USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 100 LYS NZ :NH3+ -179:sc= 2.11 (180deg=0.918) USER MOD Set 1.2: A 102 THR OG1 : rot 150:sc= 1.96 USER MOD Set 1.3: A 103 ASN : amide:sc= 2.87 K(o=6.9,f=-2.2) USER MOD Set 2.1: A 54 ASN : amide:sc= 1.13 K(o=2.4,f=-5) USER MOD Set 2.2: A 55 LYS NZ :NH3+ 180:sc= 1.25 (180deg=0) USER MOD Set 3.1: A 49 THR OG1 : rot 144:sc= 1.25 USER MOD Set 3.2: A 52 ASN : amide:sc= 0.326 K(o=5.7,f=-1.6!) USER MOD Set 3.3: A 67 TYR OH : rot -132:sc= 0.695 USER MOD Set 3.4: A 78 THR OG1 : rot 180:sc= 1.92 USER MOD Set 3.5: A 105 HEC O2D : rot 68:sc= 1.46 USER MOD Single : A 1 GLY N :NH3+ 168:sc= 0.445 (180deg=-0.217) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 166:sc= 1.46 (180deg=0.949) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0.811 K(o=0.81,f=-0.029) USER MOD Single : A 13 LYS NZ :NH3+ 158:sc= 2.17 (180deg=1.85) USER MOD Single : A 16 GLN : amide:sc= -0.196 K(o=-0.2,f=-3.5!) USER MOD Single : A 19 THR OG1 : rot -3:sc= 1.97 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= -0.0856 K(o=-0.086,f=-1.6) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -30:sc= 1.01 USER MOD Single : A 31 ASN : amide:sc= 1.2 K(o=1.2,f=-0.12) USER MOD Single : A 33 HIS : no HD1:sc= -0.124 K(o=-0.12,f=-0.99) USER MOD Single : A 39 LYS NZ :NH3+ -164:sc= 1.02 (180deg=0.149) USER MOD Single : A 40 THR OG1 : rot 45:sc= 1.56 USER MOD Single : A 42 GLN : amide:sc= -0.0179 X(o=-0.018,f=-0.018) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 179:sc= 1.23 USER MOD Single : A 53 LYS NZ :NH3+ -143:sc= 1.66 (180deg=-1.4) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.245 USER MOD Single : A 60 LYS NZ :NH3+ 166:sc= 1.18 (180deg=0.796) USER MOD Single : A 63 THR OG1 : rot -33:sc= 1.59 USER MOD Single : A 65 MET CE :methyl -159:sc= -2.6 (180deg=-6.2!) USER MOD Single : A 70 ASN : amide:sc= 1.15 K(o=1.1,f=-2!) USER MOD Single : A 72 LYS NZ :NH3+ -119:sc= 1.28 (180deg=-0.0594) USER MOD Single : A 73 LYS NZ :NH3+ 170:sc= 2.41 (180deg=2.23) USER MOD Single : A 74 TYR OH : rot 30:sc= -0.0872 USER MOD Single : A 79 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.0911) USER MOD Single : A 80 MET CE :methyl 162:sc= 0 (180deg=-0.553) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0405 USER MOD Single : A 97 TYR OH : rot 140:sc= 0.0849 USER MOD Single : A 99 LYS NZ :NH3+ -160:sc= 1.1 (180deg=-0.354!) USER MOD Single : A 105 HEC O2A : rot 50:sc= 0.353 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.404 1.406 -0.823 1.00 10.00 N ATOM 2 CA GLY A 1 2.077 1.242 0.478 1.00 10.00 C ATOM 3 C GLY A 1 1.127 0.892 1.618 1.00 10.00 C ATOM 4 O GLY A 1 1.603 0.423 2.646 1.00 10.00 O ATOM 0 H1 GLY A 1 2.063 1.837 -1.503 1.00 10.00 H new ATOM 0 H2 GLY A 1 1.100 0.476 -1.176 1.00 10.00 H new ATOM 0 H3 GLY A 1 0.573 2.021 -0.709 1.00 10.00 H new ATOM 0 HA2 GLY A 1 2.831 0.459 0.391 1.00 10.00 H new ATOM 0 HA3 GLY A 1 2.602 2.165 0.725 1.00 10.00 H new ATOM 10 N ASP A 2 -0.174 1.185 1.504 1.00 10.00 N ATOM 11 CA ASP A 2 -0.942 1.711 2.630 1.00 10.00 C ATOM 12 C ASP A 2 -2.293 0.993 2.759 1.00 10.00 C ATOM 13 O ASP A 2 -3.130 1.047 1.855 1.00 10.00 O ATOM 14 CB ASP A 2 -1.122 3.228 2.425 1.00 10.00 C ATOM 15 CG ASP A 2 0.202 3.961 2.146 1.00 10.00 C ATOM 16 OD1 ASP A 2 0.703 3.859 0.997 1.00 10.00 O ATOM 17 OD2 ASP A 2 0.717 4.594 3.093 1.00 10.00 O ATOM 0 H ASP A 2 -0.712 1.066 0.646 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.406 1.533 3.562 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -1.806 3.398 1.594 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -1.587 3.656 3.313 1.00 10.00 H new ATOM 22 N VAL A 3 -2.508 0.310 3.894 1.00 10.00 N ATOM 23 CA VAL A 3 -3.719 -0.477 4.177 1.00 10.00 C ATOM 24 C VAL A 3 -5.008 0.311 3.922 1.00 10.00 C ATOM 25 O VAL A 3 -5.941 -0.248 3.349 1.00 10.00 O ATOM 26 CB VAL A 3 -3.673 -1.135 5.580 1.00 10.00 C ATOM 27 CG1 VAL A 3 -3.183 -0.224 6.713 1.00 10.00 C ATOM 28 CG2 VAL A 3 -5.031 -1.709 6.017 1.00 10.00 C ATOM 0 H VAL A 3 -1.831 0.289 4.657 1.00 10.00 H new ATOM 0 HA VAL A 3 -3.734 -1.297 3.460 1.00 10.00 H new ATOM 0 HB VAL A 3 -2.942 -1.930 5.435 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -3.188 -0.777 7.652 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -2.170 0.114 6.496 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -3.843 0.639 6.797 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -4.936 -2.156 7.006 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -5.771 -0.909 6.050 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -5.351 -2.469 5.305 1.00 10.00 H new ATOM 38 N GLU A 4 -5.049 1.606 4.248 1.00 10.00 N ATOM 39 CA GLU A 4 -6.197 2.493 4.051 1.00 10.00 C ATOM 40 C GLU A 4 -6.632 2.621 2.591 1.00 10.00 C ATOM 41 O GLU A 4 -7.829 2.654 2.305 1.00 10.00 O ATOM 42 CB GLU A 4 -5.904 3.899 4.603 1.00 10.00 C ATOM 43 CG GLU A 4 -5.755 4.001 6.132 1.00 10.00 C ATOM 44 CD GLU A 4 -4.517 3.302 6.716 1.00 10.00 C ATOM 45 OE1 GLU A 4 -3.547 3.076 5.954 1.00 10.00 O ATOM 46 OE2 GLU A 4 -4.578 2.956 7.914 1.00 10.00 O ATOM 0 H GLU A 4 -4.253 2.082 4.672 1.00 10.00 H new ATOM 0 HA GLU A 4 -7.016 2.028 4.599 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -4.987 4.266 4.142 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -6.707 4.566 4.290 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -5.722 5.055 6.408 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -6.645 3.577 6.597 1.00 10.00 H new ATOM 53 N LYS A 5 -5.678 2.671 1.656 1.00 10.00 N ATOM 54 CA LYS A 5 -5.954 2.637 0.220 1.00 10.00 C ATOM 55 C LYS A 5 -6.357 1.225 -0.223 1.00 10.00 C ATOM 56 O LYS A 5 -7.152 1.059 -1.149 1.00 10.00 O ATOM 57 CB LYS A 5 -4.672 3.037 -0.519 1.00 10.00 C ATOM 58 CG LYS A 5 -4.014 4.361 -0.098 1.00 10.00 C ATOM 59 CD LYS A 5 -4.372 5.557 -0.983 1.00 10.00 C ATOM 60 CE LYS A 5 -5.729 6.130 -0.578 1.00 10.00 C ATOM 61 NZ LYS A 5 -6.124 7.228 -1.485 1.00 10.00 N ATOM 0 H LYS A 5 -4.685 2.737 1.879 1.00 10.00 H new ATOM 0 HA LYS A 5 -6.772 3.320 -0.006 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -3.942 2.238 -0.389 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.897 3.093 -1.584 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -4.303 4.585 0.929 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -2.932 4.232 -0.103 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -3.604 6.326 -0.895 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -4.397 5.250 -2.028 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -6.483 5.343 -0.601 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -5.683 6.497 0.447 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -7.049 7.604 -1.193 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -5.413 7.986 -1.443 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -6.189 6.868 -2.459 1.00 10.00 H new ATOM 75 N GLY A 6 -5.830 0.202 0.462 1.00 10.00 N ATOM 76 CA GLY A 6 -5.961 -1.206 0.100 1.00 10.00 C ATOM 77 C GLY A 6 -7.377 -1.676 0.402 1.00 10.00 C ATOM 78 O GLY A 6 -8.076 -2.156 -0.492 1.00 10.00 O ATOM 0 H GLY A 6 -5.283 0.342 1.312 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.738 -1.343 -0.958 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -5.241 -1.805 0.657 1.00 10.00 H new ATOM 82 N LYS A 7 -7.843 -1.409 1.631 1.00 10.00 N ATOM 83 CA LYS A 7 -9.184 -1.679 2.160 1.00 10.00 C ATOM 84 C LYS A 7 -10.319 -0.856 1.519 1.00 10.00 C ATOM 85 O LYS A 7 -11.363 -0.636 2.127 1.00 10.00 O ATOM 86 CB LYS A 7 -9.128 -1.573 3.697 1.00 10.00 C ATOM 87 CG LYS A 7 -8.917 -0.155 4.267 1.00 10.00 C ATOM 88 CD LYS A 7 -10.144 0.676 4.691 1.00 10.00 C ATOM 89 CE LYS A 7 -11.192 -0.084 5.523 1.00 10.00 C ATOM 90 NZ LYS A 7 -12.282 -0.616 4.670 1.00 10.00 N ATOM 0 H LYS A 7 -7.247 -0.966 2.331 1.00 10.00 H new ATOM 0 HA LYS A 7 -9.461 -2.694 1.876 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -10.057 -1.973 4.104 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -8.322 -2.212 4.057 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -8.265 -0.245 5.136 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -8.373 0.422 3.519 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -9.800 1.535 5.266 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -10.627 1.065 3.795 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -10.711 -0.905 6.054 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -11.611 0.581 6.278 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -12.836 -1.312 5.209 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -12.902 0.164 4.372 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -11.874 -1.074 3.830 1.00 10.00 H new ATOM 104 N LYS A 8 -10.146 -0.428 0.265 1.00 10.00 N ATOM 105 CA LYS A 8 -11.150 0.284 -0.537 1.00 10.00 C ATOM 106 C LYS A 8 -10.852 0.234 -2.033 1.00 10.00 C ATOM 107 O LYS A 8 -11.808 0.205 -2.801 1.00 10.00 O ATOM 108 CB LYS A 8 -11.361 1.733 -0.041 1.00 10.00 C ATOM 109 CG LYS A 8 -10.182 2.705 -0.231 1.00 10.00 C ATOM 110 CD LYS A 8 -10.430 3.821 -1.258 1.00 10.00 C ATOM 111 CE LYS A 8 -10.635 3.307 -2.692 1.00 10.00 C ATOM 112 NZ LYS A 8 -10.760 4.424 -3.655 1.00 10.00 N ATOM 0 H LYS A 8 -9.271 -0.572 -0.240 1.00 10.00 H new ATOM 0 HA LYS A 8 -12.090 -0.248 -0.393 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -12.229 2.146 -0.555 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -11.606 1.698 1.021 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -9.946 3.161 0.731 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -9.305 2.135 -0.538 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -11.309 4.391 -0.957 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -9.584 4.509 -1.245 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -9.795 2.673 -2.976 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -11.531 2.688 -2.733 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -10.897 4.043 -4.613 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -11.576 5.015 -3.397 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -9.895 5.000 -3.632 1.00 10.00 H new ATOM 126 N ILE A 9 -9.587 0.128 -2.480 1.00 10.00 N ATOM 127 CA ILE A 9 -9.323 -0.314 -3.859 1.00 10.00 C ATOM 128 C ILE A 9 -9.663 -1.806 -4.033 1.00 10.00 C ATOM 129 O ILE A 9 -10.285 -2.170 -5.032 1.00 10.00 O ATOM 130 CB ILE A 9 -7.902 0.070 -4.333 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.775 0.065 -5.870 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.823 -0.866 -3.774 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.604 1.145 -6.577 1.00 10.00 C ATOM 0 H ILE A 9 -8.756 0.335 -1.926 1.00 10.00 H new ATOM 0 HA ILE A 9 -9.993 0.228 -4.527 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.746 1.079 -3.952 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -6.726 0.197 -6.136 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -8.079 -0.913 -6.245 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.845 -0.552 -4.138 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.835 -0.826 -2.685 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -7.021 -1.886 -4.102 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.456 1.070 -7.654 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -9.660 1.004 -6.345 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.286 2.130 -6.235 1.00 10.00 H new ATOM 145 N PHE A 10 -9.400 -2.659 -3.024 1.00 10.00 N ATOM 146 CA PHE A 10 -9.917 -4.031 -3.012 1.00 10.00 C ATOM 147 C PHE A 10 -11.439 -4.028 -3.154 1.00 10.00 C ATOM 148 O PHE A 10 -11.998 -4.685 -4.032 1.00 10.00 O ATOM 149 CB PHE A 10 -9.484 -4.784 -1.743 1.00 10.00 C ATOM 150 CG PHE A 10 -9.916 -6.241 -1.745 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.243 -6.596 -1.429 1.00 10.00 C ATOM 152 CD2 PHE A 10 -9.005 -7.244 -2.127 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.671 -7.928 -1.556 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.419 -8.584 -2.197 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.757 -8.922 -1.938 1.00 10.00 C ATOM 0 H PHE A 10 -8.833 -2.418 -2.211 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.491 -4.559 -3.865 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.399 -4.732 -1.648 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.905 -4.286 -0.869 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.934 -5.840 -1.087 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.985 -6.982 -2.367 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.701 -8.186 -1.360 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.707 -9.356 -2.450 1.00 10.00 H new ATOM 0 HZ PHE A 10 -11.083 -9.947 -2.033 1.00 10.00 H new ATOM 165 N VAL A 11 -12.120 -3.237 -2.321 1.00 10.00 N ATOM 166 CA VAL A 11 -13.585 -3.190 -2.282 1.00 10.00 C ATOM 167 C VAL A 11 -14.192 -2.600 -3.576 1.00 10.00 C ATOM 168 O VAL A 11 -15.394 -2.698 -3.797 1.00 10.00 O ATOM 169 CB VAL A 11 -14.077 -2.475 -0.996 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.579 -2.675 -0.739 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.354 -2.996 0.263 1.00 10.00 C ATOM 0 H VAL A 11 -11.671 -2.610 -1.653 1.00 10.00 H new ATOM 0 HA VAL A 11 -13.951 -4.216 -2.238 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.860 -1.421 -1.171 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -15.865 -2.152 0.174 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -16.148 -2.276 -1.579 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -15.791 -3.739 -0.629 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -13.728 -2.470 1.141 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -13.540 -4.064 0.374 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.282 -2.823 0.165 1.00 10.00 H new ATOM 181 N GLN A 12 -13.358 -2.058 -4.475 1.00 10.00 N ATOM 182 CA GLN A 12 -13.751 -1.538 -5.784 1.00 10.00 C ATOM 183 C GLN A 12 -13.548 -2.566 -6.898 1.00 10.00 C ATOM 184 O GLN A 12 -14.437 -2.717 -7.737 1.00 10.00 O ATOM 185 CB GLN A 12 -12.937 -0.274 -6.110 1.00 10.00 C ATOM 186 CG GLN A 12 -13.291 0.389 -7.453 1.00 10.00 C ATOM 187 CD GLN A 12 -14.767 0.763 -7.588 1.00 10.00 C ATOM 188 OE1 GLN A 12 -15.160 1.891 -7.342 1.00 10.00 O ATOM 189 NE2 GLN A 12 -15.617 -0.163 -7.994 1.00 10.00 N ATOM 0 