USER MOD reduce.3.24.130724 H: found=0, std=0, add=947, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 947 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 20 ASN : amide:sc= -2.96! C(o=-4.1!,f=-5.9!) USER MOD Set 1.2: A 111 SER OG : rot 169:sc= -1.1 USER MOD Single : A 1 MET CE :methyl -134:sc= 0 (180deg=-0.506) USER MOD Single : A 1 MET N :NH3+ 145:sc= 0.095 (180deg=0) USER MOD Single : A 6 SER OG : rot 82:sc= -0.548 USER MOD Single : A 8 SER OG : rot -61:sc= 1.32 USER MOD Single : A 12 LYS NZ :NH3+ -166:sc= 0.924 (180deg=0.654) USER MOD Single : A 14 LYS NZ :NH3+ -179:sc= 1.29 (180deg=1.27) USER MOD Single : A 19 SER OG : rot 85:sc= 0.898 USER MOD Single : A 21 LYS NZ :NH3+ -140:sc= 1.22 (180deg=0.137) USER MOD Single : A 22 ASN : amide:sc= -0.0416 X(o=-0.042,f=-0.042) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -129:sc= 0.0368 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 117:sc= 1.01 USER MOD Single : A 29 THR OG1 : rot 104:sc= 1.41 USER MOD Single : A 33 SER OG : rot 81:sc= 1.26 USER MOD Single : A 37 LYS NZ :NH3+ -133:sc= -0.523 (180deg=-2.48!) USER MOD Single : A 38 SER OG : rot 87:sc= 1.2 USER MOD Single : A 44 SER OG : rot 138:sc= 1.21 USER MOD Single : A 56 SER OG : rot -170:sc= 0.00627 USER MOD Single : A 57 HIS : no HE2:sc= 1.13 K(o=1.1,f=-4.3!) USER MOD Single : A 58 LYS NZ :NH3+ -169:sc=-0.00766 (180deg=-0.12) USER MOD Single : A 61 LYS NZ :NH3+ -160:sc= -0.148 (180deg=-0.584) USER MOD Single : A 64 ASN : amide:sc= 0.44 X(o=0.44,f=0) USER MOD Single : A 67 GLN : amide:sc= -0.134 K(o=-0.13,f=-0.88) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 74:sc= 0.0337 USER MOD Single : A 74 MET CE :methyl 157:sc= -1.95! (180deg=-3.71!) USER MOD Single : A 80 ASN : amide:sc= -1.82! K(o=-1.8!,f=-0.043) USER MOD Single : A 88 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0134) USER MOD Single : A 92 ASN : amide:sc= -4.84! C(o=-4.8!,f=-2.3!) USER MOD Single : A 93 LYS NZ :NH3+ 170:sc= 1.26 (180deg=0.969) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.412 X(o=-0.41,f=0) USER MOD Single : A 110 SER OG : rot 93:sc= 1.29 USER MOD Single : A 114 HIS : no HD1:sc= -0.298 X(o=-0.3,f=-0.54) USER MOD Single : A 115 HIS : no HE2:sc= 0.838 K(o=0.84,f=-3.1!) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=-0.0021) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=0) USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.919 -11.039 -10.254 1.00 0.00 N ATOM 2 CA MET A 1 0.673 -11.218 -8.831 1.00 0.00 C ATOM 3 C MET A 1 -0.510 -10.352 -8.449 1.00 0.00 C ATOM 4 O MET A 1 -0.699 -9.262 -9.021 1.00 0.00 O ATOM 5 CB MET A 1 1.921 -10.812 -8.018 1.00 0.00 C ATOM 6 CG MET A 1 1.816 -11.071 -6.518 1.00 0.00 C ATOM 7 SD MET A 1 3.294 -10.570 -5.613 1.00 0.00 S ATOM 8 CE MET A 1 2.873 -11.129 -3.963 1.00 0.00 C ATOM 0 H1 MET A 1 1.942 -11.085 -10.438 1.00 0.00 H new ATOM 0 H2 MET A 1 0.437 -11.791 -10.787 1.00 0.00 H new ATOM 0 H3 MET A 1 0.554 -10.113 -10.556 1.00 0.00 H new ATOM 0 HA MET A 1 0.458 -12.264 -8.613 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.783 -11.353 -8.407 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.112 -9.751 -8.177 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.954 -10.534 -6.121 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.636 -12.133 -6.350 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.104 -10.344 -3.243 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.809 -11.362 -3.918 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.450 -12.022 -3.723 1.00 0.00 H new ATOM 20 N PHE A 2 -1.310 -10.821 -7.519 1.00 0.00 N ATOM 21 CA PHE A 2 -2.460 -10.077 -7.069 1.00 0.00 C ATOM 22 C PHE A 2 -2.056 -9.140 -5.941 1.00 0.00 C ATOM 23 O PHE A 2 -1.083 -9.401 -5.217 1.00 0.00 O ATOM 24 CB PHE A 2 -3.570 -11.016 -6.560 1.00 0.00 C ATOM 25 CG PHE A 2 -4.102 -12.005 -7.562 1.00 0.00 C ATOM 26 CD1 PHE A 2 -4.876 -11.584 -8.627 1.00 0.00 C ATOM 27 CD2 PHE A 2 -3.830 -13.359 -7.431 1.00 0.00 C ATOM 28 CE1 PHE A 2 -5.369 -12.491 -9.542 1.00 0.00 C ATOM 29 CE2 PHE A 2 -4.321 -14.269 -8.341 1.00 0.00 C ATOM 30 CZ PHE A 2 -5.092 -13.835 -9.399 1.00 0.00 C ATOM 0 H PHE A 2 -1.182 -11.722 -7.057 1.00 0.00 H new ATOM 0 HA PHE A 2 -2.842 -9.508 -7.917 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -3.188 -11.568 -5.701 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.400 -10.406 -6.203 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -5.097 -10.533 -8.744 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -3.226 -13.704 -6.605 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -5.972 -12.149 -10.370 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -4.103 -15.320 -8.226 1.00 0.00 H new ATOM 0 HZ PHE A 2 -5.478 -14.546 -10.114 1.00 0.00 H new ATOM 40 N ALA A 3 -2.778 -8.070 -5.805 1.00 0.00 N ATOM 41 CA ALA A 3 -2.584 -7.127 -4.736 1.00 0.00 C ATOM 42 C ALA A 3 -3.930 -6.826 -4.124 1.00 0.00 C ATOM 43 O ALA A 3 -4.772 -6.193 -4.746 1.00 0.00 O ATOM 44 CB ALA A 3 -1.925 -5.852 -5.244 1.00 0.00 C ATOM 0 H ALA A 3 -3.533 -7.819 -6.443 1.00 0.00 H new ATOM 0 HA ALA A 3 -1.919 -7.554 -3.985 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -1.790 -5.157 -4.415 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -0.954 -6.092 -5.678 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.558 -5.393 -6.003 1.00 0.00 H new ATOM 50 N VAL A 4 -4.139 -7.292 -2.933 1.00 0.00 N ATOM 51 CA VAL A 4 -5.409 -7.135 -2.276 1.00 0.00 C ATOM 52 C VAL A 4 -5.379 -5.877 -1.437 1.00 0.00 C ATOM 53 O VAL A 4 -4.442 -5.647 -0.654 1.00 0.00 O ATOM 54 CB VAL A 4 -5.764 -8.367 -1.388 1.00 0.00 C ATOM 55 CG1 VAL A 4 -7.135 -8.203 -0.734 1.00 0.00 C ATOM 56 CG2 VAL A 4 -5.728 -9.649 -2.207 1.00 0.00 C ATOM 0 H VAL A 4 -3.439 -7.792 -2.385 1.00 0.00 H new ATOM 0 HA VAL A 4 -6.182 -7.058 -3.040 1.00 0.00 H new ATOM 0 HB VAL A 4 -5.014 -8.431 -0.599 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -7.353 -9.078 -0.122 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.134 -7.312 -0.106 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -7.897 -8.102 -1.507 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.979 -10.496 -1.568 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -6.451 -9.582 -3.020 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.729 -9.789 -2.620 1.00 0.00 H new ATOM 66 N ILE A 5 -6.360 -5.060 -1.629 1.00 0.00 N ATOM 67 CA ILE A 5 -6.468 -3.825 -0.923 1.00 0.00 C ATOM 68 C ILE A 5 -7.291 -4.046 0.339 1.00 0.00 C ATOM 69 O ILE A 5 -8.412 -4.548 0.270 1.00 0.00 O ATOM 70 CB ILE A 5 -7.167 -2.757 -1.800 1.00 0.00 C ATOM 71 CG1 ILE A 5 -6.457 -2.640 -3.163 1.00 0.00 C ATOM 72 CG2 ILE A 5 -7.156 -1.414 -1.084 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.144 -1.711 -4.146 1.00 0.00 C ATOM 0 H ILE A 5 -7.119 -5.232 -2.288 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.468 -3.474 -0.669 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.200 -3.059 -1.971 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.438 -2.289 -3.000 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.385 -3.632 -3.608 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.649 -0.666 -1.705 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.685 -1.503 -0.135 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.126 -1.109 -0.898 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.580 -1.686 -5.078 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -8.154 -2.071 -4.342 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.193 -0.707 -3.725 1.00 0.00 H new ATOM 85 N SER A 6 -6.733 -3.722 1.478 1.00 0.00 N ATOM 86 CA SER A 6 -7.473 -3.818 2.704 1.00 0.00 C ATOM 87 C SER A 6 -8.298 -2.544 2.880 1.00 0.00 C ATOM 88 O SER A 6 -7.873 -1.473 2.425 1.00 0.00 O ATOM 89 CB SER A 6 -6.519 -3.996 3.880 1.00 0.00 C ATOM 90 OG SER A 6 -5.692 -5.106 3.668 1.00 0.00 O ATOM 0 H SER A 6 -5.773 -3.391 1.579 1.00 0.00 H new ATOM 0 HA SER A 6 -8.136 -4.682 2.668 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.912 -3.099 4.004 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.086 -4.127 4.801 1.00 0.00 H new ATOM 0 HG SER A 6 -4.942 -4.850 3.092 1.00 0.00 H new ATOM 96 N PRO A 7 -9.491 -2.634 3.530 1.00 0.00 N ATOM 97 CA PRO A 7 -10.385 -1.477 3.796 1.00 0.00 C ATOM 98 C PRO A 7 -9.708 -0.292 4.509 1.00 0.00 C ATOM 99 O PRO A 7 -10.288 0.784 4.627 1.00 0.00 O ATOM 100 CB PRO A 7 -11.490 -2.074 4.660 1.00 0.00 C ATOM 101 CG PRO A 7 -11.533 -3.498 4.245 1.00 0.00 C ATOM 102 CD PRO A 7 -10.105 -3.888 3.998 1.00 0.00 C ATOM 0 HA PRO A 7 -10.733 -1.037 2.861 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.266 -1.973 5.722 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.445 -1.578 4.487 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -11.981 -4.119 5.021 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -12.136 -3.627 3.346 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -9.626 -4.257 4.905 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.027 -4.678 3.251 1.00 0.00 H new ATOM 110 N SER A 8 -8.511 -0.504 5.004 1.00 0.00 N ATOM 111 CA SER A 8 -7.714 0.540 5.581 1.00 0.00 C ATOM 112 C SER A 8 -7.374 1.558 4.480 1.00 0.00 C ATOM 113 O SER A 8 -7.636 2.740 4.608 1.00 0.00 O ATOM 114 CB SER A 8 -6.419 -0.081 6.064 1.00 0.00 C ATOM 115 OG SER A 8 -6.629 -1.393 6.560 1.00 0.00 O ATOM 0 H SER A 8 -8.062 -1.420 5.015 1.00 0.00 H new ATOM 0 HA SER A 8 -8.246 1.026 6.399 1.00 0.00 H new ATOM 0 HB2 SER A 8 -5.700 -0.110 5.245 1.00 0.00 H new ATOM 0 HB3 SER A 8 -5.985 0.541 6.847 1.00 0.00 H new ATOM 0 HG SER A 8 -7.239 -1.359 7.327 1.00 0.00 H new ATOM 121 N ALA A 9 -6.930 1.030 3.338 1.00 0.00 N ATOM 122 CA ALA A 9 -6.381 1.820 2.233 1.00 0.00 C ATOM 123 C ALA A 9 -7.470 2.424 1.347 1.00 0.00 C ATOM 124 O ALA A 9 -7.216 2.829 0.206 1.00 0.00 O ATOM 125 CB ALA A 9 -5.447 0.944 1.409 1.00 0.00 C ATOM 0 H ALA A 9 -6.942 0.027 3.151 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.829 2.657 2.660 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.035 1.526 0.585 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.635 0.584 2.040 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -6.002 0.094 1.011 1.00 0.00 H new ATOM 131 N PHE A 10 -8.656 2.524 1.877 1.00 0.00 N ATOM 132 CA PHE A 10 -9.761 3.100 1.162 1.00 0.00 C ATOM 133 C PHE A 10 -9.589 4.583 1.001 1.00 0.00 C ATOM 134 O PHE A 10 -8.939 5.241 1.817 1.00 0.00 O ATOM 135 CB PHE A 10 -11.092 2.742 1.796 1.00 0.00 C ATOM 136 CG PHE A 10 -11.602 1.390 1.397 1.00 0.00 C ATOM 137 CD1 PHE A 10 -10.735 0.377 1.014 1.00 0.00 C ATOM 138 CD2 PHE A 10 -12.950 1.141 1.377 1.00 0.00 C ATOM 139 CE1 PHE A 10 -11.211 -0.847 0.629 1.00 0.00 C ATOM 140 CE2 PHE A 10 -13.430 -0.079 0.993 1.00 0.00 C ATOM 141 CZ PHE A 10 -12.563 -1.075 0.621 1.00 0.00 C ATOM 0 H PHE A 10 -8.885 2.208 2.819 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.769 2.666 0.162 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -10.989 2.777 2.881 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.830 3.495 1.521 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.670 0.557 1.020 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -13.641 1.919 1.668 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.526 -1.628 0.333 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -14.495 -0.260 0.982 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.946 -2.040 0.322 1.00 0.00 H new ATOM 151 N GLY A 11 -10.096 5.088 -0.105 1.00 0.00 N ATOM 152 CA GLY A 11 -9.943 6.483 -0.454 1.00 0.00 C ATOM 153 C GLY A 11 -8.639 6.703 -1.203 1.00 0.00 C ATOM 154 O GLY A 11 -8.576 7.482 -2.150 1.00 0.00 O ATOM 0 H GLY A 11 -10.625 4.543 -0.786 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.782 6.804 -1.071 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.959 7.094 0.449 1.00 0.00 H new ATOM 158 N LYS A 12 -7.631 5.932 -0.824 1.00 0.00 N ATOM 159 CA LYS A 12 -6.297 5.967 -1.409 1.00 0.00 C ATOM 160 C LYS A 12 -6.220 4.976 -2.570 1.00 0.00 C ATOM 161 O LYS A 12 -5.187 4.854 -3.242 1.00 0.00 O ATOM 162 CB LYS A 12 -5.299 5.551 -0.334 1.00 0.00 C ATOM 163 CG LYS A 12 -5.329 6.417 0.929 1.00 0.00 C ATOM 164 CD LYS A 12 -4.757 7.804 0.688 1.00 0.00 C ATOM 165 CE LYS A 12 -3.254 7.764 0.423 1.00 0.00 C ATOM 166 NZ LYS A 12 -2.741 9.083 0.018 1.00 0.00 N ATOM 0 H LYS A 12 -7.721 5.243 -0.077 1.00 0.00 H new ATOM 0 HA LYS A 12 -6.074 6.969 -1.777 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -5.496 4.516 -0.054 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -4.295 5.582 -0.757 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -6.356 6.506 1.282 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -4.762 5.924 1.719 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -5.263 8.262 -0.162 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.956 8.434 1.555 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.734 7.431 1.321 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -3.041 7.034 -0.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.786 8.977 -0.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -3.371 9.495 -0.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.704 9.710 0.847 1.00 0.00 H new ATOM 180 N LEU A 13 -7.343 4.297 -2.789 1.00 0.00 N ATOM 181 CA LEU A 13 -7.526 3.252 -3.814 1.00 0.00 C ATOM 182 C LEU A 13 -6.997 3.688 -5.174 1.00 0.00 C ATOM 183 O LEU A 13 -6.227 2.988 -5.815 1.00 0.00 O ATOM 184 CB LEU A 13 -9.030 2.955 -3.972 1.00 0.00 C ATOM 185 CG LEU A 13 -9.790 2.508 -2.722 1.00 0.00 C ATOM 186 CD1 LEU A 13 -11.269 2.354 -3.027 1.00 0.00 C ATOM 187 CD2 LEU A 13 -9.232 1.206 -2.200 1.00 0.00 C ATOM 0 H LEU A 13 -8.188 4.460 -2.241 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.973 2.373 -3.484 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.513 3.853 -4.358 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.143 2.181 -4.731 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.667 3.273 -1.956 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.795 2.035 -2.127 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -11.672 3.309 -3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -11.403 1.607 -3.809 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -9.785 0.904 -1.311 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -9.327 0.436 -2.966 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -8.180 1.337 -1.946 1.00 0.00 H new ATOM 199 N LYS A 14 -7.384 4.865 -5.567 1.00 0.00 N ATOM 200 CA LYS A 14 -7.097 5.388 -6.884 1.00 0.00 C ATOM 201 C LYS A 14 -5.643 5.831 -7.031 1.00 0.00 C ATOM 202 O LYS A 14 -5.104 5.863 -8.144 1.00 0.00 O ATOM 203 CB LYS A 14 -8.081 6.506 -7.165 1.00 0.00 C ATOM 204 CG LYS A 14 -9.515 5.997 -7.110 1.00 0.00 C ATOM 205 CD LYS A 14 -10.543 7.101 -7.009 1.00 0.00 C ATOM 206 CE LYS A 14 -10.597 7.987 -8.226 1.00 0.00 C ATOM 207 NZ LYS A 14 -11.680 8.976 -8.090 1.00 0.00 N ATOM 0 H LYS A 14 -7.917 5.505 -4.978 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.220 4.601 -7.628 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -7.947 7.305 -6.436 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.880 6.934 -8.147 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.716 5.404 -8.002 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.623 5.331 -6.254 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -11.526 6.658 -6.849 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -10.323 7.713 -6.134 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.643 8.498 -8.355 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -10.758 7.382 -9.