.495 -31.293 1.00 0.00 H new ATOM 0 HG2 PRO A 10 21.331 -31.519 -28.864 1.00 0.00 H new ATOM 0 HG3 PRO A 10 20.330 -32.947 -29.035 1.00 0.00 H new ATOM 0 HD2 PRO A 10 23.182 -32.925 -29.060 1.00 0.00 H new ATOM 0 HD3 PRO A 10 22.178 -34.279 -29.542 1.00 0.00 H new ATOM 165 N ARG A 11 21.923 -29.611 -32.293 1.00 0.00 N ATOM 166 CA ARG A 11 22.578 -28.278 -32.411 1.00 0.00 C ATOM 167 C ARG A 11 22.928 -27.754 -31.015 1.00 0.00 C ATOM 168 O ARG A 11 22.240 -28.042 -30.056 1.00 0.00 O ATOM 169 CB ARG A 11 21.623 -27.301 -33.101 1.00 0.00 C ATOM 170 CG ARG A 11 20.953 -27.996 -34.287 1.00 0.00 C ATOM 171 CD ARG A 11 19.434 -27.962 -34.107 1.00 0.00 C ATOM 172 NE ARG A 11 18.834 -27.050 -35.122 1.00 0.00 N ATOM 173 CZ ARG A 11 17.642 -26.554 -34.930 1.00 0.00 C ATOM 174 NH1 ARG A 11 16.642 -27.348 -34.663 1.00 0.00 N ATOM 175 NH2 ARG A 11 17.450 -25.266 -35.008 1.00 0.00 N ATOM 0 H ARG A 11 20.928 -29.627 -32.515 1.00 0.00 H new ATOM 0 HA ARG A 11 23.490 -28.372 -33.001 1.00 0.00 H new ATOM 0 HB2 ARG A 11 20.868 -26.954 -32.395 1.00 0.00 H new ATOM 0 HB3 ARG A 11 22.169 -26.421 -33.442 1.00 0.00 H new ATOM 0 HG2 ARG A 11 21.231 -27.500 -35.217 1.00 0.00 H new ATOM 0 HG3 ARG A 11 21.298 -29.027 -34.360 1.00 0.00 H new ATOM 0 HD2 ARG A 11 19.022 -28.965 -34.215 1.00 0.00 H new ATOM 0 HD3 ARG A 11 19.184 -27.621 -33.103 1.00 0.00 H new ATOM 0 HE ARG A 11 19.355 -26.814 -35.967 1.00 0.00 H new ATOM 0 HH11 ARG A 11 16.792 -28.355 -34.604 1.00 0.00 H new ATOM 0 HH12 ARG A 11 15.710 -26.962 -34.513 1.00 0.00 H new ATOM 0 HH21 ARG A 11 18.232 -24.646 -35.219 1.00 0.00 H new ATOM 0 HH22 ARG A 11 16.518 -24.879 -34.858 1.00 0.00 H new ATOM 189 N PRO A 12 23.993 -26.995 -30.947 1.00 0.00 N ATOM 190 CA PRO A 12 24.470 -26.408 -29.683 1.00 0.00 C ATOM 191 C PRO A 12 23.614 -25.198 -29.298 1.00 0.00 C ATOM 192 O PRO A 12 23.837 -24.095 -29.757 1.00 0.00 O ATOM 193 CB PRO A 12 25.907 -25.985 -30.004 1.00 0.00 C ATOM 194 CG PRO A 12 25.984 -25.832 -31.542 1.00 0.00 C ATOM 195 CD PRO A 12 24.819 -26.654 -32.124 1.00 0.00 C ATOM 0 HA PRO A 12 24.413 -27.097 -28.841 1.00 0.00 H new ATOM 0 HB2 PRO A 12 26.156 -25.047 -29.507 1.00 0.00 H new ATOM 0 HB3 PRO A 12 26.619 -26.731 -29.652 1.00 0.00 H new ATOM 0 HG2 PRO A 12 25.902 -24.784 -31.832 1.00 0.00 H new ATOM 0 HG3 PRO A 12 26.940 -26.193 -31.920 1.00 0.00 H new ATOM 0 HD2 PRO A 12 24.252 -26.078 -32.855 1.00 0.00 H new ATOM 0 HD3 PRO A 12 25.178 -27.549 -32.632 1.00 0.00 H new ATOM 203 N ARG A 13 22.633 -25.397 -28.460 1.00 0.00 N ATOM 204 CA ARG A 13 21.763 -24.260 -28.047 1.00 0.00 C ATOM 205 C ARG A 13 22.503 -23.399 -27.022 1.00 0.00 C ATOM 206 O ARG A 13 22.592 -23.740 -25.859 1.00 0.00 O ATOM 207 CB ARG A 13 20.477 -24.805 -27.420 1.00 0.00 C ATOM 208 CG ARG A 13 19.612 -25.452 -28.503 1.00 0.00 C ATOM 209 CD ARG A 13 18.219 -24.819 -28.491 1.00 0.00 C ATOM 210 NE ARG A 13 17.696 -24.742 -29.884 1.00 0.00 N ATOM 211 CZ ARG A 13 18.062 -23.764 -30.664 1.00 0.00 C ATOM 212 NH1 ARG A 13 19.121 -23.890 -31.416 1.00 0.00 N ATOM 213 NH2 ARG A 13 17.369 -22.658 -30.694 1.00 0.00 N ATOM 0 H ARG A 13 22.397 -26.298 -28.044 1.00 0.00 H new ATOM 0 HA ARG A 13 21.515 -23.655 -28.919 1.00 0.00 H new ATOM 0 HB2 ARG A 13 20.718 -25.536 -26.648 1.00 0.00 H new ATOM 0 HB3 ARG A 13 19.927 -23.999 -26.935 1.00 0.00 H new ATOM 0 HG2 ARG A 13 20.075 -25.319 -29.481 1.00 0.00 H new ATOM 0 HG3 ARG A 13 19.537 -26.525 -28.330 1.00 0.00 H new ATOM 0 HD2 ARG A 13 17.545 -25.409 -27.870 1.00 0.00 H new ATOM 0 HD3 ARG A 13 18.265 -23.822 -28.053 1.00 0.00 H new ATOM 0 HE ARG A 13 17.052 -25.454 -30.227 1.00 0.00 H new ATOM 0 HH11 ARG A 13 19.663 -24.754 -31.394 1.00 0.00 H new ATOM 0 HH12 ARG A 13 19.407 -23.124 -32.026 1.00 0.00 H new ATOM 0 HH21 ARG A 13 16.541 -22.559 -30.107 1.00 0.00 H new ATOM 0 HH22 ARG A 13 17.656 -21.893 -31.305 1.00 0.00 H new ATOM 227 N LYS A 14 23.034 -22.282 -27.441 1.00 0.00 N ATOM 228 CA LYS A 14 23.766 -21.401 -26.488 1.00 0.00 C ATOM 229 C LYS A 14 22.762 -20.534 -25.726 1.00 0.00 C ATOM 230 O LYS A 14 22.397 -20.828 -24.605 1.00 0.00 O ATOM 231 CB LYS A 14 24.736 -20.504 -27.260 1.00 0.00 C ATOM 232 CG LYS A 14 25.866 -21.356 -27.839 1.00 0.00 C ATOM 233 CD LYS A 14 27.198 -20.618 -27.680 1.00 0.00 C ATOM 234 CE LYS A 14 28.196 -21.518 -26.949 1.00 0.00 C ATOM 235 NZ LYS A 14 28.009 -21.372 -25.477 1.00 0.00 N ATOM 0 H LYS A 14 22.992 -21.942 -28.402 1.00 0.00 H new ATOM 0 HA LYS A 14 24.327 -22.014 -25.783 1.00 0.00 H new ATOM 0 HB2 LYS A 14 24.210 -19.986 -28.061 1.00 0.00 H new ATOM 0 HB3 LYS A 14 25.144 -19.739 -26.600 1.00 0.00 H new ATOM 0 HG2 LYS A 14 25.908 -22.318 -27.328 1.00 0.00 H new ATOM 0 HG3 LYS A 14 25.676 -21.563 -28.892 1.00 0.00 H new ATOM 0 HD2 LYS A 14 27.591 -20.340 -28.658 1.00 0.00 H new ATOM 0 HD3 LYS A 14 27.049 -19.694 -27.122 1.00 0.00 H new ATOM 0 HE2 LYS A 14 28.049 -22.557 -27.244 1.00 0.00 H new ATOM 0 HE3 LYS A 14 29.215 -21.249 -27.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 28.687 -21.983 -24.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 28.170 -20.382 -25.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 27.040 -21.649 -25.221 1.00 0.00 H new ATOM 249 N ASN A 15 22.308 -19.468 -26.326 1.00 0.00 N ATOM 250 CA ASN A 15 21.326 -18.585 -25.638 1.00 0.00 C ATOM 251 C ASN A 15 20.736 -17.595 -26.644 1.00 0.00 C ATOM 252 O ASN A 15 21.377 -16.640 -27.039 1.00 0.00 O ATOM 253 CB ASN A 15 22.027 -17.816 -24.515 1.00 0.00 C ATOM 254 CG ASN A 15 20.981 -17.278 -23.535 1.00 0.00 C ATOM 255 OD1 ASN A 15 20.293 -18.039 -22.885 1.00 0.00 O ATOM 256 ND2 ASN A 15 20.832 -15.988 -23.404 1.00 0.00 N ATOM 0 H ASN A 15 22.575 -19.171 -27.264 1.00 0.00 H new ATOM 0 HA ASN A 15 20.526 -19.193 -25.216 1.00 0.00 H new ATOM 0 HB2 ASN A 15 22.727 -18.469 -23.994 1.00 0.00 H new ATOM 0 HB3 ASN A 15 22.608 -16.993 -24.931 1.00 0.00 H new ATOM 0 HD21 ASN A 15 20.137 -15.618 -22.755 1.00 0.00 H new ATOM 0 HD22 ASN A 15 21.410 -15.350 -23.950 1.00 0.00 H new ATOM 263 N LYS A 16 19.520 -17.814 -27.061 1.00 0.00 N ATOM 264 CA LYS A 16 18.887 -16.887 -28.041 1.00 0.00 C ATOM 265 C LYS A 16 17.408 -17.242 -28.190 1.00 0.00 C ATOM 266 O LYS A 16 16.538 -16.543 -27.708 1.00 0.00 O ATOM 267 CB LYS A 16 19.583 -17.025 -29.396 1.00 0.00 C ATOM 268 CG LYS A 16 20.218 -15.688 -29.785 1.00 0.00 C ATOM 269 CD LYS A 16 21.450 -15.940 -30.656 1.00 0.00 C ATOM 270 CE LYS A 16 21.114 -15.640 -32.118 1.00 0.00 C ATOM 271 NZ LYS A 16 20.955 -14.169 -32.300 1.00 0.00 N ATOM 0 H LYS A 16 18.936 -18.596 -26.765 1.00 0.00 H new ATOM 0 HA LYS A 16 18.983 -15.861 -27.687 1.00 0.00 H new ATOM 0 HB2 LYS A 16 20.347 -17.801 -29.347 1.00 0.00 H new ATOM 0 HB3 LYS A 16 18.864 -17.333 -30.156 1.00 0.00 H new ATOM 0 HG2 LYS A 16 19.497 -15.075 -30.326 1.00 0.00 H new ATOM 0 HG3 LYS A 16 20.500 -15.134 -28.890 1.00 0.00 H new ATOM 0 HD2 LYS A 16 22.276 -15.311 -30.326 1.00 0.00 H new ATOM 0 HD3 LYS A 16 21.776 -16.975 -30.552 1.00 0.00 H new ATOM 0 HE2 LYS A 16 21.905 -16.014 -32.768 1.00 0.00 H new ATOM 0 HE3 LYS A 16 20.196 -16.154 -32.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 21.181 -13.914 -33.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 19.974 -13.897 -32.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 21.599 -13.668 -31.655 1.00 0.00 H new ATOM 285 N ASN A 17 17.115 -18.328 -28.852 1.00 0.00 N ATOM 286 CA ASN A 17 15.692 -18.733 -29.030 1.00 0.00 C ATOM 287 C ASN A 17 14.861 -17.519 -29.448 1.00 0.00 C ATOM 288 O ASN A 17 13.988 -17.075 -28.729 1.00 0.00 O ATOM 289 CB ASN A 17 15.154 -19.288 -27.709 1.00 0.00 C ATOM 290 CG ASN A 17 15.500 -20.774 -27.601 1.00 0.00 C ATOM 291 OD1 ASN A 17 14.700 -21.623 -27.937 1.00 0.00 O ATOM 292 ND2 ASN A 17 16.670 -21.127 -27.141 1.00 0.00 N ATOM 0 H ASN A 17 17.800 -18.952 -29.277 1.00 0.00 H new ATOM 0 HA ASN A 17 15.627 -19.499 -29.803 1.00 0.00 H new ATOM 0 HB2 ASN A 17 15.585 -18.741 -26.870 1.00 0.00 H new ATOM 0 HB3 ASN A 17 14.074 -19.151 -27.658 1.00 0.00 H new ATOM 0 HD21 ASN A 17 16.911 -22.115 -27.064 1.00 0.00 H new ATOM 0 HD22 ASN A 17 17.343 -20.415 -26.858 1.00 0.00 H new ATOM 299 N ILE A 18 15.120 -16.981 -30.608 1.00 0.00 N ATOM 300 CA ILE A 18 14.339 -15.800 -31.073 1.00 0.00 C ATOM 301 C ILE A 18 13.282 -16.261 -32.076 1.00 0.00 C ATOM 302 O ILE A 18 12.327 -15.563 -32.354 1.00 0.00 O ATOM 303 CB ILE A 18 15.277 -14.792 -31.742 1.00 0.00 C ATOM 304 CG1 ILE A 18 16.341 -15.541 -32.549 1.00 0.00 C ATOM 305 CG2 ILE A 18 15.960 -13.941 -30.671 1.00 0.00 C ATOM 306 CD1 ILE A 18 16.705 -14.726 -33.793 1.00 0.00 C ATOM 0 H ILE A 18 15.839 -17.308 -31.254 1.00 0.00 H new ATOM 0 HA ILE A 18 13.853 -15.325 -30.221 1.00 0.00 H new ATOM 0 HB ILE A 18 14.701 -14.148 -32.407 1.00 0.00 H new ATOM 0 HG12 ILE A 18 17.228 -15.706 -31.937 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.968 -16.523 -32.841 1.00 0.00 H new ATOM 0 HG21 ILE A 18 16.628 -13.223 -31.148 1.00 0.00 H new ATOM 0 HG22 ILE A 18 15.205 -13.407 -30.095 1.00 0.00 H new ATOM 0 HG23 ILE A 18 16.535 -14.586 -30.006 1.00 0.00 H new ATOM 0 HD11 ILE A 18 17.462 -15.259 -34.368 1.00 0.00 H new ATOM 0 HD12 ILE A 18 15.816 -14.584 -34.408 1.00 0.00 H new ATOM 0 HD13 ILE A 18 17.096 -13.755 -33.490 1.00 0.00 H new ATOM 318 N LYS A 19 13.446 -17.435 -32.622 1.00 0.00 N ATOM 319 CA LYS A 19 12.454 -17.948 -33.608 1.00 0.00 C ATOM 320 C LYS A 19 11.928 -19.307 -33.140 1.00 0.00 C ATOM 321 O LYS A 19 11.005 -19.854 -33.710 1.00 0.00 O ATOM 322 CB LYS A 19 13.119 -18.100 -34.980 1.00 0.00 C ATOM 323 CG LYS A 19 14.611 -18.390 -34.801 1.00 0.00 C ATOM 324 CD LYS A 19 15.222 -18.788 -36.147 1.00 0.00 C ATOM 325 CE LYS A 19 16.373 -17.839 -36.487 1.00 0.00 C ATOM 326 NZ LYS A 19 16.358 -17.543 -37.948 1.00 0.00 N ATOM 0 H LYS A 19 14.226 -18.062 -32.427 1.00 0.00 H new ATOM 0 HA LYS A 19 11.626 -17.244 -33.687 1.00 0.00 H new ATOM 0 HB2 LYS A 19 12.646 -18.909 -35.537 1.00 0.00 H new ATOM 0 HB3 LYS A 19 12.983 -17.189 -35.564 1.00 0.00 H new ATOM 0 HG2 LYS A 19 15.118 -17.510 -34.406 1.00 0.00 H new ATOM 0 HG3 LYS A 19 14.752 -19.191 -34.075 1.00 0.00 H new ATOM 0 HD2 LYS A 19 15.584 -19.815 -36.104 1.00 0.00 H new ATOM 0 HD3 LYS A 19 14.463 -18.750 -36.928 1.00 0.00 H new ATOM 0 HE2 LYS A 19 16.277 -16.915 -35.917 1.00 0.00 H new ATOM 0 HE3 LYS A 19 17.325 -18.289 -36.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 17.140 -16.898 -38.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 16.469 -18.428 -38.