H GLN A 12 -12.357 -1.968 -4.300 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.814 -1.303 -5.732 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -13.084 0.453 -5.311 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.878 -0.531 -6.115 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -12.686 1.287 -7.574 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -13.022 -0.288 -8.264 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -15.285 -1.105 -8.199 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -16.605 0.064 -8.103 1.00 10.00 H new ATOM 198 N LYS A 13 -12.360 -3.193 -6.951 1.00 10.00 N ATOM 199 CA LYS A 13 -11.899 -3.981 -8.108 1.00 10.00 C ATOM 200 C LYS A 13 -11.482 -5.428 -7.804 1.00 10.00 C ATOM 201 O LYS A 13 -11.055 -6.153 -8.698 1.00 10.00 O ATOM 202 CB LYS A 13 -10.889 -3.180 -8.949 1.00 10.00 C ATOM 203 CG LYS A 13 -9.712 -2.599 -8.156 1.00 10.00 C ATOM 204 CD LYS A 13 -8.558 -2.128 -9.048 1.00 10.00 C ATOM 205 CE LYS A 13 -8.872 -0.949 -9.963 1.00 10.00 C ATOM 206 NZ LYS A 13 -7.642 -0.489 -10.646 1.00 10.00 N ATOM 0 H LYS A 13 -11.687 -3.167 -6.185 1.00 10.00 H new ATOM 0 HA LYS A 13 -12.778 -4.143 -8.732 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -10.497 -3.827 -9.734 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -11.415 -2.363 -9.443 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -10.065 -1.760 -7.556 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -9.342 -3.354 -7.462 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -7.717 -1.856 -8.410 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -8.233 -2.966 -9.664 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -9.619 -1.241 -10.701 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -9.301 -0.133 -9.382 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -7.898 0.031 -11.509 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -7.106 0.136 -10.011 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -7.057 -1.311 -10.898 1.00 10.00 H new ATOM 220 N CYS A 14 -11.692 -5.878 -6.567 1.00 10.00 N ATOM 221 CA CYS A 14 -11.515 -7.250 -6.100 1.00 10.00 C ATOM 222 C CYS A 14 -12.814 -7.798 -5.500 1.00 10.00 C ATOM 223 O CYS A 14 -13.221 -8.925 -5.807 1.00 10.00 O ATOM 224 CB CYS A 14 -10.419 -7.246 -5.036 1.00 10.00 C ATOM 225 SG CYS A 14 -8.837 -6.475 -5.483 1.00 10.00 S ATOM 0 H CYS A 14 -12.009 -5.257 -5.822 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.240 -7.889 -6.939 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.806 -6.737 -4.153 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.223 -8.279 -4.748 1.00 10.00 H new ATOM 230 N ALA A 15 -13.502 -6.990 -4.677 1.00 10.00 N ATOM 231 CA ALA A 15 -14.774 -7.385 -4.072 1.00 10.00 C ATOM 232 C ALA A 15 -15.865 -7.717 -5.105 1.00 10.00 C ATOM 233 O ALA A 15 -16.740 -8.519 -4.795 1.00 10.00 O ATOM 234 CB ALA A 15 -15.247 -6.324 -3.081 1.00 10.00 C ATOM 0 H ALA A 15 -13.192 -6.054 -4.417 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.589 -8.313 -3.532 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -16.195 -6.634 -2.641 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.503 -6.204 -2.294 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.382 -5.375 -3.600 1.00 10.00 H new ATOM 240 N GLN A 16 -15.743 -7.219 -6.347 1.00 10.00 N ATOM 241 CA GLN A 16 -16.540 -7.580 -7.521 1.00 10.00 C ATOM 242 C GLN A 16 -16.565 -9.084 -7.865 1.00 10.00 C ATOM 243 O GLN A 16 -17.384 -9.507 -8.675 1.00 10.00 O ATOM 244 CB GLN A 16 -16.027 -6.765 -8.720 1.00 10.00 C ATOM 245 CG GLN A 16 -14.624 -7.168 -9.203 1.00 10.00 C ATOM 246 CD GLN A 16 -14.273 -6.489 -10.522 1.00 10.00 C ATOM 247 OE1 GLN A 16 -13.791 -5.370 -10.564 1.00 10.00 O ATOM 248 NE2 GLN A 16 -14.518 -7.136 -11.646 1.00 10.00 N ATOM 0 H GLN A 16 -15.042 -6.511 -6.566 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.576 -7.342 -7.280 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -16.729 -6.875 -9.547 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -16.016 -5.709 -8.449 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -13.886 -6.900 -8.447 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -14.577 -8.250 -9.325 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -14.921 -8.073 -11.618 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -14.304 -6.700 -12.543 1.00 10.00 H new ATOM 257 N CYS A 17 -15.695 -9.880 -7.237 1.00 10.00 N ATOM 258 CA CYS A 17 -15.538 -11.315 -7.446 1.00 10.00 C ATOM 259 C CYS A 17 -15.258 -12.052 -6.124 1.00 10.00 C ATOM 260 O CYS A 17 -15.671 -13.205 -5.985 1.00 10.00 O ATOM 261 CB CYS A 17 -14.366 -11.528 -8.407 1.00 10.00 C ATOM 262 SG CYS A 17 -14.679 -11.189 -10.164 1.00 10.00 S ATOM 0 H CYS A 17 -15.050 -9.519 -6.534 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.463 -11.718 -7.858 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.540 -10.897 -8.081 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -14.033 -12.562 -8.314 1.00 10.00 H new ATOM 267 N HIS A 18 -14.602 -11.394 -5.153 1.00 10.00 N ATOM 268 CA HIS A 18 -14.200 -11.973 -3.874 1.00 10.00 C ATOM 269 C HIS A 18 -15.049 -11.514 -2.661 1.00 10.00 C ATOM 270 O HIS A 18 -15.091 -12.217 -1.655 1.00 10.00 O ATOM 271 CB HIS A 18 -12.709 -11.646 -3.687 1.00 10.00 C ATOM 272 CG HIS A 18 -11.778 -12.390 -4.603 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.202 -13.594 -4.294 1.00 10.00 N ATOM 274 CD2 HIS A 18 -11.203 -11.936 -5.758 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.280 -13.849 -5.237 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.263 -12.895 -6.173 1.00 10.00 N ATOM 0 H HIS A 18 -14.332 -10.415 -5.246 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.374 -13.048 -3.908 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.565 -10.576 -3.837 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -12.431 -11.863 -2.656 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.431 -14.187 -3.496 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -11.430 -11.008 -6.261 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -9.634 -14.715 -5.239 1.00 10.00 H new ATOM 284 N THR A 19 -15.768 -10.384 -2.726 1.00 10.00 N ATOM 285 CA THR A 19 -16.732 -9.874 -1.712 1.00 10.00 C ATOM 286 C THR A 19 -16.231 -9.665 -0.258 1.00 10.00 C ATOM 287 O THR A 19 -17.044 -9.496 0.649 1.00 10.00 O ATOM 288 CB THR A 19 -18.017 -10.720 -1.727 1.00 10.00 C ATOM 289 OG1 THR A 19 -17.749 -12.015 -1.243 1.00 10.00 O ATOM 290 CG2 THR A 19 -18.636 -10.851 -3.122 1.00 10.00 C ATOM 0 H THR A 19 -15.696 -9.759 -3.529 1.00 10.00 H new ATOM 0 HA THR A 19 -16.914 -8.852 -2.044 1.00 10.00 H new ATOM 0 HB THR A 19 -18.729 -10.198 -1.088 1.00 10.00 H new ATOM 0 HG1 THR A 19 -16.791 -12.103 -1.056 1.00 10.00 H new ATOM 0 HG21 THR A 19 -19.539 -11.459 -3.064 1.00 10.00 H new ATOM 0 HG22 THR A 19 -18.889 -9.861 -3.502 1.00 10.00 H new ATOM 0 HG23 THR A 19 -17.921 -11.326 -3.794 1.00 10.00 H new ATOM 298 N VAL A 20 -14.912 -9.693 -0.019 1.00 10.00 N ATOM 299 CA VAL A 20 -14.261 -9.655 1.312 1.00 10.00 C ATOM 300 C VAL A 20 -14.473 -8.313 2.047 1.00 10.00 C ATOM 301 O VAL A 20 -14.876 -7.319 1.448 1.00 10.00 O ATOM 302 CB VAL A 20 -12.749 -9.985 1.191 1.00 10.00 C ATOM 303 CG1 VAL A 20 -12.068 -10.348 2.523 1.00 10.00 C ATOM 304 CG2 VAL A 20 -12.500 -11.175 0.256 1.00 10.00 C ATOM 0 H VAL A 20 -14.233 -9.745 -0.778 1.00 10.00 H new ATOM 0 HA VAL A 20 -14.744 -10.421 1.919 1.00 10.00 H new ATOM 0 HB VAL A 20 -12.321 -9.060 0.805 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -11.014 -10.564 2.346 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -12.156 -9.511 3.216 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -12.551 -11.226 2.951 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -11.430 -11.374 0.198 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -13.013 -12.056 0.643 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -12.880 -10.942 -0.739 1.00 10.00 H new ATOM 314 N GLU A 21 -14.180 -8.314 3.357 1.00 10.00 N ATOM 315 CA GLU A 21 -14.216 -7.212 4.343 1.00 10.00 C ATOM 316 C GLU A 21 -15.598 -7.047 5.009 1.00 10.00 C ATOM 317 O GLU A 21 -15.776 -6.209 5.888 1.00 10.00 O ATOM 318 CB GLU A 21 -13.688 -5.876 3.774 1.00 10.00 C ATOM 319 CG GLU A 21 -12.972 -5.053 4.858 1.00 10.00 C ATOM 320 CD GLU A 21 -12.970 -3.554 4.543 1.00 10.00 C ATOM 321 OE1 GLU A 21 -12.215 -3.123 3.643 1.00 10.00 O ATOM 322 OE2 GLU A 21 -13.672 -2.779 5.241 1.00 10.00 O ATOM 0 H GLU A 21 -13.879 -9.180 3.804 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.524 -7.508 5.131 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -13.001 -6.074 2.951 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -14.517 -5.299 3.364 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -13.459 -5.220 5.819 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -11.944 -5.403 4.957 1.00 10.00 H new ATOM 329 N LYS A 22 -16.570 -7.887 4.638 1.00 10.00 N ATOM 330 CA LYS A 22 -17.991 -7.866 5.015 1.00 10.00 C ATOM 331 C LYS A 22 -18.519 -9.316 4.972 1.00 10.00 C ATOM 332 O LYS A 22 -17.737 -10.255 4.814 1.00 10.00 O ATOM 333 CB LYS A 22 -18.781 -6.976 4.020 1.00 10.00 C ATOM 334 CG LYS A 22 -18.459 -5.466 3.964 1.00 10.00 C ATOM 335 CD LYS A 22 -18.989 -4.621 5.139 1.00 10.00 C ATOM 336 CE LYS A 22 -18.004 -4.566 6.311 1.00 10.00 C ATOM 337 NZ LYS A 22 -18.447 -3.653 7.388 1.00 10.00 N ATOM 0 H LYS A 22 -16.367 -8.667 4.012 1.00 10.00 H new ATOM 0 HA LYS A 22 -18.116 -7.455 6.017 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -18.632 -7.384 3.020 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -19.841 -7.080 4.252 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -17.377 -5.347 3.915 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -18.867 -5.061 3.038 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -19.193 -3.608 4.792 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -19.936 -5.036 5.483 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -17.876 -5.568 6.720 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -17.029 -4.244 5.946 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -17.745 -3.654 8.155 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -18.544 -2.690 7.008 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -19.365 -3.973 7.759 1.00 10.00 H new ATOM 351 N GLY A 23 -19.836 -9.512 5.125 1.00 10.00 N ATOM 352 CA GLY A 23 -20.522 -10.806 4.992 1.00 10.00 C ATOM 353 C GLY A 23 -20.485 -11.350 3.558 1.00 10.00 C ATOM 354 O GLY A 23 -21.509 -11.380 2.878 1.00 10.00 O ATOM 0 H GLY A 23 -20.474 -8.750 5.352 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -20.058 -11.529 5.663 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -21.559 -10.697 5.308 1.00 10.00 H new ATOM 358 N GLY A 24 -19.294 -11.742 3.105 1.00 10.00 N ATOM 359 CA GLY A 24 -18.994 -12.183 1.749 1.00 10.00 C ATOM 360 C GLY A 24 -19.252 -13.671 1.492 1.00 10.00 C ATOM 361 O GLY A 24 -19.828 -14.392 2.303 1.00 10.00 O ATOM 0 H GLY A 24 -18.472 -11.760 3.708 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -19.591 -11.598 1.050 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -17.948 -11.966 1.533 1.00 10.00 H new ATOM 365 N LYS A 25 -18.816 -14.103 0.307 1.00 10.00 N ATOM 366 CA LYS A 25 -18.967 -15.425 -0.300 1.00 10.00 C ATOM 367 C LYS A 25 -17.956 -15.569 -1.454 1.00 10.00 C ATOM 368 O LYS A 25 -17.001 -14.802 -1.552 1.00 10.00 O ATOM 369 CB LYS A 25 -20.438 -15.671 -0.717 1.00 10.00 C ATOM 370 CG LYS A 25 -21.019 -14.800 -1.850 1.00 10.00 C ATOM 371 CD LYS A 25 -21.400 -13.371 -1.428 1.00 10.00 C ATOM 372 CE LYS A 25 -22.127 -12.638 -2.561 1.00 10.00 C ATOM 373 NZ LYS A 25 -23.549 -13.031 -2.687 1.00 10.00 N ATOM 0 H LYS A 25 -18.299 -13.476 -0.309 1.00 10.00 H new ATOM 0 HA LYS A 25 -18.738 -16.207 0.424 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.531 -16.715 -1.016 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -21.064 -15.534 0.165 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -20.289 -14.744 -2.658 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -21.903 -15.294 -2.253 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -22.038 -13.407 -0.545 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -20.502 -12.819 -1.150 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -22.067 -11.563 -2.388 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -21.616 -12.838 -3.503 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -23.987 -12.503 -3.469 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -23.611 -14.051 -2.880 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -24.049 -12.815 -1.801 1.00 10.00 H new ATOM 387 N HIS A 26 -18.122 -16.584 -2.298 1.00 10.00 N ATOM 388 CA HIS A 26 -17.076 -17.079 -3.196 1.00 10.00 C ATOM 389 C HIS A 26 -17.722 -17.723 -4.427 1.00 10.00 C ATOM 390 O HIS A 26 -18.111 -18.892 -4.411 1.00 10.00 O ATOM 391 CB HIS A 26 -16.172 -18.061 -2.429 1.00 10.00 C ATOM 392 CG HIS A 26 -16.923 -18.882 -1.415 1.00 10.00 C ATOM 393 ND1 HIS A 26 -17.945 -19.752 -1.710 1.00 10.00 N ATOM 394 CD2 HIS A 26 -16.913 -18.680 -0.064 1.00 10.00 C ATOM 395 CE1 HIS A 26 -18.544 -20.075 -0.550 1.00 10.00 C ATOM 396 NE2 HIS A 26 -17.962 -19.429 0.473 1.00 10.00 N ATOM 0 H HIS A 26 -19.001 -17.096 -2.380 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.451 -16.258 -3.547 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -15.685 -18.728 -3.140 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -15.384 -17.502 -1.924 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -18.202 -20.090 -2.637 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -16.223 -18.057 0.486 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -19.376 -20.758 -0.455 1.00 10.00 H new ATOM 404 N LYS A 27 -17.909 -16.900 -5.468 1.00 10.00 N ATOM 405 CA LYS A 27 -18.766 -17.178 -6.638 1.00 10.00 C ATOM 406 C LYS A 27 -18.187 -16.634 -7.954 1.00 10.00 C ATOM 407 O LYS A 27 -18.800 -16.762 -9.013 1.00 10.00 O ATOM 408 CB LYS A 27 -20.171 -16.588 -6.398 1.00 10.00 C ATOM 409 CG LYS A 27 -20.930 -17.271 -5.246 1.00 10.00 C ATOM 410 CD LYS A 27 -22.279 -16.606 -4.957 1.00 10.00 C ATOM 411 CE LYS A 27 -23.325 -16.838 -6.053 1.00 10.00 C ATOM 