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -11.717 9.570 -8.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -12.588 8.483 -7.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -11.501 9.575 -7.259 1.00 0.00 H new ATOM 221 N GLU A 15 -5.000 6.126 -5.919 1.00 0.00 N ATOM 222 CA GLU A 15 -3.611 6.529 -5.932 1.00 0.00 C ATOM 223 C GLU A 15 -2.724 5.334 -6.165 1.00 0.00 C ATOM 224 O GLU A 15 -1.912 5.335 -7.087 1.00 0.00 O ATOM 225 CB GLU A 15 -3.223 7.243 -4.641 1.00 0.00 C ATOM 226 CG GLU A 15 -3.821 8.622 -4.504 1.00 0.00 C ATOM 227 CD GLU A 15 -3.521 9.245 -3.175 1.00 0.00 C ATOM 228 OE1 GLU A 15 -4.291 9.044 -2.237 1.00 0.00 O ATOM 229 OE2 GLU A 15 -2.494 9.937 -3.034 1.00 0.00 O ATOM 0 H GLU A 15 -5.421 6.093 -4.991 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.474 7.235 -6.751 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.537 6.635 -3.792 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.137 7.322 -4.593 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -3.436 9.262 -5.298 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -4.901 8.562 -4.639 1.00 0.00 H new ATOM 236 N ILE A 16 -2.910 4.296 -5.364 1.00 0.00 N ATOM 237 CA ILE A 16 -2.102 3.085 -5.480 1.00 0.00 C ATOM 238 C ILE A 16 -2.316 2.397 -6.828 1.00 0.00 C ATOM 239 O ILE A 16 -1.356 1.973 -7.481 1.00 0.00 O ATOM 240 CB ILE A 16 -2.339 2.086 -4.303 1.00 0.00 C ATOM 241 CG1 ILE A 16 -3.836 1.737 -4.147 1.00 0.00 C ATOM 242 CG2 ILE A 16 -1.780 2.658 -3.015 1.00 0.00 C ATOM 243 CD1 ILE A 16 -4.148 0.754 -3.037 1.00 0.00 C ATOM 0 H ILE A 16 -3.613 4.265 -4.625 1.00 0.00 H new ATOM 0 HA ILE A 16 -1.062 3.406 -5.420 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.814 1.159 -4.534 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.392 2.657 -3.965 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.199 1.326 -5.089 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -1.950 1.954 -2.200 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.710 2.831 -3.128 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -2.278 3.601 -2.790 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.222 0.571 -3.005 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.625 -0.184 -3.224 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.821 1.167 -2.083 1.00 0.00 H new ATOM 255 N LEU A 17 -3.562 2.355 -7.254 1.00 0.00 N ATOM 256 CA LEU A 17 -3.943 1.734 -8.500 1.00 0.00 C ATOM 257 C LEU A 17 -3.353 2.476 -9.700 1.00 0.00 C ATOM 258 O LEU A 17 -2.623 1.887 -10.490 1.00 0.00 O ATOM 259 CB LEU A 17 -5.473 1.694 -8.586 1.00 0.00 C ATOM 260 CG LEU A 17 -6.107 1.148 -9.867 1.00 0.00 C ATOM 261 CD1 LEU A 17 -5.691 -0.289 -10.136 1.00 0.00 C ATOM 262 CD2 LEU A 17 -7.610 1.247 -9.761 1.00 0.00 C ATOM 0 H LEU A 17 -4.345 2.756 -6.737 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.546 0.719 -8.526 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -5.839 1.096 -7.751 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -5.842 2.709 -8.437 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.754 1.748 -10.706 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.163 -0.639 -11.054 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.607 -0.340 -10.243 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -6.004 -0.920 -9.304 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.065 0.859 -10.672 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -7.954 0.664 -8.907 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.897 2.290 -9.628 1.00 0.00 H new ATOM 274 N GLY A 18 -3.616 3.774 -9.786 1.00 0.00 N ATOM 275 CA GLY A 18 -3.203 4.533 -10.948 1.00 0.00 C ATOM 276 C GLY A 18 -1.716 4.820 -11.007 1.00 0.00 C ATOM 277 O GLY A 18 -1.125 4.826 -12.097 1.00 0.00 O ATOM 0 H GLY A 18 -4.107 4.313 -9.073 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.492 3.987 -11.846 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.745 5.479 -10.962 1.00 0.00 H new ATOM 281 N SER A 19 -1.094 5.008 -9.863 1.00 0.00 N ATOM 282 CA SER A 19 0.306 5.346 -9.853 1.00 0.00 C ATOM 283 C SER A 19 1.164 4.107 -10.067 1.00 0.00 C ATOM 284 O SER A 19 1.930 4.035 -11.034 1.00 0.00 O ATOM 285 CB SER A 19 0.689 6.044 -8.551 1.00 0.00 C ATOM 286 OG SER A 19 -0.189 7.132 -8.276 1.00 0.00 O ATOM 0 H SER A 19 -1.530 4.933 -8.944 1.00 0.00 H new ATOM 0 HA SER A 19 0.490 6.036 -10.677 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.657 5.330 -7.728 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.714 6.408 -8.617 1.00 0.00 H new ATOM 0 HG SER A 19 -0.985 6.800 -7.811 1.00 0.00 H new ATOM 292 N ASN A 20 0.976 3.102 -9.226 1.00 0.00 N ATOM 293 CA ASN A 20 1.839 1.936 -9.273 1.00 0.00 C ATOM 294 C ASN A 20 1.513 1.038 -10.440 1.00 0.00 C ATOM 295 O ASN A 20 2.361 0.846 -11.318 1.00 0.00 O ATOM 296 CB ASN A 20 1.806 1.140 -7.961 1.00 0.00 C ATOM 297 CG ASN A 20 2.770 -0.048 -7.969 1.00 0.00 C ATOM 298 OD1 ASN A 20 3.806 -0.022 -8.625 1.00 0.00 O ATOM 299 ND2 ASN A 20 2.444 -1.081 -7.232 1.00 0.00 N ATOM 0 H ASN A 20 0.246 3.070 -8.514 1.00 0.00 H new ATOM 0 HA ASN A 20 2.852 2.314 -9.411 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.058 1.802 -7.132 1.00 0.00 H new ATOM 0 HB3 ASN A 20 0.793 0.780 -7.784 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.059 -1.894 -7.193 1.00 0.00 H new ATOM 0 HD22 ASN A 20 1.575 -1.072 -6.698 1.00 0.00 H new ATOM 306 N LYS A 21 0.258 0.545 -10.491 1.00 0.00 N ATOM 307 CA LYS A 21 -0.155 -0.443 -11.500 1.00 0.00 C ATOM 308 C LYS A 21 0.718 -1.704 -11.335 1.00 0.00 C ATOM 309 O LYS A 21 1.183 -1.985 -10.223 1.00 0.00 O ATOM 310 CB LYS A 21 -0.017 0.154 -12.920 1.00 0.00 C ATOM 311 CG LYS A 21 -0.889 1.382 -13.162 1.00 0.00 C ATOM 312 CD LYS A 21 -0.636 2.007 -14.527 1.00 0.00 C ATOM 313 CE LYS A 21 0.773 2.597 -14.653 1.00 0.00 C ATOM 314 NZ LYS A 21 1.030 3.686 -13.676 1.00 0.00 N ATOM 0 H LYS A 21 -0.483 0.817 -9.845 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.202 -0.712 -11.360 1.00 0.00 H new ATOM 0 HB2 LYS A 21 1.026 0.422 -13.091 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.274 -0.612 -13.652 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.939 1.101 -13.082 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.696 2.121 -12.384 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.780 1.253 -15.300 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.372 2.791 -14.705 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.508 1.805 -14.509 1.00 0.00 H new ATOM 0 HE3 LYS A 21 0.912 2.981 -15.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.570 4.446 -14.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 0.125 4.064 -13.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 1.576 3.311 -12.874 1.00 0.00 H new ATOM 328 N ASN A 22 0.849 -2.502 -12.397 1.00 0.00 N ATOM 329 CA ASN A 22 1.763 -3.684 -12.454 1.00 0.00 C ATOM 330 C ASN A 22 1.266 -4.883 -11.620 1.00 0.00 C ATOM 331 O ASN A 22 1.731 -6.004 -11.785 1.00 0.00 O ATOM 332 CB ASN A 22 3.227 -3.275 -12.084 1.00 0.00 C ATOM 333 CG ASN A 22 4.248 -4.413 -12.164 1.00 0.00 C ATOM 334 OD1 ASN A 22 4.831 -4.675 -13.223 1.00 0.00 O ATOM 335 ND2 ASN A 22 4.517 -5.054 -11.050 1.00 0.00 N ATOM 0 H ASN A 22 0.325 -2.358 -13.260 1.00 0.00 H new ATOM 0 HA ASN A 22 1.760 -4.032 -13.487 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.545 -2.472 -12.749 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.232 -2.871 -11.072 1.00 0.00 H new ATOM 0 HD21 ASN A 22 5.223 -5.790 -11.043 1.00 0.00 H new ATOM 0 HD22 ASN A 22 4.020 -4.816 -10.192 1.00 0.00 H new ATOM 342 N TYR A 23 0.311 -4.655 -10.770 1.00 0.00 N ATOM 343 CA TYR A 23 -0.288 -5.703 -9.982 1.00 0.00 C ATOM 344 C TYR A 23 -1.734 -5.842 -10.351 1.00 0.00 C ATOM 345 O TYR A 23 -2.351 -4.889 -10.835 1.00 0.00 O ATOM 346 CB TYR A 23 -0.215 -5.400 -8.480 1.00 0.00 C ATOM 347 CG TYR A 23 1.138 -5.546 -7.825 1.00 0.00 C ATOM 348 CD1 TYR A 23 1.540 -6.771 -7.313 1.00 0.00 C ATOM 349 CD2 TYR A 23 1.991 -4.461 -7.677 1.00 0.00 C ATOM 350 CE1 TYR A 23 2.755 -6.917 -6.677 1.00 0.00 C ATOM 351 CE2 TYR A 23 3.208 -4.596 -7.032 1.00 0.00 C ATOM 352 CZ TYR A 23 3.585 -5.828 -6.536 1.00 0.00 C ATOM 353 OH TYR A 23 4.787 -5.966 -5.881 1.00 0.00 O ATOM 0 H TYR A 23 -0.082 -3.730 -10.598 1.00 0.00 H new ATOM 0 HA TYR A 23 0.265 -6.620 -10.187 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.562 -4.379 -8.321 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -0.915 -6.058 -7.965 1.00 0.00 H new ATOM 0 HD1 TYR A 23 0.889 -7.627 -7.414 1.00 0.00 H new ATOM 0 HD2 TYR A 23 1.701 -3.498 -8.071 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.054 -7.881 -6.292 1.00 0.00 H new ATOM 0 HE2 TYR A 23 3.859 -3.742 -6.917 1.00 0.00 H new ATOM 0 HH TYR A 23 5.254 -5.104 -5.869 1.00 0.00 H new ATOM 363 N LYS A 24 -2.280 -7.006 -10.132 1.00 0.00 N ATOM 364 CA LYS A 24 -3.680 -7.190 -10.323 1.00 0.00 C ATOM 365 C LYS A 24 -4.345 -6.897 -8.998 1.00 0.00 C ATOM 366 O LYS A 24 -4.282 -7.699 -8.069 1.00 0.00 O ATOM 367 CB LYS A 24 -4.023 -8.611 -10.816 1.00 0.00 C ATOM 368 CG LYS A 24 -5.524 -8.867 -11.095 1.00 0.00 C ATOM 369 CD LYS A 24 -6.026 -8.359 -12.473 1.00 0.00 C ATOM 370 CE LYS A 24 -5.852 -6.856 -12.699 1.00 0.00 C ATOM 371 NZ LYS A 24 -6.471 -6.409 -13.961 1.00 0.00 N ATOM 0 H LYS A 24 -1.773 -7.835 -9.822 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.040 -6.517 -11.101 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.461 -8.807 -11.729 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.681 -9.329 -10.071 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.714 -9.938 -11.027 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.111 -8.389 -10.311 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.494 -8.895 -13.259 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.082 -8.609 -12.575 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.295 -6.311 -11.866 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.790 -6.612 -12.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.781 -5.857 -14.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.769 -7.238 -14.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.300 -5.817 -13.751 1.00 0.00 H new ATOM 385 N PHE A 25 -4.913 -5.733 -8.899 1.00 0.00 N ATOM 386 CA PHE A 25 -5.524 -5.290 -7.676 1.00 0.00 C ATOM 387 C PHE A 25 -6.853 -5.994 -7.444 1.00 0.00 C ATOM 388 O PHE A 25 -7.675 -6.144 -8.363 1.00 0.00 O ATOM 389 CB PHE A 25 -5.680 -3.768 -7.670 1.00 0.00 C ATOM 390 CG PHE A 25 -4.377 -3.003 -7.622 1.00 0.00 C ATOM 391 CD1 PHE A 25 -3.655 -2.759 -8.777 1.00 0.00 C ATOM 392 CD2 PHE A 25 -3.885 -2.524 -6.422 1.00 0.00 C ATOM 393 CE1 PHE A 25 -2.467 -2.055 -8.740 1.00 0.00 C ATOM 394 CE2 PHE A 25 -2.696 -1.817 -6.378 1.00 0.00 C ATOM 395 CZ PHE A 25 -1.986 -1.583 -7.537 1.00 0.00 C ATOM 0 H PHE A 25 -4.967 -5.060 -9.664 1.00 0.00 H new ATOM 0 HA PHE A 25 -4.868 -5.557 -6.848 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.230 -3.469 -8.562 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.287 -3.481 -6.811 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -4.026 -3.125 -9.723 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -4.434 -2.703 -5.510 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -1.916 -1.875 -9.651 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.323 -1.448 -5.434 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.057 -1.033 -7.503 1.00 0.00 H new ATOM 405 N VAL A 26 -7.023 -6.452 -6.237 1.00 0.00 N ATOM 406 CA VAL A 26 -8.170 -7.214 -5.826 1.00 0.00 C ATOM 407 C VAL A 26 -8.806 -6.551 -4.611 1.00 0.00 C ATOM 408 O VAL A 26 -8.103 -6.050 -3.720 1.00 0.00 O ATOM 409 CB VAL A 26 -7.748 -8.667 -5.435 1.00 0.00 C ATOM 410 CG1 VAL A 26 -8.942 -9.518 -5.037 1.00 0.00 C ATOM 411 CG2 VAL A 26 -6.967 -9.341 -6.551 1.00 0.00 C ATOM 0 H VAL A 26 -6.347 -6.301 -5.488 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.877 -7.253 -6.654 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.096 -8.578 -4.566 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -8.603 -10.520 -4.773 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.441 -9.066 -4.180 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.640 -9.579 -5.872 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.690 -10.350 -6.244 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.584 -9.391 -7.448 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.066 -8.766 -6.763 1.00 0.00 H new ATOM 421 N ILE A 27 -10.106 -6.532 -4.589 1.00 0.00 N ATOM 422 CA ILE A 27 -10.850 -6.021 -3.482 1.00 0.00 C ATOM 423 C ILE A 27 -11.835 -7.119 -3.058 1.00 0.00 C ATOM 424 O ILE A 27 -12.178 -7.988 -3.868 1.00 0.00 O ATOM 425 CB ILE A 27 -11.576 -4.683 -3.848 1.00 0.00 C ATOM 426 CG1 ILE A 27 -12.180 -4.016 -2.606 1.00 0.00 C ATOM 427 CG2 ILE A 27 -12.644 -4.903 -4.910 1.00 0.00 C ATOM 428 CD1 ILE A 27 -11.166 -3.688 -1.534 1.00 0.00 C ATOM 0 H ILE A 27 -10.686 -6.877 -5.354 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.188 -5.773 -2.652 1.00 0.00 H new ATOM 0 HB ILE A 27 -10.823 -4.011 -4.260 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.685 -3.098 -2.908 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.940 -4.675 -2.185 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.128 -3.954 -5.141 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.183 -5.304 -5.812 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.387 -5.609 -4.538 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -11.669 -3.219 -0.688 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -10.677 -4.604 -1.203 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.419 -3.004 -1.937 1.00 0.00 H new ATOM 440 N THR A 28 -12.240 -7.125 -1.826 1.00 0.00 N ATOM 441 CA THR A 28 -13.070 -8.181 -1.334 1.00 0.00 C ATOM 442 C THR A 28 -14.559 -7.783 -1.283 1.00 0.00 C ATOM 443 O THR A 28 -14.929 -6.630 -1.599 1.00 0.00 O ATOM 444 CB THR A 28 -12.585 -8.609 0.047 1.00 0.00 C ATOM 445 OG1 THR A 28 -12.671 -7.500 0.952 1.00 0.00 O ATOM 446 CG2 THR A 28 -11.149 -9.087 -0.008 1.00 0.00 C ATOM 0 H THR A 28 -12.008 -6.407 -1.140 1.00 0.00 H new ATOM 0 HA THR A 28 -12.991 -9.017 -2.029 1.00 0.00 H new ATOM 0 HB THR A 28 -13.217 -9.428 0.392 1.00 0.00 H new ATOM 0 HG1 THR A 28 -13.309 -7.709 1.666 1.00 0.00 H new ATOM 0 HG21 THR A 28 -10.827 -9.387 0.989 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.075 -9.939 -0.684 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.511 -8.280 -0.369 1.00 0.00 H new ATOM 454 N THR A 29 -15.390 -8.728 -0.878 1.00 0.00 N ATOM 455 CA THR A 29 -16.822 -8.570 -0.763 1.00 0.00 C ATOM 456 C THR A 29 -17.206 -7.527 0.298 1.00 0.00 C ATOM 457 O THR A 29 -18.022 -6.614 0.040 1.00 0.00 O ATOM 458 CB THR A 29 -17.415 -9.929 -0.406 1.00 0.00 C ATOM 459 OG1 THR A 29 -16.319 -10.843 -0.155 1.00 0.00 O ATOM 460 CG2 THR A 29 -18.266 -10.456 -1.544 1.00 0.00 C ATOM 0 H THR A 29 -15.070 -9.659 -0.611 1.00 0.00 H new ATOM 0 HA THR A 29 -17.218 -8.209 -1.712 1.00 0.00 H new ATOM 0 HB THR A 29 -18.049 -9.834 0.476 1.00 0.00 H new ATOM 0 HG1 THR A 29 -16.227 -10.987 0.810 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.680 -11.426 -1.270 1.00 0.00 H new ATOM 0 HG22 THR A 29 -19.079 -9.758 -1.744 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.652 -10.563 -2.438 1.00 0.00 H new ATOM 468 N LEU A 30 -16.604 -7.621 1.466 1.00 0.00 N ATOM 469 CA LEU A 30 -16.872 -6.674 2.519 1.00 0.00 C ATOM 470 C LEU A 30 -16.166 -5.379 2.199 1.00 0.00 C ATOM 471 O LEU A 30 -16.585 -4.310 2.633 1.00 0.00 O ATOM 472 CB LEU A 30 -16.443 -7.214 3.888 1.00 0.00 C ATOM 473 CG LEU A 30 -17.141 -8.500 4.355 1.00 0.00 C ATOM 474 CD1 LEU A 30 -16.590 -8.949 5.697 1.00 0.00 C ATOM 475 CD2 LEU A 30 -18.647 -8.301 4.438 1.00 0.00 C ATOM 0 H LEU A 30 -15.927 -8.345 1.706 1.00 0.00 H new ATOM 0 HA LEU A 30 -17.946 -6.500 2.576 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.369 -7.396 3.864 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.618 -6.438 4.633 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.941 -9.279 3.620 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -17.097 -9.861 6.011 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.521 -9.141 5.606 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -16.756 -8.168 6.439 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -19.118 -9.226 4.771 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -18.870 -7.504 5.147 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -19.033 -8.030 3.455 1.00 0.00 H new ATOM 487 N GLY A 31 -15.115 -5.489 1.395 1.00 0.00 N ATOM 488 CA GLY A 31 -14.394 -4.338 0.928 1.00 0.00 C ATOM 489 C GLY A 31 -15.286 -3.437 0.098 1.00 0.00 C ATOM 490 O GLY A 31 -15.482 -2.275 0.439 1.00 0.00 O ATOM 0 H GLY A 31 -14.749 -6.379 1.057 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.000 -3.782 1.779 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -13.539 -4.657 0.332 1.00 0.00 H new ATOM 494 N VAL A 32 -15.884 -3.984 -0.959 1.00 0.00 N ATOM 495 CA VAL A 32 -16.774 -3.189 -1.813 1.00 0.00 C ATOM 496 C VAL A 32 -17.980 -2.660 -1.025 1.00 0.00 C ATOM 497 O VAL A 32 -18.415 -1.533 -1.231 1.00 0.00 O ATOM 498 CB VAL A 32 -17.245 -3.933 -3.108 1.00 0.00 C ATOM 499 CG1 VAL A 32 -16.065 -4.279 -3.987 1.00 0.00 C ATOM 500 CG2 VAL A 32 -18.049 -5.188 -2.797 1.00 0.00 C ATOM 0 H VAL A 32 -15.774 -4.957 -1.244 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.171 -2.345 -2.150 1.00 0.00 H new ATOM 0 HB VAL A 32 -17.902 -3.247 -3.642 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.416 -4.795 -4.881 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -15.546 -3.365 -4.276 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.381 -4.927 -3.439 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -18.352 -5.666 -3.728 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.436 -5.878 -2.217 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -18.936 -4.919 -2.223 1.00 0.00 H new ATOM 510 N SER A 33 -18.454 -3.448 -0.073 1.00 0.00 N ATOM 511 CA SER A 33 -19.585 -3.061 0.746 1.00 0.00 C ATOM 512 C SER A 33 -19.211 -1.878 1.669 1.00 0.00 C ATOM 513 O SER A 33 -20.010 -0.950 1.879 1.00 0.00 O ATOM 514 CB SER A 33 -20.067 -4.268 1.554 1.00 0.00 C ATOM 515 OG SER A 33 -20.371 -5.368 0.685 1.00 0.00 O ATOM 0 H SER A 33 -18.068 -4.365 0.150 1.00 0.00 H new ATOM 0 HA SER A 33 -20.399 -2.727 0.102 1.00 0.00 H new ATOM 0 HB2 SER A 33 -19.299 -4.564 2.269 1.00 0.00 H new ATOM 0 HB3 SER A 33 -20.952 -3.997 2.130 1.00 0.00 H new ATOM 0 HG SER A 33 -19.542 -5.829 0.439 1.00 0.00 H new ATOM 521 N PHE A 34 -17.976 -1.894 2.172 1.00 0.00 N ATOM 522 CA PHE A 34 -17.479 -0.841 3.032 1.00 0.00 C ATOM 523 C PHE A 34 -17.301 0.444 2.229 1.00 0.00 C ATOM 524 O PHE A 34 -17.551 1.540 2.729 1.00 0.00 O ATOM 525 CB PHE A 34 -16.160 -1.268 3.710 1.00 0.00 C ATOM 526 CG PHE A 34 -15.601 -0.261 4.684 1.00 0.00 C ATOM 527 CD1 PHE A 34 -16.215 -0.041 5.905 1.00 0.00 C ATOM 528 CD2 PHE A 34 -14.467 0.469 4.371 1.00 0.00 C ATOM 529 CE1 PHE A 34 -15.706 0.886 6.792 1.00 0.00 C ATOM 530 CE2 PHE A 34 -13.956 1.397 5.253 1.00 0.00 C ATOM 531 CZ PHE A 34 -14.576 1.605 6.465 1.00 0.00 C ATOM 0 H PHE A 34 -17.302 -2.637 1.991 1.00 0.00 H new ATOM 0 HA PHE A 34 -18.207 -0.653 3.821 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -16.324 -2.209 4.235 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.415 -1.460 2.938 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -17.101 -0.600 6.166 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -13.976 0.309 3.423 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -16.193 1.048 7.742 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -13.071 1.960 4.994 1.00 0.00 H new ATOM 0 HZ PHE A 34 -14.177 2.331 7.159 1.00 0.00 H new ATOM 541 N ALA A 35 -16.907 0.300 0.978 1.00 0.00 N ATOM 542 CA ALA A 35 -16.742 1.434 0.087 1.00 0.00 C ATOM 543 C ALA A 35 -18.087 2.101 -0.180 1.00 0.00 C ATOM 544 O ALA A 35 -18.200 3.328 -0.126 1.00 0.00 O ATOM 545 CB ALA A 35 -16.093 1.003 -1.218 1.00 0.00 C ATOM 0 H ALA A 35 -16.693 -0.602 0.552 1.00 0.00 H new ATOM 0 HA ALA A 35 -16.086 2.158 0.571 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -15.979 1.868 -1.871 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -15.113 0.572 -1.012 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.721 0.259 -1.708 1.00 0.00 H new ATOM 551 N ILE A 36 -19.106 1.287 -0.433 1.00 0.00 N ATOM 552 CA ILE A 36 -20.456 1.786 -0.692 1.00 0.00 C ATOM 553 C ILE A 36 -20.975 2.613 0.493 1.00 0.00 C ATOM 554 O ILE A 36 -21.356 3.773 0.325 1.00 0.00 O ATOM 555 CB ILE A 36 -21.465 0.631 -1.011 1.00 0.00 C ATOM 556 CG1 ILE A 36 -21.025 -0.180 -2.247 1.00 0.00 C ATOM 557 CG2 ILE A 36 -22.885 1.173 -1.210 1.00 0.00 C ATOM 558 CD1 ILE A 36 -20.898 0.627 -3.530 1.00 0.00 C ATOM 0 H ILE A 36 -19.024 0.271 -0.465 1.00 0.00 H new ATOM 0 HA ILE A 36 -20.386 2.424 -1.573 1.00 0.00 H new ATOM 0 HB ILE A 36 -21.469 -0.038 -0.150 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -20.064 -0.649 -2.033 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -21.743 -0.984 -2.410 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -23.562 0.348 -1.430 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -23.212 1.678 -0.301 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -22.892 1.879 -2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.584 -0.028 -4.343 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -21.861 1.074 -3.776 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.157 1.415 -3.393 1.00 0.00 H new ATOM 570 N LYS A 37 -20.932 2.039 1.694 1.00 0.00 N ATOM 571 CA LYS A 37 -21.457 2.726 2.887 1.00 0.00 C ATOM 572 C LYS A 37 -20.664 3.987 3.238 1.00 0.00 C ATOM 573 O LYS A 37 -21.216 4.948 3.770 1.00 0.00 O ATOM 574 CB LYS A 37 -21.529 1.795 4.108 1.00 0.00 C ATOM 575 CG LYS A 37 -20.193 1.201 4.537 1.00 0.00 C ATOM 576 CD LYS A 37 -20.238 0.456 5.890 1.00 0.00 C ATOM 577 CE LYS A 37 -21.164 -0.774 5.917 1.00 0.00 C ATOM 578 NZ LYS A 37 -22.609 -0.436 5.954 1.00 0.00 N ATOM 0 H LYS A 37 -20.546 1.112 1.873 1.00 0.00 H new ATOM 0 HA LYS A 37 -22.471 3.030 2.625 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -21.950 2.350 4.946 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -22.219 0.981 3.886 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.850 0.511 3.766 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -19.455 2.001 4.600 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.228 0.139 6.148 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.561 1.154 6.663 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.966 -1.385 5.037 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.920 -1.382 6.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -23.080 -1.006 6.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -22.724 0.574 6.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -23.037 -0.638 5.028 1.00 0.00 H new ATOM 592 N SER A 38 -19.394 3.999 2.912 1.00 0.00 N ATOM 593 CA SER A 38 -18.551 5.124 3.240 1.00 0.00 C ATOM 594 C SER A 38 -18.622 6.210 2.168 1.00 0.00 C ATOM 595 O SER A 38 -18.028 7.270 2.314 1.00 0.00 O ATOM 596 CB SER A 38 -17.121 4.645 3.449 1.00 0.00 C ATOM 597 OG SER A 38 -17.090 3.609 4.422 1.00 0.00 O ATOM 0 H SER A 38 -18.921 3.242 2.419 1.00 0.00 H new ATOM 0 HA SER A 38 -18.912 5.572 4.166 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.709 4.282 2.507 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.494 5.476 3.772 1.00 0.00 H new ATOM 0 HG SER A 38 -17.245 2.745 3.985 1.00 0.00 H new ATOM 603 N GLY A 39 -19.373 5.948 1.104 1.00 0.00 N ATOM 604 CA GLY A 39 -19.517 6.917 0.042 1.00 0.00 C ATOM 605 C GLY A 39 -18.255 7.037 -0.778 1.00 0.00 C ATOM 606 O GLY A 39 -17.828 8.135 -1.123 1.00 0.00 O ATOM 0 H GLY A 39 -19.885 5.077 0.961 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -20.345 6.628 -0.605 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.769 7.889 0.467 1.00 0.00 H new ATOM 610 N ILE A 40 -17.641 5.917 -1.056 1.00 0.00 N ATOM 611 CA ILE A 40 -16.404 5.885 -1.799 1.00 0.00 C ATOM 612 C ILE A 40 -16.657 5.324 -3.181 1.00 0.00 C ATOM 613 O ILE A 40 -17.432 4.368 -3.347 1.00 0.00 O ATOM 614 CB ILE A 40 -15.339 5.029 -1.052 1.00 0.00 C ATOM 615 CG1 ILE A 40 -15.128 5.590 0.359 1.00 0.00 C ATOM 616 CG2 ILE A 40 -14.012 4.997 -1.814 1.00 0.00 C ATOM 617 CD1 ILE A 40 -14.183 4.786 1.210 1.00 0.00 C ATOM 0 H ILE A 40 -17.983 4.998 -0.774 1.00 0.00 H new ATOM 0 HA ILE A 40 -16.019 6.901 -1.891 1.00 0.00 H new ATOM 0 HB ILE A 40 -15.706 4.005 -0.987 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -14.749 6.609 0.279 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -16.093 5.647 0.863 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -13.292 4.391 -1.265 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -14.170 4.566 -2.802 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -13.628 6.012 -1.918 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -14.091 5.252 2.191 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -14.569 3.773 1.324 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -13.204 4.750 0.732 1.00 0.00 H new ATOM 629 N ASP A 41 -16.046 5.936 -4.166 1.00 0.00 N ATOM 630 CA ASP A 41 -16.171 5.519 -5.541 1.00 0.00 C ATOM 631 C ASP A 41 -15.332 4.273 -5.817 1.00 0.00 C ATOM 632 O ASP A 41 -14.149 4.339 -6.172 1.00 0.00 O ATOM 633 CB ASP A 41 -15.855 6.681 -6.526 1.00 0.00 C ATOM 634 CG ASP A 41 -14.457 7.292 -6.392 1.00 0.00 C ATOM 635 OD1 ASP A 41 -14.103 7.782 -5.291 1.00 0.00 O ATOM 636 OD2 ASP A 41 -13.700 7.312 -7.375 1.00 0.00 O ATOM 0 H ASP A 41 -15.441 6.747 -4.034 1.00 0.00 H new ATOM 0 HA ASP A 41 -17.212 5.246 -5.714 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -15.977 6.314 -7.545 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -16.593 7.469 -6.380 1.00 0.00 H new ATOM 641 N ILE A 42 -15.939 3.131 -5.599 1.00 0.00 N ATOM 642 CA ILE A 42 -15.271 1.858 -5.789 1.00 0.00 C ATOM 643 C ILE A 42 -15.304 1.485 -7.273 1.00 0.00 C ATOM 644 O ILE A 42 -14.437 0.760 -7.783 1.00 0.00 O ATOM 645 CB ILE A 42 -15.914 0.729 -4.897 1.00 0.00 C ATOM 646 CG1 ILE A 42 -15.143 -0.595 -4.988 1.00 0.00 C ATOM 647 CG2 ILE A 42 -17.386 0.508 -5.221 1.00 0.00 C ATOM 648 CD1 ILE A 42 -13.731 -0.528 -4.443 1.00 0.00 C ATOM 0 H ILE A 42 -16.907 3.054 -5.286 1.00 0.00 H new ATOM 0 HA ILE A 42 -14.233 1.954 -5.471 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.845 1.086 -3.869 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -15.695 -1.362 -4.445 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.104 -0.909 -6.031 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.785 -0.279 -4.581 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.939 1.431 -5.049 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.488 0.213 -6.265 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.255 -1.503 -4.544 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.160 0.214 -5.001 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.760 -0.246 -3.390 1.00 0.00 H new ATOM 660 N ASP A 43 -16.267 2.063 -7.973 1.00 0.00 N ATOM 661 CA ASP A 43 -16.470 1.829 -9.397 1.00 0.00 C ATOM 662 C ASP A 43 -15.262 2.274 -10.203 1.00 0.00 C ATOM 663 O ASP A 43 -14.931 1.655 -11.197 1.00 0.00 O ATOM 664 CB ASP A 43 -17.747 2.520 -9.918 1.00 0.00 C ATOM 665 CG ASP A 43 -17.698 4.034 -9.874 1.00 0.00 C ATOM 666 OD1 ASP A 43 -18.058 4.628 -8.820 1.00 0.00 O ATOM 667 OD2 ASP A 43 -17.305 4.654 -10.878 1.00 0.00 O ATOM 0 H ASP A 43 -16.938 2.715 -7.566 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.597 0.754 -9.527 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -17.924 2.203 -10.946 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -18.598 2.178 -9.328 1.00 0.00 H new ATOM 672 N SER A 44 -14.585 3.314 -9.733 1.00 0.00 N ATOM 673 CA SER A 44 -13.397 3.845 -10.382 1.00 0.00 C ATOM 674 C SER A 44 -12.254 2.827 -10.345 1.00 0.00 C ATOM 675 O SER A 44 -11.438 2.738 -11.280 1.00 0.00 O ATOM 676 CB SER A 44 -12.976 5.112 -9.663 1.00 0.00 C ATOM 677 OG SER A 44 -14.067 6.007 -9.560 