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 15.454 -17.096 -38.202 1.00 0.00 H new ATOM 340 N VAL A 20 12.505 -19.856 -32.107 1.00 0.00 N ATOM 341 CA VAL A 20 12.036 -21.178 -31.605 1.00 0.00 C ATOM 342 C VAL A 20 10.973 -20.962 -30.527 1.00 0.00 C ATOM 343 O VAL A 20 11.157 -21.316 -29.379 1.00 0.00 O ATOM 344 CB VAL A 20 13.217 -21.944 -31.006 1.00 0.00 C ATOM 345 CG1 VAL A 20 12.782 -23.370 -30.666 1.00 0.00 C ATOM 346 CG2 VAL A 20 14.361 -21.989 -32.021 1.00 0.00 C ATOM 0 H VAL A 20 13.282 -19.446 -31.588 1.00 0.00 H new ATOM 0 HA VAL A 20 11.611 -21.751 -32.429 1.00 0.00 H new ATOM 0 HB VAL A 20 13.553 -21.442 -30.099 1.00 0.00 H new ATOM 0 HG11 VAL A 20 13.624 -23.915 -30.239 1.00 0.00 H new ATOM 0 HG12 VAL A 20 11.966 -23.339 -29.944 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.445 -23.874 -31.572 1.00 0.00 H new ATOM 0 HG21 VAL A 20 15.203 -22.534 -31.596 1.00 0.00 H new ATOM 0 HG22 VAL A 20 14.024 -22.492 -32.927 1.00 0.00 H new ATOM 0 HG23 VAL A 20 14.672 -20.973 -32.264 1.00 0.00 H new ATOM 356 N ASN A 21 9.860 -20.382 -30.886 1.00 0.00 N ATOM 357 CA ASN A 21 8.788 -20.143 -29.881 1.00 0.00 C ATOM 358 C ASN A 21 7.473 -20.737 -30.387 1.00 0.00 C ATOM 359 O ASN A 21 6.724 -20.097 -31.097 1.00 0.00 O ATOM 360 CB ASN A 21 8.618 -18.636 -29.666 1.00 0.00 C ATOM 361 CG ASN A 21 7.832 -18.390 -28.378 1.00 0.00 C ATOM 362 OD1 ASN A 21 6.854 -19.061 -28.111 1.00 0.00 O ATOM 363 ND2 ASN A 21 8.219 -17.449 -27.561 1.00 0.00 N ATOM 0 H ASN A 21 9.648 -20.064 -31.832 1.00 0.00 H new ATOM 0 HA ASN A 21 9.061 -20.617 -28.938 1.00 0.00 H new ATOM 0 HB2 ASN A 21 9.594 -18.154 -29.607 1.00 0.00 H new ATOM 0 HB3 ASN A 21 8.095 -18.194 -30.514 1.00 0.00 H new ATOM 0 HD21 ASN A 21 7.701 -17.277 -26.699 1.00 0.00 H new ATOM 0 HD22 ASN A 21 9.039 -16.886 -27.784 1.00 0.00 H new ATOM 370 N THR A 22 7.187 -21.958 -30.028 1.00 0.00 N ATOM 371 CA THR A 22 5.920 -22.592 -30.489 1.00 0.00 C ATOM 372 C THR A 22 5.088 -23.010 -29.276 1.00 0.00 C ATOM 373 O THR A 22 4.613 -24.124 -29.190 1.00 0.00 O ATOM 374 CB THR A 22 6.245 -23.826 -31.335 1.00 0.00 C ATOM 375 OG1 THR A 22 5.036 -24.420 -31.785 1.00 0.00 O ATOM 376 CG2 THR A 22 7.029 -24.832 -30.492 1.00 0.00 C ATOM 0 H THR A 22 7.776 -22.544 -29.436 1.00 0.00 H new ATOM 0 HA THR A 22 5.354 -21.879 -31.089 1.00 0.00 H new ATOM 0 HB THR A 22 6.847 -23.531 -32.195 1.00 0.00 H new ATOM 0 HG1 THR A 22 4.481 -24.657 -31.013 1.00 0.00 H new ATOM 0 HG21 THR A 22 7.260 -25.710 -31.095 1.00 0.00 H new ATOM 0 HG22 THR A 22 7.956 -24.374 -30.148 1.00 0.00 H new ATOM 0 HG23 THR A 22 6.430 -25.130 -29.631 1.00 0.00 H new ATOM 384 N TYR A 23 4.906 -22.122 -28.335 1.00 0.00 N ATOM 385 CA TYR A 23 4.103 -22.470 -27.129 1.00 0.00 C ATOM 386 C TYR A 23 2.616 -22.291 -27.441 1.00 0.00 C ATOM 387 O TYR A 23 2.201 -21.281 -27.973 1.00 0.00 O ATOM 388 CB TYR A 23 4.496 -21.550 -25.971 1.00 0.00 C ATOM 389 CG TYR A 23 5.742 -22.083 -25.304 1.00 0.00 C ATOM 390 CD1 TYR A 23 6.890 -22.335 -26.065 1.00 0.00 C ATOM 391 CD2 TYR A 23 5.748 -22.325 -23.924 1.00 0.00 C ATOM 392 CE1 TYR A 23 8.046 -22.830 -25.447 1.00 0.00 C ATOM 393 CE2 TYR A 23 6.904 -22.820 -23.305 1.00 0.00 C ATOM 394 CZ TYR A 23 8.053 -23.073 -24.067 1.00 0.00 C ATOM 395 OH TYR A 23 9.191 -23.561 -23.457 1.00 0.00 O ATOM 0 H TYR A 23 5.278 -21.173 -28.350 1.00 0.00 H new ATOM 0 HA TYR A 23 4.295 -23.506 -26.850 1.00 0.00 H new ATOM 0 HB2 TYR A 23 4.672 -20.539 -26.339 1.00 0.00 H new ATOM 0 HB3 TYR A 23 3.682 -21.489 -25.249 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.884 -22.148 -27.129 1.00 0.00 H new ATOM 0 HD2 TYR A 23 4.862 -22.130 -23.337 1.00 0.00 H new ATOM 0 HE1 TYR A 23 8.931 -23.024 -26.034 1.00 0.00 H new ATOM 0 HE2 TYR A 23 6.909 -23.006 -22.241 1.00 0.00 H new ATOM 0 HH TYR A 23 9.026 -23.672 -22.497 1.00 0.00 H new ATOM 405 N ARG A 24 1.809 -23.263 -27.116 1.00 0.00 N ATOM 406 CA ARG A 24 0.351 -23.145 -27.396 1.00 0.00 C ATOM 407 C ARG A 24 -0.413 -22.974 -26.082 1.00 0.00 C ATOM 408 O ARG A 24 -1.416 -22.291 -26.021 1.00 0.00 O ATOM 409 CB ARG A 24 -0.136 -24.409 -28.108 1.00 0.00 C ATOM 410 CG ARG A 24 -1.591 -24.220 -28.545 1.00 0.00 C ATOM 411 CD ARG A 24 -1.716 -24.509 -30.041 1.00 0.00 C ATOM 412 NE ARG A 24 -2.550 -25.726 -30.244 1.00 0.00 N ATOM 413 CZ ARG A 24 -2.188 -26.629 -31.114 1.00 0.00 C ATOM 414 NH1 ARG A 24 -2.592 -26.540 -32.352 1.00 0.00 N ATOM 415 NH2 ARG A 24 -1.423 -27.620 -30.747 1.00 0.00 N ATOM 0 H ARG A 24 2.096 -24.134 -26.669 1.00 0.00 H new ATOM 0 HA ARG A 24 0.175 -22.278 -28.032 1.00 0.00 H new ATOM 0 HB2 ARG A 24 0.491 -24.615 -28.975 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -0.054 -25.269 -27.443 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -2.241 -24.887 -27.979 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -1.916 -23.202 -28.332 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -2.167 -23.657 -30.550 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -0.728 -24.655 -30.478 1.00 0.00 H new ATOM 0 HE ARG A 24 -3.405 -25.854 -29.703 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -3.190 -25.765 -32.639 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -2.310 -27.245 -33.033 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -1.107 -27.689 -29.780 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -1.141 -28.325 -31.428 1.00 0.00 H new ATOM 429 N THR A 25 0.051 -23.590 -25.030 1.00 0.00 N ATOM 430 CA THR A 25 -0.653 -23.462 -23.723 1.00 0.00 C ATOM 431 C THR A 25 0.238 -22.710 -22.734 1.00 0.00 C ATOM 432 O THR A 25 1.346 -23.116 -22.447 1.00 0.00 O ATOM 433 CB THR A 25 -0.965 -24.856 -23.173 1.00 0.00 C ATOM 434 OG1 THR A 25 -1.844 -25.528 -24.063 1.00 0.00 O ATOM 435 CG2 THR A 25 -1.626 -24.728 -21.799 1.00 0.00 C ATOM 0 H THR A 25 0.886 -24.176 -25.019 1.00 0.00 H new ATOM 0 HA THR A 25 -1.583 -22.911 -23.864 1.00 0.00 H new ATOM 0 HB THR A 25 -0.040 -25.425 -23.077 1.00 0.00 H new ATOM 0 HG1 THR A 25 -2.043 -26.421 -23.713 1.00 0.00 H new ATOM 0 HG21 THR A 25 -1.848 -25.721 -21.408 1.00 0.00 H new ATOM 0 HG22 THR A 25 -0.950 -24.212 -21.117 1.00 0.00 H new ATOM 0 HG23 THR A 25 -2.551 -24.160 -21.892 1.00 0.00 H new ATOM 443 N SER A 26 -0.239 -21.614 -22.210 1.00 0.00 N ATOM 444 CA SER A 26 0.579 -20.835 -21.239 1.00 0.00 C ATOM 445 C SER A 26 -0.210 -20.647 -19.942 1.00 0.00 C ATOM 446 O SER A 26 -0.628 -19.556 -19.611 1.00 0.00 O ATOM 447 CB SER A 26 0.910 -19.467 -21.835 1.00 0.00 C ATOM 448 OG SER A 26 2.111 -18.978 -21.254 1.00 0.00 O ATOM 0 H SER A 26 -1.160 -21.225 -22.413 1.00 0.00 H new ATOM 0 HA SER A 26 1.503 -21.374 -21.028 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.022 -19.546 -22.916 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.093 -18.770 -21.650 1.00 0.00 H new ATOM 0 HG SER A 26 2.326 -18.101 -21.636 1.00 0.00 H new ATOM 454 N ALA A 27 -0.418 -21.703 -19.205 1.00 0.00 N ATOM 455 CA ALA A 27 -1.180 -21.584 -17.930 1.00 0.00 C ATOM 456 C ALA A 27 -0.348 -22.162 -16.783 1.00 0.00 C ATOM 457 O ALA A 27 -0.683 -23.179 -16.210 1.00 0.00 O ATOM 458 CB ALA A 27 -2.493 -22.358 -18.046 1.00 0.00 C ATOM 0 H ALA A 27 -0.093 -22.643 -19.430 1.00 0.00 H new ATOM 0 HA ALA A 27 -1.394 -20.534 -17.732 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -3.050 -22.271 -17.113 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -3.086 -21.947 -18.863 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -2.280 -23.408 -18.245 1.00 0.00 H new ATOM 464 N MET A 28 0.735 -21.519 -16.443 1.00 0.00 N ATOM 465 CA MET A 28 1.588 -22.032 -15.335 1.00 0.00 C ATOM 466 C MET A 28 1.488 -21.087 -14.135 1.00 0.00 C ATOM 467 O MET A 28 2.396 -20.333 -13.851 1.00 0.00 O ATOM 468 CB MET A 28 3.041 -22.109 -15.805 1.00 0.00 C ATOM 469 CG MET A 28 3.136 -23.047 -17.010 1.00 0.00 C ATOM 470 SD MET A 28 4.871 -23.452 -17.325 1.00 0.00 S ATOM 471 CE MET A 28 4.793 -25.188 -16.824 1.00 0.00 C ATOM 0 H MET A 28 1.066 -20.661 -16.884 1.00 0.00 H new ATOM 0 HA MET A 28 1.248 -23.026 -15.044 1.00 0.00 H new ATOM 0 HB2 MET A 28 3.401 -21.116 -16.074 1.00 0.00 H new ATOM 0 HB3 MET A 28 3.677 -22.471 -14.997 1.00 0.00 H new ATOM 0 HG2 MET A 28 2.568 -23.958 -16.821 1.00 0.00 H new ATOM 0 HG3 MET A 28 2.697 -22.574 -17.888 1.00 0.00 H new ATOM 0 HE1 MET A 28 5.776 -25.645 -16.939 1.00 0.00 H new ATOM 0 HE2 MET A 28 4.483 -25.252 -15.781 1.00 0.00 H new ATOM 0 HE3 MET A 28 4.072 -25.715 -17.449 1.00 0.00 H new ATOM 481 N ASP A 29 0.391 -21.124 -13.430 1.00 0.00 N ATOM 482 CA ASP A 29 0.235 -20.227 -12.252 1.00 0.00 C ATOM 483 C ASP A 29 0.258 -18.770 -12.718 1.00 0.00 C ATOM 484 O ASP A 29 0.365 -18.488 -13.896 1.00 0.00 O ATOM 485 CB ASP A 29 1.385 -20.469 -11.272 1.00 0.00 C ATOM 486 CG ASP A 29 1.391 -21.938 -10.847 1.00 0.00 C ATOM 487 OD1 ASP A 29 0.351 -22.415 -10.423 1.00 0.00 O ATOM 488 OD2 ASP A 29 2.434 -22.561 -10.955 1.00 0.00 O ATOM 0 H ASP A 29 -0.403 -21.736 -13.619 1.00 0.00 H new ATOM 0 HA ASP A 29 -0.713 -20.436 -11.756 1.00 0.00 H new ATOM 0 HB2 ASP A 29 2.335 -20.210 -11.739 1.00 0.00 H new ATOM 0 HB3 ASP A 29 1.274 -19.827 -10.398 1.00 0.00 H new ATOM 493 N LEU A 30 0.157 -17.842 -11.807 1.00 0.00 N ATOM 494 CA LEU A 30 0.172 -16.406 -12.203 1.00 0.00 C ATOM 495 C LEU A 30 1.611 -15.886 -12.191 1.00 0.00 C ATOM 496 O LEU A 30 2.338 -16.063 -11.234 1.00 0.00 O ATOM 497 CB LEU A 30 -0.672 -15.597 -11.218 1.00 0.00 C ATOM 498 CG LEU A 30 -1.452 -14.522 -11.976 1.00 0.00 C ATOM 499 CD1 LEU A 30 -2.938 -14.881 -11.984 1.00 0.00 C ATOM 500 CD2 LEU A 30 -1.257 -13.170 -11.287 1.00 0.00 C ATOM 0 H LEU A 30 0.065 -18.016 -10.806 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.241 -16.302 -13.206 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.361 -16.255 -10.687 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.031 -15.135 -10.468 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.087 -14.463 -13.002 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -3.494 -14.115 -12.524 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.077 -15.844 -12.475 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.304 -14.940 -10.959 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -1.813 -12.403 -11.827 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.622 -13.228 -10.261 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.198 -12.914 -11.281 1.00 0.00 H new ATOM 512 N SER A 31 2.026 -15.240 -13.246 1.00 0.00 N ATOM 513 CA SER A 31 3.415 -14.705 -13.297 1.00 0.00 C ATOM 514 C SER A 31 3.374 -13.216 -13.656 1.00 0.00 C ATOM 515 O SER A 31 2.395 -12.738 -14.193 1.00 0.00 O ATOM 516 CB SER A 31 4.217 -15.460 -14.356 1.00 0.00 C ATOM 517 OG SER A 31 4.130 -14.766 -15.594 1.00 0.00 O ATOM 0 H SER A 31 1.462 -15.060 -14.076 1.00 0.00 H new ATOM 0 HA SER A 31 3.888 -14.834 -12.324 1.00 0.00 H new ATOM 0 HB2 SER A 31 5.259 -15.547 -14.047 1.00 0.00 H new ATOM 0 HB3 SER A 31 3.832 -16.474 -14.466 1.00 0.00 H new ATOM 0 HG SER A 31 4.645 -15.247 -16.275 1.00 0.00 H new ATOM 523 N PRO A 32 4.446 -12.531 -13.350 1.00 0.00 N ATOM 524 CA PRO A 32 4.574 -11.090 -13.627 1.00 0.00 C ATOM 525 C PRO A 32 4.904 -10.861 -15.105 1.00 0.00 C ATOM 526 O PRO A 32 5.754 -11.519 -15.671 1.00 0.00 O ATOM 527 CB PRO A 32 5.739 -10.655 -12.732 1.00 0.00 C ATOM 528 CG PRO A 32 6.562 -11.933 -12.436 1.00 0.00 C ATOM 529 CD PRO A 32 5.629 -13.129 -12.697 1.00 0.00 C ATOM 0 HA PRO A 32 3.660 -10.530 -13.429 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.353 -9.904 -13.230 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.373 -10.206 -11.809 1.00 0.00 H new ATOM 0 HG2 PRO A 32 7.443 -11.983 -13.075 1.00 0.00 H new ATOM 0 HG3 PRO A 32 6.916 -11.936 -11.405 1.00 0.00 H new ATOM 0 HD2 PRO A 32 6.104 -13.872 -13.337 1.00 0.00 H new ATOM 0 HD3 PRO A 32 5.359 -13.633 -11.769 1.00 0.00 H new ATOM 537 N GLY A 33 4.235 -9.934 -15.735 1.00 0.00 N ATOM 538 CA GLY A 33 4.510 -9.665 -17.174 1.00 0.00 C ATOM 539 C GLY A 33 3.468 -10.384 -18.035 1.00 0.00 C ATOM 540 O GLY A 33 3.764 -11.354 -18.703 1.00 0.00 O ATOM 0 H GLY A 33 3.510 -9.352 -15.315 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.480 -8.593 -17.367 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.512 -10.007 -17.434 1.00 0.00 H new ATOM 544 N SER A 34 2.250 -9.917 -18.021 1.00 0.00 N ATOM 545 CA SER A 34 1.191 -10.575 -18.837 1.00 0.00 C ATOM 546 C SER A 34 -0.071 -9.710 -18.833 1.00 0.00 C ATOM 547 O SER A 34 -0.271 -8.890 -17.958 1.00 0.00 O ATOM 548 CB SER A 34 0.872 -11.947 -18.243 1.00 0.00 C ATOM 549 OG SER A 34 0.918 -11.867 -16.824 1.00 0.00 O ATOM 0 H SER A 34 1.942 -9.109 -17.480 1.00 0.00 H new ATOM 0 HA SER A 34 1.543 -10.694 -19.862 1.00 0.00 H new ATOM 0 HB2 SER A 34 -0.115 -12.276 -18.568 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.589 -12.686 -18.600 1.00 0.00 H new ATOM 0 HG SER A 34 0.712 -12.745 -16.440 1.00 0.00 H new ATOM 555 N VAL A 35 -0.926 -9.888 -19.802 1.00 0.00 N ATOM 556 CA VAL A 35 -2.176 -9.080 -19.854 1.00 0.00 C ATOM 557 C VAL A 35 -3.366 -9.967 -19.482 1.00 0.00 C ATOM 558 O VAL A 35 -3.363 -11.157 -19.727 1.00 0.00 O ATOM 559 CB VAL A 35 -2.370 -8.530 -21.269 1.00 0.00 C ATOM 560 CG1 VAL A 35 -1.289 -7.487 -21.564 1.00 0.00 C ATOM 561 CG2 VAL A 35 -2.260 -9.674 -22.280 1.00 0.00 C ATOM 0 H VAL A 35 -0.812 -10.560 -20.561 1.00 0.00 H new ATOM 0 HA VAL A 35 -2.105 -8.250 -19.151 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.354 -8.067 -21.347 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.427 -7.095 -22.572 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -1.364 -6.672 -20.844 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.305 -7.950 -21.486 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.398 -9.283 -23.288 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.276 -10.136 -22.201 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.028 -10.419 -22.071 1.00 0.00 H new ATOM 571 N HIS A 36 -4.382 -9.402 -18.890 1.00 0.00 N ATOM 572 CA HIS A 36 -5.565 -10.224 -18.504 1.00 0.00 C ATOM 573 C HIS A 36 -6.821 -9.352 -18.493 1.00 0.00 C ATOM 574 O HIS A 36 -6.749 -8.139 -18.522 1.00 0.00 O ATOM 575 CB HIS A 36 -5.344 -10.808 -17.106 1.00 0.00 C ATOM 576 CG HIS A 36 -5.000 -12.267 -17.220 1.00 0.00 C ATOM 577 ND1 HIS A 36 -5.898 -13.267 -16.878 1.00 0.00 N ATOM 578 CD2 HIS A 36 -3.861 -12.912 -17.635 1.00 0.00 C ATOM 579 CE1 HIS A 36 -5.289 -14.448 -17.091 1.00 0.00 C ATOM 580 NE2 HIS A 36 -4.045 -14.289 -17.552 1.00 0.00 N ATOM 0 H HIS A 36 -4.445 -8.411 -18.657 1.00 0.00 H new ATOM 0 HA HIS A 36 -5.692 -11.031 -19.225 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -4.541 -10.273 -16.600 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -6.242 -10.681 -16.501 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -2.959 -12.425 -17.974 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -5.750 -15.408 -16.911 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -3.375 -15.019 -17.791 1.00 0.00 H new ATOM 588 N GLU A 37 -7.973 -9.961 -18.445 1.00 0.00 N ATOM 589 CA GLU A 37 -9.236 -9.173 -18.426 1.00 0.00 C ATOM 590 C GLU A 37 -9.748 -9.081 -16.988 1.00 0.00 C ATOM 591 O GLU A 37 -9.504 -9.952 -16.176 1.00 0.00 O ATOM 592 CB GLU A 37 -10.285 -9.867 -19.297 1.00 0.00 C ATOM 593 CG GLU A 37 -10.702 -11.185 -18.641 1.00 0.00 C ATOM 594 CD GLU A 37 -11.465 -12.040 -19.653 1.00 0.00 C ATOM 595 OE1 GLU A 37 -12.158 -11.467 -20.478 1.00 0.00 O ATOM 596 OE2 GLU A 37 -11.344 -13.251 -19.587 1.00 0.00 O ATOM 0 H GLU A 37 -8.094 -10.973 -18.418 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.049 -8.172 -18.815 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -11.154 -9.221 -19.423 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.880 -10.055 -20.291 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.822 -11.721 -18.286 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -11.328 -10.988 -17.770 1.00 0.00 H new ATOM 603 N GLY A 38 -10.451 -8.031 -16.660 1.00 0.00 N ATOM 604 CA GLY A 38 -10.967 -7.891 -15.269 1.00 0.00 C ATOM 605 C GLY A 38 -11.964 -6.736 -15.204 1.00 0.00 C ATOM 606 O GLY A 38 -12.187 -6.041 -16.174 1.00 0.00 O ATOM 0 H GLY A 38 -10.689 -7.267 -17.292 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -11.448 -8.817 -14.954 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -10.141 -7.711 -14.581 1.00 0.00 H new ATOM 610 N ILE A 39 -12.563 -6.520 -14.067 1.00 0.00 N ATOM 611 CA ILE A 39 -13.542 -5.404 -13.942 1.00 0.00 C ATOM 612 C ILE A 39 -12.823 -4.197 -13.340 1.00 0.00 C ATOM 613 O ILE A 39 -11.877 -4.340 -12.591 1.00 0.00 O ATOM 614 CB ILE A 39 -14.692 -5.837 -13.030 1.00 0.00 C ATOM 615 CG1 ILE A 39 -15.474 -6.967 -13.703 1.00 0.00 C ATOM 616 CG2 ILE A 39 -15.627 -4.653 -12.778 1.00 0.00 C ATOM 617 CD1 ILE A 39 -15.896 -7.995 -12.653 1.00 0.00 C ATOM 0 H ILE A 39 -12.417 -7.067 -13.219 1.00 0.00 H new ATOM 0 HA ILE A 39 -13.948 -5.143 -14.919 1.00 0.00 H new ATOM 0 HB ILE A 39 -14.287 -6.185 -12.079 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -16.353 -6.565 -14.207 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -14.859 -7.444 -14.467 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -16.444 -4.966 -12.128 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -15.072 -3.846 -12.299 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -16.032 -4.301 -13.727 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -16.453 -8.799 -13.134 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -15.010 -8.406 -12.170 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -16.527 -7.514 -11.906 1.00 0.00 H new ATOM 629 N VAL A 40 -13.244 -3.009 -13.673 1.00 0.00 N ATOM 630 CA VAL A 40 -12.551 -1.806 -13.129 1.00 0.00 C ATOM 631 C VAL A 40 -13.308 -1.253 -11.921 1.00 0.00 C ATOM 632 O VAL A 40 -14.438 -1.612 -11.662 1.00 0.00 O ATOM 633 CB VAL A 40 -12.483 -0.733 -14.218 1.00 0.00 C ATOM 634 CG1 VAL A 40 -11.625 0.435 -13.730 1.00 0.00 C ATOM 635 CG2 VAL A 40 -11.859 -1.331 -15.481 1.00 0.00 C ATOM 0 H VAL A 40 -14.031 -2.819 -14.293 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.546 -2.087 -12.815 1.00 0.00 H new ATOM 0 HB VAL A 40 -13.488 -0.376 -14.441 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -11.576 1.200 -14.505 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -12.067 0.860 -12.829 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -10.619 0.079 -13.507 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -11.809 -0.569 -16.258 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -10.853 -1.686 -15.257 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.469 -2.165 -15.829 1.00 0.00 H new ATOM 645 N TYR A 41 -12.684 -0.378 -11.180 1.00 0.00 N ATOM 646 CA TYR A 41 -13.354 0.212 -9.988 1.00 0.00 C ATOM 647 C TYR A 41 -12.803 1.620 -9.751 1.00 0.00 C ATOM 648 O TYR A 41 -11.621 1.865 -9.897 1.00 0.00 O ATOM 649 CB TYR A 41 -13.082 -0.659 -8.760 1.00 0.00 C ATOM 650 CG TYR A 41 -14.197 -0.475 -7.759 1.00 0.00 C ATOM 651 CD1 TYR A 41 -15.359 -1.252 -7.854 1.00 0.00 C ATOM 652 CD2 TYR A 41 -14.071 0.474 -6.736 1.00 0.00 C ATOM 653 CE1 TYR A 41 -16.394 -1.082 -6.927 1.00 0.00 C ATOM 654 CE2 TYR A 41 -15.107 0.644 -5.807 1.00 0.00 C ATOM 655 CZ TYR A 41 -16.269 -0.133 -5.902 1.00 0.00 C ATOM 656 OH TYR A 41 -17.289 0.035 -4.989 1.00 0.00 O ATOM 0 H TYR A 41 -11.735 -0.046 -11.350 1.00 0.00 H new ATOM 0 HA TYR A 41 -14.429 0.262 -10.159 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -13.010 -1.707 -9.052 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -12.127 -0.387 -8.311 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -15.456 -1.983 -8.643 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -13.176 1.074 -6.663 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -17.289 -1.682 -7.001 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -15.009 1.374 -5.017 1.00 0.00 H new ATOM 0 HH TYR A 41 -17.041 0.731 -4.345 1.00 0.00 H new ATOM 666 N PHE A 42 -13.643 2.549 -9.394 1.00 0.00 N ATOM 667 CA PHE A 42 -13.158 3.938 -9.156 1.00 0.00 C ATOM 668 C PHE A 42 -12.969 4.167 -7.656 1.00 0.00 C ATOM 669 O PHE A 42 -13.921 4.285 -6.911 1.00 0.00 O ATOM 670 CB PHE A 42 -14.181 4.939 -9.701 1.00 0.00 C ATOM 671 CG PHE A 42 -13.459 6.067 -10.398 1.00 0.00 C ATOM 672 CD1 PHE A 42 -12.520 5.786 -11.400 1.00 0.00 C ATOM 673 CD2 PHE A 42 -13.729 7.395 -10.043 1.00 0.00 C ATOM 674 CE1 PHE A 42 -11.851 6.834 -12.047 1.00 0.00 C ATOM 675 CE2 PHE A 42 -13.059 8.444 -10.691 1.00 0.00 C ATOM 676 CZ PHE A 42 -12.121 8.162 -11.691 1.00 0.00 C ATOM 0 H PHE A 42 -14.644 2.408 -9.256 1.00 0.00 H new ATOM 0 HA PHE A 42 -12.205 4.079 -9.666 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -14.858 4.442 -10.396 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -14.791 5.331 -8.887 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -12.312 4.762 -11.673 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -14.453 7.611 -9.271 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -11.128 6.618 -12.820 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -13.267 9.468 -10.418 1.00 0.00 H new ATOM 0 HZ PHE A 42 -11.605 8.969 -12.189 1.00 0.00 H new ATOM 686 N LYS A 43 -11.745 4.235 -7.207 1.00 0.00 N ATOM 687 CA LYS A 43 -11.493 4.459 -5.756 1.00 0.00 C ATOM 688 C LYS A 43 -11.300 5.955 -5.502 1.00 0.00 C ATOM 689 O LYS A 43 -11.200 6.742 -6.421 1.00 0.00 O ATOM 690 CB LYS A 43 -10.230 3.705 -5.337 1.00 0.00 C ATOM 691 CG LYS A 43 -10.616 2.476 -4.510 1.00 0.00 C ATOM 692 CD LYS A 43 -9.614 2.293 -3.368 1.00 0.00 C ATOM 693 CE LYS A 43 -8.189 2.307 -3.926 1.00 0.00 C ATOM 694 NZ LYS A 43 -7.595 0.946 -3.808 1.00 0.00 N ATOM 0 H LYS A 43 -10.908 4.145 -7.783 1.00 0.00 H new ATOM 0 HA LYS A 43 -12.342 4.096 -5.177 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -9.667 3.400 -6.219 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.581 4.358 -4.754 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -11.622 2.596 -4.109 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.629 1.588 -5.142 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -9.735 3.089 -2.634 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.804 1.352 -2.852 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -8.199 2.622 -4.970 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -7.581 3.029 -3.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -6.999 0.900 -2.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -8.356 0.240 -3.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -7.015 0.746 -4.648 1.00 0.00 H new ATOM 708 N ASP A 44 -11.243 6.354 -4.261 1.00 0.00 N ATOM 709 CA ASP A 44 -11.053 7.799 -3.954 1.00 0.00 C ATOM 710 C ASP A 44 -9.557 8.109 -3.874 1.00 0.00 C ATOM 711 O ASP A 44 -9.156 9.189 -3.491 1.00 0.00 O ATOM 712 CB ASP A 44 -11.717 8.128 -2.615 1.00 0.00 C ATOM 713 CG ASP A 44 -13.054 7.393 -2.515 1.00 0.00 C ATOM 714 OD1 ASP A 44 -13.902 7.626 -3.360 1.00 0.00 O ATOM 715 OD2 ASP A 44 -13.208 6.606 -1.594 1.00 0.00 O ATOM 0 H ASP A 44 -11.320 5.743 -3.448 1.00 0.00 H new ATOM 0 HA ASP A 44 -11.507 8.402 -4.741 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -11.066 7.834 -1.792 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -11.874 9.203 -2.529 1.00 0.00 H new ATOM 720 N GLY A 45 -8.727 7.166 -4.233 1.00 0.00 N ATOM 721 CA GLY A 45 -7.256 7.405 -4.177 1.00 0.00 C ATOM 722 C GLY A 45 -6.598 6.878 -5.455 1.00 0.00 C ATOM 723 O GLY A 45 -5.636 7.437 -5.944 1.00 0.00 O ATOM 0 H GLY A 45 -9.004 6.241 -4.562 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -7.055 8.471 -4.066 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -6.830 6.908 -3.306 1.00 0.00 H new ATOM 727 N ILE A 46 -7.103 5.804 -5.998 1.00 0.00 N ATOM 728 CA ILE A 46 -6.504 5.241 -7.240 1.00 0.00 C ATOM 729 C ILE A 46 -7.544 4.369 -7.948 1.00 0.00 C ATOM 730 O ILE A 46 -8.730 4.500 -7.720 1.00 0.00 O ATOM 731 CB ILE A 46 -5.283 4.396 -6.871 1.00 0.00 C ATOM 732 CG1 ILE A 46 -5.701 3.316 -5.869 1.00 0.00 C ATOM 733 CG2 ILE A 46 -4.215 5.290 -6.241 1.00 0.00 C ATOM 734 CD1 ILE A 46 -4.653 2.203 -5.849 1.00 0.00 C ATOM 0 H ILE A 46 -7.906 5.292 -5.634 1.00 0.00 H new ATOM 0 HA ILE A 46 -6.196 6.048 -7.905 1.00 0.00 H new ATOM 0 HB ILE A 46 -4.878 3.927 -7.768 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -5.805 3.749 -4.874 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -6.674 2.908 -6.143 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.345 4.688 -5.978 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -3.921 6.062 -6.952 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.617 5.759 -5.343 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -4.952 1.435 -5.136 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.571 1.763 -6.843 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.689 2.617 -5.554 1.00 0.00 H new ATOM 746 N PHE A 47 -7.116 3.481 -8.803 1.00 0.00 N ATOM 747 CA PHE A 47 -8.091 2.610 -9.515 1.00 0.00 C ATOM 748 C PHE A 47 -8.034 1.198 -8.929 1.00 0.00 C ATOM 749 O PHE A 47 -7.054 0.805 -8.331 1.00 0.00 O ATOM 750 CB PHE A 47 -7.739 2.567 -11.002 1.00 0.00 C ATOM 751 CG PHE A 47 -7.426 3.963 -11.482 1.00 0.00 C ATOM 752 CD1 PHE A 47 -6.116 4.453 -11.403 1.00 0.00 C ATOM 753 CD2 PHE A 47 -8.446 4.770 -12.003 1.00 0.00 C ATOM 754 CE1 PHE A 47 -5.826 5.750 -11.844 1.00 0.00 C ATOM 755 CE2 PHE A 47 -8.156 6.068 -12.445 1.00 0.00 C ATOM 756 CZ PHE A 47 -6.845 6.558 -12.365 1.00 0.00 C ATOM 0 H PHE A 47 -6.136 3.322 -9.038 1.00 0.00 H new ATOM 0 HA PHE A 47 -9.098 3.010 -9.393 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -6.882 1.913 -11.166 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -8.570 2.152 -11.572 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -5.330 3.830 -11.002 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -9.456 4.392 -12.064 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -4.816 6.128 -11.782 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -8.942 6.690 -12.847 1.00 0.00 H new ATOM 0 HZ PHE A 47 -6.621 7.558 -12.705 1.00 0.00 H new ATOM 766 N LYS A 48 -9.080 0.436 -9.093 1.00 0.00 N ATOM 767 CA LYS A 48 -9.087 -0.947 -8.542 1.00 0.00 C ATOM 768 C LYS A 48 -9.525 -1.927 -9.632 1.00 0.00 C ATOM 769 O LYS A 48 -10.272 -1.581 -10.529 1.00 0.00 O ATOM 770 CB LYS A 48 -10.064 -1.021 -7.366 1.00 0.00 C ATOM 771 CG LYS A 48 -9.365 -1.646 -6.158 1.00 0.00 C ATOM 772 CD LYS A 48 -10.268 -2.718 -5.545 1.00 0.00 C ATOM 773 CE LYS A 48 -10.867 -2.195 -4.238 1.00 0.00 C ATOM 774 NZ LYS A 48 -12.298 -2.604 -4.149 1.00 0.00 N ATOM 0 H LYS A 48 -9.930 0.712 -9.585 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.086 -1.208 -8.200 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -10.423 -0.023 -7.115 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.936 -1.614 -7.641 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.415 -2.086 -6.461 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -9.139 -0.879 -5.418 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -11.063 -2.981 -6.242 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -9.696 -3.627 -5.357 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.311 -2.589 -3.387 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -10.785 -1.109 -4.