412 NZ LYS A 27 -24.552 -16.058 -5.773 1.00 10.00 N ATOM 0 H LYS A 27 -17.453 -15.989 -5.524 1.00 10.00 H new ATOM 0 HA LYS A 27 -18.820 -18.261 -6.746 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -20.078 -15.524 -6.182 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -20.756 -16.678 -7.313 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -21.091 -18.320 -5.493 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -20.316 -17.246 -4.346 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -22.666 -16.985 -4.011 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -22.127 -15.534 -4.833 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -22.916 -16.549 -7.021 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -23.567 -17.899 -6.114 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -25.250 -16.227 -6.525 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -24.950 -16.353 -4.859 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -24.319 -15.045 -5.738 1.00 10.00 H new ATOM 426 N THR A 28 -16.998 -16.028 -7.924 1.00 10.00 N ATOM 427 CA THR A 28 -16.183 -15.753 -9.125 1.00 10.00 C ATOM 428 C THR A 28 -14.703 -15.651 -8.758 1.00 10.00 C ATOM 429 O THR A 28 -13.869 -16.090 -9.535 1.00 10.00 O ATOM 430 CB THR A 28 -16.628 -14.494 -9.894 1.00 10.00 C ATOM 431 OG1 THR A 28 -18.034 -14.435 -10.003 1.00 10.00 O ATOM 432 CG2 THR A 28 -16.084 -14.500 -11.328 1.00 10.00 C ATOM 0 H THR A 28 -16.563 -15.708 -7.059 1.00 10.00 H new ATOM 0 HA THR A 28 -16.338 -16.598 -9.796 1.00 10.00 H new ATOM 0 HB THR A 28 -16.243 -13.642 -9.333 1.00 10.00 H new ATOM 0 HG1 THR A 28 -18.399 -15.344 -10.017 1.00 10.00 H new ATOM 0 HG21 THR A 28 -16.414 -13.600 -11.846 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.995 -14.526 -11.304 1.00 10.00 H new ATOM 0 HG23 THR A 28 -16.456 -15.379 -11.855 1.00 10.00 H new ATOM 440 N GLY A 29 -14.383 -15.183 -7.544 1.00 10.00 N ATOM 441 CA GLY A 29 -13.158 -15.534 -6.833 1.00 10.00 C ATOM 442 C GLY A 29 -13.474 -16.331 -5.549 1.00 10.00 C ATOM 443 O GLY A 29 -14.614 -16.304 -5.077 1.00 10.00 O ATOM 0 H GLY A 29 -14.981 -14.540 -7.025 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.513 -16.125 -7.483 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.609 -14.628 -6.577 1.00 10.00 H new ATOM 447 N PRO A 30 -12.478 -17.017 -4.955 1.00 10.00 N ATOM 448 CA PRO A 30 -12.620 -17.904 -3.789 1.00 10.00 C ATOM 449 C PRO A 30 -12.791 -17.221 -2.422 1.00 10.00 C ATOM 450 O PRO A 30 -12.920 -17.932 -1.427 1.00 10.00 O ATOM 451 CB PRO A 30 -11.338 -18.748 -3.769 1.00 10.00 C ATOM 452 CG PRO A 30 -10.320 -17.913 -4.520 1.00 10.00 C ATOM 453 CD PRO A 30 -11.167 -17.188 -5.547 1.00 10.00 C ATOM 0 HA PRO A 30 -13.546 -18.465 -3.913 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.011 -18.949 -2.749 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.491 -19.714 -4.250 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -9.802 -17.217 -3.860 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.557 -18.533 -4.991 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.727 -16.223 -5.801 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.231 -17.762 -6.471 1.00 10.00 H new ATOM 461 N ASN A 31 -12.810 -15.883 -2.369 1.00 10.00 N ATOM 462 CA ASN A 31 -12.623 -15.018 -1.188 1.00 10.00 C ATOM 463 C ASN A 31 -11.210 -15.107 -0.557 1.00 10.00 C ATOM 464 O ASN A 31 -10.579 -16.162 -0.523 1.00 10.00 O ATOM 465 CB ASN A 31 -13.782 -15.181 -0.176 1.00 10.00 C ATOM 466 CG ASN A 31 -13.410 -15.872 1.134 1.00 10.00 C ATOM 467 OD1 ASN A 31 -13.270 -15.237 2.165 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.231 -17.176 1.137 1.00 10.00 N ATOM 0 H ASN A 31 -12.968 -15.331 -3.212 1.00 10.00 H new ATOM 0 HA ASN A 31 -12.672 -13.990 -1.546 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -14.184 -14.194 0.054 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -14.582 -15.748 -0.653 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -12.976 -17.654 2.001 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -13.348 -17.709 0.275 1.00 10.00 H new ATOM 475 N LEU A 32 -10.710 -13.982 -0.031 1.00 10.00 N ATOM 476 CA LEU A 32 -9.409 -13.902 0.642 1.00 10.00 C ATOM 477 C LEU A 32 -9.570 -14.299 2.119 1.00 10.00 C ATOM 478 O LEU A 32 -9.510 -13.458 3.014 1.00 10.00 O ATOM 479 CB LEU A 32 -8.759 -12.505 0.481 1.00 10.00 C ATOM 480 CG LEU A 32 -8.184 -12.128 -0.901 1.00 10.00 C ATOM 481 CD1 LEU A 32 -6.865 -12.848 -1.170 1.00 10.00 C ATOM 482 CD2 LEU A 32 -9.113 -12.385 -2.088 1.00 10.00 C ATOM 0 H LEU A 32 -11.205 -13.090 -0.062 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.726 -14.606 0.167 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.505 -11.757 0.747 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.953 -12.425 1.211 1.00 10.00 H new ATOM 0 HG LEU A 32 -8.042 -11.049 -0.831 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -6.487 -12.561 -2.151 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -6.138 -12.573 -0.406 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -7.027 -13.926 -1.145 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -8.615 -12.087 -3.011 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -9.359 -13.446 -2.135 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -10.028 -11.806 -1.966 1.00 10.00 H new ATOM 494 N HIS A 33 -9.761 -15.601 2.362 1.00 10.00 N ATOM 495 CA HIS A 33 -9.573 -16.214 3.682 1.00 10.00 C ATOM 496 C HIS A 33 -8.085 -16.218 4.122 1.00 10.00 C ATOM 497 O HIS A 33 -7.296 -15.422 3.618 1.00 10.00 O ATOM 498 CB HIS A 33 -10.290 -17.578 3.737 1.00 10.00 C ATOM 499 CG HIS A 33 -10.020 -18.594 2.645 1.00 10.00 C ATOM 500 ND1 HIS A 33 -9.088 -18.545 1.624 1.00 10.00 N ATOM 501 CD2 HIS A 33 -10.775 -19.719 2.459 1.00 10.00 C ATOM 502 CE1 HIS A 33 -9.317 -19.607 0.826 1.00 10.00 C ATOM 503 NE2 HIS A 33 -10.316 -20.360 1.311 1.00 10.00 N ATOM 0 H HIS A 33 -10.052 -16.263 1.643 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.053 -15.598 4.443 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -10.038 -18.044 4.690 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.363 -17.386 3.750 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -11.585 -20.052 3.091 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -8.771 -19.822 -0.080 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -10.670 -21.231 0.916 1.00 10.00 H new ATOM 511 N GLY A 34 -7.706 -17.051 5.106 1.00 10.00 N ATOM 512 CA GLY A 34 -6.456 -17.005 5.890 1.00 10.00 C ATOM 513 C GLY A 34 -5.128 -17.232 5.143 1.00 10.00 C ATOM 514 O GLY A 34 -4.346 -18.097 5.529 1.00 10.00 O ATOM 0 H GLY A 34 -8.303 -17.826 5.395 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.403 -16.032 6.378 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.528 -17.754 6.679 1.00 10.00 H new ATOM 518 N LEU A 35 -4.874 -16.473 4.075 1.00 10.00 N ATOM 519 CA LEU A 35 -3.633 -16.385 3.307 1.00 10.00 C ATOM 520 C LEU A 35 -2.524 -15.668 4.119 1.00 10.00 C ATOM 521 O LEU A 35 -2.737 -15.218 5.248 1.00 10.00 O ATOM 522 CB LEU A 35 -3.953 -15.693 1.957 1.00 10.00 C ATOM 523 CG LEU A 35 -4.524 -16.621 0.866 1.00 10.00 C ATOM 524 CD1 LEU A 35 -5.954 -17.100 1.149 1.00 10.00 C ATOM 525 CD2 LEU A 35 -4.582 -15.858 -0.459 1.00 10.00 C ATOM 0 H LEU A 35 -5.590 -15.854 3.695 1.00 10.00 H new ATOM 0 HA LEU A 35 -3.235 -17.378 3.098 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -4.667 -14.889 2.139 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -3.041 -15.231 1.578 1.00 10.00 H new ATOM 0 HG LEU A 35 -3.864 -17.488 0.837 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -6.288 -17.748 0.339 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.973 -17.654 2.088 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.618 -16.239 1.222 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.985 -16.508 -1.236 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -5.224 -14.984 -0.348 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -3.578 -15.538 -0.739 1.00 10.00 H new ATOM 537 N PHE A 36 -1.319 -15.559 3.545 1.00 10.00 N ATOM 538 CA PHE A 36 -0.048 -15.281 4.225 1.00 10.00 C ATOM 539 C PHE A 36 0.335 -16.390 5.219 1.00 10.00 C ATOM 540 O PHE A 36 0.880 -16.128 6.288 1.00 10.00 O ATOM 541 CB PHE A 36 0.038 -13.828 4.735 1.00 10.00 C ATOM 542 CG PHE A 36 0.130 -12.816 3.604 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.023 -12.454 2.884 1.00 10.00 C ATOM 544 CD2 PHE A 36 1.383 -12.295 3.222 1.00 10.00 C ATOM 545 CE1 PHE A 36 -0.919 -11.640 1.744 1.00 10.00 C ATOM 546 CE2 PHE A 36 1.485 -11.465 2.091 1.00 10.00 C ATOM 547 CZ PHE A 36 0.340 -11.176 1.329 1.00 10.00 C ATOM 0 H PHE A 36 -1.198 -15.669 2.538 1.00 10.00 H new ATOM 0 HA PHE A 36 0.755 -15.326 3.489 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -0.839 -13.608 5.344 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.909 -13.725 5.382 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -1.992 -12.803 3.209 1.00 10.00 H new ATOM 0 HD2 PHE A 36 2.265 -12.533 3.798 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -1.805 -11.372 1.188 1.00 10.00 H new ATOM 0 HE2 PHE A 36 2.442 -11.051 1.809 1.00 10.00 H new ATOM 0 HZ PHE A 36 0.428 -10.596 0.422 1.00 10.00 H new ATOM 557 N GLY A 37 0.082 -17.650 4.826 1.00 10.00 N ATOM 558 CA GLY A 37 0.400 -18.828 5.639 1.00 10.00 C ATOM 559 C GLY A 37 -0.399 -20.102 5.332 1.00 10.00 C ATOM 560 O GLY A 37 -0.826 -20.770 6.270 1.00 10.00 O ATOM 0 H GLY A 37 -0.351 -17.877 3.931 1.00 10.00 H new ATOM 0 HA2 GLY A 37 1.460 -19.051 5.518 1.00 10.00 H new ATOM 0 HA3 GLY A 37 0.246 -18.572 6.687 1.00 10.00 H new ATOM 564 N ARG A 38 -0.577 -20.480 4.054 1.00 10.00 N ATOM 565 CA ARG A 38 -1.231 -21.750 3.679 1.00 10.00 C ATOM 566 C ARG A 38 -0.761 -22.286 2.317 1.00 10.00 C ATOM 567 O ARG A 38 0.255 -22.982 2.234 1.00 10.00 O ATOM 568 CB ARG A 38 -2.781 -21.655 3.820 1.00 10.00 C ATOM 569 CG ARG A 38 -3.481 -20.404 3.235 1.00 10.00 C ATOM 570 CD ARG A 38 -5.022 -20.512 3.287 1.00 10.00 C ATOM 571 NE ARG A 38 -5.669 -20.388 1.960 1.00 10.00 N ATOM 572 CZ ARG A 38 -5.869 -21.343 1.060 1.00 10.00 C ATOM 573 NH1 ARG A 38 -5.483 -22.575 1.280 1.00 10.00 N ATOM 574 NH2 ARG A 38 -6.436 -21.098 -0.099 1.00 10.00 N ATOM 0 H ARG A 38 -0.275 -19.920 3.257 1.00 10.00 H new ATOM 0 HA ARG A 38 -0.907 -22.506 4.394 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -3.216 -22.535 3.346 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -3.025 -21.711 4.881 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -3.163 -19.521 3.789 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -3.164 -20.264 2.202 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -5.296 -21.470 3.728 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -5.411 -19.735 3.946 1.00 10.00 H new ATOM 0 HE ARG A 38 -6.001 -19.457 1.708 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -5.019 -22.815 2.156 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -5.646 -23.294 0.575 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -6.737 -20.151 -0.329 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -6.575 -21.855 -0.769 1.00 10.00 H new ATOM 588 N LYS A 39 -1.554 -22.051 1.270 1.00 10.00 N ATOM 589 CA LYS A 39 -1.377 -22.311 -0.162 1.00 10.00 C ATOM 590 C LYS A 39 -2.614 -21.785 -0.888 1.00 10.00 C ATOM 591 O LYS A 39 -3.392 -21.051 -0.290 1.00 10.00 O ATOM 592 CB LYS A 39 -1.031 -23.784 -0.443 1.00 10.00 C ATOM 593 CG LYS A 39 -1.773 -24.870 0.368 1.00 10.00 C ATOM 594 CD LYS A 39 -1.049 -26.230 0.362 1.00 10.00 C ATOM 595 CE LYS A 39 0.137 -26.368 1.346 1.00 10.00 C ATOM 596 NZ LYS A 39 1.250 -25.416 1.104 1.00 10.00 N ATOM 0 H LYS A 39 -2.461 -21.613 1.429 1.00 10.00 H new ATOM 0 HA LYS A 39 -0.511 -21.777 -0.553 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -1.213 -23.974 -1.501 1.00 10.00 H new ATOM 0 HB3 LYS A 39 0.038 -23.914 -0.275 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -1.888 -24.531 1.398 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -2.776 -24.997 -0.039 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -1.777 -27.009 0.589 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -0.683 -26.421 -0.647 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -0.232 -26.226 2.362 1.00 10.00 H new ATOM 0 HE3 LYS A 39 0.526 -27.385 1.287 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 2.099 -25.739 1.610 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 1.451 -25.369 0.085 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 0.980 -24.472 1.448 1.00 10.00 H new ATOM 610 N THR A 40 -2.800 -22.166 -2.150 1.00 10.00 N ATOM 611 CA THR A 40 -4.095 -22.151 -2.839 1.00 10.00 C ATOM 612 C THR A 40 -4.963 -23.349 -2.375 1.00 10.00 C ATOM 613 O THR A 40 -5.005 -23.658 -1.178 1.00 10.00 O ATOM 614 CB THR A 40 -3.849 -22.042 -4.361 1.00 10.00 C ATOM 615 OG1 THR A 40 -5.068 -22.019 -5.066 1.00 10.00 O ATOM 616 CG2 THR A 40 -2.933 -23.132 -4.920 1.00 10.00 C ATOM 0 H THR A 40 -2.038 -22.502 -2.739 1.00 10.00 H new ATOM 0 HA THR A 40 -4.688 -21.275 -2.574 1.00 10.00 H new ATOM 0 HB THR A 40 -3.325 -21.098 -4.507 1.00 10.00 H new ATOM 0 HG1 THR A 40 -5.691 -21.407 -4.622 1.00 10.00 H new ATOM 0 HG21 THR A 40 -2.809 -22.988 -5.993 1.00 10.00 H new ATOM 0 HG22 THR A 40 -1.960 -23.076 -4.431 1.00 10.00 H new ATOM 0 HG23 THR A 40 -3.376 -24.110 -4.734 1.00 10.00 H new ATOM 624 N GLY A 41 -5.710 -24.006 -3.265 1.00 10.00 N ATOM 625 CA GLY A 41 -6.474 -25.222 -2.982 1.00 10.00 C ATOM 626 C GLY A 41 -7.840 -24.936 -2.359 1.00 10.00 C ATOM 627 O GLY A 41 -8.868 -25.152 -3.004 1.00 10.00 O ATOM 0 H GLY A 41 -5.802 -23.696 -4.232 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -6.612 -25.781 -3.907 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -5.899 -25.857 -2.308 1.00 10.00 H new ATOM 631 N GLN A 42 -7.848 -24.461 -1.109 1.00 10.00 N ATOM 632 CA GLN A 42 -9.075 -24.209 -0.343 1.00 10.00 C ATOM 633 C GLN A 42 -9.923 -23.101 -0.981 1.00 10.00 C ATOM 634 O GLN A 42 -9.396 -22.039 -1.310 1.00 10.00 O ATOM 635 CB GLN A 42 -8.769 -23.796 1.109 1.00 10.00 C ATOM 636 CG GLN A 42 -7.898 -24.776 1.901 1.00 10.00 C ATOM 637 CD GLN A 42 -8.500 -26.175 1.969 1.00 10.00 C ATOM 638 