1.00 0.00 O ATOM 0 H SER A 44 -14.848 3.815 -8.884 1.00 0.00 H new ATOM 0 HA SER A 44 -13.626 4.060 -11.426 1.00 0.00 H new ATOM 0 HB2 SER A 44 -12.604 4.867 -8.668 1.00 0.00 H new ATOM 0 HB3 SER A 44 -12.157 5.588 -10.202 1.00 0.00 H new ATOM 0 HG SER A 44 -14.079 6.406 -8.665 1.00 0.00 H new ATOM 683 N ALA A 45 -12.211 2.057 -9.278 1.00 0.00 N ATOM 684 CA ALA A 45 -11.192 1.058 -9.100 1.00 0.00 C ATOM 685 C ALA A 45 -11.540 -0.159 -9.938 1.00 0.00 C ATOM 686 O ALA A 45 -10.714 -0.665 -10.713 1.00 0.00 O ATOM 687 CB ALA A 45 -11.067 0.698 -7.622 1.00 0.00 C ATOM 0 H ALA A 45 -12.884 2.110 -8.513 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.228 1.444 -9.430 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.293 -0.059 -7.496 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -10.800 1.588 -7.052 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -12.019 0.308 -7.261 1.00 0.00 H new ATOM 693 N LEU A 46 -12.789 -0.581 -9.822 1.00 0.00 N ATOM 694 CA LEU A 46 -13.312 -1.722 -10.560 1.00 0.00 C ATOM 695 C LEU A 46 -13.144 -1.506 -12.062 1.00 0.00 C ATOM 696 O LEU A 46 -12.717 -2.399 -12.782 1.00 0.00 O ATOM 697 CB LEU A 46 -14.788 -1.936 -10.219 1.00 0.00 C ATOM 698 CG LEU A 46 -15.116 -2.214 -8.745 1.00 0.00 C ATOM 699 CD1 LEU A 46 -16.610 -2.376 -8.553 1.00 0.00 C ATOM 700 CD2 LEU A 46 -14.380 -3.449 -8.243 1.00 0.00 C ATOM 0 H LEU A 46 -13.474 -0.139 -9.209 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.751 -2.611 -10.272 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -15.342 -1.051 -10.531 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -15.158 -2.770 -10.814 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.780 -1.358 -8.160 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.823 -2.572 -7.502 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -17.118 -1.462 -8.861 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -16.966 -3.210 -9.157 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.631 -3.622 -7.196 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -14.676 -4.315 -8.835 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.305 -3.295 -8.338 1.00 0.00 H new ATOM 712 N ASP A 47 -13.440 -0.291 -12.501 1.00 0.00 N ATOM 713 CA ASP A 47 -13.304 0.121 -13.902 1.00 0.00 C ATOM 714 C ASP A 47 -11.878 -0.042 -14.400 1.00 0.00 C ATOM 715 O ASP A 47 -11.654 -0.510 -15.508 1.00 0.00 O ATOM 716 CB ASP A 47 -13.730 1.578 -14.072 1.00 0.00 C ATOM 717 CG ASP A 47 -13.490 2.096 -15.469 1.00 0.00 C ATOM 718 OD1 ASP A 47 -14.378 1.957 -16.330 1.00 0.00 O ATOM 719 OD2 ASP A 47 -12.406 2.664 -15.730 1.00 0.00 O ATOM 0 H ASP A 47 -13.786 0.450 -11.891 1.00 0.00 H new ATOM 0 HA ASP A 47 -13.953 -0.526 -14.492 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -14.789 1.673 -13.831 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.184 2.197 -13.360 1.00 0.00 H new ATOM 724 N ARG A 48 -10.924 0.328 -13.571 1.00 0.00 N ATOM 725 CA ARG A 48 -9.525 0.244 -13.947 1.00 0.00 C ATOM 726 C ARG A 48 -8.956 -1.162 -13.823 1.00 0.00 C ATOM 727 O ARG A 48 -7.784 -1.388 -14.127 1.00 0.00 O ATOM 728 CB ARG A 48 -8.686 1.264 -13.206 1.00 0.00 C ATOM 729 CG ARG A 48 -8.821 2.669 -13.753 1.00 0.00 C ATOM 730 CD ARG A 48 -8.061 3.660 -12.902 1.00 0.00 C ATOM 731 NE ARG A 48 -8.077 5.014 -13.476 1.00 0.00 N ATOM 732 CZ ARG A 48 -8.985 5.970 -13.208 1.00 0.00 C ATOM 733 NH1 ARG A 48 -10.101 5.673 -12.514 1.00 0.00 N ATOM 734 NH2 ARG A 48 -8.800 7.197 -13.682 1.00 0.00 N ATOM 0 H ARG A 48 -11.090 0.690 -12.632 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.479 0.490 -15.008 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.972 1.263 -12.154 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.639 0.964 -13.252 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.447 2.702 -14.776 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.874 2.949 -13.790 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.495 3.686 -11.903 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.029 3.326 -12.793 1.00 0.00 H new ATOM 0 HE ARG A 48 -7.335 5.249 -14.135 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -10.261 4.719 -12.189 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -10.786 6.402 -12.314 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.975 7.408 -14.244 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -9.483 7.928 -13.484 1.00 0.00 H new ATOM 748 N GLY A 49 -9.762 -2.090 -13.353 1.00 0.00 N ATOM 749 CA GLY A 49 -9.357 -3.476 -13.378 1.00 0.00 C ATOM 750 C GLY A 49 -9.166 -4.102 -12.022 1.00 0.00 C ATOM 751 O GLY A 49 -8.407 -5.066 -11.885 1.00 0.00 O ATOM 0 H GLY A 49 -10.685 -1.914 -12.956 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -10.106 -4.049 -13.925 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -8.424 -3.557 -13.935 1.00 0.00 H new ATOM 755 N VAL A 50 -9.813 -3.563 -11.020 1.00 0.00 N ATOM 756 CA VAL A 50 -9.778 -4.174 -9.709 1.00 0.00 C ATOM 757 C VAL A 50 -10.881 -5.224 -9.642 1.00 0.00 C ATOM 758 O VAL A 50 -12.039 -4.941 -9.973 1.00 0.00 O ATOM 759 CB VAL A 50 -9.933 -3.127 -8.564 1.00 0.00 C ATOM 760 CG1 VAL A 50 -9.973 -3.799 -7.202 1.00 0.00 C ATOM 761 CG2 VAL A 50 -8.784 -2.139 -8.604 1.00 0.00 C ATOM 0 H VAL A 50 -10.367 -2.709 -11.082 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.804 -4.640 -9.562 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.876 -2.603 -8.718 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.082 -3.042 -6.426 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.818 -4.486 -7.160 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.048 -4.352 -7.042 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -8.901 -1.412 -7.801 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.842 -2.672 -8.477 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.782 -1.622 -9.564 1.00 0.00 H new ATOM 771 N ILE A 51 -10.523 -6.427 -9.278 1.00 0.00 N ATOM 772 CA ILE A 51 -11.475 -7.525 -9.240 1.00 0.00 C ATOM 773 C ILE A 51 -11.955 -7.792 -7.826 1.00 0.00 C ATOM 774 O ILE A 51 -11.238 -7.535 -6.864 1.00 0.00 O ATOM 775 CB ILE A 51 -10.901 -8.826 -9.869 1.00 0.00 C ATOM 776 CG1 ILE A 51 -9.586 -9.238 -9.176 1.00 0.00 C ATOM 777 CG2 ILE A 51 -10.690 -8.641 -11.370 1.00 0.00 C ATOM 778 CD1 ILE A 51 -8.994 -10.543 -9.674 1.00 0.00 C ATOM 0 H ILE A 51 -9.575 -6.680 -9.000 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.328 -7.215 -9.844 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.623 -9.629 -9.719 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.852 -8.444 -9.316 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -9.766 -9.321 -8.104 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -10.288 -9.560 -11.797 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.643 -8.407 -11.845 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.989 -7.824 -11.541 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.072 -10.754 -9.132 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -9.706 -11.352 -9.509 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.778 -10.462 -10.739 1.00 0.00 H new ATOM 790 N VAL A 52 -13.162 -8.289 -7.708 1.00 0.00 N ATOM 791 CA VAL A 52 -13.753 -8.585 -6.422 1.00 0.00 C ATOM 792 C VAL A 52 -13.618 -10.074 -6.147 1.00 0.00 C ATOM 793 O VAL A 52 -14.065 -10.909 -6.949 1.00 0.00 O ATOM 794 CB VAL A 52 -15.263 -8.198 -6.369 1.00 0.00 C ATOM 795 CG1 VAL A 52 -15.840 -8.396 -4.970 1.00 0.00 C ATOM 796 CG2 VAL A 52 -15.483 -6.770 -6.845 1.00 0.00 C ATOM 0 H VAL A 52 -13.766 -8.501 -8.502 1.00 0.00 H new ATOM 0 HA VAL A 52 -13.228 -7.997 -5.669 1.00 0.00 H new ATOM 0 HB VAL A 52 -15.794 -8.866 -7.048 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -16.894 -8.117 -4.968 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -15.741 -9.442 -4.680 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.298 -7.770 -4.261 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -16.545 -6.530 -6.796 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -14.926 -6.084 -6.207 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -15.135 -6.672 -7.873 1.00 0.00 H new ATOM 806 N ARG A 53 -13.004 -10.411 -5.052 1.00 0.00 N ATOM 807 CA ARG A 53 -12.827 -11.788 -4.666 1.00 0.00 C ATOM 808 C ARG A 53 -13.469 -12.024 -3.309 1.00 0.00 C ATOM 809 O ARG A 53 -13.178 -11.319 -2.345 1.00 0.00 O ATOM 810 CB ARG A 53 -11.329 -12.134 -4.631 1.00 0.00 C ATOM 811 CG ARG A 53 -10.974 -13.541 -4.133 1.00 0.00 C ATOM 812 CD ARG A 53 -11.515 -14.656 -5.014 1.00 0.00 C ATOM 813 NE ARG A 53 -11.101 -15.967 -4.492 1.00 0.00 N ATOM 814 CZ ARG A 53 -11.790 -17.107 -4.587 1.00 0.00 C ATOM 815 NH1 ARG A 53 -12.897 -17.178 -5.308 1.00 0.00 N ATOM 816 NH2 ARG A 53 -11.342 -18.181 -3.983 1.00 0.00 N ATOM 0 H ARG A 53 -12.608 -9.739 -4.395 1.00 0.00 H new ATOM 0 HA ARG A 53 -13.310 -12.437 -5.396 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -10.925 -12.014 -5.636 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.823 -11.407 -3.995 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.890 -13.632 -4.072 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.362 -13.668 -3.122 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -12.603 -14.601 -5.055 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -11.151 -14.532 -6.034 1.00 0.00 H new ATOM 0 HE ARG A 53 -10.202 -16.010 -4.012 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -13.237 -16.353 -5.803 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -13.410 -18.057 -5.369 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.475 -18.141 -3.447 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -11.860 -19.057 -4.049 1.00 0.00 H new ATOM 830 N ALA A 54 -14.342 -12.997 -3.256 1.00 0.00 N ATOM 831 CA ALA A 54 -14.990 -13.381 -2.026 1.00 0.00 C ATOM 832 C ALA A 54 -14.251 -14.563 -1.433 1.00 0.00 C ATOM 833 O ALA A 54 -13.684 -15.384 -2.179 1.00 0.00 O ATOM 834 CB ALA A 54 -16.440 -13.745 -2.296 1.00 0.00 C ATOM 0 H ALA A 54 -14.625 -13.548 -4.067 1.00 0.00 H new ATOM 0 HA ALA A 54 -14.971 -12.550 -1.321 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.923 -14.034 -1.362 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -16.958 -12.885 -2.721 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -16.481 -14.577 -2.998 1.00 0.00 H new ATOM 840 N PHE A 55 -14.249 -14.664 -0.132 1.00 0.00 N ATOM 841 CA PHE A 55 -13.547 -15.725 0.557 1.00 0.00 C ATOM 842 C PHE A 55 -14.449 -16.965 0.630 1.00 0.00 C ATOM 843 O PHE A 55 -15.485 -16.952 1.285 1.00 0.00 O ATOM 844 CB PHE A 55 -13.121 -15.225 1.951 1.00 0.00 C ATOM 845 CG PHE A 55 -12.221 -16.146 2.732 1.00 0.00 C ATOM 846 CD1 PHE A 55 -11.027 -16.602 2.191 1.00 0.00 C ATOM 847 CD2 PHE A 55 -12.562 -16.544 4.012 1.00 0.00 C ATOM 848 CE1 PHE A 55 -10.197 -17.437 2.916 1.00 0.00 C ATOM 849 CE2 PHE A 55 -11.734 -17.374 4.740 1.00 0.00 C ATOM 850 CZ PHE A 55 -10.551 -17.821 4.191 1.00 0.00 C ATOM 0 H PHE A 55 -14.734 -14.014 0.487 1.00 0.00 H new ATOM 0 HA PHE A 55 -12.644 -16.009 0.017 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -12.615 -14.267 1.833 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -14.019 -15.040 2.540 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.743 -16.301 1.193 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -13.489 -16.201 4.448 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.272 -17.788 2.483 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -12.013 -17.673 5.740 1.00 0.00 H new ATOM 0 HZ PHE A 55 -9.903 -18.471 4.760 1.00 0.00 H new ATOM 860 N SER A 56 -14.049 -18.017 -0.071 1.00 0.00 N ATOM 861 CA SER A 56 -14.838 -19.237 -0.224 1.00 0.00 C ATOM 862 C SER A 56 -14.942 -20.048 1.086 1.00 0.00 C ATOM 863 O SER A 56 -15.863 -20.861 1.255 1.00 0.00 O ATOM 864 CB SER A 56 -14.187 -20.090 -1.310 1.00 0.00 C ATOM 865 OG SER A 56 -13.765 -19.270 -2.393 1.00 0.00 O ATOM 0 H SER A 56 -13.153 -18.050 -0.558 1.00 0.00 H new ATOM 0 HA SER A 56 -15.855 -18.956 -0.497 1.00 0.00 H new ATOM 0 HB2 SER A 56 -13.333 -20.627 -0.897 1.00 0.00 H new ATOM 0 HB3 SER A 56 -14.894 -20.840 -1.666 1.00 0.00 H new ATOM 0 HG SER A 56 -13.495 -19.836 -3.146 1.00 0.00 H new ATOM 871 N HIS A 57 -13.994 -19.843 1.982 1.00 0.00 N ATOM 872 CA HIS A 57 -13.973 -20.539 3.265 1.00 0.00 C ATOM 873 C HIS A 57 -14.788 -19.738 4.273 1.00 0.00 C ATOM 874 O HIS A 57 -15.063 -18.565 4.043 1.00 0.00 O ATOM 875 CB HIS A 57 -12.509 -20.688 3.754 1.00 0.00 C ATOM 876 CG HIS A 57 -12.302 -21.542 4.989 1.00 0.00 C ATOM 877 ND1 HIS A 57 -12.373 -21.064 6.280 1.00 0.00 N ATOM 878 CD2 HIS A 57 -12.015 -22.849 5.104 1.00 0.00 C ATOM 879 CE1 HIS A 57 -12.139 -22.045 7.122 1.00 0.00 C ATOM 880 NE2 HIS A 57 -11.922 -23.135 6.436 1.00 0.00 N ATOM 0 H HIS A 57 -13.219 -19.194 1.847 1.00 0.00 H new ATOM 0 HA HIS A 57 -14.406 -21.533 3.158 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -11.917 -21.110 2.942 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -12.111 -19.693 3.954 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -12.576 -20.099 6.541 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -11.882 -23.547 4.291 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -12.128 -21.964 8.199 1.00 0.00 H new ATOM 889 N LYS A 58 -15.214 -20.376 5.353 1.00 0.00 N ATOM 890 CA LYS A 58 -15.879 -19.666 6.430 1.00 0.00 C ATOM 891 C LYS A 58 -14.933 -18.638 7.058 1.00 0.00 C ATOM 892 O LYS A 58 -13.703 -18.860 7.106 1.00 0.00 O ATOM 893 CB LYS A 58 -16.405 -20.623 7.503 1.00 0.00 C ATOM 894 CG LYS A 58 -17.575 -21.486 7.066 1.00 0.00 C ATOM 895 CD LYS A 58 -18.083 -22.333 8.226 1.00 0.00 C ATOM 896 CE LYS A 58 -19.278 -23.184 7.834 1.00 0.00 C ATOM 897 NZ LYS A 58 -20.454 -22.374 7.441 1.00 0.00 N ATOM 0 H LYS A 58 -15.111 -21.379 5.505 1.00 0.00 H new ATOM 0 HA LYS A 58 -16.735 -19.148 5.999 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -15.590 -21.274 7.821 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -16.706 -20.041 8.374 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -18.380 -20.853 6.691 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -17.269 -22.133 6.244 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -17.280 -22.979 8.581 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -18.359 -21.682 9.056 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -18.998 -23.836 7.006 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -19.549 -23.829 8.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -21.289 -22.989 7.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -20.628 -21.643 8.