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -12.706 -2.249 -3.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -12.823 -2.207 -4.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.364 -3.642 -4.170 1.00 0.00 H new ATOM 788 N VAL A 49 -9.067 -3.147 -9.562 1.00 0.00 N ATOM 789 CA VAL A 49 -9.453 -4.154 -10.590 1.00 0.00 C ATOM 790 C VAL A 49 -9.840 -5.464 -9.900 1.00 0.00 C ATOM 791 O VAL A 49 -9.053 -6.059 -9.192 1.00 0.00 O ATOM 792 CB VAL A 49 -8.270 -4.408 -11.526 1.00 0.00 C ATOM 793 CG1 VAL A 49 -8.669 -5.433 -12.589 1.00 0.00 C ATOM 794 CG2 VAL A 49 -7.869 -3.098 -12.207 1.00 0.00 C ATOM 0 H VAL A 49 -8.440 -3.490 -8.834 1.00 0.00 H new ATOM 0 HA VAL A 49 -10.300 -3.778 -11.164 1.00 0.00 H new ATOM 0 HB VAL A 49 -7.428 -4.792 -10.950 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -7.825 -5.613 -13.255 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -8.955 -6.367 -12.105 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -9.511 -5.050 -13.165 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -7.026 -3.278 -12.874 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -8.712 -2.714 -12.782 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -7.583 -2.367 -11.450 1.00 0.00 H new ATOM 804 N ARG A 50 -11.047 -5.918 -10.100 1.00 0.00 N ATOM 805 CA ARG A 50 -11.479 -7.190 -9.453 1.00 0.00 C ATOM 806 C ARG A 50 -11.385 -8.331 -10.467 1.00 0.00 C ATOM 807 O ARG A 50 -11.920 -8.253 -11.554 1.00 0.00 O ATOM 808 CB ARG A 50 -12.925 -7.052 -8.971 1.00 0.00 C ATOM 809 CG ARG A 50 -13.135 -7.920 -7.728 1.00 0.00 C ATOM 810 CD ARG A 50 -14.431 -7.508 -7.029 1.00 0.00 C ATOM 811 NE ARG A 50 -15.550 -7.511 -8.013 1.00 0.00 N ATOM 812 CZ ARG A 50 -16.604 -6.770 -7.804 1.00 0.00 C ATOM 813 NH1 ARG A 50 -17.537 -7.176 -6.988 1.00 0.00 N ATOM 814 NH2 ARG A 50 -16.725 -5.620 -8.411 1.00 0.00 N ATOM 0 H ARG A 50 -11.751 -5.465 -10.682 1.00 0.00 H new ATOM 0 HA ARG A 50 -10.833 -7.405 -8.602 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -13.145 -6.009 -8.741 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.613 -7.356 -9.760 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -13.180 -8.972 -8.010 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -12.291 -7.808 -7.047 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -14.650 -8.195 -6.212 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -14.321 -6.516 -6.591 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.492 -8.092 -8.849 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -17.443 -8.073 -6.512 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -18.360 -6.596 -6.825 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -15.996 -5.301 -9.049 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -17.549 -5.041 -8.247 1.00 0.00 H new ATOM 828 N LEU A 51 -10.708 -9.393 -10.121 1.00 0.00 N ATOM 829 CA LEU A 51 -10.581 -10.534 -11.073 1.00 0.00 C ATOM 830 C LEU A 51 -11.697 -11.549 -10.810 1.00 0.00 C ATOM 831 O LEU A 51 -11.473 -12.598 -10.241 1.00 0.00 O ATOM 832 CB LEU A 51 -9.222 -11.210 -10.879 1.00 0.00 C ATOM 833 CG LEU A 51 -8.501 -11.303 -12.225 1.00 0.00 C ATOM 834 CD1 LEU A 51 -9.418 -11.968 -13.254 1.00 0.00 C ATOM 835 CD2 LEU A 51 -8.134 -9.897 -12.703 1.00 0.00 C ATOM 0 H LEU A 51 -10.239 -9.520 -9.224 1.00 0.00 H new ATOM 0 HA LEU A 51 -10.662 -10.164 -12.095 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -8.619 -10.642 -10.170 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.356 -12.206 -10.457 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.595 -11.898 -12.110 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.903 -12.033 -14.212 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -9.680 -12.970 -12.914 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -10.325 -11.375 -13.370 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -7.620 -9.961 -13.662 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.041 -9.303 -12.816 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -7.479 -9.423 -11.972 1.00 0.00 H new ATOM 847 N LEU A 52 -12.897 -11.244 -11.223 1.00 0.00 N ATOM 848 CA LEU A 52 -14.025 -12.193 -10.998 1.00 0.00 C ATOM 849 C LEU A 52 -13.700 -13.536 -11.658 1.00 0.00 C ATOM 850 O LEU A 52 -13.421 -13.607 -12.838 1.00 0.00 O ATOM 851 CB LEU A 52 -15.304 -11.618 -11.610 1.00 0.00 C ATOM 852 CG LEU A 52 -16.479 -11.859 -10.661 1.00 0.00 C ATOM 853 CD1 LEU A 52 -17.051 -10.517 -10.204 1.00 0.00 C ATOM 854 CD2 LEU A 52 -17.566 -12.654 -11.389 1.00 0.00 C ATOM 0 H LEU A 52 -13.145 -10.380 -11.706 1.00 0.00 H new ATOM 0 HA LEU A 52 -14.170 -12.340 -9.928 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -15.184 -10.550 -11.793 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -15.500 -12.086 -12.575 1.00 0.00 H new ATOM 0 HG LEU A 52 -16.135 -12.421 -9.793 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -17.888 -10.690 -9.528 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -16.278 -9.949 -9.687 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -17.395 -9.954 -11.071 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -18.404 -12.827 -10.714 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -17.909 -12.091 -12.257 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -17.160 -13.611 -11.715 1.00 0.00 H new ATOM 866 N GLY A 53 -13.733 -14.601 -10.905 1.00 0.00 N ATOM 867 CA GLY A 53 -13.425 -15.937 -11.488 1.00 0.00 C ATOM 868 C GLY A 53 -12.438 -16.675 -10.581 1.00 0.00 C ATOM 869 O GLY A 53 -12.560 -17.861 -10.349 1.00 0.00 O ATOM 0 H GLY A 53 -13.960 -14.604 -9.911 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -14.341 -16.518 -11.596 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -13.002 -15.821 -12.486 1.00 0.00 H new ATOM 873 N TYR A 54 -11.461 -15.981 -10.067 1.00 0.00 N ATOM 874 CA TYR A 54 -10.466 -16.639 -9.176 1.00 0.00 C ATOM 875 C TYR A 54 -11.016 -16.694 -7.748 1.00 0.00 C ATOM 876 O TYR A 54 -10.568 -17.472 -6.930 1.00 0.00 O ATOM 877 CB TYR A 54 -9.164 -15.837 -9.191 1.00 0.00 C ATOM 878 CG TYR A 54 -8.118 -16.560 -8.380 1.00 0.00 C ATOM 879 CD1 TYR A 54 -7.285 -17.505 -8.994 1.00 0.00 C ATOM 880 CD2 TYR A 54 -7.978 -16.286 -7.013 1.00 0.00 C ATOM 881 CE1 TYR A 54 -6.313 -18.178 -8.241 1.00 0.00 C ATOM 882 CE2 TYR A 54 -7.006 -16.958 -6.260 1.00 0.00 C ATOM 883 CZ TYR A 54 -6.174 -17.904 -6.874 1.00 0.00 C ATOM 884 OH TYR A 54 -5.215 -18.564 -6.133 1.00 0.00 O ATOM 0 H TYR A 54 -11.309 -14.985 -10.226 1.00 0.00 H new ATOM 0 HA TYR A 54 -10.274 -17.652 -9.529 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -8.818 -15.705 -10.216 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -9.333 -14.841 -8.781 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -7.392 -17.715 -10.048 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -8.619 -15.557 -6.540 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.672 -18.907 -8.714 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.898 -16.747 -5.206 1.00 0.00 H new ATOM 0 HH TYR A 54 -5.251 -18.256 -5.203 1.00 0.00 H new ATOM 894 N GLU A 55 -11.986 -15.873 -7.445 1.00 0.00 N ATOM 895 CA GLU A 55 -12.569 -15.876 -6.072 1.00 0.00 C ATOM 896 C GLU A 55 -11.499 -15.477 -5.054 1.00 0.00 C ATOM 897 O GLU A 55 -10.812 -16.314 -4.503 1.00 0.00 O ATOM 898 CB GLU A 55 -13.095 -17.276 -5.741 1.00 0.00 C ATOM 899 CG GLU A 55 -13.551 -17.321 -4.282 1.00 0.00 C ATOM 900 CD GLU A 55 -14.541 -16.186 -4.019 1.00 0.00 C ATOM 901 OE1 GLU A 55 -15.723 -16.396 -4.232 1.00 0.00 O ATOM 902 OE2 GLU A 55 -14.100 -15.124 -3.609 1.00 0.00 O ATOM 0 H GLU A 55 -12.400 -15.200 -8.090 1.00 0.00 H new ATOM 0 HA GLU A 55 -13.390 -15.160 -6.029 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -13.926 -17.529 -6.400 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -12.315 -18.018 -5.912 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -14.018 -18.282 -4.066 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -12.691 -17.228 -3.619 1.00 0.00 H new ATOM 909 N GLY A 56 -11.355 -14.206 -4.795 1.00 0.00 N ATOM 910 CA GLY A 56 -10.334 -13.757 -3.808 1.00 0.00 C ATOM 911 C GLY A 56 -9.182 -13.061 -4.534 1.00 0.00 C ATOM 912 O GLY A 56 -8.068 -13.017 -4.051 1.00 0.00 O ATOM 0 H GLY A 56 -11.901 -13.459 -5.225 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -10.786 -13.076 -3.088 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -9.958 -14.612 -3.246 1.00 0.00 H new ATOM 916 N HIS A 57 -9.436 -12.516 -5.692 1.00 0.00 N ATOM 917 CA HIS A 57 -8.348 -11.825 -6.440 1.00 0.00 C ATOM 918 C HIS A 57 -8.587 -10.315 -6.422 1.00 0.00 C ATOM 919 O HIS A 57 -9.273 -9.773 -7.269 1.00 0.00 O ATOM 920 CB HIS A 57 -8.320 -12.318 -7.886 1.00 0.00 C ATOM 921 CG HIS A 57 -6.894 -12.391 -8.358 1.00 0.00 C ATOM 922 ND1 HIS A 57 -6.559 -12.777 -9.647 1.00 0.00 N ATOM 923 CD2 HIS A 57 -5.705 -12.129 -7.724 1.00 0.00 C ATOM 924 CE1 HIS A 57 -5.217 -12.736 -9.745 1.00 0.00 C ATOM 925 NE2 HIS A 57 -4.647 -12.347 -8.601 1.00 0.00 N ATOM 0 H HIS A 57 -10.347 -12.519 -6.151 1.00 0.00 H new ATOM 0 HA HIS A 57 -7.393 -12.046 -5.964 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -8.789 -13.299 -7.957 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -8.892 -11.644 -8.523 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -7.210 -13.043 -10.386 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -5.606 -11.803 -6.699 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -4.668 -12.987 -10.640 1.00 0.00 H new ATOM 933 N GLU A 58 -8.024 -9.632 -5.464 1.00 0.00 N ATOM 934 CA GLU A 58 -8.211 -8.158 -5.388 1.00 0.00 C ATOM 935 C GLU A 58 -6.937 -7.461 -5.874 1.00 0.00 C ATOM 936 O GLU A 58 -5.887 -7.572 -5.269 1.00 0.00 O ATOM 937 CB GLU A 58 -8.494 -7.753 -3.940 1.00 0.00 C ATOM 938 CG GLU A 58 -9.501 -6.601 -3.918 1.00 0.00 C ATOM 939 CD GLU A 58 -9.029 -5.527 -2.935 1.00 0.00 C ATOM 940 OE1 GLU A 58 -7.987 -4.943 -3.183 1.00 0.00 O ATOM 941 OE2 GLU A 58 -9.717 -5.307 -1.952 1.00 0.00 O ATOM 0 H GLU A 58 -7.441 -10.033 -4.729 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.051 -7.863 -6.017 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -8.887 -8.604 -3.384 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.569 -7.451 -3.449 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -9.604 -6.175 -4.916 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -10.484 -6.969 -3.626 1.00 0.00 H new ATOM 948 N CYS A 59 -7.018 -6.747 -6.962 1.00 0.00 N ATOM 949 CA CYS A 59 -5.812 -6.049 -7.483 1.00 0.00 C ATOM 950 C CYS A 59 -6.037 -4.537 -7.439 1.00 0.00 C ATOM 951 O CYS A 59 -7.151 -4.069 -7.318 1.00 0.00 O ATOM 952 CB CYS A 59 -5.554 -6.484 -8.927 1.00 0.00 C ATOM 953 SG CYS A 59 -5.904 -8.252 -9.096 1.00 0.00 S ATOM 0 H CYS A 59 -7.867 -6.617 -7.512 1.00 0.00 H new ATOM 0 HA CYS A 59 -4.951 -6.306 -6.866 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -6.183 -5.911 -9.609 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -4.519 -6.279 -9.200 1.00 0.00 H new ATOM 0 HG CYS A 59 -5.687 -8.622 -10.323 1.00 0.00 H new ATOM 959 N ILE A 60 -4.987 -3.773 -7.537 1.00 0.00 N ATOM 960 CA ILE A 60 -5.135 -2.291 -7.504 1.00 0.00 C ATOM 961 C ILE A 60 -4.389 -1.684 -8.692 1.00 0.00 C ATOM 962 O ILE A 60 -3.217 -1.930 -8.887 1.00 0.00 O ATOM 963 CB ILE A 60 -4.544 -1.746 -6.202 1.00 0.00 C ATOM 964 CG1 ILE A 60 -3.118 -2.273 -6.032 1.00 0.00 C ATOM 965 CG2 ILE A 60 -5.399 -2.205 -5.018 1.00 0.00 C ATOM 966 CD1 ILE A 60 -2.485 -1.645 -4.789 1.00 0.00 C ATOM 0 H ILE A 60 -4.030 -4.111 -7.639 1.00 0.00 H new ATOM 0 HA ILE A 60 -6.192 -2.029 -7.560 1.00 0.00 H new ATOM 0 HB ILE A 60 -4.530 -0.657 -6.239 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -3.129 -3.359 -5.938 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -2.524 -2.036 -6.915 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -4.976 -1.816 -4.092 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.416 -1.832 -5.138 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.414 -3.294 -4.981 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -1.469 -2.021 -4.669 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -2.460 -0.561 -4.902 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -3.075 -1.905 -3.910 1.00 0.00 H new ATOM 978 N LEU A 61 -5.052 -0.893 -9.491 1.00 0.00 N ATOM 979 CA LEU A 61 -4.363 -0.283 -10.662 1.00 0.00 C ATOM 980 C LEU A 61 -3.930 1.141 -10.317 1.00 0.00 C ATOM 981 O LEU A 61 -4.735 1.986 -9.974 1.00 0.00 O ATOM 982 CB LEU A 61 -5.309 -0.250 -11.865 1.00 0.00 C ATOM 983 CG LEU A 61 -4.640 0.497 -13.023 1.00 0.00 C ATOM 984 CD1 LEU A 61 -3.809 -0.482 -13.852 1.00 0.00 C ATOM 985 CD2 LEU A 61 -5.714 1.130 -13.911 1.00 0.00 C ATOM 0 H LEU A 61 -6.035 -0.644 -9.384 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.486 -0.881 -10.911 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.561 -1.266 -12.171 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.243 0.242 -11.593 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.991 1.276 -12.623 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.334 0.051 -14.676 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.043 -0.934 -13.222 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -4.457 -1.262 -14.251 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.238 1.662 -14.735 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -6.363 0.350 -14.309 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.307 1.830 -13.322 1.00 0.00 H new ATOM 997 N LEU A 62 -2.659 1.407 -10.413 1.00 0.00 N ATOM 998 CA LEU A 62 -2.154 2.773 -10.100 1.00 0.00 C ATOM 999 C LEU A 62 -0.966 3.094 -11.011 1.00 0.00 C ATOM 1000 O LEU A 62 -0.783 4.219 -11.432 1.00 0.00 O ATOM 1001 CB LEU A 62 -1.716 2.841 -8.635 1.00 0.00 C ATOM 1002 CG LEU A 62 -0.728 1.713 -8.338 1.00 0.00 C ATOM 1003 CD1 LEU A 62 0.668 2.302 -8.129 1.00 0.00 C ATOM 1004 CD2 LEU A 62 -1.164 0.975 -7.070 1.00 0.00 C ATOM 0 H LEU A 62 -1.945 0.736 -10.696 1.00 0.00 H new ATOM 0 HA LEU A 62 -2.948 3.501 -10.267 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -1.253 3.806 -8.428 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.585 2.758 -7.982 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.708 1.016 -9.176 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.374 1.499 -7.917 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.979 2.830 -9.031 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.648 2.998 -7.290 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.460 0.170 -6.857 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.183 1.672 -6.232 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.160 0.557 -7.217 1.00 0.00 H new ATOM 1016 N ASP A 63 -0.159 2.115 -11.326 1.00 0.00 N ATOM 1017 CA ASP A 63 1.007 2.371 -12.214 1.00 0.00 C ATOM 1018 C ASP A 63 0.516 3.036 -13.499 1.00 0.00 C ATOM 1019 O ASP A 63 1.216 3.821 -14.107 1.00 0.00 O ATOM 1020 CB ASP A 63 1.696 1.048 -12.555 1.00 0.00 C ATOM 1021 CG ASP A 63 2.915 0.861 -11.650 1.00 0.00 C ATOM 1022 OD1 ASP A 63 2.818 1.197 -10.482 1.00 0.00 O ATOM 1023 OD2 ASP A 63 3.926 0.385 -12.142 1.00 0.00 O ATOM 0 H ASP A 63 -0.259 1.152 -11.006 1.00 0.00 H new ATOM 0 HA ASP A 63 1.718 3.024 -11.707 1.00 0.00 H new ATOM 0 HB2 ASP A 63 1.001 0.219 -12.423 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.002 1.044 -13.601 1.00 0.00 H new ATOM 1028 N TYR A 64 -0.687 2.730 -13.914 1.00 0.00 N ATOM 1029 CA TYR A 64 -1.228 3.350 -15.159 1.00 0.00 C ATOM 1030 C TYR A 64 -0.859 4.836 -15.184 1.00 0.00 C ATOM 1031 O TYR A 64 -0.321 5.335 -16.152 1.00 0.00 O ATOM 1032 CB TYR A 64 -2.752 3.197 -15.186 1.00 0.00 C ATOM 1033 CG TYR A 64 -3.337 4.111 -16.237 1.00 0.00 C ATOM 1034 CD1 TYR A 64 -2.784 4.144 -17.524 1.00 0.00 C ATOM 1035 CD2 TYR A 64 -4.432 4.927 -15.925 1.00 0.00 C ATOM 1036 CE1 TYR A 64 -3.326 4.992 -18.498 1.00 0.00 C ATOM 1037 CE2 TYR A 64 -4.974 5.775 -16.899 1.00 0.00 C ATOM 1038 CZ TYR A 64 -4.421 5.808 -18.186 1.00 0.00 C ATOM 1039 OH TYR A 64 -4.956 6.643 -19.145 1.00 0.00 O ATOM 0 H TYR A 64 -1.316 2.079 -13.445 1.00 0.00 H new ATOM 0 HA TYR A 64 -0.802 2.854 -16.031 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -3.020 2.162 -15.400 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -3.169 3.438 -14.208 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -1.940 3.515 -17.765 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -4.858 4.902 -14.933 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -2.900 5.017 -19.490 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -5.818 6.404 -16.658 1.00 0.00 H new ATOM 0 HH TYR A 64 -5.711 7.138 -18.763 1.00 0.00 H new ATOM 1049 N LEU A 65 -1.139 5.545 -14.124 1.00 0.00 N ATOM 1050 CA LEU A 65 -0.796 6.994 -14.088 1.00 0.00 C ATOM 1051 C LEU A 65 0.692 7.166 -14.397 1.00 0.00 C ATOM 1052 O LEU A 65 1.068 7.606 -15.464 1.00 0.00 O ATOM 1053 CB LEU A 65 -1.096 7.556 -12.697 1.00 0.00 C ATOM 1054 CG LEU A 65 -1.930 8.831 -12.827 1.00 0.00 C ATOM 1055 CD1 LEU A 65 -2.585 9.154 -11.483 1.00 0.00 C ATOM 1056 CD2 LEU A 65 -1.024 9.993 -13.244 1.00 0.00 C ATOM 0 H LEU A 65 -1.590 5.184 -13.283 1.00 0.00 H new ATOM 0 HA LEU A 65 -1.389 7.529 -14.829 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.634 6.817 -12.103 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -0.165 7.770 -12.172 1.00 0.00 H new ATOM 0 HG LEU A 65 -2.703 8.683 -13.581 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.179 10.063 -11.577 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.230 8.328 -11.185 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -1.813 9.302 -10.728 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.618 10.902 -13.337 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.251 10.140 -12.490 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.558 9.765 -14.202 1.00 0.00 H new ATOM 1068 N ASN A 66 1.541 6.815 -13.469 1.00 0.00 N ATOM 1069 CA ASN A 66 3.007 6.950 -13.705 1.00 0.00 C ATOM 1070 C ASN A 66 3.295 8.292 -14.381 1.00 0.00 C ATOM 1071 O ASN A 66 4.080 8.374 -15.305 1.00 0.00 O ATOM 1072 CB ASN A 66 3.482 5.810 -14.608 1.00 0.00 C ATOM 1073 CG ASN A 66 4.415 4.890 -13.819 1.00 0.00 C ATOM 1074 OD1 ASN A 66 4.351 3.684 -13.948 1.00 0.00 O ATOM 1075 ND2 ASN A 66 5.288 5.413 -13.001 1.00 0.00 N ATOM 0 H ASN A 66 1.282 6.440 -12.556 1.00 0.00 H new ATOM 0 HA ASN A 66 3.535 6.905 -12.753 1.00 0.00 H new ATOM 0 HB2 ASN A 66 2.627 5.246 -14.980 1.00 0.00 H new ATOM 0 HB3 ASN A 66 4.001 6.213 -15.478 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.916 4.809 -12.471 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.342 6.426 -12.892 1.00 0.00 H new ATOM 1082 N TYR A 67 2.669 9.343 -13.928 1.00 0.00 N ATOM 1083 CA TYR A 67 2.910 10.676 -14.547 1.00 0.00 C ATOM 1084 C TYR A 67 2.180 11.752 -13.741 1.00 0.00 C ATOM 1085 O TYR A 67 1.226 12.346 -14.202 1.00 0.00 O ATOM 1086 CB TYR A 67 2.392 10.674 -15.986 1.00 0.00 C ATOM 1087 CG TYR A 67 3.527 10.986 -16.931 1.00 0.00 C ATOM 1088 CD1 TYR A 67 4.014 12.295 -17.032 1.00 0.00 C ATOM 1089 CD2 TYR A 67 4.097 9.964 -17.705 1.00 0.00 C ATOM 1090 CE1 TYR A 67 5.068 12.586 -17.909 1.00 0.00 C ATOM 1091 CE2 TYR A 67 5.151 10.254 -18.580 1.00 0.00 C ATOM 1092 CZ TYR A 67 5.637 11.565 -18.682 1.00 0.00 C ATOM 1093 OH TYR A 67 6.676 11.851 -19.545 1.00 0.00 O ATOM 0 H TYR A 67 2.002 9.336 -13.157 1.00 0.00 H new ATOM 0 HA TYR A 67 3.979 10.887 -14.549 1.00 0.00 H new ATOM 0 HB2 TYR A 67 1.961 9.702 -16.227 1.00 0.00 H new ATOM 0 HB3 TYR A 67 1.598 11.412 -16.099 1.00 0.00 H new ATOM 0 HD1 TYR A 67 3.577 13.081 -16.434 1.00 0.00 H new ATOM 0 HD2 TYR A 67 3.723 8.954 -17.626 1.00 0.00 H new ATOM 0 HE1 TYR A 67 5.441 13.596 -17.989 1.00 0.00 H new ATOM 0 HE2 TYR A 67 5.590 9.468 -19.176 1.00 0.00 H new ATOM 0 HH TYR A 67 6.955 11.031 -20.004 1.00 0.00 H new ATOM 1103 N ARG A 68 2.621 12.006 -12.540 1.00 0.00 N ATOM 1104 CA ARG A 68 1.955 13.042 -11.701 1.00 0.00 C ATOM 1105 C ARG A 68 1.926 14.371 -12.458 1.00 0.00 C ATOM 1106 O ARG A 68 2.936 15.030 -12.615 1.00 0.00 O ATOM 1107 CB ARG A 68 2.733 13.216 -10.395 1.00 0.00 C ATOM 1108 CG ARG A 68 1.762 13.548 -9.261 1.00 0.00 C ATOM 1109 CD ARG A 68 1.793 15.053 -8.988 1.00 0.00 C ATOM 1110 NE ARG A 68 1.455 15.305 -7.559 1.00 0.00 N ATOM 1111 CZ ARG A 68 1.758 16.448 -7.009 1.00 0.00 C ATOM 1112 NH1 ARG A 68 1.272 17.556 -7.497 1.00 0.00 N ATOM 1113 NH2 ARG A 68 2.550 16.484 -5.971 1.00 0.00 N ATOM 0 H ARG A 68 3.416 11.540 -12.102 1.00 0.00 H new ATOM 0 HA ARG A 68 0.935 12.729 -11.478 1.00 0.00 H new ATOM 0 HB2 ARG A 68 3.282 12.303 -10.162 1.00 0.00 H new ATOM 0 HB3 ARG A 68 3.470 14.012 -10.502 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.752 13.237 -9.529 1.00 0.00 H new ATOM 0 HG3 ARG A 68 2.036 12.998 -8.360 1.00 0.00 H new ATOM 0 HD2 ARG A 68 2.780 15.455 -9.216 1.00 0.00 H new ATOM 0 HD3 ARG A 68 1.083 15.566 -9.637 1.00 0.00 H new ATOM 0 HE ARG A 68 0.987 14.584 -7.011 1.00 0.00 H new ATOM 0 HH11 ARG A 68 0.655 17.528 -8.309 1.00 0.00 H new ATOM 0 HH12 ARG A 68 1.509 18.450 -7.067 1.00 0.00 H new ATOM 0 HH21 ARG A 68 2.932 15.618 -5.590 1.00 0.00 H new ATOM 0 HH22 ARG A 68 2.787 17.378 -5.541 1.00 0.00 H new ATOM 1127 N GLN A 69 0.777 14.774 -12.929 1.00 0.00 N ATOM 1128 CA GLN A 69 0.687 16.063 -13.673 1.00 0.00 C ATOM 1129 C GLN A 69 -0.784 16.427 -13.887 1.00 0.00 C ATOM 1130 O GLN A 69 -1.349 17.216 -13.156 1.00 0.00 O ATOM 1131 CB GLN A 69 1.382 15.920 -15.029 1.00 0.00 C ATOM 1132 CG GLN A 69 2.589 16.860 -15.085 1.00 0.00 C ATOM 1133 CD GLN A 69 3.750 16.161 -15.794 1.00 0.00 C ATOM 1134 OE1 GLN A 69 3.546 15.422 -16.735 1.00 0.00 O ATOM 1135 NE2 GLN A 69 4.970 16.367 -15.379 1.00 0.00 N ATOM 0 H GLN A 69 -0.103 14.267 -12.831 1.00 0.00 H new ATOM 0 HA GLN A 69 1.175 16.850 -13.097 1.00 0.00 H new ATOM 0 HB2 GLN A 69 1.703 14.889 -15.178 1.00 0.00 H new ATOM 0 HB3 GLN A 69 0.686 16.157 -15.833 1.00 0.00 H new ATOM 0 HG2 GLN A 69 2.325 17.776 -15.614 1.00 0.00 H new ATOM 0 HG3 GLN A 69 2.886 17.148 -14.076 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.142 16.988 -14.588 1.00 0.00 H new ATOM 0 HE22 GLN A 69 5.752 15.907 -15.845 1.00 0.00 H new ATOM 1144 N ASP A 70 -1.408 15.862 -14.885 1.00 0.00 N ATOM 1145 CA ASP A 70 -2.841 16.182 -15.142 1.00 0.00 C ATOM 1146 C ASP A 70 -3.511 15.003 -15.853 1.00 0.00 C ATOM 1147 O ASP A 70 -2.857 14.091 -16.316 1.00 0.00 O ATOM 1148 CB ASP A 70 -2.936 17.427 -16.027 1.00 0.00 C ATOM 1149 CG ASP A 70 -4.059 18.330 -15.517 1.00 0.00 C ATOM 1150 OD1 ASP A 70 -3.982 18.753 -14.375 1.00 0.00 O ATOM 1151 OD2 ASP A 70 -4.978 18.587 -16.278 1.00 0.00 O ATOM 0 H ASP A 70 -0.988 15.194 -15.532 1.00 0.00 H new ATOM 0 HA ASP A 70 -3.344 16.369 -14.193 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.989 17.966 -16.018 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -3.128 17.138 -17.060 1.00 0.00 H new ATOM 1156 N THR A 71 -4.813 15.019 -15.942 1.00 0.00 N ATOM 1157 CA THR A 71 -5.528 13.902 -16.622 1.00 0.00 C ATOM 1158 C THR A 71 -7.038 14.108 -16.483 1.00 0.00 C ATOM 1159 O THR A 71 -7.532 14.462 -15.431 1.00 0.00 O ATOM 1160 CB THR A 71 -5.132 12.572 -15.977 1.00 0.00 C ATOM 1161 OG1 THR A 71 -5.920 11.527 -16.529 1.00 0.00 O ATOM 1162 CG2 THR A 71 -5.364 12.646 -14.467 1.00 0.00 C ATOM 0 H THR A 71 -5.412 15.757 -15.573 1.00 0.00 H new ATOM 0 HA THR A 71 -5.257 13.886 -17.678 1.00 0.00 H new ATOM 0 HB THR A 71 -4.078 12.373 -16.170 1.00 0.00 H new ATOM 0 HG1 THR A 71 -5.666 10.674 -16.118 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.082 11.698 -14.009 1.00 0.00 H new ATOM 0 HG22 THR A 71 -4.758 13.448 -14.045 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.417 12.845 -14.270 1.00 0.00 H new ATOM 1170 N LEU A 72 -7.776 13.894 -17.539 1.00 0.00 N ATOM 1171 CA LEU A 72 -9.253 14.082 -17.465 1.00 0.00 C ATOM 1172 C LEU A 72 -9.941 12.722 -17.318 1.00 0.00 C ATOM 1173 O LEU A 72 -11.141 12.640 -17.158 1.00 0.00 O ATOM 1174 CB LEU A 72 -9.745 14.763 -18.744 1.00 0.00 C ATOM 1175 CG LEU A 72 -8.707 15.783 -19.215 1.00 0.00 C ATOM 1176 CD1 LEU A 72 -9.037 16.226 -20.641 1.00 0.00 C ATOM 1177 CD2 LEU A 72 -8.733 16.999 -18.285 1.00 0.00 C ATOM 0 H LEU A 72 -7.420 13.598 -18.448 1.00 0.00 H new ATOM 0 HA LEU A 72 -9.493 14.704 -16.603 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -9.917 14.018 -19.521 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -10.699 15.258 -18.561 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.716 15.330 -19.196 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -8.297 16.953 -20.977 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -9.022 15.361 -21.304 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -10.027 16.681 -20.661 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.994 17.728 -18.618 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -9.724 17.452 -18.306 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -8.499 16.684 -17.268 1.00 0.00 H new ATOM 1189 N ASP A 73 -9.191 11.655 -17.373 1.00 0.00 N ATOM 1190 CA ASP A 73 -9.809 10.306 -17.237 1.00 0.00 C ATOM 1191 C ASP A 73 -11.051 10.225 -18.128 1.00 0.00 C ATOM 1192 O ASP A 73 -12.111 9.813 -17.700 1.00 0.00 O ATOM 1193 CB ASP A 73 -10.215 10.075 -15.779 1.00 0.00 C ATOM 1194 CG ASP A 73 -9.020 9.519 -15.000 1.00 0.00 C ATOM 1195 OD1 ASP A 73 -8.792 8.324 -15.080 1.00 0.00 O ATOM 1196 OD2 ASP A 73 -8.355 10.299 -14.339 1.00 0.00 O ATOM 0 H ASP A 73 -8.180 11.659 -17.506 1.00 0.00 H new ATOM 0 HA ASP A 73 -9.090 9.544 -17.540 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -10.552 11.010 -15.331 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -11.052 9.378 -15.729 1.00 0.00 H new ATOM 1201 N ARG A 74 -10.929 10.618 -19.367 1.00 0.00 N ATOM 1202 CA ARG A 74 -12.101 10.567 -20.286 1.00 0.00 C ATOM 1203 C ARG A 74 -12.474 9.108 -20.563 1.00 0.00 C ATOM 1204 O ARG A 74 -13.625 8.781 -20.771 1.00 0.00 O ATOM 1205 CB ARG A 74 -11.746 11.261 -21.602 1.00 0.00 C ATOM 1206 CG ARG A 74 -12.141 12.737 -21.526 1.00 0.00 C ATOM 1207 CD ARG A 74 -12.998 13.100 -22.741 1.00 0.00 C ATOM 1208 NE ARG A 74 -14.053 14.070 -22.333 1.00 0.00 N ATOM 1209 CZ ARG A 74 -14.359 15.070 -23.114 1.00 0.00 C ATOM 1210 NH1 ARG A 74 -14.921 14.849 -24.270 1.00 0.00 N ATOM 1211 NH2 ARG A 74 -14.099 16.292 -22.738 1.00 0.00 N ATOM 0 H ARG A 74 -10.067 10.972 -19.782 1.00 0.00 H new ATOM 0 HA ARG A 74 -12.947 11.075 -19.822 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -10.677 11.170 -21.796 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -12.263 10.778 -22.431 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -12.694 12.929 -20.607 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -11.249 13.362 -21.497 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -12.374 13.533 -23.523 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -13.456 12.203 -23.158 1.00 0.00 H new ATOM 0 HE ARG A 74 -14.536 13.952 -21.443 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -15.122 13.894 -24.565 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -15.159 15.632 -24.879 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -13.657 16.465 -21.835 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -14.337 17.075 -23.347 1.00 0.00 H new ATOM 1225 N LEU A 75 -11.510 8.228 -20.568 1.00 0.00 N ATOM 1226 CA LEU A 75 -11.813 6.793 -20.833 1.00 0.00 C ATOM 1227 C LEU A 75 -12.592 6.208 -19.653 1.00 0.00 C ATOM 1228 O LEU A 75 -13.581 5.523 -19.828 1.00 0.00 O ATOM 1229 CB LEU A 75 -10.507 6.019 -21.017 1.00 0.00 C ATOM 1230 CG LEU A 75 -10.134 5.993 -22.501 1.00 0.00 C ATOM 1231 CD1 LEU A 75 -8.860 6.811 -22.723 1.00 0.00 C ATOM 1232 CD2 LEU A 75 -9.890 4.548 -22.941 1.00 0.00 C ATOM 0 H LEU A 75 -10.527 8.441 -20.400 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.413 6.712 -21.740 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -9.710 6.487 -20.439 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.619 5.002 -20.641 1.00 0.00 H new ATOM 0 HG LEU A 75 -10.949 6.421 -23.086 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -8.595 6.792 -23.780 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -9.030 7.841 -22.410 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.046 6.383 -22.137 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -9.624 4.529 -23.998 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.076 4.122 -22.355 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -10.796 3.962 -22.784 1.00 0.00 H new ATOM 1244 N LYS A 76 -12.157 6.473 -18.451 1.00 0.00 N ATOM 1245 CA LYS A 76 -12.878 5.933 -17.264 1.00 0.00 C ATOM 1246 C LYS A 76 -14.262 6.577 -17.174 1.00 0.00 C ATOM 1247 O LYS A 76 -15.201 5.989 -16.675 1.00 0.00 O ATOM 1248 CB LYS A 76 -12.086 6.254 -15.994 1.00 0.00 C ATOM 1249 CG LYS A 76 -11.247 5.039 -15.595 1.00 0.00 C ATOM 1250 CD LYS A 76 -9.902 5.088 -16.322 1.00 0.00 C ATOM 1251 CE LYS A 76 -9.882 4.030 -17.427 1.00 0.00 C ATOM 1252 NZ LYS A 76 -8.604 3.265 -17.360 1.00 0.00 N ATOM 0 H LYS A 76 -11.335 7.039 -18.240 1.00 0.00 H new ATOM 0 HA LYS A 76 -12.983 4.853 -17.364 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -11.440 7.115 -16.164 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -12.767 6.520 -15.186 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -11.090 5.031 -14.516 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -11.776 4.120 -15.847 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -9.743 6.078 -16.749 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -9.089 4.910 -15.618 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -10.729 3.354 -17.313 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -9.983 4.506 -18.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -8.711 2.365 -17.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -7.842 3.823 -17.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -8.366 3.072 -16.366 1.00 0.00 H new ATOM 1266 N GLU A 77 -14.396 7.782 -17.657 1.00 0.00 N ATOM 1267 CA GLU A 77 -15.718 8.464 -17.600 1.00 0.00 C ATOM 1268 C GLU A 77 -16.696 7.754 -18.537 1.00 0.00 C ATOM 1269 O GLU A 77 -17.882 7.692 -18.281 1.00 0.00 O ATOM 1270 CB GLU A 77 -15.563 9.924 -18.036 1.00 0.00 C ATOM 1271 CG GLU A 77 -16.933 10.603 -18.041 1.00 0.00 C ATOM 1272 CD GLU A 77 -17.541 10.539 -16.640 1.00 0.00 C ATOM 1273 OE1 GLU A 77 -17.226 11.402 -15.838 1.00 0.00 O ATOM 1274 OE2 GLU A 77 -18.312 9.626 -16.391 1.00 0.00 O ATOM 0 H GLU A 77 -13.647 8.323 -18.088 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.099 8.430 -16.579 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -14.888 10.447 -17.358 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.118 9.973 -19.030 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.835 11.641 -18.359 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.591 10.111 -18.757 1.00 0.00 H new ATOM 1281 N ARG A 78 -16.209 7.213 -19.620 1.00 0.00 N ATOM 1282 CA ARG A 78 -17.114 6.506 -20.568 1.00 0.00 C ATOM 1283 C ARG A 78 -18.013 5.545 -19.788 1.00 0.00 C ATOM 1284 O ARG A 78 -19.224 5.616 -19.861 1.00 0.00 O ATOM 1285 CB ARG A 78 -16.282 5.720 -21.583 1.00 0.00 C ATOM 1286 CG ARG A 78 -16.875 5.909 -22.981 1.00 0.00 C ATOM 1287 CD ARG A 78 -16.524 7.305 -23.499 1.00 0.00 C ATOM 1288 NE ARG A 78 -15.989 7.201 -24.885 1.00 0.00 N ATOM 1289 CZ ARG A 78 -15.092 8.053 -25.304 1.00 0.00 C ATOM 1290 NH1 ARG A 78 -15.415 9.304 -25.483 1.00 0.00 N ATOM 1291 NH2 ARG A 78 -13.874 7.651 -25.545 1.00 0.00 N ATOM 0 H ARG A 78 -15.225 7.230 -19.889 1.00 0.00 H new ATOM 0 HA ARG A 78 -17.730 7.235 -21.095 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -15.248 6.063 -21.565 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -16.272 4.662 -21.320 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -16.485 5.149 -23.659 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -17.957 5.783 -22.949 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -17.408 7.942 -23.486 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -15.786 7.771 -22.847 1.00 0.00 H new ATOM 0 HE ARG A 78 -16.323 6.465 -25.507 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -16.368 9.617 -25.296 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -14.715 9.970 -25.810 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -13.623 6.672 -25.406 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.173 8.316 -25.872 1.00 0.00 H new ATOM 1305 N LEU A 79 -17.432 4.648 -19.038 1.00 0.00 N ATOM 1306 CA LEU A 79 -18.258 3.688 -18.252 1.00 0.00 C ATOM 1307 C LEU A 79 -17.366 2.925 -17.272 1.00 0.00 C ATOM 1308 O LEU A 79 -17.269 1.713 -17.319 1.00 0.00 O ATOM 1309 CB LEU A 79 -18.934 2.699 -19.204 1.00 0.00 C ATOM 1310 CG LEU A 79 -20.406 3.077 -19.368 1.00 0.00 C ATOM 1311 CD1 LEU A 79 -20.838 2.836 -20.815 1.00 0.00 C ATOM 1312 CD2 LEU A 79 -21.260 2.216 -18.433 1.00 0.00 C ATOM 0 H LEU A 79 -16.423 4.539 -18.936 1.00 0.00 H new ATOM 0 HA LEU A 79 -19.019 4.236 -17.696 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -18.434 2.710 -20.173 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -18.849 1.685 -18.813 1.00 0.00 H new ATOM 0 HG LEU A 79 -20.540 4.130 -19.119 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -21.888 3.106 -20.931 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -20.230 3.447 -21.483 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -20.704 1.783 -21.064 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -22.310 2.485 -18.549 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -21.125 1.164 -18.683 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -20.954 2.386 -17.401 1.00 0.00 H new ATOM 1324 N VAL A 80 -16.715 3.623 -16.381 1.00 0.00 N ATOM 1325 CA VAL A 80 -15.834 2.934 -15.397 1.00 0.00 C ATOM 1326 C VAL A 80 -16.557 1.703 -14.856 1.00 0.00 C ATOM 1327 O VAL A 80 -17.748 1.539 -15.029 1.00 0.00 O ATOM 1328 CB VAL A 80 -15.501 3.892 -14.247 1.00 0.00 C ATOM 1329 CG1 VAL A 80 -16.739 4.717 -13.896 1.00 0.00 C ATOM 1330 CG2 VAL A 80 -15.054 3.101 -13.011 1.00 0.00 C ATOM 0 H VAL A 80 -16.755 4.638 -16.293 1.00 0.00 H new ATOM 0 HA VAL A 80 -14.907 2.627 -15.882 1.00 0.00 H new ATOM 0 HB VAL A 80 -14.692 4.552 -14.561 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -16.503 5.398 -13.078 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -17.053 5.291 -14.768 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -17.546 4.051 -13.591 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -14.820 3.792 -12.201 