OE1 GLN A 42 -8.190 -27.039 1.165 1.00 10.00 O ATOM 639 NE2 GLN A 42 -9.382 -26.445 2.913 1.00 10.00 N ATOM 0 H GLN A 42 -6.996 -24.238 -0.595 1.00 10.00 H new ATOM 0 HA GLN A 42 -9.628 -25.148 -0.349 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -8.274 -22.825 1.096 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -9.713 -23.666 1.638 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -6.911 -24.831 1.442 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -7.758 -24.395 2.913 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -9.644 -25.726 3.587 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -9.802 -27.373 2.968 1.00 10.00 H new ATOM 648 N ALA A 43 -11.232 -23.362 -1.098 1.00 10.00 N ATOM 649 CA ALA A 43 -12.301 -22.397 -1.347 1.00 10.00 C ATOM 650 C ALA A 43 -13.657 -23.066 -1.028 1.00 10.00 C ATOM 651 O ALA A 43 -14.027 -24.019 -1.722 1.00 10.00 O ATOM 652 CB ALA A 43 -12.252 -21.934 -2.799 1.00 10.00 C ATOM 0 H ALA A 43 -11.591 -24.313 -1.015 1.00 10.00 H new ATOM 0 HA ALA A 43 -12.175 -21.522 -0.709 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -13.051 -21.215 -2.979 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.289 -21.464 -2.999 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -12.381 -22.792 -3.459 1.00 10.00 H new ATOM 658 N PRO A 44 -14.373 -22.663 0.040 1.00 10.00 N ATOM 659 CA PRO A 44 -15.453 -23.460 0.631 1.00 10.00 C ATOM 660 C PRO A 44 -16.743 -23.522 -0.219 1.00 10.00 C ATOM 661 O PRO A 44 -17.740 -22.872 0.080 1.00 10.00 O ATOM 662 CB PRO A 44 -15.648 -22.894 2.045 1.00 10.00 C ATOM 663 CG PRO A 44 -15.187 -21.444 1.921 1.00 10.00 C ATOM 664 CD PRO A 44 -14.061 -21.524 0.894 1.00 10.00 C ATOM 0 HA PRO A 44 -15.181 -24.515 0.670 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -16.689 -22.958 2.362 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -15.057 -23.441 2.780 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -15.993 -20.792 1.585 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -14.835 -21.050 2.875 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -13.999 -20.605 0.311 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -13.096 -21.656 1.383 1.00 10.00 H new ATOM 672 N GLY A 45 -16.733 -24.349 -1.274 1.00 10.00 N ATOM 673 CA GLY A 45 -17.879 -24.608 -2.161 1.00 10.00 C ATOM 674 C GLY A 45 -17.901 -23.760 -3.440 1.00 10.00 C ATOM 675 O GLY A 45 -18.917 -23.704 -4.124 1.00 10.00 O ATOM 0 H GLY A 45 -15.901 -24.874 -1.543 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -17.875 -25.662 -2.439 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -18.800 -24.428 -1.606 1.00 10.00 H new ATOM 679 N PHE A 46 -16.791 -23.088 -3.753 1.00 10.00 N ATOM 680 CA PHE A 46 -16.647 -22.089 -4.817 1.00 10.00 C ATOM 681 C PHE A 46 -16.850 -22.643 -6.240 1.00 10.00 C ATOM 682 O PHE A 46 -17.769 -22.211 -6.929 1.00 10.00 O ATOM 683 CB PHE A 46 -15.254 -21.476 -4.634 1.00 10.00 C ATOM 684 CG PHE A 46 -14.702 -20.595 -5.743 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.518 -19.807 -6.565 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.317 -20.590 -5.958 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.959 -19.037 -7.603 1.00 10.00 C ATOM 688 CE2 PHE A 46 -12.750 -19.822 -6.980 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.574 -19.046 -7.812 1.00 10.00 C ATOM 0 H PHE A 46 -15.920 -23.234 -3.243 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.437 -21.343 -4.725 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -15.268 -20.886 -3.717 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -14.550 -22.293 -4.477 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.585 -19.790 -6.401 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -12.678 -21.188 -5.325 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -15.598 -18.440 -8.237 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -11.680 -19.825 -7.129 1.00 10.00 H new ATOM 0 HZ PHE A 46 -13.142 -18.459 -8.609 1.00 10.00 H new ATOM 699 N THR A 47 -16.036 -23.622 -6.661 1.00 10.00 N ATOM 700 CA THR A 47 -15.819 -24.101 -8.049 1.00 10.00 C ATOM 701 C THR A 47 -14.909 -23.166 -8.864 1.00 10.00 C ATOM 702 O THR A 47 -15.137 -21.966 -8.949 1.00 10.00 O ATOM 703 CB THR A 47 -17.127 -24.305 -8.842 1.00 10.00 C ATOM 704 OG1 THR A 47 -18.134 -24.859 -8.033 1.00 10.00 O ATOM 705 CG2 THR A 47 -16.928 -25.235 -10.038 1.00 10.00 C ATOM 0 H THR A 47 -15.466 -24.144 -5.996 1.00 10.00 H new ATOM 0 HA THR A 47 -15.332 -25.067 -7.918 1.00 10.00 H new ATOM 0 HB THR A 47 -17.424 -23.316 -9.191 1.00 10.00 H new ATOM 0 HG1 THR A 47 -18.951 -24.975 -8.561 1.00 10.00 H new ATOM 0 HG21 THR A 47 -17.873 -25.352 -10.569 1.00 10.00 H new ATOM 0 HG22 THR A 47 -16.184 -24.808 -10.711 1.00 10.00 H new ATOM 0 HG23 THR A 47 -16.585 -26.209 -9.689 1.00 10.00 H new ATOM 713 N TYR A 48 -13.861 -23.740 -9.456 1.00 10.00 N ATOM 714 CA TYR A 48 -12.703 -23.088 -10.078 1.00 10.00 C ATOM 715 C TYR A 48 -12.047 -24.007 -11.126 1.00 10.00 C ATOM 716 O TYR A 48 -12.508 -25.128 -11.341 1.00 10.00 O ATOM 717 CB TYR A 48 -11.703 -22.692 -8.982 1.00 10.00 C ATOM 718 CG TYR A 48 -11.482 -23.642 -7.809 1.00 10.00 C ATOM 719 CD1 TYR A 48 -11.603 -25.046 -7.920 1.00 10.00 C ATOM 720 CD2 TYR A 48 -11.118 -23.075 -6.574 1.00 10.00 C ATOM 721 CE1 TYR A 48 -11.408 -25.859 -6.790 1.00 10.00 C ATOM 722 CE2 TYR A 48 -10.812 -23.892 -5.471 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.974 -25.291 -5.575 1.00 10.00 C ATOM 724 OH TYR A 48 -10.659 -26.106 -4.532 1.00 10.00 O ATOM 0 H TYR A 48 -13.793 -24.756 -9.519 1.00 10.00 H new ATOM 0 HA TYR A 48 -13.033 -22.191 -10.602 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.737 -22.528 -9.460 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -12.023 -21.733 -8.574 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -11.845 -25.494 -8.872 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -11.073 -22.001 -6.472 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -11.591 -26.922 -6.853 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -10.456 -23.453 -4.551 1.00 10.00 H new ATOM 0 HH TYR A 48 -10.361 -25.564 -3.772 1.00 10.00 H new ATOM 734 N THR A 49 -10.965 -23.559 -11.777 1.00 10.00 N ATOM 735 CA THR A 49 -10.119 -24.426 -12.613 1.00 10.00 C ATOM 736 C THR A 49 -9.322 -25.420 -11.756 1.00 10.00 C ATOM 737 O THR A 49 -9.159 -25.220 -10.555 1.00 10.00 O ATOM 738 CB THR A 49 -9.164 -23.619 -13.512 1.00 10.00 C ATOM 739 OG1 THR A 49 -8.091 -23.068 -12.790 1.00 10.00 O ATOM 740 CG2 THR A 49 -9.856 -22.467 -14.242 1.00 10.00 C ATOM 0 H THR A 49 -10.651 -22.589 -11.740 1.00 10.00 H new ATOM 0 HA THR A 49 -10.794 -24.983 -13.262 1.00 10.00 H new ATOM 0 HB THR A 49 -8.802 -24.347 -14.238 1.00 10.00 H new ATOM 0 HG1 THR A 49 -7.283 -23.081 -13.344 1.00 10.00 H new ATOM 0 HG21 THR A 49 -9.129 -21.938 -14.858 1.00 10.00 H new ATOM 0 HG22 THR A 49 -10.650 -22.862 -14.876 1.00 10.00 H new ATOM 0 HG23 THR A 49 -10.283 -21.778 -13.513 1.00 10.00 H new ATOM 748 N ASP A 50 -8.855 -26.529 -12.343 1.00 10.00 N ATOM 749 CA ASP A 50 -8.153 -27.571 -11.588 1.00 10.00 C ATOM 750 C ASP A 50 -6.678 -27.269 -11.231 1.00 10.00 C ATOM 751 O ASP A 50 -6.225 -27.610 -10.136 1.00 10.00 O ATOM 752 CB ASP A 50 -8.289 -28.919 -12.305 1.00 10.00 C ATOM 753 CG ASP A 50 -7.909 -30.055 -11.350 1.00 10.00 C ATOM 754 OD1 ASP A 50 -8.600 -30.161 -10.306 1.00 10.00 O ATOM 755 OD2 ASP A 50 -6.896 -30.737 -11.614 1.00 10.00 O ATOM 0 H ASP A 50 -8.951 -26.727 -13.339 1.00 10.00 H new ATOM 0 HA ASP A 50 -8.650 -27.605 -10.619 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -9.312 -29.053 -12.656 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -7.645 -28.940 -13.184 1.00 10.00 H new ATOM 760 N ALA A 51 -5.914 -26.704 -12.171 1.00 10.00 N ATOM 761 CA ALA A 51 -4.454 -26.814 -12.189 1.00 10.00 C ATOM 762 C ALA A 51 -3.695 -25.897 -11.203 1.00 10.00 C ATOM 763 O ALA A 51 -2.584 -26.241 -10.786 1.00 10.00 O ATOM 764 CB ALA A 51 -3.995 -26.574 -13.630 1.00 10.00 C ATOM 0 H ALA A 51 -6.293 -26.156 -12.943 1.00 10.00 H new ATOM 0 HA ALA A 51 -4.204 -27.815 -11.836 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.909 -26.648 -13.683 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -4.442 -27.323 -14.284 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -4.307 -25.580 -13.950 1.00 10.00 H new ATOM 770 N ASN A 52 -4.286 -24.769 -10.788 1.00 10.00 N ATOM 771 CA ASN A 52 -3.731 -23.888 -9.753 1.00 10.00 C ATOM 772 C ASN A 52 -3.579 -24.615 -8.417 1.00 10.00 C ATOM 773 O ASN A 52 -2.473 -24.648 -7.885 1.00 10.00 O ATOM 774 CB ASN A 52 -4.548 -22.594 -9.614 1.00 10.00 C ATOM 775 CG ASN A 52 -6.044 -22.792 -9.742 1.00 10.00 C ATOM 776 OD1 ASN A 52 -6.608 -23.764 -9.265 1.00 10.00 O ATOM 777 ND2 ASN A 52 -6.685 -21.910 -10.463 1.00 10.00 N ATOM 0 H ASN A 52 -5.174 -24.439 -11.166 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.730 -23.599 -10.074 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -4.333 -22.144 -8.645 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -4.219 -21.886 -10.375 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -7.683 -22.024 -10.640 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -6.187 -21.108 -10.849 1.00 10.00 H new ATOM 784 N LYS A 53 -4.653 -25.238 -7.910 1.00 10.00 N ATOM 785 CA LYS A 53 -4.688 -25.963 -6.631 1.00 10.00 C ATOM 786 C LYS A 53 -3.487 -26.901 -6.472 1.00 10.00 C ATOM 787 O LYS A 53 -2.817 -26.882 -5.439 1.00 10.00 O ATOM 788 CB LYS A 53 -5.998 -26.751 -6.488 1.00 10.00 C ATOM 789 CG LYS A 53 -7.283 -25.900 -6.561 1.00 10.00 C ATOM 790 CD LYS A 53 -8.111 -26.117 -7.833 1.00 10.00 C ATOM 791 CE LYS A 53 -8.878 -27.446 -7.935 1.00 10.00 C ATOM 792 NZ LYS A 53 -8.009 -28.598 -8.280 1.00 10.00 N ATOM 0 H LYS A 53 -5.550 -25.252 -8.395 1.00 10.00 H new ATOM 0 HA LYS A 53 -4.634 -25.217 -5.838 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -6.036 -27.508 -7.272 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -5.984 -27.280 -5.535 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.904 -26.126 -5.694 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.012 -24.846 -6.493 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -8.829 -25.301 -7.915 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -7.443 -26.042 -8.691 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -9.374 -27.645 -6.985 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -9.659 -27.350 -8.689 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -8.523 -29.244 -8.913 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -7.151 -28.255 -8.758 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -7.742 -29.104 -7.411 1.00 10.00 H new ATOM 806 N ASN A 54 -3.185 -27.670 -7.527 1.00 10.00 N ATOM 807 CA ASN A 54 -2.055 -28.595 -7.603 1.00 10.00 C ATOM 808 C ASN A 54 -0.686 -27.921 -7.385 1.00 10.00 C ATOM 809 O ASN A 54 0.230 -28.580 -6.892 1.00 10.00 O ATOM 810 CB ASN A 54 -2.116 -29.307 -8.970 1.00 10.00 C ATOM 811 CG ASN A 54 -0.878 -30.149 -9.261 1.00 10.00 C ATOM 812 OD1 ASN A 54 0.083 -29.686 -9.869 1.00 10.00 O ATOM 813 ND2 ASN A 54 -0.856 -31.394 -8.829 1.00 10.00 N ATOM 0 H ASN A 54 -3.744 -27.662 -8.380 1.00 10.00 H new ATOM 0 HA ASN A 54 -2.144 -29.312 -6.787 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -2.998 -29.946 -9.001 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -2.234 -28.562 -9.756 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -0.038 -31.978 -8.999 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -1.657 -31.773 -8.324 1.00 10.00 H new ATOM 820 N LYS A 55 -0.520 -26.634 -7.732 1.00 10.00 N ATOM 821 CA LYS A 55 0.742 -25.912 -7.521 1.00 10.00 C ATOM 822 C LYS A 55 1.017 -25.567 -6.057 1.00 10.00 C ATOM 823 O LYS A 55 2.181 -25.409 -5.708 1.00 10.00 O ATOM 824 CB LYS A 55 0.851 -24.702 -8.469 1.00 10.00 C ATOM 825 CG LYS A 55 2.005 -24.860 -9.482 1.00 10.00 C ATOM 826 CD LYS A 55 1.869 -26.103 -10.392 1.00 10.00 C ATOM 827 CE LYS A 55 2.822 -27.238 -9.978 1.00 10.00 C ATOM 828 NZ LYS A 55 2.443 -28.534 -10.592 1.00 10.00 N ATOM 0 H LYS A 55 -1.252 -26.070 -8.163 1.00 10.00 H new ATOM 0 HA LYS A 55 1.547 -26.599 -7.784 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.089 -24.578 -9.007 1.00 10.00 H new ATOM 0 HB3 LYS A 55 1.005 -23.796 -7.883 1.00 10.00 H new ATOM 0 HG2 LYS A 55 2.053 -23.968 -10.106 1.00 10.00 H new ATOM 0 HG3 LYS A 55 2.948 -24.920 -8.938 1.00 10.00 H new ATOM 0 HD2 LYS A 55 0.841 -26.464 -10.358 1.00 10.00 H new ATOM 0 HD3 LYS A 55 2.073 -25.819 -11.424 1.00 10.00 H new ATOM 0 HE2 LYS A 55 3.840 -26.982 -10.272 1.00 10.00 H new ATOM 0 HE3 LYS A 55 2.819 -27.336 -8.892 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 3.110 -29.271 -10.287 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 1.481 -28.792 -10.292 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 2.471 -28.449 -11.628 1.00 10.00 H new ATOM 842 N GLY A 56 -0.005 -25.536 -5.189 1.00 10.00 N ATOM 843 CA GLY A 56 0.113 -25.881 -3.756 1.00 10.00 C ATOM 844 C GLY A 56 1.091 -25.082 -2.866 1.00 10.00 C ATOM 845 O GLY A 56 1.328 -25.484 -1.728 1.00 10.00 O ATOM 0 H GLY A 56 -0.951 -25.268 -5.461 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.880 -25.792 -3.314 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.397 -26.932 -3.694 1.00 10.00 H new ATOM 849 N ILE A 57 1.632 -23.964 -3.360 1.00 10.00 N ATOM 850 CA ILE A 57 2.711 -23.125 -2.810 1.00 10.00 C ATOM 851 C ILE A 57 2.548 -22.703 -1.331 1.00 10.00 C ATOM 852 O ILE A 57 2.899 -23.450 -0.417 1.00 10.00 O ATOM 853 CB ILE A 57 2.949 -21.915 -3.759 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.615 -21.275 -4.232 1.00 10.00 C ATOM 855 CG2 ILE A 57 3.794 -22.336 -4.973 1.00 10.00 C ATOM 856 CD1 ILE A 57 1.756 -19.803 -4.606 1.00 10.00 C ATOM 0 H ILE A 57 1.294 -23.583 -4.244 1.00 10.00 H new ATOM 0 HA ILE A 57 3.603 -23.751 -2.775 1.00 10.00 H new ATOM 0 HB ILE A 57 3.493 -21.162 -3.189 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.239 -21.828 -5.093 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.872 -21.373 -3.441 1.00 10.00 H new ATOM 0 HG21 ILE A 57 3.949 -21.476 -5.624 1.00 10.00 H new ATOM 0 HG22 ILE A 57 4.759 -22.712 -4.632 1.00 10.00 H new ATOM 0 HG23 ILE A 57 3.274 -23.119 -5.524 1.00 10.00 H new ATOM 0 HD11 ILE A 57 0.790 -19.415 -4.928 1.00 10.00 H new ATOM 0 HD12 ILE A 57 2.103 -19.239 -3.740 1.00 10.00 H new ATOM 0 HD13 ILE A 57 2.476 -19.701 -5.418 1.00 10.00 H new ATOM 868 N THR A 58 2.115 -21.465 -1.054 1.00 10.00 N ATOM 869 CA THR A 58 2.048 -20.903 0.314 1.00 10.00 C ATOM 870 C THR A 58 1.024 -19.782 0.506 1.00 10.00 C ATOM 871 O THR A 58 0.497 -19.612 1.602 1.00 10.00 O ATOM 872 CB THR A 58 3.440 -20.424 0.783 1.00 10.00 C ATOM 873 OG1 THR A 58 4.391 -21.454 0.638 1.00 10.00 O ATOM 874 CG2 THR A 58 3.486 -20.018 2.257 1.00 10.00 C ATOM 0 H THR A 58 1.798 -20.816 -1.774 1.00 10.00 H new ATOM 0 HA THR A 58 1.702 -21.731 0.932 1.00 10.00 H new ATOM 0 HB THR A 58 3.659 -19.557 0.160 1.00 10.00 H new ATOM 0 HG1 THR A 58 5.268 -21.134 0.938 1.00 10.00 H new ATOM 0 HG21 THR A 58 4.494 -19.693 2.514 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.786 -19.201 2.431 1.00 10.00 H new ATOM 0 HG23 THR A 58 3.210 -20.870 2.878 1.00 10.00 H new ATOM 882 N TRP A 59 0.729 -19.056 -0.570 1.00 10.00 N ATOM 883 CA TRP A 59 0.132 -17.721 -0.602 1.00 10.00 C ATOM 884 C TRP A 59 0.667 -16.784 0.472 1.00 10.00 C ATOM 885 O TRP A 59 0.183 -16.759 1.598 1.00 10.00 O ATOM 886 CB TRP A 59 -1.396 -17.737 -0.631 1.00 10.00 C ATOM 887 CG TRP A 59 -2.023 -18.022 -1.962 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.211 -18.636 -2.120 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.575 -17.682 -3.317 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.476 -18.795 -3.460 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.471 -18.289 -4.243 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.528 -16.915 -3.879 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.280 -18.256 -5.630 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.304 -16.890 -5.262 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.158 -17.589 -6.136 1.00 10.00 C ATOM 0 H TRP A 59 0.913 -19.409 -1.509 1.00 10.00 H new ATOM 0 HA TRP A 59 0.456 -17.306 -1.557 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.746 -18.485 0.081 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.757 -16.770 -0.281 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.858 -18.955 -1.316 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.319 -19.236 -3.827 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.112 -16.337 -3.229 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -2.983 -18.735 -6.295 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.530 -16.331 -5.660 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -0.948 -17.611 -7.195 1.00 10.00 H new ATOM 906 N LYS A 60 1.653 -15.983 0.066 1.00 10.00 N ATOM 907 CA LYS A 60 2.320 -14.922 0.812 1.00 10.00 C ATOM 908 C LYS A 60 3.073 -14.015 -0.171 1.00 10.00 C ATOM 909 O LYS A 60 3.005 -14.204 -1.387 1.00 10.00 O ATOM 910 CB LYS A 60 3.248 -15.520 1.896 1.00 10.00 C ATOM 911 CG LYS A 60 4.549 -16.158 1.369 1.00 10.00 C ATOM 912 CD LYS A 60 5.455 -16.560 2.544 1.00 10.00 C ATOM 913 CE LYS A 60 6.920 -16.738 2.130 1.00 10.00 C ATOM 914 NZ LYS A 60 7.139 -17.804 1.126 1.00 10.00 N ATOM 0 H LYS A 60 2.036 -16.070 -0.875 1.00 10.00 H new ATOM 0 HA LYS A 60 1.584 -14.314 1.337 1.00 10.00 H new ATOM 0 HB2 LYS A 60 3.509 -14.732 2.603 1.00 10.00 H new ATOM 0 HB3 LYS A 60 2.691 -16.275 2.452 1.00 10.00 H new ATOM 0 HG2 LYS A 60 4.314 -17.034 0.764 1.00 10.00 H new ATOM 0 HG3 LYS A 60 5.072 -15.454 0.721 1.00 10.00 H new ATOM 0 HD2 LYS A 60 5.392 -15.800 3.322 1.00 10.00 H new ATOM 0 HD3 LYS A 60 5.089 -17.491 2.977 1.00 10.00 H new ATOM 0 HE2 LYS A 60 7.290 -15.794 1.729 1.00 10.00 H new ATOM 0 HE3 LYS A 60 7.512 -16.962 3.017 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 8.093 -17.711 0.723 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 7.045 -18.734 1.581 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 6.433 -17.717 0.367 1.00 10.00 H new ATOM 928 N GLU A 61 3.817 -13.057 0.369 1.00 10.00 N ATOM 929 CA GLU A 61 4.530 -11.989 -0.332 1.00 10.00 C ATOM 930 C GLU A 61 5.284 -12.484 -1.584 1.00 10.00 C ATOM 931 O GLU A 61 5.007 -12.046 -2.696 1.00 10.00 O ATOM 932 CB GLU A 61 5.432 -11.341 0.731 1.00 10.00 C ATOM 933 CG GLU A 61 5.833 -9.893 0.441 1.00 10.00 C ATOM 934 CD GLU A 61 5.864 -9.102 1.753 1.00 10.00 C ATOM 935 OE1 GLU A 61 6.588 -9.509 2.692 1.00 10.00 O ATOM 936 OE2 GLU A 61 5.041 -8.170 1.920 1.00 10.00 O ATOM 0 H GLU A 61 3.949 -13.000 1.379 1.00 10.00 H new ATOM 0 HA GLU A 61 3.843 -11.254 -0.752 1.00 10.00 H new ATOM 0 HB2 GLU A 61 4.918 -11.375 1.692 1.00 10.00 H new ATOM 0 HB3 GLU A 61 6.337 -11.940 0.832 1.00 10.00 H new ATOM 0 HG2 GLU A 61 6.812 -9.864 -0.037 1.00 10.00 H new ATOM 0 HG3 GLU A 61 5.125 -9.440 -0.253 1.00 10.00 H new ATOM 943 N GLU A 62 6.136 -13.499 -1.425 1.00 10.00 N ATOM 944 CA GLU A 62 6.963 -14.143 -2.463 1.00 10.00 C ATOM 945 C GLU A 62 6.197 -14.891 -3.580 1.00 10.00 C ATOM 946 O GLU A 62 6.764 -15.743 -4.262 1.00 10.00 O ATOM 947 CB GLU A 62 7.951 -15.122 -1.795 1.00 10.00 C ATOM 948 CG GLU A 62 8.803 -14.529 -0.666 1.00 10.00 C ATOM 949 CD GLU A 62 9.796 -15.573 -0.135 1.00 10.00 C ATOM 950 OE1 GLU A 62 9.324 -16.678 0.230 1.00 10.00 O ATOM 951 OE2 GLU A 62 11.002 -15.259 -0.076 1.00 10.00 O ATOM 0 H GLU A 62 6.280 -13.925 -0.510 1.00 10.00 H new ATOM 0 HA GLU A 62 7.466 -13.317 -2.966 1.00 10.00 H new ATOM 0 HB2 GLU A 62 7.387 -15.965 -1.397 1.00 10.00 H new ATOM 0 HB3 GLU A 62 8.618 -15.518 -2.561 1.00 10.00 H new ATOM 0 HG2 GLU A 62 9.345 -13.656 -1.031 1.00 10.00 H new ATOM 0 HG3 GLU A 62 8.158 -14.188 0.143 1.00 10.00 H new ATOM 958 N THR A 63 4.913 -14.596 -3.783 1.00 10.00 N ATOM 959 CA THR A 63 3.971 -15.398 -4.577 1.00 10.00 C ATOM 960 C THR A 63 2.775 -14.559 -5.002 1.00 10.00 C ATOM 961 O THR A 63 2.421 -14.558 -6.175 1.00 10.00 O ATOM 962 CB THR A 63 3.477 -16.651 -3.796 1.00 10.00 C ATOM 963 OG1 THR A 63 2.620 -16.326 -2.723 1.00 10.00 O ATOM 964 CG2 THR A 63 4.538 -17.544 -3.138 1.00 10.00 C ATOM 0 H THR A 63 4.481 -13.762 -3.386 1.00 10.00 H new ATOM 0 HA THR A 63 4.508 -15.737 -5.463 1.00 10.00 H new ATOM 0 HB THR A 63 3.000 -17.190 -4.614 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.889 -15.466 -2.338 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.050 -18.376 -2.631 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.213 -17.930 -3.902 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.106 -16.961 -2.413 1.00 10.00 H new ATOM 972 N LEU A 64 2.191 -13.782 -4.089 1.00 10.00 N ATOM 973 CA LEU A 64 1.052 -12.921 -4.346 1.00 10.00 C ATOM 974 C LEU A 64 1.454 -11.659 -5.111 1.00 10.00 C ATOM 975 O LEU A 64 0.616 -11.111 -5.817 1.00 10.00 O ATOM 976 CB LEU A 64 0.365 -12.636 -2.995 1.00 10.00 C ATOM 977 CG LEU A 64 -1.173 -12.669 -3.054 1.00 10.00 C ATOM 978 CD1 LEU A 64 -1.747 -13.191 -1.732 1.00 10.00 C ATOM 979 CD2 LEU A 64 -1.748 -11.268 -3.293 1.00 10.00 C ATOM 0 H LEU A 64 2.513 -13.738 -3.122 1.00 10.00 H new ATOM 0 HA LEU A 64 0.336 -13.416 -5.003 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.706 -13.369 -2.264 1.00 10.00 H new ATOM 0 HB3 LEU A 64 0.683 -11.657 -2.637 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.449 -13.327 -3.878 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -2.835 -13.208 -1.790 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -1.377 -14.200 -1.548 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -1.437 -12.537 -0.917 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -2.836 -11.323 -3.330 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -1.445 -10.607 -2.481 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -1.372 -10.877 -4.238 1.00 10.00 H new ATOM 991 N MET A 65 2.732 -11.250 -5.060 1.00 10.00 N ATOM 992 CA MET A 65 3.275 -10.252 -5.981 1.00 10.00 C ATOM 993 C MET A 65 3.183 -10.801 -7.402 1.00 10.00 C ATOM 994 O MET A 65 2.484 -10.231 -8.236 1.00 10.00 O ATOM 995 CB MET A 65 4.740 -9.889 -5.643 1.00 10.00 C ATOM 996 CG MET A 65 4.908 -8.576 -4.868 1.00 10.00 C ATOM 997 SD MET A 65 4.998 -8.648 -3.058 1.00 10.00 S ATOM 998 CE MET A 65 3.385 -9.336 -2.640 1.00 10.00 C ATOM 0 H MET A 65 3.409 -11.602 -4.383 1.00 10.00 H new ATOM 0 HA MET A 65 2.690 -9.337 -5.887 1.00 10.00 H new ATOM 0 HB2 MET A 65 5.176 -10.699 -5.059 1.00 10.00 H new ATOM 0 HB3 MET A 65 5.308 -9.824 -6.571 1.00 10.00 H new ATOM 0 HG2 MET A 65 5.817 -8.093 -5.227 1.00 10.00 H new ATOM 0 HG3 MET A 65 4.075 -7.925 -5.133 1.00 10.00 H new ATOM 0 HE1 MET A 65 3.145 -9.098 -1.604 1.00 10.00 H new ATOM 0 HE2 MET A 65 2.626 -8.908 -3.295 1.00 10.00 H new ATOM 0 HE3 MET A 65 3.407 -10.418 -2.768 1.00 10.00 H new ATOM 1008 N GLU A 66 3.847 -11.935 -7.661 1.00 10.00 N ATOM 1009 CA GLU A 66 3.897 -12.502 -9.009 1.00 10.00 C ATOM 1010 C GLU A 66 2.492 -12.851 -9.496 1.00 10.00 C ATOM 1011 O GLU A 66 2.160 -12.614 -10.657 1.00 10.00 O ATOM 1012 CB GLU A 66 4.820 -13.737 -9.062 1.00 10.00 C ATOM 1013 CG GLU A 66 5.505 -13.773 -10.445 1.00 10.00 C ATOM 1014 CD GLU A 66 6.423 -14.978 -10.677 1.00 10.00 C ATOM 1015 OE1 GLU A 66 7.168 -15.351 -9.747 1.00 10.00 O ATOM 1016 OE2 GLU A 66 6.369 -15.523 -11.809 1.00 10.00 O ATOM 0 H GLU A 66 4.353 -12.473 -6.958 1.00 10.00 H new ATOM 0 HA GLU A 66 4.315 -11.748 -9.676 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.567 -13.687 -8.270 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.244 -14.648 -8.900 1.00 10.00 H new ATOM 0 HG2 GLU A 66 4.735 -13.767 -11.216 1.00 10.00 H new ATOM 0 HG3 GLU A 66 6.088 -12.861 -10.570 1.00 10.00 H new ATOM 1023 N TYR A 67 1.648 -13.347 -8.586 1.00 10.00 N ATOM 1024 CA TYR A 67 0.290 -13.717 -8.920 1.00 10.00 C ATOM 1025 C TYR A 67 -0.613 -12.509 -9.215 1.00 10.00 C ATOM 1026 O TYR A 67 -1.245 -12.506 -10.263 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.272 -14.614 -7.829 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.696 -15.046 -8.096 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -1.965 -16.040 -9.058 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.751 -14.433 -7.402 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.291 -16.438 -9.303 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.079 -14.793 -7.682 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.354 -15.806 -8.626 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.631 -16.171 -8.905 1.00 10.00 O ATOM 0 H TYR A 67 1.894 -13.498 -7.608 1.00 10.00 H new ATOM 0 HA TYR A 67 0.313 -14.276 -9.856 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.358 -15.498 -7.732 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.230 -14.087 -6.876 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.154 -16.495 -9.606 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.541 -13.684 -6.652 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.495 -17.228 -10.010 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.891 -14.294 -7.174 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.176 -15.370 -9.048 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.703 -11.477 -8.358 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.577 -10.332 -8.678 1.00 10.00 C ATOM 1046 C LEU A 68 -1.086 -9.513 -9.877 1.00 10.00 C ATOM 1047 O LEU A 68 -1.922 -9.007 -10.629 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.787 -9.419 -7.452 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.171 -9.529 -6.797 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -4.238 -8.884 -7.683 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -3.557 -10.972 -6.468 1.00 10.00 C ATOM 0 H LEU A 68 -0.203 -11.409 -7.471 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.537 -10.765 -8.961 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.028 -9.655 -6.706 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -1.625 -8.385 -7.755 1.00 10.00 H new ATOM 0 HG LEU A 68 -3.113 -8.991 -5.851 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.212 -8.972 -7.202 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -4.000 -7.831 -7.831 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -4.263 -9.389 -8.649 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.545 -10.988 -6.007 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -3.574 -11.562 -7.384 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -2.827 -11.395 -5.778 1.00 10.00 H new ATOM 1063 N GLU A 69 0.233 -9.385 -10.075 1.00 10.00 N ATOM 1064 CA GLU A 69 0.788 -8.725 -11.250 1.00 10.00 C ATOM 1065 C GLU A 69 0.648 -9.564 -12.539 1.00 10.00 C ATOM 1066 O GLU A 69 0.529 -8.989 -13.624 1.00 10.00 O ATOM 1067 CB GLU A 69 2.266 -8.404 -10.987 1.00 10.00 C ATOM 1068 CG GLU A 69 2.602 -7.449 -9.814 1.00 10.00 C ATOM 1069 CD GLU A 69 1.968 -6.046 -9.792 1.00 10.00 C ATOM 1070 OE1 GLU A 69 1.180 -5.711 -10.703 1.00 10.00 O ATOM 1071 OE2 GLU A 69 2.251 -5.331 -8.796 1.00 10.00 O ATOM 0 H GLU A 69 0.937 -9.736 -9.425 1.00 10.00 H new ATOM 0 HA GLU A 69 0.217 -7.811 -11.416 1.00 10.00 H new ATOM 0 HB2 GLU A 69 2.787 -9.345 -10.812 1.00 10.00 H new ATOM 0 HB3 GLU A 69 2.682 -7.974 -11.898 1.00 10.00 H new ATOM 0 HG2 GLU A 69 2.321 -7.952 -8.889 1.00 10.00 H new ATOM 0 HG3 GLU A 69 3.684 -7.322 -9.792 1.00 10.00 H new ATOM 1078 N ASN A 70 0.640 -10.906 -12.455 1.00 10.00 N ATOM 1079 CA ASN A 70 0.646 -11.804 -13.622 1.00 10.00 C ATOM 1080 C ASN A 70 0.200 -13.263 -13.293 1.00 10.00 C ATOM 1081 O ASN A 70 0.995 -14.206 -13.335 1.00 10.00 O ATOM 1082 CB ASN A 70 2.049 -11.710 -14.283 1.00 10.00 C ATOM 1083 CG ASN A 70 1.967 -11.277 -15.735 1.00 10.00 C ATOM 1084 OD1 ASN A 70 2.338 -12.002 -16.643 1.00 10.00 O ATOM 1085 ND2 ASN A 70 1.460 -10.088 -15.984 1.00 10.00 N ATOM 0 H ASN A 70 0.629 -11.403 -11.564 1.00 10.00 H new ATOM 0 HA ASN A 70 -0.111 -11.478 -14.335 1.00 10.00 H new ATOM 0 HB2 ASN A 70 2.664 -11.002 -13.728 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.544 -12.679 -14.221 1.00 10.00 H new ATOM 0 HD21 ASN A 70 1.373 -9.762 -16.947 1.00 10.00 H new ATOM 0 HD22 ASN A 70 1.154 -9.493 -15.214 1.00 10.00 H new ATOM 1092 N PRO A 71 -1.105 -13.501 -13.033 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.601 -14.736 -12.410 1.00 10.00 C ATOM 1094 C PRO