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -20.272 -21.921 6.523 1.00 0.00 H new ATOM 911 N PRO A 59 -15.478 -17.499 7.506 1.00 0.00 N ATOM 912 CA PRO A 59 -14.700 -16.432 8.123 1.00 0.00 C ATOM 913 C PRO A 59 -13.922 -16.904 9.359 1.00 0.00 C ATOM 914 O PRO A 59 -14.400 -17.759 10.136 1.00 0.00 O ATOM 915 CB PRO A 59 -15.756 -15.390 8.529 1.00 0.00 C ATOM 916 CG PRO A 59 -17.050 -16.117 8.504 1.00 0.00 C ATOM 917 CD PRO A 59 -16.910 -17.144 7.431 1.00 0.00 C ATOM 0 HA PRO A 59 -13.944 -16.048 7.438 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -15.550 -14.986 9.520 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -15.764 -14.548 7.837 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -17.257 -16.582 9.468 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -17.877 -15.439 8.293 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -17.551 -18.007 7.610 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -17.178 -16.746 6.452 1.00 0.00 H new ATOM 925 N PRO A 60 -12.714 -16.373 9.551 1.00 0.00 N ATOM 926 CA PRO A 60 -11.883 -16.714 10.693 1.00 0.00 C ATOM 927 C PRO A 60 -12.339 -15.981 11.948 1.00 0.00 C ATOM 928 O PRO A 60 -13.212 -15.090 11.887 1.00 0.00 O ATOM 929 CB PRO A 60 -10.507 -16.205 10.270 1.00 0.00 C ATOM 930 CG PRO A 60 -10.813 -15.017 9.441 1.00 0.00 C ATOM 931 CD PRO A 60 -12.049 -15.386 8.666 1.00 0.00 C ATOM 0 HA PRO A 60 -11.913 -17.776 10.935 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.894 -15.944 11.133 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.958 -16.958 9.704 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -10.985 -14.137 10.061 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -9.985 -14.779 8.773 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -12.683 -14.519 8.480 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -11.803 -15.816 7.695 1.00 0.00 H new ATOM 939 N LYS A 61 -11.771 -16.343 13.058 1.00 0.00 N ATOM 940 CA LYS A 61 -12.052 -15.698 14.288 1.00 0.00 C ATOM 941 C LYS A 61 -10.925 -14.727 14.600 1.00 0.00 C ATOM 942 O LYS A 61 -9.787 -15.141 14.866 1.00 0.00 O ATOM 943 CB LYS A 61 -12.193 -16.719 15.416 1.00 0.00 C ATOM 944 CG LYS A 61 -12.474 -16.080 16.759 1.00 0.00 C ATOM 945 CD LYS A 61 -12.529 -17.102 17.870 1.00 0.00 C ATOM 946 CE LYS A 61 -12.614 -16.432 19.237 1.00 0.00 C ATOM 947 NZ LYS A 61 -11.468 -15.513 19.476 1.00 0.00 N ATOM 0 H LYS A 61 -11.094 -17.103 13.128 1.00 0.00 H new ATOM 0 HA LYS A 61 -12.995 -15.159 14.204 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -12.999 -17.412 15.173 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -11.277 -17.307 15.484 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -11.700 -15.345 16.980 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -13.421 -15.542 16.714 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -13.393 -17.751 17.727 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -11.643 -17.736 17.828 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -13.548 -15.875 19.311 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -12.636 -17.195 20.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -11.366 -15.343 20.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -10.596 -15.943 19.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -11.640 -14.610 18.991 1.00 0.00 H new ATOM 961 N VAL A 62 -11.220 -13.472 14.528 1.00 0.00 N ATOM 962 CA VAL A 62 -10.264 -12.440 14.836 1.00 0.00 C ATOM 963 C VAL A 62 -10.716 -11.700 16.072 1.00 0.00 C ATOM 964 O VAL A 62 -11.880 -11.819 16.480 1.00 0.00 O ATOM 965 CB VAL A 62 -10.028 -11.455 13.659 1.00 0.00 C ATOM 966 CG1 VAL A 62 -9.350 -12.167 12.498 1.00 0.00 C ATOM 967 CG2 VAL A 62 -11.337 -10.831 13.198 1.00 0.00 C ATOM 0 H VAL A 62 -12.137 -13.122 14.252 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.304 -12.923 15.017 1.00 0.00 H new ATOM 0 HB VAL A 62 -9.375 -10.657 14.014 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -9.192 -11.462 11.681 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -8.389 -12.564 12.826 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -9.982 -12.985 12.154 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -11.143 -10.146 12.373 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -12.017 -11.615 12.865 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -11.791 -10.284 14.025 1.00 0.00 H new ATOM 977 N GLY A 63 -9.828 -10.989 16.684 1.00 0.00 N ATOM 978 CA GLY A 63 -10.174 -10.297 17.888 1.00 0.00 C ATOM 979 C GLY A 63 -10.191 -8.809 17.700 1.00 0.00 C ATOM 980 O GLY A 63 -11.260 -8.182 17.695 1.00 0.00 O ATOM 0 H GLY A 63 -8.863 -10.870 16.376 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -11.155 -10.630 18.228 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.461 -10.555 18.671 1.00 0.00 H new ATOM 984 N ASN A 64 -9.022 -8.254 17.492 1.00 0.00 N ATOM 985 CA ASN A 64 -8.847 -6.816 17.393 1.00 0.00 C ATOM 986 C ASN A 64 -9.236 -6.269 16.039 1.00 0.00 C ATOM 987 O ASN A 64 -9.852 -5.198 15.951 1.00 0.00 O ATOM 988 CB ASN A 64 -7.404 -6.414 17.756 1.00 0.00 C ATOM 989 CG ASN A 64 -7.110 -4.939 17.500 1.00 0.00 C ATOM 990 OD1 ASN A 64 -7.436 -4.078 18.320 1.00 0.00 O ATOM 991 ND2 ASN A 64 -6.423 -4.647 16.417 1.00 0.00 N ATOM 0 H ASN A 64 -8.158 -8.785 17.385 1.00 0.00 H new ATOM 0 HA ASN A 64 -9.528 -6.367 18.116 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -7.225 -6.636 18.808 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -6.708 -7.022 17.179 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -6.143 -3.683 16.235 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -6.170 -5.384 15.759 1.00 0.00 H new ATOM 998 N LEU A 65 -8.920 -6.993 15.007 1.00 0.00 N ATOM 999 CA LEU A 65 -9.172 -6.537 13.664 1.00 0.00 C ATOM 1000 C LEU A 65 -10.640 -6.602 13.293 1.00 0.00 C ATOM 1001 O LEU A 65 -11.359 -7.521 13.712 1.00 0.00 O ATOM 1002 CB LEU A 65 -8.335 -7.312 12.656 1.00 0.00 C ATOM 1003 CG LEU A 65 -6.834 -7.085 12.738 1.00 0.00 C ATOM 1004 CD1 LEU A 65 -6.121 -7.920 11.704 1.00 0.00 C ATOM 1005 CD2 LEU A 65 -6.511 -5.612 12.545 1.00 0.00 C ATOM 0 H LEU A 65 -8.482 -7.912 15.067 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.877 -5.488 13.633 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.532 -8.376 12.789 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.670 -7.049 11.653 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.489 -7.388 13.727 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -5.047 -7.747 11.774 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.331 -8.975 11.880 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.469 -7.642 10.709 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.433 -5.465 12.606 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.867 -5.287 11.567 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.002 -5.027 13.323 1.00 0.00 H new ATOM 1017 N PRO A 66 -11.126 -5.592 12.549 1.00 0.00 N ATOM 1018 CA PRO A 66 -12.477 -5.592 12.029 1.00 0.00 C ATOM 1019 C PRO A 66 -12.652 -6.726 11.031 1.00 0.00 C ATOM 1020 O PRO A 66 -11.699 -7.092 10.305 1.00 0.00 O ATOM 1021 CB PRO A 66 -12.606 -4.237 11.314 1.00 0.00 C ATOM 1022 CG PRO A 66 -11.510 -3.404 11.865 1.00 0.00 C ATOM 1023 CD PRO A 66 -10.402 -4.356 12.186 1.00 0.00 C ATOM 0 HA PRO A 66 -13.227 -5.731 12.808 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -12.510 -4.350 10.234 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -13.579 -3.783 11.502 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.186 -2.655 11.142 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -11.836 -2.867 12.756 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -9.741 -4.510 11.333 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.783 -3.994 13.007 1.00 0.00 H new ATOM 1031 N GLN A 67 -13.849 -7.253 10.972 1.00 0.00 N ATOM 1032 CA GLN A 67 -14.178 -8.386 10.133 1.00 0.00 C ATOM 1033 C GLN A 67 -13.876 -8.085 8.666 1.00 0.00 C ATOM 1034 O GLN A 67 -13.292 -8.914 7.963 1.00 0.00 O ATOM 1035 CB GLN A 67 -15.652 -8.747 10.308 1.00 0.00 C ATOM 1036 CG GLN A 67 -16.037 -10.083 9.708 1.00 0.00 C ATOM 1037 CD GLN A 67 -15.308 -11.240 10.367 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -14.949 -11.182 11.543 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -15.118 -12.296 9.645 1.00 0.00 N ATOM 0 H GLN A 67 -14.639 -6.903 11.514 1.00 0.00 H new ATOM 0 HA GLN A 67 -13.563 -9.233 10.436 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.889 -8.757 11.372 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.262 -7.967 9.853 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -17.112 -10.228 9.810 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -15.816 -10.077 8.641 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.428 -12.312 8.673 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -14.659 -13.113 10.047 1.00 0.00 H new ATOM 1048 N TYR A 68 -14.220 -6.875 8.225 1.00 0.00 N ATOM 1049 CA TYR A 68 -13.977 -6.480 6.840 1.00 0.00 C ATOM 1050 C TYR A 68 -12.484 -6.477 6.452 1.00 0.00 C ATOM 1051 O TYR A 68 -12.122 -6.867 5.336 1.00 0.00 O ATOM 1052 CB TYR A 68 -14.722 -5.164 6.434 1.00 0.00 C ATOM 1053 CG TYR A 68 -14.580 -3.958 7.368 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -13.401 -3.242 7.460 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -15.656 -3.525 8.134 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -13.287 -2.139 8.286 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -15.552 -2.421 8.968 1.00 0.00 C ATOM 1058 CZ TYR A 68 -14.362 -1.733 9.037 1.00 0.00 C ATOM 1059 OH TYR A 68 -14.245 -0.629 9.864 1.00 0.00 O ATOM 0 H TYR A 68 -14.663 -6.159 8.801 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.426 -7.269 6.237 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -14.370 -4.868 5.446 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.783 -5.393 6.339 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.549 -3.551 6.873 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.593 -4.059 8.079 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -12.354 -1.598 8.340 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.399 -2.104 9.559 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.096 -0.474 10.325 1.00 0.00 H new ATOM 1069 N GLU A 69 -11.612 -6.109 7.379 1.00 0.00 N ATOM 1070 CA GLU A 69 -10.187 -6.079 7.068 1.00 0.00 C ATOM 1071 C GLU A 69 -9.598 -7.475 7.170 1.00 0.00 C ATOM 1072 O GLU A 69 -8.646 -7.817 6.472 1.00 0.00 O ATOM 1073 CB GLU A 69 -9.431 -5.086 7.953 1.00 0.00 C ATOM 1074 CG GLU A 69 -9.994 -3.678 7.875 1.00 0.00 C ATOM 1075 CD GLU A 69 -9.163 -2.653 8.587 1.00 0.00 C ATOM 1076 OE1 GLU A 69 -8.894 -2.815 9.766 1.00 0.00 O ATOM 1077 OE2 GLU A 69 -8.796 -1.632 7.960 1.00 0.00 O ATOM 0 H GLU A 69 -11.855 -5.833 8.330 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.074 -5.731 6.041 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.466 -5.429 8.987 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.382 -5.069 7.658 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.088 -3.392 6.827 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.999 -3.675 8.298 1.00 0.00 H new ATOM 1084 N SER A 70 -10.210 -8.287 7.995 1.00 0.00 N ATOM 1085 CA SER A 70 -9.785 -9.649 8.185 1.00 0.00 C ATOM 1086 C SER A 70 -10.095 -10.492 6.937 1.00 0.00 C ATOM 1087 O SER A 70 -9.352 -11.428 6.604 1.00 0.00 O ATOM 1088 CB SER A 70 -10.453 -10.213 9.424 1.00 0.00 C ATOM 1089 OG SER A 70 -10.161 -9.393 10.546 1.00 0.00 O ATOM 0 H SER A 70 -11.020 -8.020 8.555 1.00 0.00 H new ATOM 0 HA SER A 70 -8.705 -9.679 8.331 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.531 -10.268 9.273 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.104 -11.230 9.605 1.00 0.00 H new ATOM 0 HG SER A 70 -10.675 -8.561 10.485 1.00 0.00 H new ATOM 1095 N GLU A 71 -11.184 -10.145 6.243 1.00 0.00 N ATOM 1096 CA GLU A 71 -11.533 -10.792 4.989 1.00 0.00 C ATOM 1097 C GLU A 71 -10.426 -10.521 3.970 1.00 0.00 C ATOM 1098 O GLU A 71 -9.941 -11.446 3.316 1.00 0.00 O ATOM 1099 CB GLU A 71 -12.873 -10.262 4.457 1.00 0.00 C ATOM 1100 CG GLU A 71 -13.288 -10.871 3.122 1.00 0.00 C ATOM 1101 CD GLU A 71 -14.519 -10.228 2.543 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -14.469 -9.029 2.218 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -15.538 -10.915 2.350 1.00 0.00 O ATOM 0 H GLU A 71 -11.836 -9.417 6.535 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.635 -11.864 5.155 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.651 -10.461 5.194 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.807 -9.179 4.347 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.466 -10.774 2.413 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.470 -11.937 3.256 1.00 0.00 H new ATOM 1110 N ALA A 72 -10.007 -9.250 3.885 1.00 0.00 N ATOM 1111 CA ALA A 72 -8.935 -8.829 2.972 1.00 0.00 C ATOM 1112 C ALA A 72 -7.663 -9.644 3.201 1.00 0.00 C ATOM 1113 O ALA A 72 -7.070 -10.167 2.250 1.00 0.00 O ATOM 1114 CB ALA A 72 -8.655 -7.346 3.131 1.00 0.00 C ATOM 0 H ALA A 72 -10.398 -8.491 4.442 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.270 -9.012 1.951 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.859 -7.051 2.448 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.558 -6.779 2.903 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.347 -7.142 4.157 1.00 0.00 H new ATOM 1120 N ILE A 73 -7.269 -9.767 4.463 1.00 0.00 N ATOM 1121 CA ILE A 73 -6.106 -10.574 4.846 1.00 0.00 C ATOM 1122 C ILE A 73 -6.264 -12.025 4.368 1.00 0.00 C ATOM 1123 O ILE A 73 -5.356 -12.590 3.752 1.00 0.00 O ATOM 1124 CB ILE A 73 -5.889 -10.582 6.389 1.00 0.00 C ATOM 1125 CG1 ILE A 73 -5.637 -9.164 6.909 1.00 0.00 C ATOM 1126 CG2 ILE A 73 -4.731 -11.509 6.772 1.00 0.00 C ATOM 1127 CD1 ILE A 73 -5.429 -9.093 8.405 1.00 0.00 C ATOM 0 H ILE A 73 -7.739 -9.316 5.248 1.00 0.00 H new ATOM 0 HA ILE A 73 -5.240 -10.117 4.368 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.798 -10.962 6.855 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.759 -8.754 6.409 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.483 -8.532 6.638 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.599 -11.498 7.854 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.954 -12.524 6.444 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.815 -11.165 6.291 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.256 -8.058 8.700 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.315 -9.472 8.914 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.565 -9.698 8.681 1.00 