USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1080 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 NoAdj-H: A 46 HIS HD1 : A 46 HIS ND1 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 48 HIS HE2 : A 48 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 63 HIS HD1 : A 63 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 71 HIS HD1 : A 71 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 80 HIS HD1 : A 80 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 120 HIS HE2 : A 120 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD Set 1.1: A 133 GLN : amide:sc= -0.4 K(o=0.92,f=-2.5!) USER MOD Set 1.2: A 137 THR OG1 : rot 155:sc= 1.22 USER MOD Set 1.3: A 139 ASN : amide:sc= 0.0963 K(o=0.92,f=-2.5) USER MOD Set 2.1: A 22 GLN : amide:sc= 1.29 K(o=2.5,f=-1.2!) USER MOD Set 2.2: A 105 SER OG : rot 34:sc= 1.19 USER MOD Single : A 1 ALA N :NH3+ -119:sc= 0.816 (180deg=-4.75!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc=-0.00486 X(o=-0.0049,f=-0.039) USER MOD Single : A 19 ASN : amide:sc= -0.0291 X(o=-0.029,f=0.014) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0.363 X(o=0.36,f=-0.08) USER MOD Single : A 30 LYS NZ :NH3+ 162:sc= 1.25 (180deg=1.04) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : +bothHN:sc= -2.21 K(o=-2.2,f=-6.9!) USER MOD Single : A 53 ASN : amide:sc= -0.236 X(o=-0.24,f=-0.0025) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0195 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.063 USER MOD Single : A 59 SER OG : rot 67:sc= 0.269 USER MOD Single : A 65 ASN :FLIP amide:sc= -0.212 F(o=-0.81,f=-0.21) USER MOD Single : A 68 SER OG : rot -133:sc= 1.08 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ -122:sc= 0.67 (180deg=0.328) USER MOD Single : A 86 ASN : amide:sc= 1.01 K(o=1,f=-0.95) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 48:sc= 0.368 USER MOD Single : A 102 SER OG : rot 180:sc= 0.00633 USER MOD Single : A 107 SER OG : rot 180:sc= -0.377 USER MOD Single : A 110 HIS : no HD1:sc= -0.202 K(o=-0.2,f=-0.91) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 126:sc= 1.11 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN :FLIP amide:sc= -0.673 F(o=-4.9!,f=-0.67) USER MOD Single : A 134 SER OG : rot -177:sc= 1.21 USER MOD Single : A 135 THR OG1 : rot 70:sc= 0.696 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0.17 USER MOD Single : A 153 GLN : amide:sc= 1.26 K(o=1.3,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 16.266 10.875 5.441 1.00 0.00 N ATOM 2 CA ALA A 1 14.947 10.574 6.032 1.00 0.00 C ATOM 3 C ALA A 1 15.059 9.938 7.414 1.00 0.00 C ATOM 4 O ALA A 1 15.985 10.294 8.136 1.00 0.00 O ATOM 5 CB ALA A 1 14.265 11.891 6.280 1.00 0.00 C ATOM 0 H1 ALA A 1 16.346 11.898 5.274 1.00 0.00 H new ATOM 0 H2 ALA A 1 17.016 10.571 6.093 1.00 0.00 H new ATOM 0 H3 ALA A 1 16.366 10.368 4.538 1.00 0.00 H new ATOM 0 HA ALA A 1 14.426 9.901 5.351 1.00 0.00 H new ATOM 0 HB1 ALA A 1 13.283 11.715 6.718 1.00 0.00 H new ATOM 0 HB2 ALA A 1 14.866 12.489 6.965 1.00 0.00 H new ATOM 0 HB3 ALA A 1 14.151 12.425 5.337 1.00 0.00 H new ATOM 13 N THR A 2 14.123 9.066 7.804 1.00 0.00 N ATOM 14 CA THR A 2 14.063 8.502 9.150 1.00 0.00 C ATOM 15 C THR A 2 13.168 7.254 9.161 1.00 0.00 C ATOM 16 O THR A 2 12.631 6.889 8.117 1.00 0.00 O ATOM 17 CB THR A 2 13.491 9.531 10.138 1.00 0.00 C ATOM 18 OG1 THR A 2 12.259 10.044 9.677 1.00 0.00 O ATOM 19 CG2 THR A 2 14.414 10.691 10.521 1.00 0.00 C ATOM 0 H THR A 2 13.382 8.732 7.188 1.00 0.00 H new ATOM 0 HA THR A 2 15.075 8.233 9.451 1.00 0.00 H new ATOM 0 HB THR A 2 13.360 8.956 11.055 1.00 0.00 H new ATOM 0 HG1 THR A 2 11.914 10.695 10.323 1.00 0.00 H new ATOM 0 HG21 THR A 2 13.900 11.349 11.222 1.00 0.00 H new ATOM 0 HG22 THR A 2 15.317 10.298 10.988 1.00 0.00 H new ATOM 0 HG23 THR A 2 14.683 11.253 9.626 1.00 0.00 H new ATOM 27 N LYS A 3 13.016 6.637 10.344 1.00 0.00 N ATOM 28 CA LYS A 3 12.045 5.596 10.656 1.00 0.00 C ATOM 29 C LYS A 3 10.631 6.178 10.863 1.00 0.00 C ATOM 30 O LYS A 3 10.407 7.045 11.709 1.00 0.00 O ATOM 31 CB LYS A 3 12.509 4.776 11.876 1.00 0.00 C ATOM 32 CG LYS A 3 12.796 5.610 13.137 1.00 0.00 C ATOM 33 CD LYS A 3 13.050 4.715 14.359 1.00 0.00 C ATOM 34 CE LYS A 3 13.109 5.590 15.622 1.00 0.00 C ATOM 35 NZ LYS A 3 13.474 4.819 16.828 1.00 0.00 N ATOM 0 H LYS A 3 13.602 6.869 11.146 1.00 0.00 H new ATOM 0 HA LYS A 3 11.984 4.923 9.801 1.00 0.00 H new ATOM 0 HB2 LYS A 3 11.744 4.036 12.112 1.00 0.00 H new ATOM 0 HB3 LYS A 3 13.411 4.227 11.606 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.664 6.246 12.964 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.952 6.270 13.338 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.257 3.973 14.453 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.985 4.168 14.237 1.00 0.00 H new ATOM 0 HE2 LYS A 3 13.835 6.390 15.473 1.00 0.00 H new ATOM 0 HE3 LYS A 3 12.140 6.064 15.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 13.500 5.454 17.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 12.769 4.072 16.