A 71 -1.453 -15.962 -13.317 1.00 10.00 C ATOM 1095 O PRO A 71 -0.883 -16.974 -12.906 1.00 10.00 O ATOM 1096 CB PRO A 71 -3.061 -14.448 -12.023 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.490 -13.332 -12.971 1.00 10.00 C ATOM 1098 CD PRO A 71 -2.195 -12.554 -13.209 1.00 10.00 C ATOM 0 HA PRO A 71 -1.009 -14.997 -11.533 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.686 -15.333 -12.142 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.143 -14.138 -10.981 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.897 -13.729 -13.901 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.262 -12.702 -12.528 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -2.179 -12.126 -14.211 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -2.106 -11.725 -12.507 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.920 -15.848 -14.569 1.00 10.00 N ATOM 1107 CA LYS A 72 -1.838 -16.857 -15.628 1.00 10.00 C ATOM 1108 C LYS A 72 -0.397 -17.282 -15.938 1.00 10.00 C ATOM 1109 O LYS A 72 -0.148 -18.441 -16.254 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.496 -16.290 -16.891 1.00 10.00 C ATOM 1111 CG LYS A 72 -3.984 -15.916 -16.748 1.00 10.00 C ATOM 1112 CD LYS A 72 -4.506 -15.397 -18.101 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.972 -14.944 -18.085 1.00 10.00 C ATOM 1114 NZ LYS A 72 -6.898 -16.051 -17.751 1.00 10.00 N ATOM 0 H LYS A 72 -2.391 -15.000 -14.884 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.357 -17.751 -15.281 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -1.944 -15.403 -17.201 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.398 -17.023 -17.692 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.561 -16.785 -16.431 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -4.108 -15.153 -15.980 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -3.884 -14.561 -18.420 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -4.390 -16.183 -18.847 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -6.094 -14.140 -17.359 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -6.235 -14.535 -19.061 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -7.553 -16.207 -18.544 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -6.353 -16.919 -17.577 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -7.440 -15.805 -16.898 1.00 10.00 H new ATOM 1128 N LYS A 73 0.540 -16.328 -15.867 1.00 10.00 N ATOM 1129 CA LYS A 73 1.983 -16.536 -16.023 1.00 10.00 C ATOM 1130 C LYS A 73 2.628 -17.163 -14.787 1.00 10.00 C ATOM 1131 O LYS A 73 3.675 -17.801 -14.902 1.00 10.00 O ATOM 1132 CB LYS A 73 2.633 -15.181 -16.319 1.00 10.00 C ATOM 1133 CG LYS A 73 4.066 -15.296 -16.871 1.00 10.00 C ATOM 1134 CD LYS A 73 5.072 -14.383 -16.152 1.00 10.00 C ATOM 1135 CE LYS A 73 5.231 -14.657 -14.647 1.00 10.00 C ATOM 1136 NZ LYS A 73 5.767 -16.005 -14.339 1.00 10.00 N ATOM 0 H LYS A 73 0.303 -15.351 -15.692 1.00 10.00 H new ATOM 0 HA LYS A 73 2.140 -17.237 -16.843 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.017 -14.641 -17.038 1.00 10.00 H new ATOM 0 HB3 LYS A 73 2.651 -14.588 -15.405 1.00 10.00 H new ATOM 0 HG2 LYS A 73 4.399 -16.330 -16.784 1.00 10.00 H new ATOM 0 HG3 LYS A 73 4.059 -15.051 -17.933 1.00 10.00 H new ATOM 0 HD2 LYS A 73 6.045 -14.490 -16.631 1.00 10.00 H new ATOM 0 HD3 LYS A 73 4.762 -13.347 -16.288 1.00 10.00 H new ATOM 0 HE2 LYS A 73 5.894 -13.906 -14.218 1.00 10.00 H new ATOM 0 HE3 LYS A 73 4.262 -14.542 -14.161 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 6.007 -16.061 -13.329 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 5.050 -16.724 -14.565 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 6.621 -16.177 -14.907 1.00 10.00 H new ATOM 1150 N TYR A 74 2.083 -16.892 -13.602 1.00 10.00 N ATOM 1151 CA TYR A 74 2.593 -17.454 -12.355 1.00 10.00 C ATOM 1152 C TYR A 74 2.221 -18.926 -12.140 1.00 10.00 C ATOM 1153 O TYR A 74 3.114 -19.732 -11.886 1.00 10.00 O ATOM 1154 CB TYR A 74 2.203 -16.604 -11.147 1.00 10.00 C ATOM 1155 CG TYR A 74 2.910 -17.052 -9.879 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.307 -17.249 -9.872 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.182 -17.271 -8.700 1.00 10.00 C ATOM 1158 CE1 TYR A 74 4.983 -17.600 -8.694 1.00 10.00 C ATOM 1159 CE2 TYR A 74 2.855 -17.592 -7.508 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.254 -17.766 -7.502 1.00 10.00 C ATOM 1161 OH TYR A 74 4.895 -18.097 -6.353 1.00 10.00 O ATOM 0 H TYR A 74 1.278 -16.278 -13.481 1.00 10.00 H new ATOM 0 HA TYR A 74 3.678 -17.430 -12.453 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.444 -15.560 -11.346 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.125 -16.659 -10.999 1.00 10.00 H new ATOM 0 HD1 TYR A 74 4.865 -17.128 -10.789 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.105 -17.193 -8.708 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.054 -17.742 -8.702 1.00 10.00 H new ATOM 0 HE2 TYR A 74 2.296 -17.706 -6.591 1.00 10.00 H new ATOM 0 HH TYR A 74 5.805 -17.734 -6.370 1.00 10.00 H new ATOM 1171 N ILE A 75 0.930 -19.281 -12.229 1.00 10.00 N ATOM 1172 CA ILE A 75 0.457 -20.652 -11.978 1.00 10.00 C ATOM 1173 C ILE A 75 -0.428 -21.181 -13.118 1.00 10.00 C ATOM 1174 O ILE A 75 -1.255 -20.441 -13.658 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.221 -20.799 -10.595 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.282 -19.713 -10.311 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.844 -20.840 -9.485 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -2.050 -19.956 -9.008 1.00 10.00 C ATOM 0 H ILE A 75 0.186 -18.628 -12.476 1.00 10.00 H new ATOM 0 HA ILE A 75 1.345 -21.283 -11.954 1.00 10.00 H new ATOM 0 HB ILE A 75 -0.764 -21.744 -10.609 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.794 -18.739 -10.263 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.987 -19.676 -11.141 1.00 10.00 H new ATOM 0 HG21 ILE A 75 0.356 -20.944 -8.516 1.00 10.00 H new ATOM 0 HG22 ILE A 75 1.508 -21.688 -9.649 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.423 -19.917 -9.502 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -2.781 -19.161 -8.863 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -2.564 -20.916 -9.062 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -1.352 -19.965 -8.171 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.269 -22.469 -13.497 1.00 10.00 N ATOM 1191 CA PRO A 76 -0.869 -23.019 -14.705 1.00 10.00 C ATOM 1192 C PRO A 76 -2.388 -23.153 -14.577 1.00 10.00 C ATOM 1193 O PRO A 76 -2.913 -23.429 -13.498 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.203 -24.384 -14.912 1.00 10.00 C ATOM 1195 CG PRO A 76 0.148 -24.815 -13.491 1.00 10.00 C ATOM 1196 CD PRO A 76 0.525 -23.492 -12.828 1.00 10.00 C ATOM 0 HA PRO A 76 -0.709 -22.360 -15.558 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -0.877 -25.093 -15.394 1.00 10.00 H new ATOM 0 HB3 PRO A 76 0.684 -24.309 -15.541 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.695 -25.293 -12.992 1.00 10.00 H new ATOM 0 HG3 PRO A 76 0.973 -25.527 -13.475 1.00 10.00 H new ATOM 0 HD2 PRO A 76 0.311 -23.516 -11.759 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.591 -23.291 -12.935 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.090 -22.972 -15.700 1.00 10.00 N ATOM 1205 CA GLY A 77 -4.537 -23.149 -15.818 1.00 10.00 C ATOM 1206 C GLY A 77 -5.392 -22.267 -14.901 1.00 10.00 C ATOM 1207 O GLY A 77 -6.592 -22.511 -14.795 1.00 10.00 O ATOM 0 H GLY A 77 -2.652 -22.690 -16.577 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -4.825 -22.954 -16.851 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -4.775 -24.193 -15.612 1.00 10.00 H new ATOM 1211 N THR A 78 -4.827 -21.261 -14.226 1.00 10.00 N ATOM 1212 CA THR A 78 -5.589 -20.320 -13.402 1.00 10.00 C ATOM 1213 C THR A 78 -6.415 -19.380 -14.289 1.00 10.00 C ATOM 1214 O THR A 78 -5.933 -18.916 -15.327 1.00 10.00 O ATOM 1215 CB THR A 78 -4.631 -19.592 -12.437 1.00 10.00 C ATOM 1216 OG1 THR A 78 -5.182 -19.574 -11.141 1.00 10.00 O ATOM 1217 CG2 THR A 78 -4.250 -18.161 -12.808 1.00 10.00 C ATOM 0 H THR A 78 -3.824 -21.077 -14.236 1.00 10.00 H new ATOM 0 HA THR A 78 -6.313 -20.851 -12.784 1.00 10.00 H new ATOM 0 HB THR A 78 -3.709 -20.170 -12.499 1.00 10.00 H new ATOM 0 HG1 THR A 78 -4.569 -19.112 -10.531 1.00 10.00 H new ATOM 0 HG21 THR A 78 -3.574 -17.757 -12.054 1.00 10.00 H new ATOM 0 HG22 THR A 78 -3.755 -18.156 -13.779 1.00 10.00 H new ATOM 0 HG23 THR A 78 -5.149 -17.546 -12.856 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.660 -19.086 -13.896 1.00 10.00 N ATOM 1226 CA LYS A 79 -8.521 -18.182 -14.661 1.00 10.00 C ATOM 1227 C LYS A 79 -8.285 -16.717 -14.319 1.00 10.00 C ATOM 1228 O LYS A 79 -7.935 -15.975 -15.235 1.00 10.00 O ATOM 1229 CB LYS A 79 -10.007 -18.578 -14.566 1.00 10.00 C ATOM 1230 CG LYS A 79 -10.470 -19.059 -15.950 1.00 10.00 C ATOM 1231 CD LYS A 79 -11.982 -19.292 -16.059 1.00 10.00 C ATOM 1232 CE LYS A 79 -12.376 -19.664 -17.499 1.00 10.00 C ATOM 1233 NZ LYS A 79 -12.232 -18.523 -18.444 1.00 10.00 N ATOM 0 H LYS A 79 -8.092 -19.462 -13.052 1.00 10.00 H new ATOM 0 HA LYS A 79 -8.235 -18.295 -15.707 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -10.143 -19.366 -13.826 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.606 -17.728 -14.240 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -10.172 -18.323 -16.697 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -9.952 -19.987 -16.192 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -12.282 -20.089 -15.378 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -12.516 -18.393 -15.752 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -11.756 -20.493 -17.839 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -13.409 -20.013 -17.511 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -13.087 -18.449 -19.031 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -12.103 -17.642 -17.907 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -11.405 -18.680 -19.055 1.00 10.00 H new ATOM 1247 N MET A 80 -8.505 -16.316 -13.057 1.00 10.00 N ATOM 1248 CA MET A 80 -8.578 -14.940 -12.524 1.00 10.00 C ATOM 1249 C MET A 80 -8.585 -13.847 -13.606 1.00 10.00 C ATOM 1250 O MET A 80 -7.548 -13.287 -13.979 1.00 10.00 O ATOM 1251 CB MET A 80 -7.487 -14.729 -11.460 1.00 10.00 C ATOM 1252 CG MET A 80 -7.506 -13.294 -10.915 1.00 10.00 C ATOM 1253 SD MET A 80 -6.744 -13.080 -9.296 1.00 10.00 S ATOM 1254 CE MET A 80 -6.282 -11.338 -9.415 1.00 10.00 C ATOM 0 H MET A 80 -8.649 -17.003 -12.317 1.00 10.00 H new ATOM 0 HA MET A 80 -9.550 -14.832 -12.043 1.00 10.00 H new ATOM 0 HB2 MET A 80 -7.635 -15.433 -10.641 1.00 10.00 H new ATOM 0 HB3 MET A 80 -6.509 -14.943 -11.892 1.00 10.00 H new ATOM 0 HG2 MET A 80 -6.997 -12.645 -11.627 1.00 10.00 H new ATOM 0 HG3 MET A 80 -8.541 -12.957 -10.859 1.00 10.00 H new ATOM 0 HE1 MET A 80 -6.093 -10.943 -8.417 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.381 -11.241 -10.020 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.093 -10.777 -9.880 1.00 10.00 H new ATOM 1264 N ILE A 81 -9.784 -13.595 -14.143 1.00 10.00 N ATOM 1265 CA ILE A 81 -10.028 -12.736 -15.305 1.00 10.00 C ATOM 1266 C ILE A 81 -9.852 -11.259 -14.911 1.00 10.00 C ATOM 1267 O ILE A 81 -10.819 -10.517 -14.757 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.406 -13.039 -15.953 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -11.646 -14.563 -16.115 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -11.482 -12.333 -17.323 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -12.989 -14.937 -16.754 1.00 10.00 C ATOM 0 H ILE A 81 -10.641 -13.999 -13.766 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.288 -12.954 -16.075 1.00 10.00 H new ATOM 0 HB ILE A 81 -12.189 -12.662 -15.295 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -10.842 -14.981 -16.721 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -11.583 -15.033 -15.134 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -12.447 -12.540 -17.786 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -11.369 -11.258 -17.185 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -10.684 -12.702 -17.967 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -13.068 -16.022 -16.826 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -13.804 -14.554 -16.139 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -13.051 -14.501 -17.751 1.00 10.00 H new ATOM 1283 N PHE A 82 -8.592 -10.849 -14.733 1.00 10.00 N ATOM 1284 CA PHE A 82 -8.222 -9.503 -14.306 1.00 10.00 C ATOM 1285 C PHE A 82 -6.747 -9.176 -14.573 1.00 10.00 C ATOM 1286 O PHE A 82 -6.471 -8.179 -15.227 1.00 10.00 O ATOM 1287 CB PHE A 82 -8.553 -9.317 -12.814 1.00 10.00 C ATOM 1288 CG PHE A 82 -8.731 -7.873 -12.417 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -9.637 -7.050 -13.112 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -8.017 -7.364 -11.319 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -9.773 -5.696 -12.763 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -8.179 -6.017 -10.951 1.00 10.00 C ATOM 1293 CZ PHE A 82 -9.029 -5.176 -11.696 1.00 10.00 C ATOM 0 H PHE A 82 -7.788 -11.458 -14.886 1.00 10.00 H new ATOM 0 HA PHE A 82 -8.808 -8.804 -14.903 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.465 -9.866 -12.580 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -7.755 -9.755 -12.215 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -10.230 -7.461 -13.916 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -7.348 -8.003 -10.762 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -10.448 -5.059 -13.315 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -7.650 -5.626 -10.094 1.00 10.00 H new ATOM 0 HZ PHE A 82 -9.107 -4.129 -11.444 1.00 10.00 H new ATOM 1303 N ALA A 83 -5.824 -10.036 -14.117 1.00 10.00 N ATOM 1304 CA ALA A 83 -4.376 -10.008 -14.375 1.00 10.00 C ATOM 1305 C ALA A 83 -3.707 -8.610 -14.365 1.00 10.00 C ATOM 1306 O ALA A 83 -3.445 -8.033 -15.421 1.00 10.00 O ATOM 1307 CB ALA A 83 -4.111 -10.783 -15.677 1.00 10.00 C ATOM 0 H ALA A 83 -6.086 -10.820 -13.520 1.00 10.00 H new ATOM 0 HA ALA A 83 -3.891 -10.492 -13.527 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -3.043 -10.778 -15.892 