0.00 H new ATOM 1139 N MET A 74 -7.425 -12.601 4.624 1.00 0.00 N ATOM 1140 CA MET A 74 -7.688 -13.993 4.265 1.00 0.00 C ATOM 1141 C MET A 74 -7.672 -14.206 2.769 1.00 0.00 C ATOM 1142 O MET A 74 -7.160 -15.210 2.292 1.00 0.00 O ATOM 1143 CB MET A 74 -8.993 -14.495 4.867 1.00 0.00 C ATOM 1144 CG MET A 74 -9.005 -14.638 6.389 1.00 0.00 C ATOM 1145 SD MET A 74 -8.216 -16.154 7.061 1.00 0.00 S ATOM 1146 CE MET A 74 -6.485 -16.001 6.606 1.00 0.00 C ATOM 0 H MET A 74 -8.206 -12.129 5.080 1.00 0.00 H new ATOM 0 HA MET A 74 -6.875 -14.581 4.691 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.792 -13.813 4.578 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.226 -15.464 4.427 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.505 -13.771 6.820 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.040 -14.610 6.729 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.877 -16.606 7.279 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.346 -16.347 5.582 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.180 -14.957 6.681 1.00 0.00 H new ATOM 1156 N VAL A 75 -8.209 -13.262 2.036 1.00 0.00 N ATOM 1157 CA VAL A 75 -8.218 -13.336 0.589 1.00 0.00 C ATOM 1158 C VAL A 75 -6.793 -13.231 0.033 1.00 0.00 C ATOM 1159 O VAL A 75 -6.416 -13.971 -0.886 1.00 0.00 O ATOM 1160 CB VAL A 75 -9.163 -12.268 -0.027 1.00 0.00 C ATOM 1161 CG1 VAL A 75 -9.017 -12.196 -1.537 1.00 0.00 C ATOM 1162 CG2 VAL A 75 -10.608 -12.605 0.331 1.00 0.00 C ATOM 0 H VAL A 75 -8.650 -12.425 2.418 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.613 -14.310 0.300 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.889 -11.296 0.383 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.694 -11.438 -1.932 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.990 -11.934 -1.791 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -9.263 -13.164 -1.973 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -11.274 -11.857 -0.100 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.861 -13.588 -0.066 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.722 -12.611 1.415 1.00 0.00 H new ATOM 1172 N ALA A 76 -5.990 -12.366 0.628 1.00 0.00 N ATOM 1173 CA ALA A 76 -4.600 -12.220 0.222 1.00 0.00 C ATOM 1174 C ALA A 76 -3.807 -13.473 0.571 1.00 0.00 C ATOM 1175 O ALA A 76 -2.862 -13.835 -0.119 1.00 0.00 O ATOM 1176 CB ALA A 76 -3.985 -11.000 0.866 1.00 0.00 C ATOM 0 H ALA A 76 -6.275 -11.754 1.393 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.568 -12.087 -0.859 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.946 -10.907 0.551 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.537 -10.111 0.562 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.028 -11.101 1.951 1.00 0.00 H new ATOM 1182 N PHE A 77 -4.213 -14.130 1.633 1.00 0.00 N ATOM 1183 CA PHE A 77 -3.613 -15.378 2.065 1.00 0.00 C ATOM 1184 C PHE A 77 -3.990 -16.499 1.096 1.00 0.00 C ATOM 1185 O PHE A 77 -3.143 -17.289 0.687 1.00 0.00 O ATOM 1186 CB PHE A 77 -4.084 -15.703 3.497 1.00 0.00 C ATOM 1187 CG PHE A 77 -3.545 -16.983 4.084 1.00 0.00 C ATOM 1188 CD1 PHE A 77 -2.271 -17.032 4.619 1.00 0.00 C ATOM 1189 CD2 PHE A 77 -4.322 -18.132 4.108 1.00 0.00 C ATOM 1190 CE1 PHE A 77 -1.780 -18.202 5.163 1.00 0.00 C ATOM 1191 CE2 PHE A 77 -3.836 -19.303 4.652 1.00 0.00 C ATOM 1192 CZ PHE A 77 -2.562 -19.337 5.181 1.00 0.00 C ATOM 0 H PHE A 77 -4.977 -13.812 2.230 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.527 -15.284 2.068 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.801 -14.877 4.150 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.173 -15.753 3.500 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.654 -16.146 4.611 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.320 -18.110 3.696 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.782 -18.228 5.575 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.451 -20.191 4.664 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.178 -20.251 5.608 1.00 0.00 H new ATOM 1202 N GLU A 78 -5.255 -16.522 0.717 1.00 0.00 N ATOM 1203 CA GLU A 78 -5.821 -17.526 -0.176 1.00 0.00 C ATOM 1204 C GLU A 78 -5.174 -17.409 -1.569 1.00 0.00 C ATOM 1205 O GLU A 78 -4.626 -18.387 -2.099 1.00 0.00 O ATOM 1206 CB GLU A 78 -7.363 -17.309 -0.227 1.00 0.00 C ATOM 1207 CG GLU A 78 -8.227 -18.451 -0.791 1.00 0.00 C ATOM 1208 CD GLU A 78 -8.135 -18.653 -2.285 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -8.871 -17.977 -3.035 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -7.370 -19.531 -2.734 1.00 0.00 O ATOM 0 H GLU A 78 -5.936 -15.829 1.027 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.619 -18.534 0.186 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.706 -17.098 0.786 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.557 -16.416 -0.822 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -7.940 -19.379 -0.297 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -9.268 -18.260 -0.530 1.00 0.00 H new ATOM 1217 N LEU A 79 -5.162 -16.199 -2.108 1.00 0.00 N ATOM 1218 CA LEU A 79 -4.638 -15.949 -3.454 1.00 0.00 C ATOM 1219 C LEU A 79 -3.124 -15.948 -3.465 1.00 0.00 C ATOM 1220 O LEU A 79 -2.506 -16.158 -4.519 1.00 0.00 O ATOM 1221 CB LEU A 79 -5.126 -14.594 -3.988 1.00 0.00 C ATOM 1222 CG LEU A 79 -6.631 -14.426 -4.195 1.00 0.00 C ATOM 1223 CD1 LEU A 79 -6.936 -13.009 -4.651 1.00 0.00 C ATOM 1224 CD2 LEU A 79 -7.145 -15.423 -5.218 1.00 0.00 C ATOM 0 H LEU A 79 -5.511 -15.366 -1.634 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.005 -16.754 -4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.791 -13.819 -3.299 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.631 -14.408 -4.941 1.00 0.00 H new ATOM 0 HG LEU A 79 -7.135 -14.614 -3.247 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.010 -12.897 -4.796 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.597 -12.302 -3.894 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.420 -12.810 -5.590 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -8.218 -15.287 -5.351 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.638 -15.262 -6.169 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.948 -16.437 -4.869 1.00 0.00 H new ATOM 1236 N ASN A 80 -2.550 -15.743 -2.285 1.00 0.00 N ATOM 1237 CA ASN A 80 -1.112 -15.563 -2.080 1.00 0.00 C ATOM 1238 C ASN A 80 -0.737 -14.291 -2.804 1.00 0.00 C ATOM 1239 O ASN A 80 -0.085 -14.294 -3.853 1.00 0.00 O ATOM 1240 CB ASN A 80 -0.269 -16.770 -2.556 1.00 0.00 C ATOM 1241 CG ASN A 80 1.203 -16.783 -2.081 1.00 0.00 C ATOM 1242 OD1 ASN A 80 1.782 -17.858 -1.925 1.00 0.00 O ATOM 1243 ND2 ASN A 80 1.819 -15.635 -1.871 1.00 0.00 N ATOM 0 H ASN A 80 -3.085 -15.696 -1.418 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.894 -15.493 -1.014 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -0.751 -17.685 -2.213 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -0.281 -16.792 -3.646 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.795 -15.627 -1.573 1.00 0.00 H new ATOM 0 HD22 ASN A 80 1.320 -14.756 -2.007 1.00 0.00 H new ATOM 1250 N ALA A 81 -1.217 -13.225 -2.273 1.00 0.00 N ATOM 1251 CA ALA A 81 -1.115 -11.945 -2.890 1.00 0.00 C ATOM 1252 C ALA A 81 -0.326 -10.977 -2.038 1.00 0.00 C ATOM 1253 O ALA A 81 0.153 -11.324 -0.956 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.515 -11.411 -3.126 1.00 0.00 C ATOM 0 H ALA A 81 -1.704 -13.214 -1.377 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.584 -12.051 -3.836 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.456 -10.430 -3.598 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.060 -12.095 -3.777 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.037 -11.324 -2.173 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.190 -9.787 -2.547 1.00 0.00 N ATOM 1261 CA LEU A 82 0.457 -8.704 -1.871 1.00 0.00 C ATOM 1262 C LEU A 82 -0.666 -7.967 -1.157 1.00 0.00 C ATOM 1263 O LEU A 82 -1.712 -7.741 -1.757 1.00 0.00 O ATOM 1264 CB LEU A 82 1.132 -7.808 -2.955 1.00 0.00 C ATOM 1265 CG LEU A 82 2.173 -6.750 -2.525 1.00 0.00 C ATOM 1266 CD1 LEU A 82 1.572 -5.636 -1.692 1.00 0.00 C ATOM 1267 CD2 LEU A 82 3.323 -7.411 -1.795 1.00 0.00 C ATOM 0 H LEU A 82 -0.538 -9.537 -3.473 1.00 0.00 H new ATOM 0 HA LEU A 82 1.226 -9.011 -1.162 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.617 -8.471 -3.672 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.338 -7.287 -3.489 1.00 0.00 H new ATOM 0 HG LEU A 82 2.549 -6.283 -3.436 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.351 -4.924 -1.420 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.800 -5.126 -2.269 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.132 -6.055 -0.787 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.049 -6.654 -1.498 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.946 -7.920 -0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.803 -8.135 -2.453 1.00 0.00 H new ATOM 1279 N LEU A 83 -0.500 -7.636 0.093 1.00 0.00 N ATOM 1280 CA LEU A 83 -1.572 -6.967 0.798 1.00 0.00 C ATOM 1281 C LEU A 83 -1.211 -5.516 1.055 1.00 0.00 C ATOM 1282 O LEU A 83 -0.131 -5.214 1.572 1.00 0.00 O ATOM 1283 CB LEU A 83 -1.912 -7.679 2.114 1.00 0.00 C ATOM 1284 CG LEU A 83 -3.166 -7.172 2.841 1.00 0.00 C ATOM 1285 CD1 LEU A 83 -4.414 -7.483 2.041 1.00 0.00 C ATOM 1286 CD2 LEU A 83 -3.273 -7.762 4.225 1.00 0.00 C ATOM 0 H LEU A 83 0.343 -7.810 0.639 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.459 -7.002 0.166 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.039 -8.742 1.908 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.060 -7.584 2.788 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.075 -6.090 2.939 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.290 -7.115 2.575 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.352 -6.997 1.067 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.499 -8.561 1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.171 -7.384 4.713 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.329 -8.848 4.154 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.397 -7.481 4.809 1.00 0.00 H new ATOM 1298 N ILE A 84 -2.088 -4.633 0.671 1.00 0.00 N ATOM 1299 CA ILE A 84 -1.886 -3.217 0.868 1.00 0.00 C ATOM 1300 C ILE A 84 -2.790 -2.762 2.001 1.00 0.00 C ATOM 1301 O ILE A 84 -4.030 -2.835 1.883 1.00 0.00 O ATOM 1302 CB ILE A 84 -2.239 -2.423 -0.415 1.00 0.00 C ATOM 1303 CG1 ILE A 84 -1.478 -3.002 -1.621 1.00 0.00 C ATOM 1304 CG2 ILE A 84 -1.899 -0.938 -0.230 1.00 0.00 C ATOM 1305 CD1 ILE A 84 -1.865 -2.390 -2.948 1.00 0.00 C ATOM 0 H ILE A 84 -2.967 -4.870 0.211 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.838 -3.033 1.106 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.309 -2.513 -0.602 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.409 -2.858 -1.465 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.652 -4.077 -1.665 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.152 -0.391 -1.138 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.470 -0.535 0.607 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.833 -0.831 -0.027 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.284 -2.853 -3.745 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.927 -2.556 -3.130 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.664 -1.319 -2.927 1.00 0.00 H new ATOM 1317 N ALA A 85 -2.201 -2.317 3.087 1.00 0.00 N ATOM 1318 CA ALA A 85 -2.963 -1.909 4.245 1.00 0.00 C ATOM 1319 C ALA A 85 -2.302 -0.727 4.923 1.00 0.00 C ATOM 1320 O ALA A 85 -1.121 -0.499 4.756 1.00 0.00 O ATOM 1321 CB ALA A 85 -3.091 -3.067 5.223 1.00 0.00 C ATOM 0 H ALA A 85 -1.190 -2.228 3.193 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.959 -1.611 3.917 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.667 -2.748 6.092 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.599 -3.900 4.737 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.099 -3.385 5.543 1.00 0.00 H new ATOM 1327 N GLU A 86 -3.073 0.021 5.676 1.00 0.00 N ATOM 1328 CA GLU A 86 -2.543 1.168 6.390 1.00 0.00 C ATOM 1329 C GLU A 86 -2.247 0.795 7.823 1.00 0.00 C ATOM 1330 O GLU A 86 -1.199 1.142 8.363 1.00 0.00 O ATOM 1331 CB GLU A 86 -3.520 2.341 6.387 1.00 0.00 C ATOM 1332 CG GLU A 86 -3.897 2.865 5.024 1.00 0.00 C ATOM 1333 CD GLU A 86 -4.640 4.175 5.117 1.00 0.00 C ATOM 1334 OE1 GLU A 86 -5.658 4.248 5.818 1.00 0.00 O ATOM 1335 OE2 GLU A 86 -4.192 5.164 4.528 1.00 0.00 O ATOM 0 H GLU A 86 -4.071 -0.141 5.813 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.630 1.471 5.877 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.429 2.036 6.905 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.084 3.157 6.963 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.997 2.999 4.424 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.517 2.130 4.510 1.00 0.00 H new ATOM 1342 N ASP A 87 -3.175 0.069 8.428 1.00 0.00 N ATOM 1343 CA ASP A 87 -3.064 -0.300 9.824 1.00 0.00 C ATOM 1344 C ASP A 87 -2.026 -1.371 10.057 1.00 0.00 C ATOM 1345 O ASP A 87 -2.062 -2.438 9.438 1.00 0.00 O ATOM 1346 CB ASP A 87 -4.409 -0.708 10.413 1.00 0.00 C ATOM 1347 CG ASP A 87 -4.275 -1.280 11.809 1.00 0.00 C ATOM 1348 OD1 ASP A 87 -3.844 -0.555 12.738 1.00 0.00 O ATOM 1349 OD2 ASP A 87 -4.557 -2.463 11.992 1.00 0.00 O ATOM 0 H ASP A 87 -4.017 -0.276 7.967 1.00 0.00 H new ATOM 0 HA ASP A 87 -2.728 0.595 10.348 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.069 0.159 10.440 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.879 -1.447 9.764 1.00 0.00 H new ATOM 1354 N LYS A 88 -1.123 -1.079 10.968 1.00 0.00 N ATOM 1355 CA LYS A 88 -0.017 -1.936 11.304 1.00 0.00 C ATOM 1356 C LYS A 88 -0.468 -3.291 11.877 1.00 0.00 C ATOM 1357 O LYS A 88 0.221 -4.279 11.711 1.00 0.00 O ATOM 1358 CB LYS A 88 0.917 -1.196 12.270 1.00 0.00 C ATOM 1359 CG LYS A 88 2.186 -1.944 12.655 1.00 0.00 C ATOM 1360 CD LYS A 88 3.132 -1.053 13.457 1.00 0.00 C ATOM 1361 CE LYS A 88 2.551 -0.621 14.805 1.00 0.00 C ATOM 1362 NZ LYS A 88 2.375 -1.754 15.742 1.00 0.00 N ATOM 0 H LYS A 88 -1.143 -0.214 11.508 1.00 0.00 H new ATOM 0 HA LYS A 88 0.523 -2.171 10.387 1.00 0.00 H new ATOM 0 HB2 LYS A 88 1.199 -0.245 11.818 1.00 0.00 H new ATOM 0 HB3 LYS A 88 0.362 -0.965 13.179 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.928 -2.825 13.242 1.00 0.00 H new ATOM 0 HG3 LYS A 88 2.690 -2.297 11.755 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.068 -1.586 13.625 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.371 -0.166 12.870 1.00 0.00 H new ATOM 0 HE2 LYS A 88 3.209 0.121 15.258 1.00 0.00 H new ATOM 0 HE3 LYS A 88 1.588 -0.137 14.