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 14.411 4.388 16.694 1.00 0.00 H new ATOM 49 N ALA A 4 9.664 5.655 10.115 1.00 0.00 N ATOM 50 CA ALA A 4 8.249 5.961 10.157 1.00 0.00 C ATOM 51 C ALA A 4 7.483 4.656 10.320 1.00 0.00 C ATOM 52 O ALA A 4 8.034 3.587 10.058 1.00 0.00 O ATOM 53 CB ALA A 4 7.858 6.703 8.877 1.00 0.00 C ATOM 0 H ALA A 4 9.873 4.950 9.409 1.00 0.00 H new ATOM 0 HA ALA A 4 8.007 6.609 10.999 1.00 0.00 H new ATOM 0 HB1 ALA A 4 6.794 6.936 8.902 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.430 7.628 8.803 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.071 6.074 8.012 1.00 0.00 H new ATOM 59 N VAL A 5 6.231 4.755 10.762 1.00 0.00 N ATOM 60 CA VAL A 5 5.322 3.649 11.009 1.00 0.00 C ATOM 61 C VAL A 5 3.966 4.035 10.420 1.00 0.00 C ATOM 62 O VAL A 5 3.653 5.226 10.378 1.00 0.00 O ATOM 63 CB VAL A 5 5.270 3.363 12.525 1.00 0.00 C ATOM 64 CG1 VAL A 5 4.517 4.450 13.304 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.656 1.995 12.843 1.00 0.00 C ATOM 0 H VAL A 5 5.805 5.659 10.967 1.00 0.00 H new ATOM 0 HA VAL A 5 5.651 2.725 10.533 1.00 0.00 H new ATOM 0 HB VAL A 5 6.311 3.362 12.849 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.511 4.199 14.365 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.013 5.410 13.161 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.492 4.514 12.940 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.643 1.844 13.922 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.637 1.956 12.459 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.251 1.211 12.374 1.00 0.00 H new ATOM 75 N ALA A 6 3.159 3.071 9.965 1.00 0.00 N ATOM 76 CA ALA A 6 1.760 3.339 9.655 1.00 0.00 C ATOM 77 C ALA A 6 0.908 2.211 10.209 1.00 0.00 C ATOM 78 O ALA A 6 1.022 1.089 9.731 1.00 0.00 O ATOM 79 CB ALA A 6 1.550 3.512 8.148 1.00 0.00 C ATOM 0 H ALA A 6 3.452 2.107 9.806 1.00 0.00 H new ATOM 0 HA ALA A 6 1.459 4.276 10.123 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.497 3.711 7.948 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.151 4.348 7.790 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.852 2.601 7.632 1.00 0.00 H new ATOM 85 N VAL A 7 0.093 2.483 11.229 1.00 0.00 N ATOM 86 CA VAL A 7 -0.758 1.495 11.860 1.00 0.00 C ATOM 87 C VAL A 7 -2.102 1.410 11.122 1.00 0.00 C ATOM 88 O VAL A 7 -2.961 2.277 11.259 1.00 0.00 O ATOM 89 CB VAL A 7 -0.867 1.794 13.367 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.530 1.828 14.007 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.610 3.086 13.740 1.00 0.00 C ATOM 0 H VAL A 7 0.010 3.413 11.640 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.323 0.499 11.784 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.473 0.976 13.757 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.437 2.040 15.072 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.016 0.862 13.871 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.129 2.606 13.533 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.627 3.196 14.824 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.099 3.941 13.296 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.632 3.039 13.364 1.00 0.00 H new ATOM 101 N LEU A 8 -2.272 0.371 10.304 1.00 0.00 N ATOM 102 CA LEU A 8 -3.516 0.042 9.627 1.00 0.00 C ATOM 103 C LEU A 8 -4.482 -0.593 10.629 1.00 0.00 C ATOM 104 O LEU A 8 -4.062 -1.497 11.346 1.00 0.00 O ATOM 105 CB LEU A 8 -3.218 -0.912 8.451 1.00 0.00 C ATOM 106 CG LEU A 8 -3.013 -0.169 7.124 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.719 0.643 7.150 1.00 0.00 C ATOM 108 CD2 LEU A 8 -2.914 -1.180 5.979 1.00 0.00 C ATOM 0 H LEU A 8 -1.519 -0.283 10.091 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.982 0.943 9.227 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.325 -1.495 8.678 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -4.041 -1.619 8.344 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.861 0.500 6.978 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.595 1.161 6.199 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.764 1.374 7.958 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.873 -0.025 7.312 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.768 -0.650 5.038 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.070 -1.847 6.154 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.833 -1.764 5.929 1.00 0.00 H new ATOM 120 N LYS A 9 -5.751 -0.164 10.655 1.00 0.00 N ATOM 121 CA LYS A 9 -6.862 -0.877 11.286 1.00 0.00 C ATOM 122 C LYS A 9 -8.123 -0.615 10.449 1.00 0.00 C ATOM 123 O LYS A 9 -8.144 0.352 9.696 1.00 0.00 O ATOM 124 CB LYS A 9 -7.049 -0.446 12.752 1.00 0.00 C ATOM 125 CG LYS A 9 -7.699 -1.588 13.552 1.00 0.00 C ATOM 126 CD LYS A 9 -8.362 -1.149 14.861 1.00 0.00 C ATOM 127 CE LYS A 9 -7.350 -0.675 15.910 1.00 0.00 C ATOM 128 NZ LYS A 9 -7.911 -0.761 17.276 1.00 0.00 N ATOM 0 H LYS A 9 -6.038 0.715 10.224 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.653 -1.946 11.313 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -6.085 -0.186 13.190 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.673 0.446 12.802 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.447 -2.074 12.925 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.938 -2.335 13.778 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -9.067 -0.344 14.654 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.938 -1.980 15.268 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -6.447 -1.282 15.847 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.059 0.354 15.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.203 -0.433 17.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -8.759 -0.163 17.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.166 -1.747 17.485 1.00 0.00 H new ATOM 142 N GLY A 10 -9.165 -1.443 10.534 1.00 0.00 N ATOM 143 CA GLY A 10 -10.439 -1.168 9.881 1.00 0.00 C ATOM 144 C GLY A 10 -11.588 -1.415 10.849 1.00 0.00 C ATOM 145 O GLY A 10 -11.431 -1.266 12.061 1.00 0.00 O ATOM 0 H GLY A 10 -9.147 -2.319 11.056 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.462 -0.135 9.533 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.551 -1.803 9.002 1.00 0.00 H new ATOM 149 N ASP A 11 -12.734 -1.816 10.302 1.00 0.00 N ATOM 150 CA ASP A 11 -13.870 -2.335 11.040 1.00 0.00 C ATOM 151 C ASP A 11 -13.460 -3.627 11.746 1.00 0.00 C ATOM 152 O ASP A 11 -13.771 -3.827 12.919 1.00 0.00 O ATOM 153 CB ASP A 11 -15.023 -2.600 10.055 1.00 0.00 C ATOM 154 CG ASP A 11 -14.654 -3.644 9.006 1.00 0.00 C ATOM 155 OD1 ASP A 11 -13.536 -3.506 8.457 1.00 0.00 O ATOM 156 OD2 ASP A 11 -15.453 -4.583 8.820 