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -4.454 -11.812 -15.564 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -4.649 -10.309 -16.498 1.00 10.00 H new ATOM 1313 N GLY A 84 -3.367 -8.106 -13.169 1.00 10.00 N ATOM 1314 CA GLY A 84 -2.762 -6.785 -12.974 1.00 10.00 C ATOM 1315 C GLY A 84 -3.786 -5.758 -12.483 1.00 10.00 C ATOM 1316 O GLY A 84 -4.607 -5.277 -13.259 1.00 10.00 O ATOM 0 H GLY A 84 -3.508 -8.616 -12.297 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -1.948 -6.861 -12.253 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -2.325 -6.443 -13.912 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.733 -5.394 -11.193 1.00 10.00 N ATOM 1321 CA ILE A 85 -4.747 -4.540 -10.545 1.00 10.00 C ATOM 1322 C ILE A 85 -4.819 -3.134 -11.169 1.00 10.00 C ATOM 1323 O ILE A 85 -5.916 -2.655 -11.482 1.00 10.00 O ATOM 1324 CB ILE A 85 -4.520 -4.489 -9.008 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -5.525 -3.512 -8.370 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -3.089 -4.114 -8.588 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -5.620 -3.515 -6.844 1.00 10.00 C ATOM 0 H ILE A 85 -2.983 -5.684 -10.565 1.00 10.00 H new ATOM 0 HA ILE A 85 -5.721 -4.995 -10.724 1.00 10.00 H new ATOM 0 HB ILE A 85 -4.679 -5.505 -8.646 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -5.268 -2.503 -8.692 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -6.514 -3.732 -8.772 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -3.020 -4.102 -7.500 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -2.389 -4.847 -8.988 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.842 -3.126 -8.978 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -6.362 -2.784 -6.524 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -5.915 -4.506 -6.500 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -4.650 -3.257 -6.419 1.00 10.00 H new ATOM 1339 N LYS A 86 -3.648 -2.496 -11.283 1.00 10.00 N ATOM 1340 CA LYS A 86 -3.221 -1.354 -12.100 1.00 10.00 C ATOM 1341 C LYS A 86 -1.936 -0.758 -11.507 1.00 10.00 C ATOM 1342 O LYS A 86 -1.494 -1.158 -10.429 1.00 10.00 O ATOM 1343 CB LYS A 86 -4.311 -0.281 -12.290 1.00 10.00 C ATOM 1344 CG LYS A 86 -5.011 -0.357 -13.654 1.00 10.00 C ATOM 1345 CD LYS A 86 -5.711 0.983 -13.882 1.00 10.00 C ATOM 1346 CE LYS A 86 -6.554 1.020 -15.158 1.00 10.00 C ATOM 1347 NZ LYS A 86 -7.253 2.323 -15.252 1.00 10.00 N ATOM 0 H LYS A 86 -2.862 -2.819 -10.719 1.00 10.00 H new ATOM 0 HA LYS A 86 -3.023 -1.729 -13.104 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -5.056 -0.387 -11.501 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -3.863 0.706 -12.175 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -4.288 -0.553 -14.446 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -5.732 -1.175 -13.671 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -6.351 1.200 -13.027 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -4.961 1.773 -13.928 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -5.918 0.873 -16.031 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -7.279 0.206 -15.151 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -7.826 2.348 -16.120 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -7.872 2.446 -14.425 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -6.553 3.092 -15.278 1.00 10.00 H new ATOM 1361 N LYS A 87 -1.365 0.224 -12.219 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.217 1.060 -11.846 1.00 10.00 C ATOM 1363 C LYS A 87 0.919 0.238 -11.211 1.00 10.00 C ATOM 1364 O LYS A 87 1.734 -0.338 -11.924 1.00 10.00 O ATOM 1365 CB LYS A 87 -0.691 2.263 -10.982 1.00 10.00 C ATOM 1366 CG LYS A 87 -1.872 3.117 -11.488 1.00 10.00 C ATOM 1367 CD LYS A 87 -1.615 3.989 -12.718 1.00 10.00 C ATOM 1368 CE LYS A 87 -1.583 3.175 -14.014 1.00 10.00 C ATOM 1369 NZ LYS A 87 -1.310 4.046 -15.176 1.00 10.00 N ATOM 0 H LYS A 87 -1.722 0.473 -13.142 1.00 10.00 H new ATOM 0 HA LYS A 87 0.225 1.478 -12.751 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -0.959 1.878 -9.998 1.00 10.00 H new ATOM 0 HB3 LYS A 87 0.162 2.927 -10.843 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -2.703 2.448 -11.713 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -2.196 3.765 -10.674 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -2.392 4.750 -12.789 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -0.666 4.512 -12.597 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -0.816 2.403 -13.945 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -2.537 2.666 -14.152 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -1.293 3.472 -16.043 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -2.056 4.767 -15.252 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -0.389 4.513 -15.051 1.00 10.00 H new ATOM 1383 N LYS A 88 0.980 0.243 -9.876 1.00 10.00 N ATOM 1384 CA LYS A 88 1.840 -0.533 -8.974 1.00 10.00 C ATOM 1385 C LYS A 88 1.389 -0.318 -7.526 1.00 10.00 C ATOM 1386 O LYS A 88 1.116 -1.273 -6.803 1.00 10.00 O ATOM 1387 CB LYS A 88 3.351 -0.244 -9.167 1.00 10.00 C ATOM 1388 CG LYS A 88 3.843 1.223 -9.259 1.00 10.00 C ATOM 1389 CD LYS A 88 3.703 1.848 -10.659 1.00 10.00 C ATOM 1390 CE LYS A 88 4.535 3.122 -10.822 1.00 10.00 C ATOM 1391 NZ LYS A 88 4.472 3.619 -12.218 1.00 10.00 N ATOM 0 H LYS A 88 0.363 0.856 -9.343 1.00 10.00 H new ATOM 0 HA LYS A 88 1.724 -1.587 -9.228 1.00 10.00 H new ATOM 0 HB2 LYS A 88 3.882 -0.715 -8.340 1.00 10.00 H new ATOM 0 HB3 LYS A 88 3.667 -0.752 -10.078 1.00 10.00 H new ATOM 0 HG2 LYS A 88 3.283 1.828 -8.546 1.00 10.00 H new ATOM 0 HG3 LYS A 88 4.890 1.263 -8.958 1.00 10.00 H new ATOM 0 HD2 LYS A 88 4.010 1.120 -11.410 1.00 10.00 H new ATOM 0 HD3 LYS A 88 2.654 2.077 -10.847 1.00 10.00 H new ATOM 0 HE2 LYS A 88 4.169 3.890 -10.141 1.00 10.00 H new ATOM 0 HE3 LYS A 88 5.571 2.922 -10.549 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 5.044 4.484 -12.305 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 4.844 2.892 -12.862 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 3.485 3.830 -12.467 1.00 10.00 H new ATOM 1405 N THR A 89 1.205 0.949 -7.141 1.00 10.00 N ATOM 1406 CA THR A 89 0.821 1.413 -5.802 1.00 10.00 C ATOM 1407 C THR A 89 -0.388 0.674 -5.250 1.00 10.00 C ATOM 1408 O THR A 89 -0.336 0.200 -4.124 1.00 10.00 O ATOM 1409 CB THR A 89 0.556 2.927 -5.816 1.00 10.00 C ATOM 1410 OG1 THR A 89 1.545 3.581 -6.589 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.593 3.536 -4.415 1.00 10.00 C ATOM 0 H THR A 89 1.327 1.724 -7.793 1.00 10.00 H new ATOM 0 HA THR A 89 1.659 1.196 -5.140 1.00 10.00 H new ATOM 0 HB THR A 89 -0.439 3.065 -6.238 1.00 10.00 H new ATOM 0 HG1 THR A 89 1.370 4.545 -6.596 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.400 4.607 -4.479 1.00 10.00 H new ATOM 0 HG22 THR A 89 -0.170 3.066 -3.794 1.00 10.00 H new ATOM 0 HG23 THR A 89 1.575 3.370 -3.972 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.445 0.514 -6.053 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.661 -0.207 -5.675 1.00 10.00 C ATOM 1421 C GLU A 90 -2.368 -1.650 -5.245 1.00 10.00 C ATOM 1422 O GLU A 90 -3.014 -2.156 -4.332 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.634 -0.240 -6.864 1.00 10.00 C ATOM 1424 CG GLU A 90 -4.115 1.131 -7.361 1.00 10.00 C ATOM 1425 CD GLU A 90 -4.731 0.999 -8.759 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -5.844 0.430 -8.886 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -4.060 1.435 -9.717 1.00 10.00 O ATOM 0 H GLU A 90 -1.478 0.889 -7.001 1.00 10.00 H new ATOM 0 HA GLU A 90 -3.099 0.322 -4.828 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -3.151 -0.759 -7.692 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.505 -0.831 -6.582 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -4.851 1.540 -6.668 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -3.279 1.830 -7.388 1.00 10.00 H new ATOM 1434 N ARG A 91 -1.393 -2.322 -5.878 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.970 -3.670 -5.483 1.00 10.00 C ATOM 1436 C ARG A 91 -0.158 -3.633 -4.185 1.00 10.00 C ATOM 1437 O ARG A 91 -0.390 -4.468 -3.315 1.00 10.00 O ATOM 1438 CB ARG A 91 -0.238 -4.392 -6.632 1.00 10.00 C ATOM 1439 CG ARG A 91 -0.478 -5.924 -6.614 1.00 10.00 C ATOM 1440 CD ARG A 91 0.736 -6.840 -6.392 1.00 10.00 C ATOM 1441 NE ARG A 91 1.523 -6.482 -5.205 1.00 10.00 N ATOM 1442 CZ ARG A 91 2.581 -5.682 -5.163 1.00 10.00 C ATOM 1443 NH1 ARG A 91 3.105 -5.103 -6.224 1.00 10.00 N ATOM 1444 NH2 ARG A 91 3.108 -5.430 -3.990 1.00 10.00 N ATOM 0 H ARG A 91 -0.879 -1.946 -6.675 1.00 10.00 H new ATOM 0 HA ARG A 91 -1.862 -4.261 -5.275 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -0.574 -3.985 -7.586 1.00 10.00 H new ATOM 0 HB3 ARG A 91 0.831 -4.193 -6.560 1.00 10.00 H new ATOM 0 HG2 ARG A 91 -1.206 -6.139 -5.832 1.00 10.00 H new ATOM 0 HG3 ARG A 91 -0.937 -6.202 -7.563 1.00 10.00 H new ATOM 0 HD2 ARG A 91 0.393 -7.870 -6.295 1.00 10.00 H new ATOM 0 HD3 ARG A 91 1.379 -6.800 -7.271 1.00 10.00 H new ATOM 0 HE ARG A 91 1.225 -6.891 -4.320 1.00 10.00 H new ATOM 0 HH11 ARG A 91 2.696 -5.260 -7.145 1.00 10.00 H new ATOM 0 HH12 ARG A 91 3.920 -4.498 -6.124 1.00 10.00 H new ATOM 0 HH21 ARG A 91 2.704 -5.844 -3.150 1.00 10.00 H new ATOM 0 HH22 ARG A 91 3.922 -4.820 -3.917 1.00 10.00 H new ATOM 1458 N GLU A 92 0.740 -2.651 -4.014 1.00 10.00 N ATOM 1459 CA GLU A 92 1.430 -2.395 -2.734 1.00 10.00 C ATOM 1460 C GLU A 92 0.435 -2.164 -1.577 1.00 10.00 C ATOM 1461 O GLU A 92 0.570 -2.762 -0.508 1.00 10.00 O ATOM 1462 CB GLU A 92 2.420 -1.211 -2.835 1.00 10.00 C ATOM 1463 CG GLU A 92 3.386 -1.185 -4.036 1.00 10.00 C ATOM 1464 CD GLU A 92 4.124 -2.505 -4.282 1.00 10.00 C ATOM 1465 OE1 GLU A 92 4.412 -3.231 -3.306 1.00 10.00 O ATOM 1466 OE2 GLU A 92 4.322 -2.877 -5.460 1.00 10.00 O ATOM 0 H GLU A 92 1.011 -2.009 -4.759 1.00 10.00 H new ATOM 0 HA GLU A 92 2.003 -3.295 -2.512 1.00 10.00 H new ATOM 0 HB2 GLU A 92 1.839 -0.289 -2.852 1.00 10.00 H new ATOM 0 HB3 GLU A 92 3.018 -1.195 -1.924 1.00 10.00 H new ATOM 0 HG2 GLU A 92 2.824 -0.924 -4.933 1.00 10.00 H new ATOM 0 HG3 GLU A 92 4.121 -0.395 -3.879 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.581 -1.319 -1.800 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.693 -1.060 -0.878 1.00 10.00 C ATOM 1475 C ASP A 93 -2.448 -2.345 -0.521 1.00 10.00 C ATOM 1476 O ASP A 93 -2.711 -2.615 0.653 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.662 -0.052 -1.518 1.00 10.00 C ATOM 1478 CG ASP A 93 -2.056 1.321 -1.809 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -1.170 1.738 -1.028 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -2.517 1.969 -2.774 1.00 10.00 O ATOM 0 H ASP A 93 -0.653 -0.777 -2.661 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.278 -0.652 0.044 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -3.039 -0.473 -2.450 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.519 0.077 -0.857 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.755 -3.166 -1.532 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.382 -4.475 -1.372 1.00 10.00 C ATOM 1487 C LEU A 94 -2.609 -5.405 -0.452 1.00 10.00 C ATOM 1488 O LEU A 94 -3.232 -6.018 0.412 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.532 -5.148 -2.743 1.00 10.00 C ATOM 1490 CG LEU A 94 -4.974 -5.425 -3.154 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.798 -4.142 -3.234 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -4.903 -6.075 -4.531 1.00 10.00 C ATOM 0 H LEU A 94 -2.568 -2.929 -2.506 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.354 -4.297 -0.912 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -3.067 -4.514 -3.498 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -2.982 -6.089 -2.734 1.00 10.00 H new ATOM 0 HG LEU A 94 -5.460 -6.064 -2.417 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.819 -4.383 -3.530 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.808 -3.655 -2.259 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -5.356 -3.471 -3.970 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -5.911 -6.298 -4.880 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.419 -5.393 -5.231 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.328 -6.999 -4.468 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.287 -5.521 -0.629 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.471 -6.346 0.264 1.00 10.00 C ATOM 1506 C ILE A 95 -0.543 -5.777 1.674 1.00 10.00 C ATOM 1507 O ILE A 95 -0.804 -6.540 2.597 1.00 10.00 O ATOM 1508 CB ILE A 95 0.985 -6.497 -0.226 1.00 10.00 C ATOM 1509 CG1 ILE A 95 1.068 -7.033 -1.668 1.00 10.00 C ATOM 1510 CG2 ILE A 95 1.799 -7.415 0.709 1.00 10.00 C ATOM 1511 CD1 ILE A 95 0.275 -8.314 -1.972 1.00 10.00 C ATOM 0 H ILE A 95 -0.766 -5.059 -1.374 1.00 10.00 H new ATOM 0 HA ILE A 95 -0.879 -7.357 0.265 1.00 10.00 H new ATOM 0 HB ILE A 95 1.414 -5.495 -0.211 1.00 10.00 H new ATOM 0 HG12 ILE A 95 0.722 -6.250 -2.343 1.00 10.00 H new ATOM 0 HG13 ILE A 95 2.116 -7.217 -1.903 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.820 -7.501 0.336 1.00 10.00 H new ATOM 0 HG22 ILE A 95 1.814 -6.991 1.713 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.340 -8.403 0.739 1.00 10.00 H new ATOM 0 HD11 ILE A 95 0.414 -8.589 -3.018 1.00 10.00 H new ATOM 0 HD12 ILE A 95 0.631 -9.123 -1.334 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -0.784 -8.140 -1.780 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.397 -4.458 1.849 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.477 -3.849 3.177 1.00 10.00 C ATOM 1525 C ALA A 96 -1.819 -4.130 3.876 1.00 10.00 C ATOM 1526 O ALA A 96 -1.835 -4.457 5.063 1.00 10.00 O ATOM 1527 CB ALA A 96 -0.188 -2.348 3.063 1.00 10.00 C ATOM 0 H ALA A 96 -0.224 -3.798 1.091 1.00 10.00 H new ATOM 0 HA ALA A 96 0.280 -4.307 3.813 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -0.247 -1.890 4.050 1.00 10.00 H new ATOM 0 HB2 ALA A 96 0.811 -2.200 2.653 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.923 -1.885 2.404 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.931 -4.068 3.134 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.256 -4.479 3.599 1.00 10.00 C ATOM 1535 C TYR A 97 -4.338 -5.987 3.890 1.00 10.00 C ATOM 1536 O TYR