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 2.059 -1.395 16.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 1.662 -2.410 15.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 3.280 -2.254 15.856 1.00 0.00 H new ATOM 1376 N ASP A 89 -1.631 -3.343 12.517 1.00 0.00 N ATOM 1377 CA ASP A 89 -2.110 -4.606 13.105 1.00 0.00 C ATOM 1378 C ASP A 89 -2.621 -5.517 11.998 1.00 0.00 C ATOM 1379 O ASP A 89 -2.366 -6.727 12.005 1.00 0.00 O ATOM 1380 CB ASP A 89 -3.172 -4.368 14.193 1.00 0.00 C ATOM 1381 CG ASP A 89 -3.448 -5.592 15.049 1.00 0.00 C ATOM 1382 OD1 ASP A 89 -2.612 -5.916 15.938 1.00 0.00 O ATOM 1383 OD2 ASP A 89 -4.509 -6.206 14.919 1.00 0.00 O ATOM 0 H ASP A 89 -2.255 -2.546 12.645 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.276 -5.098 13.605 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.845 -3.551 14.836 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.100 -4.049 13.720 1.00 0.00 H new ATOM 1388 N VAL A 90 -3.307 -4.917 11.017 1.00 0.00 N ATOM 1389 CA VAL A 90 -3.715 -5.633 9.793 1.00 0.00 C ATOM 1390 C VAL A 90 -2.459 -6.183 9.111 1.00 0.00 C ATOM 1391 O VAL A 90 -2.356 -7.387 8.818 1.00 0.00 O ATOM 1392 CB VAL A 90 -4.459 -4.693 8.781 1.00 0.00 C ATOM 1393 CG1 VAL A 90 -4.833 -5.433 7.501 1.00 0.00 C ATOM 1394 CG2 VAL A 90 -5.705 -4.100 9.400 1.00 0.00 C ATOM 0 H VAL A 90 -3.593 -3.938 11.043 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.400 -6.431 10.080 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.768 -3.888 8.531 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.347 -4.751 6.823 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -3.930 -5.809 7.021 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.490 -6.268 7.742 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.199 -3.453 8.675 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.383 -4.902 9.692 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.432 -3.517 10.280 1.00 0.00 H new ATOM 1404 N ILE A 91 -1.494 -5.288 8.913 1.00 0.00 N ATOM 1405 CA ILE A 91 -0.216 -5.607 8.299 1.00 0.00 C ATOM 1406 C ILE A 91 0.503 -6.733 9.044 1.00 0.00 C ATOM 1407 O ILE A 91 0.926 -7.724 8.430 1.00 0.00 O ATOM 1408 CB ILE A 91 0.701 -4.344 8.235 1.00 0.00 C ATOM 1409 CG1 ILE A 91 0.089 -3.293 7.299 1.00 0.00 C ATOM 1410 CG2 ILE A 91 2.127 -4.699 7.799 1.00 0.00 C ATOM 1411 CD1 ILE A 91 0.828 -1.975 7.281 1.00 0.00 C ATOM 0 H ILE A 91 -1.583 -4.308 9.180 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.424 -5.948 7.285 1.00 0.00 H new ATOM 0 HB ILE A 91 0.766 -3.926 9.239 1.00 0.00 H new ATOM 0 HG12 ILE A 91 0.062 -3.696 6.287 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.944 -3.114 7.598 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.734 -3.794 7.767 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.561 -5.401 8.511 1.00 0.00 H new ATOM 0 HG23 ILE A 91 2.102 -5.154 6.809 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.331 -1.289 6.595 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.832 -1.547 8.283 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.854 -2.138 6.951 1.00 0.00 H new ATOM 1423 N ASN A 92 0.612 -6.605 10.359 1.00 0.00 N ATOM 1424 CA ASN A 92 1.346 -7.578 11.139 1.00 0.00 C ATOM 1425 C ASN A 92 0.709 -8.945 11.114 1.00 0.00 C ATOM 1426 O ASN A 92 1.401 -9.914 10.928 1.00 0.00 O ATOM 1427 CB ASN A 92 1.744 -7.087 12.573 1.00 0.00 C ATOM 1428 CG ASN A 92 0.629 -6.876 13.620 1.00 0.00 C ATOM 1429 OD1 ASN A 92 0.674 -5.899 14.376 1.00 0.00 O ATOM 1430 ND2 ASN A 92 -0.268 -7.809 13.780 1.00 0.00 N ATOM 0 H ASN A 92 0.204 -5.842 10.900 1.00 0.00 H new ATOM 0 HA ASN A 92 2.303 -7.691 10.630 1.00 0.00 H new ATOM 0 HB2 ASN A 92 2.452 -7.807 12.984 1.00 0.00 H new ATOM 0 HB3 ASN A 92 2.277 -6.143 12.463 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -0.947 -7.739 14.538 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -0.291 -8.608 13.147 1.00 0.00 H new ATOM 1437 N LYS A 93 -0.615 -9.012 11.242 1.00 0.00 N ATOM 1438 CA LYS A 93 -1.333 -10.286 11.181 1.00 0.00 C ATOM 1439 C LYS A 93 -1.202 -10.955 9.857 1.00 0.00 C ATOM 1440 O LYS A 93 -1.011 -12.163 9.795 1.00 0.00 O ATOM 1441 CB LYS A 93 -2.787 -10.142 11.549 1.00 0.00 C ATOM 1442 CG LYS A 93 -3.000 -9.806 13.001 1.00 0.00 C ATOM 1443 CD LYS A 93 -4.206 -10.542 13.554 1.00 0.00 C ATOM 1444 CE LYS A 93 -4.005 -12.061 13.549 1.00 0.00 C ATOM 1445 NZ LYS A 93 -2.857 -12.483 14.387 1.00 0.00 N ATOM 0 H LYS A 93 -1.213 -8.199 11.389 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.856 -10.924 11.925 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.236 -9.363 10.933 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.308 -11.071 11.317 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.112 -10.072 13.574 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -3.142 -8.731 13.113 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.400 -10.206 14.572 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -5.086 -10.291 12.962 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.912 -12.546 13.910 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -3.848 -12.400 12.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.863 -13.518 14.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -1.969 -12.185 13.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.932 -12.042 15.326 1.00 0.00 H new ATOM 1459 N ALA A 94 -1.287 -10.191 8.802 1.00 0.00 N ATOM 1460 CA ALA A 94 -1.125 -10.736 7.479 1.00 0.00 C ATOM 1461 C ALA A 94 0.274 -11.298 7.324 1.00 0.00 C ATOM 1462 O ALA A 94 0.465 -12.409 6.829 1.00 0.00 O ATOM 1463 CB ALA A 94 -1.383 -9.673 6.447 1.00 0.00 C ATOM 0 H ALA A 94 -1.468 -9.188 8.832 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.845 -11.541 7.332 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -1.258 -10.096 5.450 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.401 -9.298 6.557 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.678 -8.853 6.585 1.00 0.00 H new ATOM 1469 N LYS A 95 1.242 -10.560 7.821 1.00 0.00 N ATOM 1470 CA LYS A 95 2.621 -10.953 7.730 1.00 0.00 C ATOM 1471 C LYS A 95 2.945 -12.124 8.683 1.00 0.00 C ATOM 1472 O LYS A 95 3.847 -12.924 8.408 1.00 0.00 O ATOM 1473 CB LYS A 95 3.526 -9.724 7.896 1.00 0.00 C ATOM 1474 CG LYS A 95 5.005 -9.981 7.684 1.00 0.00 C ATOM 1475 CD LYS A 95 5.719 -8.735 7.168 1.00 0.00 C ATOM 1476 CE LYS A 95 5.567 -7.532 8.089 1.00 0.00 C ATOM 1477 NZ LYS A 95 6.229 -6.332 7.536 1.00 0.00 N ATOM 0 H LYS A 95 1.090 -9.672 8.299 1.00 0.00 H new ATOM 0 HA LYS A 95 2.823 -11.351 6.736 1.00 0.00 H new ATOM 0 HB2 LYS A 95 3.202 -8.956 7.193 1.00 0.00 H new ATOM 0 HB3 LYS A 95 3.383 -9.320 8.898 1.00 0.00 H new ATOM 0 HG2 LYS A 95 5.459 -10.299 8.623 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.136 -10.797 6.974 1.00 0.00 H new ATOM 0 HD2 LYS A 95 6.779 -8.957 7.043 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.328 -8.482 6.183 1.00 0.00 H new ATOM 0 HE2 LYS A 95 4.508 -7.324 8.244 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.993 -7.765 9.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 6.104 -5.534 8.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 7.244 -6.522 7.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 5.806 -6.095 6.616 1.00 0.00 H new ATOM 1491 N GLU A 96 2.172 -12.247 9.777 1.00 0.00 N ATOM 1492 CA GLU A 96 2.257 -13.412 10.678 1.00 0.00 C ATOM 1493 C GLU A 96 1.826 -14.651 9.918 1.00 0.00 C ATOM 1494 O GLU A 96 2.390 -15.742 10.085 1.00 0.00 O ATOM 1495 CB GLU A 96 1.320 -13.283 11.898 1.00 0.00 C ATOM 1496 CG GLU A 96 1.643 -12.185 12.887 1.00 0.00 C ATOM 1497 CD GLU A 96 0.693 -12.196 14.064 1.00 0.00 C ATOM 1498 OE1 GLU A 96 -0.373 -11.542 14.011 1.00 0.00 O ATOM 1499 OE2 GLU A 96 0.988 -12.871 15.071 1.00 0.00 O ATOM 0 H GLU A 96 1.480 -11.553 10.059 1.00 0.00 H new ATOM 0 HA GLU A 96 3.288 -13.473 11.027 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.305 -13.125 11.533 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.322 -14.234 12.431 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.666 -12.306 13.244 1.00 0.00 H new ATOM 0 HG3 GLU A 96 1.592 -11.218 12.387 1.00 0.00 H new ATOM 1506 N LEU A 97 0.838 -14.468 9.072 1.00 0.00 N ATOM 1507 CA LEU A 97 0.259 -15.541 8.297 1.00 0.00 C ATOM 1508 C LEU A 97 1.102 -15.864 7.062 1.00 0.00 C ATOM 1509 O LEU A 97 0.942 -16.921 6.460 1.00 0.00 O ATOM 1510 CB LEU A 97 -1.181 -15.188 7.911 1.00 0.00 C ATOM 1511 CG LEU A 97 -2.142 -14.925 9.088 1.00 0.00 C ATOM 1512 CD1 LEU A 97 -3.512 -14.534 8.573 1.00 0.00 C ATOM 1513 CD2 LEU A 97 -2.249 -16.154 9.983 1.00 0.00 C ATOM 0 H LEU A 97 0.409 -13.559 8.901 1.00 0.00 H new ATOM 0 HA LEU A 97 0.245 -16.440 8.914 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.161 -14.302 7.277 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.586 -16.001 7.309 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.740 -14.102 9.679 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.179 -14.352 9.416 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.430 -13.628 7.972 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.914 -15.341 7.960 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.932 -15.946 10.807 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.627 -16.995 9.402 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.265 -16.401 10.381 1.00 0.00 H new ATOM 1525 N GLY A 98 1.998 -14.968 6.704 1.00 0.00 N ATOM 1526 CA GLY A 98 2.886 -15.219 5.580 1.00 0.00 C ATOM 1527 C GLY A 98 2.587 -14.343 4.379 1.00 0.00 C ATOM 1528 O GLY A 98 3.186 -14.499 3.313 1.00 0.00 O ATOM 0 H GLY A 98 2.133 -14.069 7.166 1.00 0.00 H new ATOM 0 HA2 GLY A 98 3.916 -15.054 5.895 1.00 0.00 H new ATOM 0 HA3 GLY A 98 2.805 -16.266 5.288 1.00 0.00 H new ATOM 1532 N VAL A 99 1.675 -13.427 4.542 1.00 0.00 N ATOM 1533 CA VAL A 99 1.301 -12.526 3.480 1.00 0.00 C ATOM 1534 C VAL A 99 2.107 -11.248 3.616 1.00 0.00 C ATOM 1535 O VAL A 99 2.187 -10.674 4.703 1.00 0.00 O ATOM 1536 CB VAL A 99 -0.208 -12.179 3.552 1.00 0.00 C ATOM 1537 CG1 VAL A 99 -0.627 -11.276 2.403 1.00 0.00 C ATOM 1538 CG2 VAL A 99 -1.049 -13.439 3.577 1.00 0.00 C ATOM 0 H VAL A 99 1.167 -13.281 5.414 1.00 0.00 H new ATOM 0 HA VAL A 99 1.501 -13.010 2.524 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.377 -11.634 4.481 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.691 -11.053 2.485 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.057 -10.348 2.443 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.434 -11.779 1.456 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.104 -13.171 3.628 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.865 -14.018 2.672 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.784 -14.036 4.450 1.00 0.00 H new ATOM 1548 N ASN A 100 2.717 -10.806 2.545 1.00 0.00 N ATOM 1549 CA ASN A 100 3.474 -9.579 2.611 1.00 0.00 C ATOM 1550 C ASN A 100 2.543 -8.391 2.548 1.00 0.00 C ATOM 1551 O ASN A 100 2.072 -7.998 1.467 1.00 0.00 O ATOM 1552 CB ASN A 100 4.535 -9.479 1.515 1.00 0.00 C ATOM 1553 CG ASN A 100 5.433 -8.251 1.693 1.00 0.00 C ATOM 1554 OD1 ASN A 100 6.456 -8.309 2.378 1.00 0.00 O ATOM 1555 ND2 ASN A 100 5.068 -7.147 1.097 1.00 0.00 N ATOM 0 H ASN A 100 2.707 -11.265 1.634 1.00 0.00 H new ATOM 0 HA ASN A 100 4.003 -9.581 3.564 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.148 -10.380 1.521 1.00 0.00 H new ATOM 0 HB3 ASN A 100 4.047 -9.433 0.542 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.635 -6.304 1.193 1.00 0.00 H new ATOM 0 HD22 ASN A 100 4.216 -7.128 0.536 1.00 0.00 H new ATOM 1562 N ALA A 101 2.222 -7.881 3.695 1.00 0.00 N ATOM 1563 CA ALA A 101 1.406 -6.716 3.811 1.00 0.00 C ATOM 1564 C ALA A 101 2.298 -5.536 4.043 1.00 0.00 C ATOM 1565 O ALA A 101 3.233 -5.614 4.845 1.00 0.00 O ATOM 1566 CB ALA A 101 0.424 -6.869 4.950 1.00 0.00 C ATOM 0 H ALA A 101 2.524 -8.268 4.589 1.00 0.00 H new ATOM 0 HA ALA A 101 0.833 -6.573 2.895 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -0.190 -5.971 5.024 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.216 -7.732 4.766 1.00 0.00 H new ATOM 0 HB3 ALA A 101 0.969 -7.014 5.883 1.00 0.00 H new ATOM 1572 N ILE A 102 2.053 -4.480 3.329 1.00 0.00 N ATOM 1573 CA ILE A 102 2.843 -3.277 3.440 1.00 0.00 C ATOM 1574 C ILE A 102 1.959 -2.028 3.386 1.00 0.00 C ATOM 1575 O ILE A 102 0.830 -2.092 2.867 1.00 0.00 O ATOM 1576 CB ILE A 102 4.009 -3.210 2.371 1.00 0.00 C ATOM 1577 CG1 ILE A 102 3.561 -3.602 0.937 1.00 0.00 C ATOM 1578 CG2 ILE A 102 5.209 -4.036 2.801 1.00 0.00 C ATOM 1579 CD1 ILE A 102 2.647 -2.614 0.246 1.00 0.00 C ATOM 0 H ILE A 102 1.297 -4.421 2.647 1.00 0.00 H new ATOM 0 HA ILE A 102 3.325 -3.308 4.417 1.00 0.00 H new ATOM 0 HB ILE A 102 4.303 -2.161 2.328 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.451 -3.739 0.322 1.00 0.00 H new ATOM 0 HG13 ILE A 102 3.055 -4.566 0.984 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.989 -3.966 2.043 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.590 -3.658 3.750 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.910 -5.078 2.919 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.395 -2.985 -0.748 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.735 -2.493 0.830 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.152 -1.652 0.157 1.00 0.00 H new ATOM 1591 N PRO A 103 2.424 -0.900 3.965 1.00 0.00 N ATOM 1592 CA PRO A 103 1.701 0.368 3.907 1.00 0.00 C ATOM 1593 C PRO A 103 1.662 0.943 2.490 1.00 0.00 C ATOM 1594 O PRO A 103 2.468 0.563 1.617 1.00 0.00 O ATOM 1595 CB PRO A 103 2.510 1.303 4.823 1.00 0.00 C ATOM 1596 CG PRO A 103 3.365 0.402 5.637 1.00 0.00 C ATOM 1597 CD PRO A 103 3.653 -0.781 4.766 1.00 0.00 C ATOM 0 HA PRO A 103 0.661 0.247 4.211 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.113 2.000 4.241 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.853 1.901 5.455 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.287 0.902 5.936 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.855 0.100 6.552 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.530 -0.619 4.140 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.842 -1.680 5.353 1.00 0.00 H new ATOM 1605 N ILE A 104 0.757 1.871 2.283 1.00 0.00 N ATOM 1606 CA ILE A 104 0.547 2.528 1.000 1.00 0.00 C ATOM 1607 C ILE A 104 1.818 3.208 0.503 1.00 0.00 C ATOM 1608 O ILE A 104 2.196 3.050 -0.655 1.00 0.00 O ATOM 1609 CB ILE A 104 -0.599 3.560 1.111 1.00 0.00 C ATOM 1610 CG1 ILE A 104 -1.903 2.840 1.438 1.00 0.00 C ATOM 1611 CG2 ILE A 104 -0.734 4.404 -0.160 1.00 0.00 