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -15.856 2.433 -12.697 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -14.168 2.515 -13.255 1.00 0.00 H new ATOM 1340 N GLY A 81 -15.844 0.836 -14.200 1.00 0.00 N ATOM 1341 CA GLY A 81 -16.486 -0.386 -13.644 1.00 0.00 C ATOM 1342 C GLY A 81 -16.551 -1.473 -14.718 1.00 0.00 C ATOM 1343 O GLY A 81 -16.279 -2.630 -14.458 1.00 0.00 O ATOM 0 H GLY A 81 -14.843 0.919 -14.024 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -15.921 -0.745 -12.784 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.490 -0.151 -13.290 1.00 0.00 H new ATOM 1347 N ARG A 82 -16.917 -1.107 -15.920 1.00 0.00 N ATOM 1348 CA ARG A 82 -17.017 -2.107 -17.023 1.00 0.00 C ATOM 1349 C ARG A 82 -15.792 -3.022 -17.029 1.00 0.00 C ATOM 1350 O ARG A 82 -14.883 -2.879 -16.236 1.00 0.00 O ATOM 1351 CB ARG A 82 -17.107 -1.372 -18.363 1.00 0.00 C ATOM 1352 CG ARG A 82 -18.513 -1.541 -18.943 1.00 0.00 C ATOM 1353 CD ARG A 82 -18.752 -0.483 -20.022 1.00 0.00 C ATOM 1354 NE ARG A 82 -18.645 -1.111 -21.368 1.00 0.00 N ATOM 1355 CZ ARG A 82 -19.455 -2.077 -21.705 1.00 0.00 C ATOM 1356 NH1 ARG A 82 -20.716 -1.823 -21.927 1.00 0.00 N ATOM 1357 NH2 ARG A 82 -19.006 -3.297 -21.820 1.00 0.00 N ATOM 0 H ARG A 82 -17.152 -0.151 -16.185 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.909 -2.715 -16.869 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -16.883 -0.314 -18.226 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -16.365 -1.767 -19.057 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.625 -2.539 -19.366 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -19.258 -1.444 -18.153 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -19.738 -0.036 -19.895 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.022 0.321 -19.925 1.00 0.00 H new ATOM 0 HE ARG A 82 -17.938 -0.786 -22.027 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -21.068 -0.870 -21.837 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -21.350 -2.578 -22.190 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -18.021 -3.496 -21.646 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -19.640 -4.051 -22.083 1.00 0.00 H new ATOM 1371 N VAL A 83 -15.763 -3.962 -17.929 1.00 0.00 N ATOM 1372 CA VAL A 83 -14.604 -4.893 -17.995 1.00 0.00 C ATOM 1373 C VAL A 83 -13.617 -4.389 -19.044 1.00 0.00 C ATOM 1374 O VAL A 83 -13.995 -3.802 -20.038 1.00 0.00 O ATOM 1375 CB VAL A 83 -15.088 -6.291 -18.382 1.00 0.00 C ATOM 1376 CG1 VAL A 83 -16.146 -6.761 -17.383 1.00 0.00 C ATOM 1377 CG2 VAL A 83 -15.697 -6.249 -19.786 1.00 0.00 C ATOM 0 H VAL A 83 -16.492 -4.127 -18.623 1.00 0.00 H new ATOM 0 HA VAL A 83 -14.117 -4.938 -17.021 1.00 0.00 H new ATOM 0 HB VAL A 83 -14.245 -6.982 -18.370 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -16.490 -7.757 -17.660 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -15.714 -6.791 -16.383 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -16.989 -6.070 -17.394 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -16.042 -7.245 -20.063 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -16.539 -5.557 -19.797 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -14.944 -5.915 -20.499 1.00 0.00 H new ATOM 1387 N ILE A 84 -12.352 -4.597 -18.818 1.00 0.00 N ATOM 1388 CA ILE A 84 -11.336 -4.113 -19.785 1.00 0.00 C ATOM 1389 C ILE A 84 -10.057 -4.937 -19.633 1.00 0.00 C ATOM 1390 O ILE A 84 -9.945 -5.774 -18.757 1.00 0.00 O ATOM 1391 CB ILE A 84 -11.034 -2.644 -19.485 1.00 0.00 C ATOM 1392 CG1 ILE A 84 -10.789 -2.477 -17.983 1.00 0.00 C ATOM 1393 CG2 ILE A 84 -12.230 -1.782 -19.895 1.00 0.00 C ATOM 1394 CD1 ILE A 84 -9.307 -2.690 -17.679 1.00 0.00 C ATOM 0 H ILE A 84 -11.979 -5.083 -18.003 1.00 0.00 H new ATOM 0 HA ILE A 84 -11.711 -4.216 -20.803 1.00 0.00 H new ATOM 0 HB ILE A 84 -10.151 -2.333 -20.043 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -11.097 -1.482 -17.662 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -11.392 -3.193 -17.424 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -12.014 -0.735 -19.681 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -12.417 -1.903 -20.962 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -13.112 -2.093 -19.334 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -9.134 -2.571 -16.609 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.014 -3.694 -17.984 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -8.714 -1.957 -18.226 1.00 0.00 H new ATOM 1406 N LYS A 85 -9.089 -4.704 -20.476 1.00 0.00 N ATOM 1407 CA LYS A 85 -7.816 -5.469 -20.379 1.00 0.00 C ATOM 1408 C LYS A 85 -6.756 -4.598 -19.704 1.00 0.00 C ATOM 1409 O LYS A 85 -6.703 -3.401 -19.906 1.00 0.00 O ATOM 1410 CB LYS A 85 -7.345 -5.856 -21.781 1.00 0.00 C ATOM 1411 CG LYS A 85 -7.079 -4.589 -22.596 1.00 0.00 C ATOM 1412 CD LYS A 85 -6.195 -4.933 -23.796 1.00 0.00 C ATOM 1413 CE LYS A 85 -6.432 -3.915 -24.913 1.00 0.00 C ATOM 1414 NZ LYS A 85 -7.765 -4.163 -25.535 1.00 0.00 N ATOM 0 H LYS A 85 -9.126 -4.016 -21.228 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.975 -6.373 -19.791 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -6.439 -6.458 -21.719 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.101 -6.467 -22.275 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -8.021 -4.158 -22.936 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -6.591 -3.839 -21.974 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.146 -4.928 -23.501 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.421 -5.938 -24.152 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -6.388 -2.902 -24.512 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.647 -3.995 -25.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.761 -3.815 -26.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -7.966 -5.183 -25.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -8.499 -3.663 -24.994 1.00 0.00 H new ATOM 1428 N THR A 86 -5.912 -5.186 -18.901 1.00 0.00 N ATOM 1429 CA THR A 86 -4.862 -4.384 -18.216 1.00 0.00 C ATOM 1430 C THR A 86 -3.596 -5.228 -18.056 1.00 0.00 C ATOM 1431 O THR A 86 -3.572 -6.399 -18.381 1.00 0.00 O ATOM 1432 CB THR A 86 -5.367 -3.953 -16.837 1.00 0.00 C ATOM 1433 OG1 THR A 86 -6.787 -3.940 -16.840 1.00 0.00 O ATOM 1434 CG2 THR A 86 -4.842 -2.554 -16.514 1.00 0.00 C ATOM 0 H THR A 86 -5.905 -6.184 -18.691 1.00 0.00 H new ATOM 0 HA THR A 86 -4.635 -3.500 -18.812 1.00 0.00 H new ATOM 0 HB THR A 86 -5.011 -4.654 -16.082 1.00 0.00 H new ATOM 0 HG1 THR A 86 -7.113 -3.666 -15.958 1.00 0.00 H new ATOM 0 HG21 THR A 86 -5.202 -2.248 -15.532 1.00 0.00 H new ATOM 0 HG22 THR A 86 -3.752 -2.566 -16.513 1.00 0.00 H new ATOM 0 HG23 THR A 86 -5.197 -1.850 -17.266 1.00 0.00 H new ATOM 1442 N ARG A 87 -2.541 -4.641 -17.559 1.00 0.00 N ATOM 1443 CA ARG A 87 -1.275 -5.405 -17.380 1.00 0.00 C ATOM 1444 C ARG A 87 -1.124 -5.799 -15.909 1.00 0.00 C ATOM 1445 O ARG A 87 -1.639 -5.144 -15.025 1.00 0.00 O ATOM 1446 CB ARG A 87 -0.085 -4.535 -17.796 1.00 0.00 C ATOM 1447 CG ARG A 87 -0.523 -3.540 -18.875 1.00 0.00 C ATOM 1448 CD ARG A 87 -1.049 -4.303 -20.092 1.00 0.00 C ATOM 1449 NE ARG A 87 0.096 -4.884 -20.846 1.00 0.00 N ATOM 1450 CZ ARG A 87 0.396 -4.425 -22.029 1.00 0.00 C ATOM 1451 NH1 ARG A 87 0.228 -3.159 -22.298 1.00 0.00 N ATOM 1452 NH2 ARG A 87 0.866 -5.230 -22.942 1.00 0.00 N ATOM 0 H ARG A 87 -2.502 -3.664 -17.269 1.00 0.00 H new ATOM 0 HA ARG A 87 -1.303 -6.301 -18.000 1.00 0.00 H new ATOM 0 HB2 ARG A 87 0.306 -3.999 -16.931 1.00 0.00 H new ATOM 0 HB3 ARG A 87 0.722 -5.163 -18.173 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -1.298 -2.881 -18.483 1.00 0.00 H new ATOM 0 HG3 ARG A 87 0.317 -2.908 -19.164 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.727 -5.094 -19.773 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -1.620 -3.634 -20.735 1.00 0.00 H new ATOM 0 HE ARG A 87 0.645 -5.640 -20.438 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -0.138 -2.530 -21.583 1.00 0.00 H new ATOM 0 HH12 ARG A 87 0.462 -2.799 -23.223 1.00 0.00 H new ATOM 0 HH21 ARG A 87 0.999 -6.219 -22.730 1.00 0.00 H new ATOM 0 HH22 ARG A 87 1.100 -4.870 -23.867 1.00 0.00 H new ATOM 1466 N VAL A 88 -0.418 -6.862 -15.639 1.00 0.00 N ATOM 1467 CA VAL A 88 -0.237 -7.292 -14.225 1.00 0.00 C ATOM 1468 C VAL A 88 1.111 -6.779 -13.715 1.00 0.00 C ATOM 1469 O VAL A 88 2.147 -7.054 -14.286 1.00 0.00 O ATOM 1470 CB VAL A 88 -0.269 -8.819 -14.145 1.00 0.00 C ATOM 1471 CG1 VAL A 88 0.146 -9.268 -12.744 1.00 0.00 C ATOM 1472 CG2 VAL A 88 -1.688 -9.311 -14.440 1.00 0.00 C ATOM 0 H VAL A 88 0.040 -7.450 -16.335 1.00 0.00 H new ATOM 0 HA VAL A 88 -1.041 -6.885 -13.611 1.00 0.00 H new ATOM 0 HB VAL A 88 0.423 -9.237 -14.877 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.123 -10.356 -12.689 1.00 0.00 H new ATOM 0 HG12 VAL A 88 1.156 -8.916 -12.533 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -0.544 -8.853 -12.010 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.715 -10.399 -14.384 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -2.378 -8.893 -13.707 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.983 -8.992 -15.440 1.00 0.00 H new ATOM 1482 N VAL A 89 1.102 -6.026 -12.650 1.00 0.00 N ATOM 1483 CA VAL A 89 2.381 -5.485 -12.113 1.00 0.00 C ATOM 1484 C VAL A 89 3.064 -6.536 -11.235 1.00 0.00 C ATOM 1485 O VAL A 89 4.271 -6.674 -11.247 1.00 0.00 O ATOM 1486 CB VAL A 89 2.099 -4.232 -11.284 1.00 0.00 C ATOM 1487 CG1 VAL A 89 3.362 -3.833 -10.518 1.00 0.00 C ATOM 1488 CG2 VAL A 89 1.688 -3.089 -12.214 1.00 0.00 C ATOM 0 H VAL A 89 0.265 -5.762 -12.129 1.00 0.00 H new ATOM 0 HA VAL A 89 3.038 -5.231 -12.945 1.00 0.00 H new ATOM 0 HB VAL A 89 1.294 -4.436 -10.578 1.00 0.00 H new ATOM 0 HG11 VAL A 89 3.162 -2.940 -9.927 1.00 0.00 H new ATOM 0 HG12 VAL A 89 3.659 -4.647 -9.857 1.00 0.00 H new ATOM 0 HG13 VAL A 89 4.166 -3.628 -11.224 1.00 0.00 H new ATOM 0 HG21 VAL A 89 1.487 -2.195 -11.624 1.00 0.00 H new ATOM 0 HG22 VAL A 89 2.494 -2.885 -12.918 1.00 0.00 H new ATOM 0 HG23 VAL A 89 0.790 -3.372 -12.763 1.00 0.00 H new ATOM 1498 N ARG A 90 2.308 -7.276 -10.470 1.00 0.00 N ATOM 1499 CA ARG A 90 2.929 -8.307 -9.594 1.00 0.00 C ATOM 1500 C ARG A 90 1.864 -8.907 -8.676 1.00 0.00 C ATOM 1501 O ARG A 90 1.435 -8.290 -7.720 1.00 0.00 O ATOM 1502 CB ARG A 90 4.028 -7.664 -8.746 1.00 0.00 C ATOM 1503 CG ARG A 90 5.271 -8.555 -8.761 1.00 0.00 C ATOM 1504 CD ARG A 90 6.088 -8.316 -7.489 1.00 0.00 C ATOM 1505 NE ARG A 90 6.054 -9.541 -6.641 1.00 0.00 N ATOM 1506 CZ ARG A 90 6.726 -10.601 -7.001 1.00 0.00 C ATOM 1507 NH1 ARG A 90 7.944 -10.479 -7.450 1.00 0.00 N ATOM 1508 NH2 ARG A 90 6.179 -11.784 -6.909 1.00 0.00 N ATOM 0 H ARG A 90 1.292 -7.211 -10.414 1.00 0.00 H new ATOM 0 HA ARG A 90 3.361 -9.094 -10.213 1.00 0.00 H new ATOM 0 HB2 ARG A 90 4.271 -6.676 -9.136 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.679 -7.526 -7.723 1.00 0.00 H new ATOM 0 HG2 ARG A 90 4.979 -9.603 -8.826 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.877 -8.337 -9.641 1.00 0.00 H new ATOM 0 HD2 ARG A 90 7.118 -8.067 -7.746 1.00 0.00 H new ATOM 0 HD3 ARG A 90 5.683 -7.467 -6.938 1.00 0.00 H new ATOM 0 HE ARG A 90 5.506 -9.551 -5.780 1.00 0.00 H new ATOM 0 HH11 ARG A 90 8.372 -9.556 -7.520 1.00 0.00 H new ATOM 0 HH12 ARG A 90 8.469 -11.307 -7.731 1.00 0.00 H new ATOM 0 HH21 ARG A 90 5.227 -11.880 -6.556 1.00 0.00 H new ATOM 0 HH22 ARG A 90 6.704 -12.612 -7.190 1.00 0.00 H new ATOM 1522 N ALA A 91 1.437 -10.106 -8.956 1.00 0.00 N ATOM 1523 CA ALA A 91 0.405 -10.750 -8.096 1.00 0.00 C ATOM 1524 C ALA A 91 1.095 -11.560 -6.997 1.00 0.00 C ATOM 1525 O ALA A 91 1.949 -12.384 -7.263 1.00 0.00 O ATOM 1526 CB ALA A 91 -0.463 -11.678 -8.947 1.00 0.00 C ATOM 0 H ALA A 91 1.758 -10.669 -9.744 1.00 0.00 H new ATOM 0 HA ALA A 91 -0.223 -9.983 -7.643 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -1.218 -12.149 -8.317 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -0.953 -11.100 -9.731 1.00 0.00 H new ATOM 0 HB3 ALA A 91 0.163 -12.447 -9.400 1.00 0.00 H new ATOM 