1.00 0.00 O ATOM 0 H ASP A 11 -12.897 -1.785 9.296 1.00 0.00 H new ATOM 0 HA ASP A 11 -14.200 -1.615 11.789 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -15.901 -2.936 10.607 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -15.296 -1.669 9.559 1.00 0.00 H new ATOM 161 N GLY A 12 -12.755 -4.506 11.030 1.00 0.00 N ATOM 162 CA GLY A 12 -12.295 -5.768 11.539 1.00 0.00 C ATOM 163 C GLY A 12 -10.926 -5.582 12.173 1.00 0.00 C ATOM 164 O GLY A 12 -10.360 -4.485 12.189 1.00 0.00 O ATOM 0 H GLY A 12 -12.490 -4.341 10.059 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.000 -6.156 12.274 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.240 -6.500 10.733 1.00 0.00 H new ATOM 168 N PRO A 13 -10.349 -6.680 12.667 1.00 0.00 N ATOM 169 CA PRO A 13 -9.123 -6.643 13.430 1.00 0.00 C ATOM 170 C PRO A 13 -7.884 -6.582 12.531 1.00 0.00 C ATOM 171 O PRO A 13 -6.781 -6.775 13.027 1.00 0.00 O ATOM 172 CB PRO A 13 -9.166 -7.921 14.275 1.00 0.00 C ATOM 173 CG PRO A 13 -9.937 -8.904 13.387 1.00 0.00 C ATOM 174 CD PRO A 13 -10.913 -8.013 12.612 1.00 0.00 C ATOM 0 HA PRO A 13 -9.049 -5.747 14.046 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.165 -8.286 14.504 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -9.671 -7.757 15.227 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.269 -9.444 12.715 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.464 -9.651 13.981 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.019 -8.352 11.581 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.906 -8.037 13.060 1.00 0.00 H new ATOM 182 N VAL A 14 -8.063 -6.318 11.230 1.00 0.00 N ATOM 183 CA VAL A 14 -7.018 -6.245 10.222 1.00 0.00 C ATOM 184 C VAL A 14 -5.982 -5.204 10.614 1.00 0.00 C ATOM 185 O VAL A 14 -6.142 -4.031 10.284 1.00 0.00 O ATOM 186 CB VAL A 14 -7.644 -5.940 8.853 1.00 0.00 C ATOM 187 CG1 VAL A 14 -6.535 -5.830 7.794 1.00 0.00 C ATOM 188 CG2 VAL A 14 -8.641 -7.020 8.414 1.00 0.00 C ATOM 0 H VAL A 14 -8.989 -6.142 10.841 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.506 -7.205 10.153 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.186 -4.999 8.948 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -6.980 -5.614 6.823 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -5.850 -5.027 8.067 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -5.988 -6.771 7.741 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.056 -6.758 7.441 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.130 -7.980 8.344 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.447 -7.090 9.145 1.00 0.00 H new ATOM 198 N GLN A 15 -4.929 -5.629 11.315 1.00 0.00 N ATOM 199 CA GLN A 15 -3.974 -4.710 11.913 1.00 0.00 C ATOM 200 C GLN A 15 -2.653 -4.731 11.162 1.00 0.00 C ATOM 201 O GLN A 15 -1.990 -5.761 11.166 1.00 0.00 O ATOM 202 CB GLN A 15 -3.794 -5.032 13.410 1.00 0.00 C ATOM 203 CG GLN A 15 -3.981 -3.778 14.269 1.00 0.00 C ATOM 204 CD GLN A 15 -2.668 -3.167 14.743 1.00 0.00 C ATOM 205 OE1 GLN A 15 -2.124 -2.270 14.111 1.00 0.00 O ATOM 206 NE2 GLN A 15 -2.167 -3.629 15.885 1.00 0.00 N ATOM 0 H GLN A 15 -4.720 -6.614 11.480 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.365 -3.695 11.835 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.514 -5.793 13.711 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -2.801 -5.448 13.579 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -4.534 -3.033 13.696 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -4.591 -4.029 15.137 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -2.646 -4.377 16.386 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -1.304 -3.235 16.260 1.00 0.00 H new ATOM 215 N GLY A 16 -2.279 -3.628 10.510 1.00 0.00 N ATOM 216 CA GLY A 16 -1.089 -3.574 9.664 1.00 0.00 C ATOM 217 C GLY A 16 -0.096 -2.527 10.121 1.00 0.00 C ATOM 218 O GLY A 16 -0.181 -1.375 9.722 1.00 0.00 O ATOM 0 H GLY A 16 -2.794 -2.748 10.555 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.606 -4.551 9.661 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.387 -3.363 8.637 1.00 0.00 H new ATOM 222 N ILE A 17 0.875 -2.935 10.928 1.00 0.00 N ATOM 223 CA ILE A 17 1.933 -2.057 11.385 1.00 0.00 C ATOM 224 C ILE A 17 2.974 -1.996 10.264 1.00 0.00 C ATOM 225 O ILE A 17 3.864 -2.840 10.190 1.00 0.00 O ATOM 226 CB ILE A 17 2.465 -2.581 12.731 1.00 0.00 C ATOM 227 CG1 ILE A 17 1.344 -2.528 13.790 1.00 0.00 C ATOM 228 CG2 ILE A 17 3.656 -1.746 13.217 1.00 0.00 C ATOM 229 CD1 ILE A 17 1.514 -3.616 14.851 1.00 0.00 C ATOM 0 H ILE A 17 0.947 -3.889 11.283 1.00 0.00 H new ATOM 0 HA ILE A 17 1.601 -1.037 11.580 1.00 0.00 H new ATOM 0 HB ILE A 17 2.796 -3.610 12.587 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.343 -1.549 14.270 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.377 -2.644 13.302 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.011 -2.139 14.170 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.459 -1.796 12.482 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.345 -0.709 13.345 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.705 -3.545 15.578 1.00 0.00 H new ATOM 0 HD12 ILE A 17 1.488 -4.596 14.375 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.470 -3.484 15.358 1.00 0.00 H new ATOM 241 N ILE A 18 2.821 -1.029 9.357 1.00 0.00 N ATOM 242 CA ILE A 18 3.805 -0.732 8.325 1.00 0.00 C ATOM 243 C ILE A 18 4.931 0.048 8.976 1.00 0.00 C ATOM 244 O ILE A 18 4.712 0.712 9.986 1.00 0.00 O ATOM 245 CB ILE A 18 3.184 0.080 7.173 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.869 -0.539 6.688 1.00 0.00 C ATOM 247 CG2 ILE A 18 4.133 0.267 5.979 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.039 -1.994 6.267 1.00 0.00 C ATOM 0 H ILE A 18 1.999 -0.426 9.322 1.00 0.00 H new ATOM 0 HA ILE A 18 4.178 -1.661 7.893 1.00 0.00 H new ATOM 0 HB ILE A 18 2.986 1.066 7.594 