A 97 -4.550 -6.372 5.042 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.305 -3.959 2.598 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.574 -4.773 2.432 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.504 -4.916 3.481 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.807 -5.410 1.202 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.662 -5.699 3.290 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -7.941 -6.215 1.027 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.884 -6.355 2.062 1.00 10.00 C ATOM 1544 OH TYR A 97 -9.988 -7.130 1.879 1.00 10.00 O ATOM 0 H TYR A 97 -2.932 -3.723 2.174 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.469 -4.028 4.568 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.588 -2.951 2.900 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.827 -3.877 1.622 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -7.331 -4.428 4.429 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -6.110 -5.279 0.388 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.382 -5.796 4.089 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.092 -6.732 0.091 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.340 -6.990 0.975 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.159 -6.853 2.885 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.342 -8.303 3.015 1.00 10.00 C ATOM 1556 C LEU A 98 -3.411 -8.923 4.059 1.00 10.00 C ATOM 1557 O LEU A 98 -3.852 -9.769 4.835 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.192 -8.990 1.645 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.366 -8.685 0.694 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.071 -9.161 -0.726 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.669 -9.348 1.152 1.00 10.00 C ATOM 0 H LEU A 98 -3.880 -6.563 1.948 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.357 -8.470 3.376 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.260 -8.666 1.181 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.118 -10.068 1.790 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.486 -7.602 0.710 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -5.919 -8.930 -1.371 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.182 -8.655 -1.102 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -4.901 -10.238 -0.721 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.467 -9.104 0.451 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.534 -10.429 1.187 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -6.934 -8.983 2.144 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.164 -8.446 4.159 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.182 -8.910 5.145 1.00 10.00 C ATOM 1575 C LYS A 99 -1.642 -8.724 6.597 1.00 10.00 C ATOM 1576 O LYS A 99 -1.148 -9.430 7.477 1.00 10.00 O ATOM 1577 CB LYS A 99 0.159 -8.231 4.837 1.00 10.00 C ATOM 1578 CG LYS A 99 1.366 -8.881 5.517 1.00 10.00 C ATOM 1579 CD LYS A 99 2.643 -8.178 5.039 1.00 10.00 C ATOM 1580 CE LYS A 99 3.829 -9.137 5.077 1.00 10.00 C ATOM 1581 NZ LYS A 99 5.040 -8.464 4.555 1.00 10.00 N ATOM 0 H LYS A 99 -1.804 -7.714 3.546 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.065 -9.990 5.055 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.317 -8.238 3.759 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.103 -7.187 5.144 1.00 10.00 H new ATOM 0 HG2 LYS A 99 1.276 -8.803 6.600 1.00 10.00 H new ATOM 0 HG3 LYS A 99 1.408 -9.943 5.276 1.00 10.00 H new ATOM 0 HD2 LYS A 99 2.502 -7.806 4.024 1.00 10.00 H new ATOM 0 HD3 LYS A 99 2.847 -7.313 5.671 1.00 10.00 H new ATOM 0 HE2 LYS A 99 4.002 -9.474 6.099 1.00 10.00 H new ATOM 0 HE3 LYS A 99 3.610 -10.023 4.482 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 5.737 -9.179 4.265 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 4.785 -7.877 3.735 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 5.450 -7.862 5.297 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.661 -7.885 6.841 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.472 -7.912 8.065 1.00 10.00 C ATOM 1597 C LYS A 100 -4.843 -8.567 7.881 1.00 10.00 C ATOM 1598 O LYS A 100 -5.201 -9.377 8.726 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.585 -6.507 8.688 1.00 10.00 C ATOM 1600 CG LYS A 100 -2.492 -6.208 9.738 1.00 10.00 C ATOM 1601 CD LYS A 100 -2.372 -7.223 10.898 1.00 10.00 C ATOM 1602 CE LYS A 100 -3.731 -7.582 11.516 1.00 10.00 C ATOM 1603 NZ LYS A 100 -3.675 -8.790 12.370 1.00 10.00 N ATOM 0 H LYS A 100 -2.947 -7.160 6.184 1.00 10.00 H new ATOM 0 HA LYS A 100 -2.939 -8.554 8.767 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -3.529 -5.761 7.895 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -4.564 -6.403 9.155 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -1.530 -6.154 9.227 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -2.683 -5.222 10.162 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -1.893 -8.131 10.532 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -1.724 -6.810 11.671 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -4.088 -6.740 12.109 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -4.457 -7.741 10.718 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -4.623 -8.994 12.746 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -3.345 -9.599 11.806 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -3.017 -8.627 13.159 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.605 -8.275 6.822 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.983 -8.758 6.671 1.00 10.00 C ATOM 1619 C ALA A 101 -7.151 -10.291 6.635 1.00 10.00 C ATOM 1620 O ALA A 101 -8.219 -10.793 6.971 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.619 -8.100 5.445 1.00 10.00 C ATOM 0 H ALA A 101 -5.285 -7.697 6.045 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.505 -8.462 7.581 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.643 -8.457 5.330 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.624 -7.018 5.575 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -7.044 -8.356 4.555 1.00 10.00 H new ATOM 1627 N THR A 102 -6.103 -11.060 6.304 1.00 10.00 N ATOM 1628 CA THR A 102 -6.148 -12.532 6.430 1.00 10.00 C ATOM 1629 C THR A 102 -6.102 -13.035 7.881 1.00 10.00 C ATOM 1630 O THR A 102 -6.289 -14.228 8.117 1.00 10.00 O ATOM 1631 CB THR A 102 -5.020 -13.232 5.659 1.00 10.00 C ATOM 1632 OG1 THR A 102 -3.749 -13.047 6.248 1.00 10.00 O ATOM 1633 CG2 THR A 102 -4.941 -12.858 4.179 1.00 10.00 C ATOM 0 H THR A 102 -5.219 -10.695 5.950 1.00 10.00 H new ATOM 0 HA THR A 102 -7.114 -12.790 5.996 1.00 10.00 H new ATOM 0 HB THR A 102 -5.294 -14.285 5.721 1.00 10.00 H new ATOM 0 HG1 THR A 102 -3.186 -13.828 6.064 1.00 10.00 H new ATOM 0 HG21 THR A 102 -4.117 -13.397 3.711 1.00 10.00 H new ATOM 0 HG22 THR A 102 -5.876 -13.124 3.686 1.00 10.00 H new ATOM 0 HG23 THR A 102 -4.773 -11.785 4.083 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.817 -12.155 8.846 1.00 10.00 N ATOM 1642 CA ASN A 103 -5.404 -12.480 10.212 1.00 10.00 C ATOM 1643 C ASN A 103 -5.766 -11.356 11.207 1.00 10.00 C ATOM 1644 O ASN A 103 -5.080 -11.188 12.214 1.00 10.00 O ATOM 1645 CB ASN A 103 -3.884 -12.755 10.186 1.00 10.00 C ATOM 1646 CG ASN A 103 -3.056 -11.559 9.725 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -2.698 -10.680 10.504 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -2.716 -11.499 8.450 1.00 10.00 N ATOM 0 H ASN A 103 -5.871 -11.149 8.687 1.00 10.00 H new ATOM 0 HA ASN A 103 -5.939 -13.363 10.562 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -3.559 -13.049 11.184 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -3.687 -13.599 9.525 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -2.153 -10.720 8.108 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -3.016 -12.232 7.807 1.00 10.00 H new ATOM 1655 N GLU A 104 -6.784 -10.547 10.879 1.00 10.00 N ATOM 1656 CA GLU A 104 -7.043 -9.205 11.424 1.00 10.00 C ATOM 1657 C GLU A 104 -7.119 -9.124 12.954 1.00 10.00 C ATOM 1658 O GLU A 104 -8.132 -9.552 13.545 1.00 10.00 O ATOM 1659 CB GLU A 104 -8.203 -8.510 10.682 1.00 10.00 C ATOM 1660 CG GLU A 104 -9.428 -9.377 10.324 1.00 10.00 C ATOM 1661 CD GLU A 104 -10.425 -8.618 9.428 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -9.975 -8.040 8.410 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -11.635 -8.639 9.754 1.00 10.00 O ATOM 1664 OXT GLU A 104 -6.105 -8.620 13.497 1.00 10.00 O ATOM 0 H GLU A 104 -7.485 -10.824 10.192 1.00 10.00 H new ATOM 0 HA GLU A 104 -6.147 -8.620 11.215 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -8.546 -7.677 11.295 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -7.808 -8.085 9.759 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -9.096 -10.281 9.814 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -9.929 -9.693 11.239 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -8.836 -13.052 -7.603 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -7.968 -16.307 -6.871 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.818 -11.967 -5.131 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.518 -9.878 -8.507 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.150 -14.180 -9.810 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.612 -13.956 -6.294 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.362 -15.308 -6.120 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.357 -15.511 -5.074 1.00 10.00 C HETATM 1680 C3A HEC A 105 -5.920 -14.279 -4.722 1.00 10.00 C HETATM 1681 C4A HEC A 105 -6.793 -13.323 -5.387 1.00 10.00 C HETATM 1682 CMA HEC A 105 -4.746 -13.958 -3.820 1.00 10.00 C HETATM 1683 CAA HEC A 105 -5.841 -16.832 -4.534 1.00 10.00 C HETATM 1684 CBA HEC A 105 -6.923 -17.677 -3.832 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.453 -18.979 -3.193 1.00 10.00 C HETATM 1686 O1A HEC A 105 -6.046 -19.870 -3.973 1.00 10.00 O HETATM 1687 O2A HEC A 105 -6.481 -19.066 -1.944 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.360 -11.290 -6.901 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.544 -11.021 -5.834 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.461 -9.593 -5.591 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.161 -8.980 -6.592 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.710 -10.055 -7.402 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.649 -8.985 -4.470 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.334 -7.487 -6.888 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.108 -6.903 -7.586 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.157 -12.212 -8.783 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.260 -10.877 -9.095 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.371 -10.621 -9.988 1.00 10.00 C HETATM 1699 C3C HEC A 105 -11.963 -11.823 -10.202 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.100 -12.818 -9.575 1.00 10.00 C HETATM 1701 CMC HEC A 105 -11.830 -9.244 -10.425 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.285 -12.104 -10.892 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.208 -11.970 -12.419 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.467 -14.867 -8.172 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.348 -15.128 -9.202 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.343 -16.541 -9.559 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.583 -17.169 -8.628 1.00 10.00 C HETATM 1708 C4D HEC A 105 -8.956 -16.109 -7.829 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.091 -17.175 -10.720 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.399 -18.674 -8.471 1.00 10.00 C HETATM 1711 CBD HEC A 105 -8.140 -19.262 -9.127 1.00 10.00 C HETATM 1712 CGD HEC A 105 -8.126 -19.122 -10.649 1.00 10.00 C HETATM 1713 O1D HEC A 105 -8.772 -19.946 -11.331 1.00 10.00 O HETATM 1714 O2D HEC A 105 -7.412 -18.218 -11.132 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.161 -17.002 -10.601 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -10.753 -16.731 -11.656 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -10.896 -18.247 -10.736 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.120 -8.662 -9.550 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -11.017 -8.737 -10.944 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -12.684 -9.341 -11.096 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -7.013 -9.359 -3.513 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.601 -9.257 -4.591 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.747 -7.900 -4.497 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -4.914 -14.393 -2.835 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -3.834 -14.373 -4.249 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -4.644 -12.877 -3.726 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.260 -18.767 -8.716 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -8.063 -20.317 -8.866 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -12.909 -10.955 -12.681 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -12.475 -12.676 -12.810 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -14.185 -12.183 -12.853 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.233 -7.026 -6.948 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -6.945 -7.423 -8.530 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.270 -5.842 -7.779 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -7.388 -17.065 -3.059 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.699 -17.914 -4.560 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.376 -18.910 -7.407 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.272 -19.174 -8.890 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.417 -17.410 -5.355 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -5.032 -16.636 -3.831 1.00 10.00 H new HETATM 0 HHD HEC A 105 -11.882 -14.536 -10.535 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.572 -8.880 -8.943 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.211 -11.608 -4.300 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.642 -17.332 -6.695 1.00 10.00 H new HETATM 0 H2D HEC A 105 -6.467 -18.434 -10.986 1.00 10.00 H new HETATM 0 H2A HEC A 105 -7.362 -18.789 -1.616 1.00 10.00 H new