1532 N ASP A 92 0.735 -11.332 -5.763 1.00 0.00 N ATOM 1533 CA ASP A 92 1.374 -12.089 -4.649 1.00 0.00 C ATOM 1534 C ASP A 92 0.324 -12.950 -3.946 1.00 0.00 C ATOM 1535 O ASP A 92 0.512 -14.133 -3.739 1.00 0.00 O ATOM 1536 CB ASP A 92 1.982 -11.106 -3.646 1.00 0.00 C ATOM 1537 CG ASP A 92 2.623 -11.883 -2.494 1.00 0.00 C ATOM 1538 OD1 ASP A 92 3.080 -12.988 -2.734 1.00 0.00 O ATOM 1539 OD2 ASP A 92 2.645 -11.360 -1.392 1.00 0.00 O ATOM 0 H ASP A 92 0.027 -10.655 -5.478 1.00 0.00 H new ATOM 0 HA ASP A 92 2.158 -12.730 -5.051 1.00 0.00 H new ATOM 0 HB2 ASP A 92 2.729 -10.483 -4.138 1.00 0.00 H new ATOM 0 HB3 ASP A 92 1.211 -10.437 -3.263 1.00 0.00 H new ATOM 1544 N GLY A 93 -0.779 -12.366 -3.576 1.00 0.00 N ATOM 1545 CA GLY A 93 -1.843 -13.147 -2.884 1.00 0.00 C ATOM 1546 C GLY A 93 -3.198 -12.475 -3.110 1.00 0.00 C ATOM 1547 O GLY A 93 -3.607 -12.241 -4.230 1.00 0.00 O ATOM 0 H GLY A 93 -0.992 -11.379 -3.723 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -1.864 -14.169 -3.263 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -1.629 -13.208 -1.817 1.00 0.00 H new ATOM 1551 N LEU A 94 -3.899 -12.162 -2.054 1.00 0.00 N ATOM 1552 CA LEU A 94 -5.228 -11.506 -2.210 1.00 0.00 C ATOM 1553 C LEU A 94 -5.037 -10.098 -2.778 1.00 0.00 C ATOM 1554 O LEU A 94 -5.878 -9.587 -3.491 1.00 0.00 O ATOM 1555 CB LEU A 94 -5.918 -11.421 -0.847 1.00 0.00 C ATOM 1556 CG LEU A 94 -7.047 -12.452 -0.784 1.00 0.00 C ATOM 1557 CD1 LEU A 94 -6.593 -13.658 0.040 1.00 0.00 C ATOM 1558 CD2 LEU A 94 -8.276 -11.822 -0.126 1.00 0.00 C ATOM 0 H LEU A 94 -3.609 -12.332 -1.091 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.846 -12.091 -2.892 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.197 -11.605 -0.050 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.317 -10.419 -0.691 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.299 -12.775 -1.794 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.398 -14.392 0.084 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.717 -14.108 -0.426 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.341 -13.335 1.050 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.081 -12.556 -0.081 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.023 -11.499 0.884 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.602 -10.962 -0.711 1.00 0.00 H new ATOM 1570 N TYR A 95 -3.935 -9.468 -2.472 1.00 0.00 N ATOM 1571 CA TYR A 95 -3.689 -8.094 -2.998 1.00 0.00 C ATOM 1572 C TYR A 95 -2.662 -8.164 -4.130 1.00 0.00 C ATOM 1573 O TYR A 95 -1.648 -8.823 -4.019 1.00 0.00 O ATOM 1574 CB TYR A 95 -3.155 -7.204 -1.874 1.00 0.00 C ATOM 1575 CG TYR A 95 -4.298 -6.432 -1.255 1.00 0.00 C ATOM 1576 CD1 TYR A 95 -4.656 -5.179 -1.770 1.00 0.00 C ATOM 1577 CD2 TYR A 95 -4.998 -6.970 -0.167 1.00 0.00 C ATOM 1578 CE1 TYR A 95 -5.715 -4.463 -1.197 1.00 0.00 C ATOM 1579 CE2 TYR A 95 -6.058 -6.253 0.406 1.00 0.00 C ATOM 1580 CZ TYR A 95 -6.416 -5.000 -0.109 1.00 0.00 C ATOM 1581 OH TYR A 95 -7.459 -4.294 0.456 1.00 0.00 O ATOM 0 H TYR A 95 -3.194 -9.845 -1.881 1.00 0.00 H new ATOM 0 HA TYR A 95 -4.621 -7.674 -3.377 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -2.662 -7.813 -1.117 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -2.407 -6.515 -2.266 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -4.116 -4.765 -2.609 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.721 -7.936 0.230 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -5.991 -3.497 -1.594 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -6.599 -6.667 1.244 1.00 0.00 H new ATOM 0 HH TYR A 95 -7.838 -4.809 1.199 1.00 0.00 H new ATOM 1591 N VAL A 96 -2.917 -7.494 -5.221 1.00 0.00 N ATOM 1592 CA VAL A 96 -1.953 -7.534 -6.360 1.00 0.00 C ATOM 1593 C VAL A 96 -1.745 -6.125 -6.922 1.00 0.00 C ATOM 1594 O VAL A 96 -2.527 -5.226 -6.683 1.00 0.00 O ATOM 1595 CB VAL A 96 -2.515 -8.434 -7.461 1.00 0.00 C ATOM 1596 CG1 VAL A 96 -1.686 -8.264 -8.736 1.00 0.00 C ATOM 1597 CG2 VAL A 96 -2.458 -9.894 -7.007 1.00 0.00 C ATOM 0 H VAL A 96 -3.748 -6.922 -5.374 1.00 0.00 H new ATOM 0 HA VAL A 96 -0.998 -7.924 -6.007 1.00 0.00 H new ATOM 0 HB VAL A 96 -3.550 -8.156 -7.662 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.088 -8.906 -9.520 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.728 -7.225 -9.061 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -0.651 -8.540 -8.536 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.859 -10.535 -7.792 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.424 -10.172 -6.804 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.051 -10.017 -6.101 1.00 0.00 H new ATOM 1607 N ASP A 97 -0.698 -5.932 -7.680 1.00 0.00 N ATOM 1608 CA ASP A 97 -0.439 -4.590 -8.277 1.00 0.00 C ATOM 1609 C ASP A 97 -0.940 -4.590 -9.725 1.00 0.00 C ATOM 1610 O ASP A 97 -0.974 -5.617 -10.374 1.00 0.00 O ATOM 1611 CB ASP A 97 1.063 -4.296 -8.249 1.00 0.00 C ATOM 1612 CG ASP A 97 1.495 -3.983 -6.814 1.00 0.00 C ATOM 1613 OD1 ASP A 97 0.623 -3.772 -5.987 1.00 0.00 O ATOM 1614 OD2 ASP A 97 2.689 -3.960 -6.566 1.00 0.00 O ATOM 0 H ASP A 97 -0.010 -6.648 -7.912 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.960 -3.822 -7.706 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.619 -5.153 -8.629 1.00 0.00 H new ATOM 0 HB3 ASP A 97 1.292 -3.453 -8.901 1.00 0.00 H new ATOM 1619 N LEU A 98 -1.348 -3.459 -10.235 1.00 0.00 N ATOM 1620 CA LEU A 98 -1.862 -3.428 -11.635 1.00 0.00 C ATOM 1621 C LEU A 98 -1.327 -2.206 -12.383 1.00 0.00 C ATOM 1622 O LEU A 98 -1.333 -1.095 -11.881 1.00 0.00 O ATOM 1623 CB LEU A 98 -3.391 -3.372 -11.608 1.00 0.00 C ATOM 1624 CG LEU A 98 -3.972 -4.431 -12.547 1.00 0.00 C ATOM 1625 CD1 LEU A 98 -3.705 -4.026 -13.997 1.00 0.00 C ATOM 1626 CD2 LEU A 98 -3.316 -5.786 -12.264 1.00 0.00 C ATOM 0 H LEU A 98 -1.348 -2.563 -9.748 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.526 -4.327 -12.151 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.751 -3.538 -10.593 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.732 -2.381 -11.909 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.047 -4.510 -12.383 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.118 -4.780 -14.667 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.176 -3.064 -14.199 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -2.630 -3.946 -14.160 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.732 -6.539 -12.934 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -2.241 -5.710 -12.426 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -3.508 -6.075 -11.231 1.00 0.00 H new ATOM 1638 N ARG A 99 -0.885 -2.409 -13.597 1.00 0.00 N ATOM 1639 CA ARG A 99 -0.363 -1.282 -14.418 1.00 0.00 C ATOM 1640 C ARG A 99 -1.075 -1.298 -15.774 1.00 0.00 C ATOM 1641 O ARG A 99 -1.082 -2.297 -16.467 1.00 0.00 O ATOM 1642 CB ARG A 99 1.145 -1.456 -14.621 1.00 0.00 C ATOM 1643 CG ARG A 99 1.623 -0.550 -15.759 1.00 0.00 C ATOM 1644 CD ARG A 99 3.113 -0.791 -16.012 1.00 0.00 C ATOM 1645 NE ARG A 99 3.294 -2.088 -16.722 1.00 0.00 N ATOM 1646 CZ ARG A 99 4.183 -2.947 -16.297 1.00 0.00 C ATOM 1647 NH1 ARG A 99 5.216 -2.534 -15.617 1.00 0.00 N ATOM 1648 NH2 ARG A 99 4.036 -4.218 -16.554 1.00 0.00 N ATOM 0 H ARG A 99 -0.864 -3.319 -14.057 1.00 0.00 H new ATOM 0 HA ARG A 99 -0.545 -0.332 -13.915 1.00 0.00 H new ATOM 0 HB2 ARG A 99 1.676 -1.211 -13.701 1.00 0.00 H new ATOM 0 HB3 ARG A 99 1.372 -2.497 -14.852 1.00 0.00 H new ATOM 0 HG2 ARG A 99 1.052 -0.754 -16.665 1.00 0.00 H new ATOM 0 HG3 ARG A 99 1.451 0.495 -15.502 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.528 0.022 -16.607 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.656 -0.803 -15.067 1.00 0.00 H new ATOM 0 HE ARG A 99 2.724 -2.306 -17.540 1.00 0.00 H new ATOM 0 HH11 ARG A 99 5.331 -1.540 -15.417 1.00 0.00 H new ATOM 0 HH12 ARG A 99 5.910 -3.204 -15.285 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.228 -4.541 -17.086 1.00 0.00 H new ATOM 0 HH22 ARG A 99 4.729 -4.889 -16.223 1.00 0.00 H new ATOM 1662 N ARG A 100 -1.686 -0.209 -16.156 1.00 0.00 N ATOM 1663 CA ARG A 100 -2.404 -0.182 -17.463 1.00 0.00 C ATOM 1664 C ARG A 100 -1.557 0.544 -18.510 1.00 0.00 C ATOM 1665 O ARG A 100 -0.687 1.327 -18.187 1.00 0.00 O ATOM 1666 CB ARG A 100 -3.739 0.546 -17.296 1.00 0.00 C ATOM 1667 CG ARG A 100 -4.645 0.229 -18.487 1.00 0.00 C ATOM 1668 CD ARG A 100 -6.111 0.329 -18.059 1.00 0.00 C ATOM 1669 NE ARG A 100 -6.912 0.924 -19.164 1.00 0.00 N ATOM 1670 CZ ARG A 100 -7.217 0.207 -20.211 1.00 0.00 C ATOM 1671 NH1 ARG A 100 -6.299 -0.086 -21.092 1.00 0.00 N ATOM 1672 NH2 ARG A 100 -8.439 -0.220 -20.377 1.00 0.00 N ATOM 0 H ARG A 100 -1.719 0.660 -15.622 1.00 0.00 H new ATOM 0 HA ARG A 100 -2.582 -1.205 -17.794 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -4.220 0.238 -16.368 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -3.573 1.621 -17.228 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -4.446 0.924 -19.303 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -4.433 -0.772 -18.862 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -6.496 -0.660 -17.808 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -6.198 0.942 -17.162 1.00 0.00 H new ATOM 0 HE ARG A 100 -7.223 1.894 -19.103 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -5.343 0.245 -20.962 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -6.538 -0.646 -21.910 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -9.156 0.007 -19.688 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -8.677 -0.780 -21.196 1.00 0.00 H new ATOM 1686 N PHE A 101 -1.811 0.289 -19.765 1.00 0.00 N ATOM 1687 CA PHE A 101 -1.028 0.961 -20.840 1.00 0.00 C ATOM 1688 C PHE A 101 -1.352 0.312 -22.188 1.00 0.00 C ATOM 1689 O PHE A 101 -1.315 -0.894 -22.331 1.00 0.00 O ATOM 1690 CB PHE A 101 0.468 0.817 -20.550 1.00 0.00 C ATOM 1691 CG PHE A 101 1.073 2.183 -20.327 1.00 0.00 C ATOM 1692 CD1 PHE A 101 0.855 3.206 -21.260 1.00 0.00 C ATOM 1693 CD2 PHE A 101 1.851 2.428 -19.188 1.00 0.00 C ATOM 1694 CE1 PHE A 101 1.416 4.474 -21.053 1.00 0.00 C ATOM 1695 CE2 PHE A 101 2.412 3.695 -18.981 1.00 0.00 C ATOM 1696 CZ PHE A 101 2.194 4.718 -19.914 1.00 0.00 C ATOM 0 H PHE A 101 -2.529 -0.357 -20.092 1.00 0.00 H new ATOM 0 HA PHE A 101 -1.290 2.018 -20.873 1.00 0.00 H new ATOM 0 HB2 PHE A 101 0.620 0.192 -19.670 1.00 0.00 H new ATOM 0 HB3 PHE A 101 0.964 0.320 -21.383 1.00 0.00 H new ATOM 0 HD1 PHE A 101 0.255 3.018 -22.138 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.018 1.640 -18.469 1.00 0.00 H new ATOM 0 HE1 PHE A 101 1.248 5.263 -21.772 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.012 3.883 -18.103 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.626 5.695 -19.755 1.00 0.00 H new ATOM 1706 N PHE A 102 -1.670 1.103 -23.177 1.00 0.00 N ATOM 1707 CA PHE A 102 -1.996 0.530 -24.513 1.00 0.00 C ATOM 1708 C PHE A 102 -0.709 0.071 -25.201 1.00 0.00 C ATOM 1709 O PHE A 102 -0.748 -0.948 -25.871 1.00 0.00 O ATOM 1710 CB PHE A 102 -2.682 1.597 -25.371 1.00 0.00 C ATOM 1711 CG PHE A 102 -3.602 0.931 -26.367 1.00 0.00 C ATOM 1712 CD1 PHE A 102 -4.701 0.188 -25.916 1.00 0.00 C ATOM 1713 CD2 PHE A 102 -3.355 1.053 -27.741 1.00 0.00 C ATOM 1714 CE1 PHE A 102 -5.554 -0.431 -26.838 1.00 0.00 C ATOM 1715 CE2 PHE A 102 -4.209 0.434 -28.664 1.00 0.00 C ATOM 1716 CZ PHE A 102 -5.309 -0.310 -28.213 1.00 0.00 C ATOM 1717 OXT PHE A 102 0.295 0.747 -25.047 1.00 0.00 O ATOM 0 H PHE A 102 -1.718 2.120 -23.117 1.00 0.00 H new ATOM 0 HA PHE A 102 -2.664 -0.322 -24.389 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -3.248 2.279 -24.737 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -1.935 2.194 -25.894 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -4.890 0.093 -24.857 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -2.507 1.624 -28.089 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.402 -1.002 -26.489 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -4.020 0.530 -29.723 1.00 0.00 H new ATOM 0 HZ PHE A 102 -5.966 -0.789 -28.924 1.00 0.00 H new TER 1727 PHE A 102