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.125 -0.477 7.482 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.486 0.039 5.847 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.633 0.847 5.204 1.00 0.00 H new ATOM 0 HG22 ILE A 18 5.029 0.795 6.306 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.411 -0.708 5.579 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.081 -2.390 5.931 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.762 -2.055 5.454 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.396 -2.579 7.115 1.00 0.00 H new ATOM 260 N ASN A 19 6.113 -0.013 8.376 1.00 0.00 N ATOM 261 CA ASN A 19 7.308 0.693 8.762 1.00 0.00 C ATOM 262 C ASN A 19 7.951 1.192 7.472 1.00 0.00 C ATOM 263 O ASN A 19 7.945 0.489 6.462 1.00 0.00 O ATOM 264 CB ASN A 19 8.269 -0.225 9.521 1.00 0.00 C ATOM 265 CG ASN A 19 7.602 -1.240 10.445 1.00 0.00 C ATOM 266 OD1 ASN A 19 7.478 -2.411 10.105 1.00 0.00 O ATOM 267 ND2 ASN A 19 7.178 -0.821 11.634 1.00 0.00 N ATOM 0 H ASN A 19 6.262 -0.598 7.554 1.00 0.00 H new ATOM 0 HA ASN A 19 7.070 1.520 9.431 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.880 -0.763 8.797 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.945 0.392 10.113 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.741 -1.478 12.280 1.00 0.00 H new ATOM 0 HD22 ASN A 19 7.290 0.157 11.900 1.00 0.00 H new ATOM 274 N PHE A 20 8.476 2.413 7.510 1.00 0.00 N ATOM 275 CA PHE A 20 9.217 3.040 6.434 1.00 0.00 C ATOM 276 C PHE A 20 10.547 3.497 7.010 1.00 0.00 C ATOM 277 O PHE A 20 10.527 4.217 7.997 1.00 0.00 O ATOM 278 CB PHE A 20 8.438 4.260 5.948 1.00 0.00 C ATOM 279 CG PHE A 20 7.327 3.933 4.984 1.00 0.00 C ATOM 280 CD1 PHE A 20 6.060 3.546 5.446 1.00 0.00 C ATOM 281 CD2 PHE A 20 7.563 4.065 3.611 1.00 0.00 C ATOM 282 CE1 PHE A 20 5.027 3.309 4.522 1.00 0.00 C ATOM 283 CE2 PHE A 20 6.516 3.897 2.691 1.00 0.00 C ATOM 284 CZ PHE A 20 5.251 3.490 3.146 1.00 0.00 C ATOM 0 H PHE A 20 8.390 3.014 8.330 1.00 0.00 H new ATOM 0 HA PHE A 20 9.368 2.350 5.604 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.017 4.777 6.810 1.00 0.00 H new ATOM 0 HB3 PHE A 20 9.130 4.953 5.468 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.879 3.431 6.505 1.00 0.00 H new ATOM 0 HD2 PHE A 20 8.556 4.297 3.257 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.057 2.986 4.871 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.682 4.080 1.640 1.00 0.00 H new ATOM 0 HZ PHE A 20 4.452 3.316 2.440 1.00 0.00 H new ATOM 294 N GLU A 21 11.681 3.123 6.424 1.00 0.00 N ATOM 295 CA GLU A 21 12.980 3.665 6.800 1.00 0.00 C ATOM 296 C GLU A 21 13.658 4.203 5.543 1.00 0.00 C ATOM 297 O GLU A 21 13.487 3.638 4.463 1.00 0.00 O ATOM 298 CB GLU A 21 13.798 2.638 7.603 1.00 0.00 C ATOM 299 CG GLU A 21 14.199 1.368 6.831 1.00 0.00 C ATOM 300 CD GLU A 21 15.553 1.459 6.136 1.00 0.00 C ATOM 301 OE1 GLU A 21 16.162 2.551 6.192 1.00 0.00 O ATOM 302 OE2 GLU A 21 15.966 0.411 5.593 1.00 0.00 O ATOM 0 H GLU A 21 11.723 2.434 5.673 1.00 0.00 H new ATOM 0 HA GLU A 21 12.877 4.506 7.486 1.00 0.00 H new ATOM 0 HB2 GLU A 21 14.704 3.124 7.966 1.00 0.00 H new ATOM 0 HB3 GLU A 21 13.221 2.343 8.479 1.00 0.00 H new ATOM 0 HG2 GLU A 21 14.214 0.526 7.523 1.00 0.00 H new ATOM 0 HG3 GLU A 21 13.434 1.154 6.085 1.00 0.00 H new ATOM 309 N GLN A 22 14.335 5.351 5.657 1.00 0.00 N ATOM 310 CA GLN A 22 15.076 5.899 4.521 1.00 0.00 C ATOM 311 C GLN A 22 16.449 6.362 4.976 1.00 0.00 C ATOM 312 O GLN A 22 17.476 5.895 4.495 1.00 0.00 O ATOM 313 CB GLN A 22 14.284 7.058 3.904 1.00 0.00 C ATOM 314 CG GLN A 22 15.010 7.661 2.690 1.00 0.00 C ATOM 315 CD GLN A 22 14.290 8.885 2.138 1.00 0.00 C ATOM 316 OE1 GLN A 22 13.695 9.658 2.887 1.00 0.00 O ATOM 317 NE2 GLN A 22 14.342 9.081 0.828 1.00 0.00 N ATOM 0 H GLN A 22 14.384 5.909 6.510 1.00 0.00 H new ATOM 0 HA GLN A 22 15.210 5.127 3.763 1.00 0.00 H new ATOM 0 HB2 GLN A 22 13.299 6.704 3.600 1.00 0.00 H new ATOM 0 HB3 GLN A 22 14.127 7.832 4.655 1.00 0.00 H new ATOM 0 HG2 GLN A 22 16.025 7.937 2.976 1.00 0.00 H new ATOM 0 HG3 GLN A 22 15.093 6.907 1.907 1.00 0.00 H new ATOM 0 HE21 GLN A 22 14.844 8.422 0.233 1.00 0.00 H new ATOM 0 HE22 GLN A 22 13.880 9.891 0.415 1.00 0.00 H new ATOM 326 N LYS A 23 16.451 7.366 5.855 1.00 0.00 N ATOM 327 CA LYS A 23 17.635 8.012 6.399 1.00 0.00 C ATOM 328 C LYS A 23 18.437 8.818 5.376 1.00 0.00 C ATOM 329 O LYS A 23 18.764 9.964 5.688 1.00 0.00 O ATOM 330 CB LYS A 23 18.505 6.992 7.147 1.00 0.00 C ATOM 331 CG LYS A 23 19.426 7.630 8.196 1.00 0.00 C ATOM 332 CD LYS A 23 20.742 6.848 8.323 1.00 0.00 C ATOM 333 CE LYS A 23 20.526 5.362 8.664 1.00 0.00 C ATOM 334 NZ LYS A 23 21.781 4.586 8.568 1.00 0.00 N ATOM 0 H LYS A 23 15.586 7.765 6.220 1.00 0.00 H new ATOM 0 HA LYS A 23 17.280 8.757 7.111 1.00 0.00 H new ATOM 0 HB2 LYS A 23 17.858 6.264 7.637 1.00 0.00 H new ATOM 0 HB3 LYS A 23 19.112 6.445 6.426 1.00 0.00 H new ATOM 0 HG2 LYS A 23 19.638 8.663 7.919 1.00 0.00 H new ATOM 0 HG3 LYS A 23 18.920 7.656 9.161 1.00 0.00 H new ATOM 0 HD2 LYS A 23 21.296 6.924 7.387 1.00 0.00 H new ATOM 0 HD3 LYS A 23 21.358 7.307 9.096 1.00 0.00 H new ATOM 0 HE2 LYS A 23 20.122 5.276 9.673 1.00 0.00 H new ATOM 0 HE3 LYS A 23 19.784 4.938 7.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 21.593 3.591 8.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 22.153 4.647 7.