C ATOM 1612 CD1 ILE A 104 -3.059 3.763 1.666 1.00 0.00 C ATOM 0 H ILE A 104 0.128 2.203 3.015 1.00 0.00 H new ATOM 0 HA ILE A 104 0.273 1.762 0.275 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.361 4.252 1.919 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.147 2.161 0.621 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.757 2.228 2.328 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.551 5.116 -0.039 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.195 4.945 -0.338 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.943 3.753 -1.009 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -3.951 3.179 1.893 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -2.836 4.426 2.502 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.233 4.357 0.769 1.00 0.00 H new ATOM 1624 N GLU A 105 2.472 3.935 1.385 1.00 0.00 N ATOM 1625 CA GLU A 105 3.698 4.642 1.061 1.00 0.00 C ATOM 1626 C GLU A 105 4.776 3.660 0.582 1.00 0.00 C ATOM 1627 O GLU A 105 5.516 3.941 -0.359 1.00 0.00 O ATOM 1628 CB GLU A 105 4.228 5.467 2.253 1.00 0.00 C ATOM 1629 CG GLU A 105 3.214 6.402 2.950 1.00 0.00 C ATOM 1630 CD GLU A 105 2.234 5.677 3.866 1.00 0.00 C ATOM 1631 OE1 GLU A 105 1.202 5.189 3.382 1.00 0.00 O ATOM 1632 OE2 GLU A 105 2.498 5.570 5.086 1.00 0.00 O ATOM 0 H GLU A 105 2.168 4.054 2.352 1.00 0.00 H new ATOM 0 HA GLU A 105 3.461 5.339 0.257 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.622 4.776 2.998 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.065 6.071 1.904 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.760 7.144 3.533 1.00 0.00 H new ATOM 0 HG3 GLU A 105 2.652 6.944 2.189 1.00 0.00 H new ATOM 1639 N GLU A 106 4.814 2.486 1.201 1.00 0.00 N ATOM 1640 CA GLU A 106 5.754 1.439 0.832 1.00 0.00 C ATOM 1641 C GLU A 106 5.413 0.926 -0.567 1.00 0.00 C ATOM 1642 O GLU A 106 6.296 0.667 -1.380 1.00 0.00 O ATOM 1643 CB GLU A 106 5.671 0.292 1.832 1.00 0.00 C ATOM 1644 CG GLU A 106 6.700 -0.810 1.634 1.00 0.00 C ATOM 1645 CD GLU A 106 8.106 -0.333 1.864 1.00 0.00 C ATOM 1646 OE1 GLU A 106 8.474 -0.090 3.033 1.00 0.00 O ATOM 1647 OE2 GLU A 106 8.882 -0.229 0.906 1.00 0.00 O ATOM 0 H GLU A 106 4.194 2.235 1.971 1.00 0.00 H new ATOM 0 HA GLU A 106 6.766 1.843 0.838 1.00 0.00 H new ATOM 0 HB2 GLU A 106 5.784 0.698 2.837 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.675 -0.147 1.776 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.483 -1.632 2.316 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.615 -1.205 0.621 1.00 0.00 H new ATOM 1654 N LEU A 107 4.125 0.805 -0.835 1.00 0.00 N ATOM 1655 CA LEU A 107 3.625 0.366 -2.128 1.00 0.00 C ATOM 1656 C LEU A 107 4.011 1.403 -3.190 1.00 0.00 C ATOM 1657 O LEU A 107 4.542 1.053 -4.240 1.00 0.00 O ATOM 1658 CB LEU A 107 2.079 0.146 -2.036 1.00 0.00 C ATOM 1659 CG LEU A 107 1.320 -0.465 -3.250 1.00 0.00 C ATOM 1660 CD1 LEU A 107 1.168 0.513 -4.404 1.00 0.00 C ATOM 1661 CD2 LEU A 107 1.990 -1.752 -3.721 1.00 0.00 C ATOM 0 H LEU A 107 3.391 1.010 -0.158 1.00 0.00 H new ATOM 0 HA LEU A 107 4.071 -0.585 -2.418 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.891 -0.496 -1.176 1.00 0.00 H new ATOM 0 HB3 LEU A 107 1.624 1.112 -1.818 1.00 0.00 H new ATOM 0 HG LEU A 107 0.315 -0.699 -2.900 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.631 0.031 -5.221 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.610 1.387 -4.069 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.154 0.823 -4.750 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.440 -2.159 -4.570 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.016 -1.539 -4.021 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.993 -2.479 -2.909 1.00 0.00 H new ATOM 1673 N LEU A 108 3.782 2.671 -2.880 1.00 0.00 N ATOM 1674 CA LEU A 108 4.119 3.788 -3.768 1.00 0.00 C ATOM 1675 C LEU A 108 5.624 3.810 -4.062 1.00 0.00 C ATOM 1676 O LEU A 108 6.048 4.065 -5.191 1.00 0.00 O ATOM 1677 CB LEU A 108 3.703 5.121 -3.128 1.00 0.00 C ATOM 1678 CG LEU A 108 2.204 5.324 -2.847 1.00 0.00 C ATOM 1679 CD1 LEU A 108 2.001 6.585 -2.021 1.00 0.00 C ATOM 1680 CD2 LEU A 108 1.401 5.411 -4.153 1.00 0.00 C ATOM 0 H LEU A 108 3.354 2.962 -2.001 1.00 0.00 H new ATOM 0 HA LEU A 108 3.577 3.652 -4.704 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.241 5.227 -2.186 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.038 5.928 -3.779 1.00 0.00 H new ATOM 0 HG LEU A 108 1.841 4.462 -2.287 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.938 6.724 -1.825 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.535 6.491 -1.076 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.384 7.445 -2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.345 5.554 -3.922 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.760 6.252 -4.746 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.526 4.488 -4.719 1.00 0.00 H new ATOM 1692 N ALA A 109 6.421 3.524 -3.048 1.00 0.00 N ATOM 1693 CA ALA A 109 7.871 3.509 -3.183 1.00 0.00 C ATOM 1694 C ALA A 109 8.358 2.267 -3.941 1.00 0.00 C ATOM 1695 O ALA A 109 9.487 2.231 -4.439 1.00 0.00 O ATOM 1696 CB ALA A 109 8.533 3.606 -1.819 1.00 0.00 C ATOM 0 H ALA A 109 6.086 3.296 -2.112 1.00 0.00 H new ATOM 0 HA ALA A 109 8.158 4.380 -3.771 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.616 3.593 -1.939 1.00 0.00 H new ATOM 0 HB2 ALA A 109 8.232 4.535 -1.334 1.00 0.00 H new ATOM 0 HB3 ALA A 109 8.226 2.760 -1.205 1.00 0.00 H new ATOM 1702 N SER A 110 7.500 1.273 -4.056 1.00 0.00 N ATOM 1703 CA SER A 110 7.829 0.038 -4.750 1.00 0.00 C ATOM 1704 C SER A 110 7.265 0.062 -6.169 1.00 0.00 C ATOM 1705 O SER A 110 7.184 -0.972 -6.836 1.00 0.00 O ATOM 1706 CB SER A 110 7.260 -1.154 -3.979 1.00 0.00 C ATOM 1707 OG SER A 110 7.741 -1.163 -2.637 1.00 0.00 O ATOM 0 H SER A 110 6.555 1.296 -3.672 1.00 0.00 H new ATOM 0 HA SER A 110 8.913 -0.058 -4.808 1.00 0.00 H new ATOM 0 HB2 SER A 110 6.171 -1.107 -3.980 1.00 0.00 H new ATOM 0 HB3 SER A 110 7.540 -2.082 -4.477 1.00 0.00 H new ATOM 0 HG SER A 110 7.106 -0.691 -2.059 1.00 0.00 H new ATOM 1713 N SER A 111 6.881 1.241 -6.618 1.00 0.00 N ATOM 1714 CA SER A 111 6.351 1.404 -7.934 1.00 0.00 C ATOM 1715 C SER A 111 7.473 1.239 -8.946 1.00 0.00 C ATOM 1716 O SER A 111 8.394 2.071 -9.033 1.00 0.00 O ATOM 1717 CB SER A 111 5.668 2.769 -8.069 1.00 0.00 C ATOM 1718 OG SER A 111 4.975 2.911 -9.310 1.00 0.00 O ATOM 0 H SER A 111 6.932 2.102 -6.074 1.00 0.00 H new ATOM 0 HA SER A 111 5.595 0.643 -8.125 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.966 2.904 -7.246 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.416 3.557 -7.982 1.00 0.00 H new ATOM 0 HG SER A 111 4.413 3.714 -9.281 1.00 0.00 H new ATOM 1724 N LEU A 112 7.430 0.143 -9.651 1.00 0.00 N ATOM 1725 CA LEU A 112 8.419 -0.166 -10.632 1.00 0.00 C ATOM 1726 C LEU A 112 7.757 -0.302 -11.988 1.00 0.00 C ATOM 1727 O LEU A 112 7.372 -1.411 -12.397 1.00 0.00 O ATOM 1728 CB LEU A 112 9.165 -1.467 -10.277 1.00 0.00 C ATOM 1729 CG LEU A 112 9.881 -1.521 -8.916 1.00 0.00 C ATOM 1730 CD1 LEU A 112 10.506 -2.886 -8.704 1.00 0.00 C ATOM 1731 CD2 LEU A 112 10.942 -0.440 -8.815 1.00 0.00 C ATOM 0 H LEU A 112 6.700 -0.563 -9.556 1.00 0.00 H new ATOM 0 HA LEU A 112 9.148 0.644 -10.658 1.00 0.00 H new ATOM 0 HB2 LEU A 112 8.448 -2.288 -10.314 1.00 0.00 H new ATOM 0 HB3 LEU A 112 9.905 -1.655 -11.055 1.00 0.00 H new ATOM 0 HG LEU A 112 9.139 -1.345 -8.137 1.00 0.00 H new ATOM 0 HD11 LEU A 112 11.009 -2.910 -7.737 1.00 0.00 H new ATOM 0 HD12 LEU A 112 9.729 -3.650 -8.727 1.00 0.00 H new ATOM 0 HD13 LEU A 112 11.230 -3.081 -9.495 1.00 0.00 H new ATOM 0 HD21 LEU A 112 11.432 -0.501 -7.843 1.00 0.00 H new ATOM 0 HD22 LEU A 112 11.681 -0.581 -9.604 1.00 0.00 H new ATOM 0 HD23 LEU A 112 10.476 0.539 -8.925 1.00 0.00 H new ATOM 1743 N GLU A 113 7.554 0.825 -12.649 1.00 0.00 N ATOM 1744 CA GLU A 113 6.956 0.847 -13.976 1.00 0.00 C ATOM 1745 C GLU A 113 7.930 0.216 -14.947 1.00 0.00 C ATOM 1746 O GLU A 113 7.540 -0.486 -15.888 1.00 0.00 O ATOM 1747 CB GLU A 113 6.651 2.286 -14.450 1.00 0.00 C ATOM 1748 CG GLU A 113 5.962 3.183 -13.429 1.00 0.00 C ATOM 1749 CD GLU A 113 6.940 3.991 -12.594 1.00 0.00 C ATOM 1750 OE1 GLU A 113 7.742 3.417 -11.847 1.00 0.00 O ATOM 1751 OE2 GLU A 113 6.925 5.245 -12.692 1.00 0.00 O ATOM 0 H GLU A 113 7.797 1.746 -12.285 1.00 0.00 H new ATOM 0 HA GLU A 113 6.015 0.299 -13.936 1.00 0.00 H new ATOM 0 HB2 GLU A 113 7.588 2.757 -14.748 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.024 2.231 -15.340 1.00 0.00 H new ATOM 0 HG2 GLU A 113 5.287 3.864 -13.948 1.00 0.00 H new ATOM 0 HG3 GLU A 113 5.350 2.569 -12.769 1.00 0.00 H new ATOM 1758 N HIS A 114 9.208 0.470 -14.677 1.00 0.00 N ATOM 1759 CA HIS A 114 10.342 -0.021 -15.438 1.00 0.00 C ATOM 1760 C HIS A 114 10.500 0.679 -16.783 1.00 0.00 C ATOM 1761 O HIS A 114 9.623 1.441 -17.216 1.00 0.00 O ATOM 1762 CB HIS A 114 10.364 -1.553 -15.578 1.00 0.00 C ATOM 1763 CG HIS A 114 10.622 -2.303 -14.297 1.00 0.00 C ATOM 1764 ND1 HIS A 114 9.762 -3.244 -13.784 1.00 0.00 N ATOM 1765 CD2 HIS A 114 11.694 -2.298 -13.467 1.00 0.00 C ATOM 1766 CE1 HIS A 114 10.289 -3.780 -12.708 1.00 0.00 C ATOM 1767 NE2 HIS A 114 11.457 -3.227 -12.492 1.00 0.00 N ATOM 0 H HIS A 114 9.488 1.050 -13.886 1.00 0.00 H new ATOM 0 HA HIS A 114 11.218 0.241 -14.845 1.00 0.00 H new ATOM 0 HB2 HIS A 114 9.408 -1.880 -15.987 1.00 0.00 H new ATOM 0 HB3 HIS A 114 11.131 -1.826 -16.303 1.00 0.00 H new ATOM 0 HD2 HIS A 114 12.572 -1.676 -13.559 1.00 0.00 H new ATOM 0 HE1 HIS A 114 9.835 -4.549 -12.101 1.00 0.00 H new ATOM 0 HE2 HIS A 114 12.087 -3.453 -11.722 1.00 0.00 H new ATOM 1776 N HIS A 115 11.629 0.431 -17.434 1.00 0.00 N ATOM 1777 CA HIS A 115 11.982 1.095 -18.698 1.00 0.00 C ATOM 1778 C HIS A 115 11.057 0.733 -19.856 1.00 0.00 C ATOM 1779 O HIS A 115 11.002 1.468 -20.839 1.00 0.00 O ATOM 1780 CB HIS A 115 13.467 0.864 -19.101 1.00 0.00 C ATOM 1781 CG HIS A 115 13.867 -0.575 -19.341 1.00 0.00 C ATOM 1782 ND1 HIS A 115 13.547 -1.282 -20.485 1.00 0.00 N ATOM 1783 CD2 HIS A 115 14.572 -1.432 -18.572 1.00 0.00 C ATOM 1784 CE1 HIS A 115 14.035 -2.495 -20.400 1.00 0.00 C ATOM 1785 NE2 HIS A 115 14.660 -2.610 -19.253 1.00 0.00 N ATOM 0 H HIS A 115 12.330 -0.234 -17.107 1.00 0.00 H new ATOM 0 HA HIS A 115 11.845 2.157 -18.497 1.00 0.00 H new ATOM 0 HB2 HIS A 115 13.671 1.434 -20.007 1.00 0.00 H new ATOM 0 HB3 HIS A 115 14.105 1.273 -18.317 1.00 0.00 H new ATOM 0 HD1 HIS A 115 13.013 -0.916 -21.273 1.00 0.00 H new ATOM 0 HD2 HIS A 115 14.989 -1.223 -17.598 1.00 0.00 H new ATOM 0 HE1 HIS A 115 13.939 -3.269 -21.147 1.00 0.00 H new ATOM 1794 N HIS A 116 10.371 -0.410 -19.747 1.00 0.00 N ATOM 1795 CA HIS A 116 9.429 -0.897 -20.778 1.00 0.00 C ATOM 1796 C HIS A 116 10.153 -1.264 -22.070 1.00 0.00 C ATOM 1797 O HIS A 116 11.386 -1.232 -22.146 1.00 0.00 O ATOM 1798 CB HIS A 116 8.294 0.115 -21.077 1.00 0.00 C ATOM 1799 CG HIS A 116 7.332 0.328 -19.956 1.00 0.00 C ATOM 1800 ND1 HIS A 116 7.034 1.567 -19.442 1.00 0.00 N ATOM 1801 CD2 HIS A 116 6.565 -0.549 -19.277 1.00 0.00 C ATOM 1802 CE1 HIS A 116 6.132 1.440 -18.498 1.00 0.00 C ATOM 1803 NE2 HIS A 116 5.830 0.170 -18.378 1.00 0.00 N ATOM 0 H HIS A 116 10.449 -1.030 -18.941 1.00 0.00 H new ATOM 0 HA HIS A 116 8.970 -1.795 -20.363 1.00 0.00 H new ATOM 0 HB2 HIS A 116 8.741 1.074 -21.340 1.00 0.00 H new ATOM 0 HB3 HIS A 116 7.741 -0.229 -21.951 1.00 0.00 H new ATOM 0 HD2 HIS A 116 6.537 -1.619 -19.418 1.00 0.00 H new ATOM 0 HE1 HIS A 116 5.709 2.246 -17.917 1.00 0.00 H new ATOM 0 HE2 HIS A 116 5.155 -0.219 -17.719 1.00 0.00 H new ATOM 1812 N HIS A 117 9.402 -1.656 -23.056 1.00 0.00 N ATOM 1813 CA HIS A 117 9.943 -2.000 -24.351 1.00 0.00 C ATOM 1814 C HIS A 117 9.136 -1.306 -25.410 1.00 0.00 C ATOM 1815 O HIS A 117 7.976 -1.654 -25.639 1.00 0.00 O ATOM 1816 CB HIS A 117 9.914 -3.522 -24.596 1.00 0.00 C ATOM 1817 CG HIS A 117 10.756 -4.318 -23.648 1.00 0.00 C ATOM 1818 ND1 HIS A 117 10.230 -5.069 -22.625 1.00 0.00 N ATOM 1819 CD2 HIS A 117 12.093 -4.477 -23.576 1.00 0.00 C ATOM 1820 CE1 HIS A 117 11.200 -5.650 -21.962 1.00 0.00 C ATOM 1821 NE2 HIS A 117 12.346 -5.311 -22.515 1.00 0.00 N ATOM 0 H HIS A 117 8.388 -1.749 -22.991 1.00 0.00 H new ATOM 0 HA HIS A 117 10.984 -1.679 -24.387 1.00 0.00 H new ATOM 0 HB2 HIS A 117 8.883 -3.869 -24.526 1.00 0.00 H new ATOM 0 HB3 HIS A 117 10.249 -3.720 -25.614 1.00 0.00 H new ATOM 0 HD2 HIS A 117 12.828 -4.032 -24.231 1.00 0.00 H new ATOM 0 HE1 HIS A 117 11.080 -6.298 -21.106 1.00 0.00 H new ATOM 0 HE2 HIS A 117 13.269 -5.617 -22.206 1.00 0.00 H new ATOM 1830 N HIS A 118 9.706 -0.305 -26.026 1.00 0.00 N ATOM 1831 CA HIS A 118 9.000 0.406 -27.060 1.00 0.00 C ATOM 1832 C HIS A 118 9.504 -0.047 -28.400 1.00 0.00 C ATOM 1833 O HIS A 118 10.696 -0.330 -28.554 1.00 0.00 O ATOM 1834 CB HIS A 118 9.114 1.957 -26.925 1.00 0.00 C ATOM 1835 CG HIS A 118 10.457 2.585 -27.287 1.00 0.00 C ATOM 1836 ND1 HIS A 118 11.396 2.961 -26.359 1.00 0.00 N ATOM 1837 CD2 HIS A 118 10.975 2.940 -28.495 1.00 0.00 C ATOM 1838 CE1 HIS A 118 12.423 3.514 -26.967 1.00 0.00 C ATOM 1839 NE2 HIS A 118 12.190 3.511 -28.260 1.00 0.00 N ATOM 0 H HIS A 118 10.648 0.035 -25.833 1.00 0.00 H new ATOM 0 HA HIS A 118 7.940 0.173 -26.957 1.00 0.00 H new ATOM 0 HB2 HIS A 118 8.347 2.409 -27.554 1.00 0.00 H new ATOM 0 HB3 HIS A 118 8.881 2.226 -25.895 1.00 0.00 H new ATOM 0 HD2 HIS A 118 10.510 2.796 -29.459 1.00 0.00 H new ATOM 0 HE1 HIS A 118 13.307 3.904 -26.485 1.00 0.00 H new ATOM 0 HE2 HIS A 118 12.819 3.878 -28.975 1.00 0.00 H new ATOM 1848 N HIS A 119 8.635 -0.121 -29.346 1.00 0.00 N ATOM 1849 CA HIS A 119 9.014 -0.477 -30.673 1.00 0.00 C ATOM 1850 C HIS A 119 8.779 0.726 -31.541 1.00 0.00 C ATOM 1851 O HIS A 119 9.747 1.402 -31.890 1.00 0.00 O ATOM 1852 CB HIS A 119 8.227 -1.692 -31.176 1.00 0.00 C ATOM 1853 CG HIS A 119 8.686 -2.214 -32.513 1.00 0.00 C ATOM 1854 ND1 HIS A 119 9.656 -3.177 -32.649 1.00 0.00 N ATOM 1855 CD2 HIS A 119 8.291 -1.912 -33.769 1.00 0.00 C ATOM 1856 CE1 HIS A 119 9.838 -3.443 -33.922 1.00 0.00 C ATOM 1857 NE2 HIS A 119 9.022 -2.691 -34.619 1.00 0.00 N ATOM 1858 OXT HIS A 119 7.603 1.049 -31.800 1.00 0.00 O ATOM 0 H HIS A 119 7.639 0.063 -29.224 1.00 0.00 H new ATOM 0 HA HIS A 119 10.064 -0.766 -30.701 1.00 0.00 H new ATOM 0 HB2 HIS A 119 8.305 -2.492 -30.440 1.00 0.00 H new ATOM 0 HB3 HIS A 119 7.173 -1.425 -31.245 1.00 0.00 H new ATOM 0 HD2 HIS A 119 7.538 -1.190 -34.048 1.00 0.00 H new ATOM 0 HE1 HIS A 119 10.539 -4.158 -34.325 1.00 0.00 H new ATOM 0 HE2 HIS A 119 8.945 -2.688 -35.636 1.00 0.00 H new TER 1867 HIS A 119