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 22.481 4.974 9.233 1.00 0.00 H new ATOM 348 N GLU A 24 18.667 8.324 4.158 1.00 0.00 N ATOM 349 CA GLU A 24 19.332 9.093 3.125 1.00 0.00 C ATOM 350 C GLU A 24 18.491 10.322 2.790 1.00 0.00 C ATOM 351 O GLU A 24 17.284 10.346 3.049 1.00 0.00 O ATOM 352 CB GLU A 24 19.525 8.217 1.888 1.00 0.00 C ATOM 353 CG GLU A 24 20.583 7.132 2.113 1.00 0.00 C ATOM 354 CD GLU A 24 20.807 6.340 0.830 1.00 0.00 C ATOM 355 OE1 GLU A 24 21.216 6.987 -0.157 1.00 0.00 O ATOM 356 OE2 GLU A 24 20.523 5.126 0.848 1.00 0.00 O ATOM 0 H GLU A 24 18.396 7.384 3.869 1.00 0.00 H new ATOM 0 HA GLU A 24 20.310 9.424 3.475 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.577 7.749 1.623 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.819 8.841 1.044 1.00 0.00 H new ATOM 0 HG2 GLU A 24 21.519 7.588 2.435 1.00 0.00 H new ATOM 0 HG3 GLU A 24 20.263 6.462 2.911 1.00 0.00 H new ATOM 363 N SER A 25 19.134 11.351 2.237 1.00 0.00 N ATOM 364 CA SER A 25 18.453 12.585 1.871 1.00 0.00 C ATOM 365 C SER A 25 17.671 12.415 0.573 1.00 0.00 C ATOM 366 O SER A 25 16.679 13.104 0.352 1.00 0.00 O ATOM 367 CB SER A 25 19.455 13.741 1.770 1.00 0.00 C ATOM 368 OG SER A 25 18.769 14.975 1.841 1.00 0.00 O ATOM 0 H SER A 25 20.133 11.350 2.033 1.00 0.00 H new ATOM 0 HA SER A 25 17.736 12.826 2.656 1.00 0.00 H new ATOM 0 HB2 SER A 25 20.185 13.673 2.576 1.00 0.00 H new ATOM 0 HB3 SER A 25 20.008 13.675 0.833 1.00 0.00 H new ATOM 0 HG SER A 25 19.413 15.711 1.778 1.00 0.00 H new ATOM 374 N ASN A 26 18.147 11.521 -0.292 1.00 0.00 N ATOM 375 CA ASN A 26 17.591 11.278 -1.613 1.00 0.00 C ATOM 376 C ASN A 26 17.880 9.830 -2.008 1.00 0.00 C ATOM 377 O ASN A 26 18.180 9.551 -3.168 1.00 0.00 O ATOM 378 CB ASN A 26 18.187 12.288 -2.610 1.00 0.00 C ATOM 379 CG ASN A 26 19.715 12.293 -2.588 1.00 0.00 C ATOM 380 OD1 ASN A 26 20.329 13.232 -2.092 1.00 0.00 O ATOM 381 ND2 ASN A 26 20.346 11.235 -3.086 1.00 0.00 N ATOM 0 H ASN A 26 18.953 10.932 -0.083 1.00 0.00 H new ATOM 0 HA ASN A 26 16.510 11.418 -1.616 1.00 0.00 H new ATOM 0 HB2 ASN A 26 17.841 12.049 -3.616 1.00 0.00 H new ATOM 0 HB3 ASN A 26 17.819 13.287 -2.375 1.00 0.00 H new ATOM 0 HD21 ASN A 26 21.365 11.190 -3.061 1.00 0.00 H new ATOM 0 HD22 ASN A 26 19.812 10.467 -3.493 1.00 0.00 H new ATOM 388 N GLY A 27 17.827 8.919 -1.030 1.00 0.00 N ATOM 389 CA GLY A 27 18.018 7.495 -1.275 1.00 0.00 C ATOM 390 C GLY A 27 16.665 6.798 -1.322 1.00 0.00 C ATOM 391 O GLY A 27 15.646 7.426 -1.025 1.00 0.00 O ATOM 0 H GLY A 27 17.651 9.152 -0.053 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.548 7.346 -2.216 1.00 0.00 H new ATOM 0 HA3 GLY A 27 18.635 7.060 -0.489 1.00 0.00 H new ATOM 395 N PRO A 28 16.633 5.510 -1.687 1.00 0.00 N ATOM 396 CA PRO A 28 15.396 4.757 -1.760 1.00 0.00 C ATOM 397 C PRO A 28 14.755 4.684 -0.372 1.00 0.00 C ATOM 398 O PRO A 28 15.432 4.442 0.625 1.00 0.00 O ATOM 399 CB PRO A 28 15.785 3.384 -2.316 1.00 0.00 C ATOM 400 CG PRO A 28 17.256 3.233 -1.923 1.00 0.00 C ATOM 401 CD PRO A 28 17.788 4.667 -1.947 1.00 0.00 C ATOM 0 HA PRO A 28 14.648 5.218 -2.405 1.00 0.00 H new ATOM 0 HB2 PRO A 28 15.173 2.591 -1.887 1.00 0.00 H new ATOM 0 HB3 PRO A 28 15.653 3.338 -3.397 1.00 0.00 H new ATOM 0 HG2 PRO A 28 17.362 2.783 -0.936 1.00 0.00 H new ATOM 0 HG3 PRO A 28 17.794 2.595 -2.624 1.00 0.00 H new ATOM 0 HD2 PRO A 28 18.559 4.813 -1.191 1.00 0.00 H new ATOM 0 HD3 PRO A 28 18.238 4.903 -2.911 1.00 0.00 H new ATOM 409 N VAL A 29 13.443 4.905 -0.311 1.00 0.00 N ATOM 410 CA VAL A 29 12.644 4.617 0.862 1.00 0.00 C ATOM 411 C VAL A 29 12.479 3.101 0.880 1.00 0.00 C ATOM 412 O VAL A 29 12.037 2.532 -0.118 1.00 0.00 O ATOM 413 CB VAL A 29 11.295 5.373 0.769 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.055 4.484 0.926 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.223 6.466 1.837 1.00 0.00 C ATOM 0 H VAL A 29 12.906 5.293 -1.087 1.00 0.00 H new ATOM 0 HA VAL A 29 13.107 4.950 1.791 1.00 0.00 H new ATOM 0 HB VAL A 29 11.277 5.787 -0.239 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.156 5.096 0.848 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.048 3.727 0.142 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.078 3.996 1.901 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.270 6.988 1.759 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.310 6.015 2.826 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.038 7.174 1.688 1.00 0.00 H new ATOM 425 N LYS A 30 12.811 2.457 1.998 1.00 0.00 N ATOM 426 CA LYS A 30 12.471 1.070 2.242 1.00 0.00 C ATOM 427 C LYS A 30 11.174 1.047 3.036 1.00 0.00 C ATOM 428 O LYS A 30 11.081 1.681 4.084 1.00 0.00 O ATOM 429 CB LYS A 30 13.613 0.373 2.985 1.00 0.00 C ATOM 430 CG LYS A 30 13.202 -1.069 3.312 1.00 0.00 C ATOM 431 CD LYS A 30 14.372 -2.044 3.152 1.00 0.00 C ATOM 432 CE LYS A 30 13.839 -3.471 2.952 1.00 0.00 C ATOM 433 NZ LYS A 30 14.875 -4.357 2.391 1.00 0.00 N ATOM 0 H LYS A 30 13.328 2.893 2.762 1.00 0.00 H new ATOM 0 HA LYS A 30 12.328 0.528 1.307 1.00 0.00 H new ATOM 0 HB2 LYS A 30 14.515 0.376 2.373 1.00 0.00 H new ATOM 0 HB3 LYS A 30 13.848 0.913 3.902 1.00 0.00 H new ATOM 0 HG2 LYS A 30 12.826 -1.117 4.334 1.00 0.00 H new ATOM 0 HG3 LYS A 30 12.385 -1.371 2.657 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.986 -1.753 2.300 1.00 0.00 H new ATOM 0 HD3 LYS A 30 15.012 -2.006 4.033 1.00 0.00 H new ATOM 0 HE2 LYS A 30 13.495 -3.870 3.906 1.00 0.00 H new ATOM 0 HE3 LYS A 30 12.977 -3.449 2.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 14.605 -5.349 2.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 14.968 -4.180 1.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 15.784 -4.168 2.859 1.00 0.00 H new ATOM 447 N VAL A 31 10.179 0.320 2.532 1.00 0.00 N ATOM 448 CA VAL A 31 8.874 0.147 3.135 1.00 0.00 C ATOM 449 C VAL A 31 8.718 -1.335 3.444 1.00 0.00 C ATOM 450 O VAL A 31 9.159 -2.187 2.677 1.00 0.00 O ATOM 451 CB VAL A 31 7.795 0.681 2.178 1.00 0.00 C ATOM 452 CG1 VAL A 31 8.139 0.464 0.711 1.00 0.00 C ATOM 453 CG2 VAL A 31 6.415 0.063 2.422 1.00 0.00 C ATOM 0 H VAL A 31 10.273 -0.185 1.651 1.00 0.00 H new ATOM 0 HA VAL A 31 8.766 0.710 4.062 1.00 0.00 H new ATOM 0 HB VAL A 31 7.763 1.749 2.396 1.00 0.00 H new ATOM 0 HG11 VAL A 31 7.339 0.862 0.087 1.00 0.00 H new ATOM 0 HG12 VAL A 31 9.072 0.977 0.476 1.00 0.00 H new ATOM 0 HG13 VAL A 31 8.253 -0.603 0.518 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.699 0.481 1.715 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.471 -1.017 2.286 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.092 0.284 3.439 1.00 0.00 H new ATOM 463 N TRP A 32 8.097 -1.662 4.569 1.00 0.00 N ATOM 464 CA TRP A 32 7.860 -3.039 4.955 1.00 0.00 C ATOM 465 C TRP A 32 6.757 -3.027 6.004 1.00 0.00 C ATOM 466 O TRP A 32 6.428 -1.963 6.509 1.00 0.00 O ATOM 467 CB TRP A 32 9.163 -3.712 5.427 1.00 0.00 C ATOM 468 CG TRP A 32 9.591 -3.508 6.842 1.00 0.00 C ATOM 469 CD1 TRP A 32 9.388 -4.385 7.850 1.00 0.00 C ATOM 470 CD2 TRP A 32 10.329 -2.397 7.421 1.00 0.00 C ATOM 471 NE1 TRP A 32 9.978 -3.913 9.000 1.00 0.00 N ATOM 472 CE2 TRP A 32 10.580 -2.690 8.795 1.00 0.00 C ATOM 473 CE3 TRP A 32 10.779 -1.150 6.937 1.00 0.00 C ATOM 474 CZ2 TRP A 32 11.266 -1.805 9.640 1.00 0.00 C ATOM 475 CZ3 TRP A 32 11.409 -0.233 7.794 1.00 0.00 C ATOM 476 CH2 TRP A 32 11.687 -0.567 9.130 1.00 0.00 C ATOM 0 H TRP A 32 7.745 -0.977 5.238 1.00 0.00 H new ATOM 0 HA TRP A 32 7.530 -3.643 4.110 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.062 -4.785 5.261 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.970 -3.364 4.782 1.00 0.00 H new ATOM 0 HD1 TRP A 32 8.845 -5.315 7.766 1.00 0.00 H new ATOM 0 HE1 TRP A 32 9.971 -4.406 9.893 1.00 0.00 H new ATOM 0 HE3 TRP A 32 10.637 -0.898 5.896 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 11.467 -2.072 10.667 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 11.684 0.743 7.421 1.00 0.00 H new ATOM 0 HH2 TRP A 32 12.222 0.126 9.762 1.00 0.00 H new ATOM 487 N GLY A 33 6.133 -4.157 6.311 1.00 0.00 N ATOM 488 CA GLY A 33 5.033 -4.153 7.267 1.00 0.00 C ATOM 489 C GLY A 33 4.519 -5.550 7.518 1.00 0.00 C ATOM 490 O GLY A 33 5.092 -6.491 6.977 1.00 0.00 O ATOM 0 H GLY A 33 6.363 -5.071 5.921 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.366 -3.712 8.206 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.224 -3.528 6.891 1.00 0.00 H new ATOM 494 N SER A 34 3.434 -5.672 8.290 1.00 0.00 N ATOM 495 CA SER A 34 2.909 -6.963 8.696 1.00 0.00 C ATOM 496 C SER A 34 1.449 -6.754 9.036 1.00 0.00 C ATOM 497 O SER A 34 1.147 -6.215 10.101 1.00 0.00 O ATOM 498 CB SER A 34 3.657 -7.513 9.919 1.00 0.00 C ATOM 499 OG SER A 34 5.001 -7.807 9.598 1.00 0.00 O ATOM 0 H SER A 34 2.903 -4.877 8.645 1.00 0.00 H new ATOM 0 HA SER A 34 3.035 -7.688 7.892 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.623 -6.784 10.729 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.160 -8.413 10.280 1.00 0.00 H new ATOM 0 HG SER A 34 5.459 -8.154 10.392 1.00 0.00 H new ATOM 505 N ILE A 35 0.553 -7.136 8.130 1.00 0.00 N ATOM 506 CA ILE A 35 -0.862 -7.137 8.426 1.00 0.00 C ATOM 507 C ILE A 35 -1.178 -8.290 9.367 1.00 0.00 C ATOM 508 O ILE A 35 -0.446 -9.272 9.400 1.00 0.00 O ATOM 509 CB ILE A 35 -1.651 -7.129 7.112 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.243 -5.724 6.912 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.718 -8.216 7.075 1.00 0.00 C ATOM 512 CD1 ILE A 35 -2.733 -5.507 5.488 1.00 0.00 C ATOM 0 H ILE A 35 0.789 -7.447 7.188 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.169 -6.236 8.957 1.00 0.00 H new ATOM 0 HB ILE A 35 -0.980 -7.359 6.285 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.071 -5.578 7.606 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.488 -4.975 7.153 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.251 -8.171 6.125 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.246 -9.193 7.180 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.422 -8.063 7.893 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.143 -4.501 5.394 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.900 -5.626 4.795 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -3.507 -6.238 5.254 1.00 0.00 H new ATOM 524 N LYS A 36 -2.279 -8.191 10.106 1.00 0.00 N ATOM 525 CA LYS A 36 -2.836 -9.306 10.836 1.00 0.00 C ATOM 526 C LYS A 36 -4.349 -9.227 10.715 1.00 0.00 C ATOM 527 O LYS A 36 -4.978 -8.477 11.454 1.00 0.00 O ATOM 528 CB LYS A 36 -2.353 -9.256 12.290 1.00 0.00 C ATOM 529 CG LYS A 36 -2.400 -10.660 12.896 1.00 0.00 C ATOM 530 CD LYS A 36 -1.972 -10.661 14.366 1.00 0.00 C ATOM 531 CE LYS A 36 -2.049 -12.106 14.886 1.00 0.00 C ATOM 532 NZ LYS A 36 -1.203 -12.327 16.073 1.00 0.00 N ATOM 0 H LYS A 36 -2.807 -7.325 10.211 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.507 -10.263 10.430 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.337 -8.865 12.333 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.980 -8.578 12.869 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.411 -11.058 12.812 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.748 -11.323 12.327 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.958 -10.274 14.467 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -2.622 -10.011 14.952 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -3.084 -12.345 15.132 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.744 -12.790 14.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.291 -13.316 16.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.211 -12.126 15.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.509 -11.695 16.840 1.00 0.00 H new ATOM 546 N GLY A 37 -4.922 -9.969 9.767 1.00 0.00 N ATOM 547 CA GLY A 37 -6.368 -10.065 9.609 1.00 0.00 C ATOM 548 C GLY A 37 -6.821 -10.238 8.156 1.00 0.00 C ATOM 549 O GLY A 37 -8.019 -10.318 7.896 1.00 0.00 O ATOM 0 H GLY A 37 -4.395 -10.519 9.089 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.733 -10.907 10.196 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.829 -9.167 10.019 1.00 0.00 H new ATOM 553 N LEU A 38 -5.885 -10.263 7.202 1.00 0.00 N ATOM 554 CA LEU A 38 -6.160 -10.614 5.819 1.00 0.00 C ATOM 555 C LEU A 38 -6.557 -12.095 5.720 1.00 0.00 C ATOM 556 O LEU A 38 -6.829 -12.752 6.720 1.00 0.00 O ATOM 557 CB LEU A 38 -4.914 -10.244 4.981 1.00 0.00 C ATOM 558 CG LEU A 38 -5.116 -8.948 4.184 1.00 0.00 C ATOM 559 CD1 LEU A 38 -5.719 -7.767 4.958 1.00 0.00 C ATOM 560 CD2 LEU A 38 -3.849 -8.543 3.410 1.00 0.00 C ATOM 0 H LEU A 38 -4.906 -10.036 7.378 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.009 -10.057 5.421 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.054 -10.132 5.641 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.685 -11.059 4.294 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.893 -9.208 3.465 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.815 -6.908 4.294 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.703 -8.045 5.337 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.068 -7.509 5.793 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.038 -7.621 2.860 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.029 -8.387 4.111 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.582 -9.334 2.710 1.00 0.00 H new ATOM 572 N THR A 39 -6.595 -12.627 4.501 1.00 0.00 N ATOM 573 CA THR A 39 -6.721 -14.049 4.238 1.00 0.00 C ATOM 574 C THR A 39 -5.754 -14.350 3.109 1.00 0.00 C ATOM 575 O THR A 39 -5.427 -13.435 2.340 1.00 0.00 O ATOM 576 CB THR A 39 -8.163 -14.414 3.861 1.00 0.00 C ATOM 577 OG1 THR A 39 -8.295 -15.812 3.699 1.00 0.00 O ATOM 578 CG2 THR A 39 -8.627 -13.725 2.573 1.00 0.00 C ATOM 0 H THR A 39 -6.537 -12.064 3.652 1.00 0.00 H new ATOM 0 HA THR A 39 -6.486 -14.642 5.122 1.00 0.00 H new ATOM 0 HB THR A 39 -8.791 -14.065 4.681 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.221 -16.028 3.461 1.00 0.00 H new ATOM 0 HG21 THR A 39 -9.653 -14.018 2.353 1.00 0.00 H new ATOM 0 HG22 THR A 39 -8.578 -12.644 2.701 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.980 -14.022 1.748 1.00 0.00 H new ATOM 586 N GLU A 40 -5.345 -15.617 3.032 1.00 0.00 N ATOM 587 CA GLU A 40 -4.406 -16.135 2.064 1.00 0.00 C ATOM 588 C GLU A 40 -4.769 -15.702 0.653 1.00 0.00 C ATOM 589 O GLU A 40 -5.943 -15.684 0.281 1.00 0.00 O ATOM 590 CB GLU A 40 -4.315 -17.657 2.182 1.00 0.00 C ATOM 591 CG GLU A 40 -5.656 -18.404 2.090 1.00 0.00 C ATOM 592 CD GLU A 40 -5.484 -19.897 2.349 1.00 0.00 C ATOM 593 OE1 GLU A 40 -4.425 -20.428 1.951 1.00 0.00 O ATOM 594 OE2 GLU A 40 -6.413 -20.477 2.948 1.00 0.00 O ATOM 0 H GLU A 40 -5.680 -16.334 3.676 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.422 -15.718 2.279 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.657 -18.027 1.396 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.845 -17.904 3.134 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.356 -17.987 2.813 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.091 -18.253 1.102 1.00 0.00 H new ATOM 601 N GLY A 41 -3.752 -15.324 -0.119 1.00 0.00 N ATOM 602 CA GLY A 41 -3.943 -14.804 -1.455 1.00 0.00 C ATOM 603 C GLY A 41 -3.305 -13.434 -1.450 1.00 0.00 C ATOM 604 O GLY A 41 -2.271 -13.268 -0.808 1.00 0.00 O ATOM 0 H GLY A 41 -2.776 -15.373 0.172 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.477 -15.451 -2.198 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.002 -14.743 -1.705 1.00 0.00 H new ATOM 608 N LEU A 42 -3.907 -12.456 -2.126 1.00 0.00 N ATOM 609 CA LEU A 42 -3.266 -11.178 -2.375 1.00 0.00 C ATOM 610 C LEU A 42 -4.240 -10.013 -2.214 1.00 0.00 C ATOM 611 O LEU A 42 -5.451 -10.195 -2.337 1.00 0.00 O ATOM 612 CB LEU A 42 -2.549 -11.212 -3.735 1.00 0.00 C ATOM 613 CG LEU A 42 -3.478 -11.003 -4.936 1.00 0.00 C ATOM 614 CD1 LEU A 42 -2.694 -11.138 -6.244 1.00 0.00 C ATOM 615 CD2 LEU A 42 -4.641 -12.010 -5.001 1.00 0.00 C ATOM 0 H LEU A 42 -4.848 -12.532 -2.512 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.501 -11.004 -1.618 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.778 -10.442 -3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.043 -12.171 -3.843 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.891 -10.003 -4.807 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.366 -10.987 -7.088 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.902 -10.389 -6.272 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.254 -12.134 -6.304 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.255 -11.800 -5.877 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.242 -13.022 -5.071 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -5.250 -11.922 -4.101 1.00 0.00 H new ATOM 627 N HIS A 43 -3.718 -8.836 -1.857 1.00 0.00 N ATOM 628 CA HIS A 43 -4.528 -7.692 -1.464 1.00 0.00 C ATOM 629 C HIS A 43 -3.893 -6.388 -1.939 1.00 0.00 C ATOM 630 O HIS A 43 -2.709 -6.184 -1.679 1.00 0.00 O ATOM 631 CB HIS A 43 -4.626 -7.698 0.062 1.00 0.00 C ATOM 632 CG HIS A 43 -5.529 -8.782 0.601 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.854 -8.599 0.918 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.210 -10.092 0.849 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.340 -9.773 1.361 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.358 -10.693 1.332 1.00 0.00 N ATOM 0 H HIS A 43 -2.715 -8.655 -1.834 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.517 -7.762 -1.918 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.628 -7.824 0.482 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.993 -6.729 0.399 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.377 -7.727 0.833 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.250 -10.563 0.697 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.354 -9.949 1.687 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.446 -11.668 1.618 1.00 0.00 H new ATOM 645 N GLY A 44 -4.665 -5.519 -2.610 1.00 0.00 N ATOM 646 CA GLY A 44 -4.191 -4.242 -3.132 1.00 0.00 C ATOM 647 C GLY A 44 -3.738 -3.325 -1.999 1.00 0.00 C ATOM 648 O GLY A 44 -4.281 -3.420 -0.896 1.00 0.00 O ATOM 0 H GLY A 44 -5.651 -5.693 -2.805 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.364 -4.411 -3.821 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.986 -3.759 -3.700 1.00 0.00 H new ATOM 652 N PHE A 45 -2.762 -2.452 -2.272 1.00 0.00 N ATOM 653 CA PHE A 45 -2.044 -1.687 -1.252 1.00 0.00 C ATOM 654 C PHE A 45 -1.633 -0.316 -1.772 1.00 0.00 C ATOM 655 O PHE A 45 -0.826 -0.231 -2.701 1.00 0.00 O ATOM 656 CB PHE A 45 -0.783 -2.451 -0.824 1.00 0.00 C ATOM 657 CG PHE A 45 -0.766 -2.752 0.653 1.00 0.00 C ATOM 658 CD1 PHE A 45 -0.262 -1.817 1.575 1.00 0.00 C ATOM 659 CD2 PHE A 45 -1.362 -3.933 1.109 1.00 0.00 C ATOM 660 CE1 PHE A 45 -0.300 -2.098 2.952 1.00 0.00 C ATOM 661 CE2 PHE A 45 -1.349 -4.240 2.475 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.821 -3.323 3.402 1.00 0.00 C ATOM 0 H PHE A 45 -2.446 -2.256 -3.222 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.715 -1.553 -0.403 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.720 -3.385 -1.383 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.099 -1.865 -1.083 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.154 -0.884 1.225 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -1.832 -4.607 0.408 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.070 -1.374 3.662 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.746 -5.184 2.818 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.816 -3.560 4.456 1.00 0.00 H new ATOM 672 N HIS A 46 -2.163 0.769 -1.193 1.00 0.00 N ATOM 673 CA HIS A 46 -1.896 2.094 -1.748 1.00 0.00 C ATOM 674 C HIS A 46 -1.888 3.187 -0.694 1.00 0.00 C ATOM 675 O HIS A 46 -2.515 3.074 0.360 1.00 0.00 O ATOM 676 CB HIS A 46 -2.913 2.456 -2.838 1.00 0.00 C ATOM 677 CG HIS A 46 -3.527 1.276 -3.524 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.742 0.686 -3.182 1.00 0.00 N ATOM 679 CD2 HIS A 46 -2.980 0.541 -4.530 1.00 0.00 C ATOM 680 CE1 HIS A 46 -4.925 -0.363 -4.014 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.874 -0.430 -4.831 1.00 0.00 N ATOM 0 H HIS A 46 -2.760 0.756 -0.366 1.00 0.00 H new ATOM 0 HA HIS A 46 -0.897 2.036 -2.180 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.707 3.056 -2.393 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.421 3.080 -3.584 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -2.020 0.701 -4.997 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.774 -1.030 -4.017 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.760 -1.116 -5.577 1.00 0.00 H new ATOM 689 N VAL A 47 -1.213 4.280 -1.041 1.00 0.00 N ATOM 690 CA VAL A 47 -1.210 5.520 -0.297 1.00 0.00 C ATOM 691 C VAL A 47 -2.408 6.330 -0.787 1.00 0.00 C ATOM 692 O VAL A 47 -2.356 6.914 -1.868 1.00 0.00 O ATOM 693 CB VAL A 47 0.110 6.261 -0.560 1.00 0.00 C ATOM 694 CG1 VAL A 47 0.238 7.467 0.364 1.00 0.00 C ATOM 695 CG2 VAL A 47 1.338 5.364 -0.347 1.00 0.00 C ATOM 0 H VAL A 47 -0.634 4.320 -1.880 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.287 5.354 0.778 1.00 0.00 H new ATOM 0 HB VAL A 47 0.082 6.575 -1.603 1.00 0.00 H new ATOM 0 HG11 VAL A 47 1.179 7.980 0.164 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -0.593 8.150 0.188 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.220 7.134 1.402 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.245 5.935 -0.546 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.353 5.006 0.682 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.289 4.513 -1.026 1.00 0.00 H new ATOM 705 N HIS A 48 -3.501 6.346 -0.030 1.00 0.00 N ATOM 706 CA HIS A 48 -4.603 7.256 -0.258 1.00 0.00 C ATOM 707 C HIS A 48 -4.227 8.646 0.254 1.00 0.00 C ATOM 708 O HIS A 48 -3.371 8.795 1.133 1.00 0.00 O ATOM 709 CB HIS A 48 -5.882 6.741 0.414 1.00 0.00 C ATOM 710 CG HIS A 48 -6.412 5.481 -0.222 1.00 0.00 C ATOM 711 ND1 HIS A 48 -7.675 5.304 -0.697 1.00 0.00 N ATOM 712 CD2 HIS A 48 -5.691 4.341 -0.418 1.00 0.00 C ATOM 713 CE1 HIS A 48 -7.765 4.058 -1.179 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.557 3.470 -1.071 1.00 0.00 N ATOM 0 H HIS A 48 -3.641 5.720 0.763 1.00 0.00 H new ATOM 0 HA HIS A 48 -4.803 7.319 -1.328 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -5.682 6.553 1.469 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -6.648 7.515 0.368 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -8.422 5.999 -0.688 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.667 4.154 -0.129 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -8.655 3.601 -1.586 1.00 0.00 H new ATOM 722 N GLU A 49 -4.880 9.657 -0.320 1.00 0.00 N ATOM 723 CA GLU A 49 -4.736 11.044 0.099 1.00 0.00 C ATOM 724 C GLU A 49 -5.353 11.272 1.491 1.00 0.00 C ATOM 725 O GLU A 49 -5.616 10.314 2.222 1.00 0.00 O ATOM 726 CB GLU A 49 -5.248 11.963 -1.033 1.00 0.00 C ATOM 727 CG GLU A 49 -4.067 12.714 -1.667 1.00 0.00 C ATOM 728 CD GLU A 49 -4.344 13.175 -3.094 1.00 0.00 C ATOM 729 OE1 GLU A 49 -4.483 12.285 -3.961 1.00 0.00 O ATOM 730 OE2 GLU A 49 -4.334 14.405 -3.302 1.00 0.00 O ATOM 0 H GLU A 49 -5.529 9.531 -1.096 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.689 11.308 0.245 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.763 11.371 -1.790 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -5.973 12.674 -0.637 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.824 13.581 -1.053 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.190 12.067 -1.665 1.00 0.00 H new ATOM 737 N GLU A 50 -5.533 12.534 1.885 1.00 0.00 N ATOM 738 CA GLU A 50 -5.897 12.938 3.234 1.00 0.00 C ATOM 739 C GLU A 50 -4.893 12.416 4.274 1.00 0.00 C ATOM 740 O GLU A 50 -3.780 12.013 3.932 1.00 0.00 O ATOM 741 CB GLU A 50 -7.353 12.545 3.548 1.00 0.00 C ATOM 742 CG GLU A 50 -8.305 12.738 2.354 1.00 0.00 C ATOM 743 CD GLU A 50 -8.236 14.149 1.786 1.00 0.00 C ATOM 744 OE1 GLU A 50 -7.347 14.373 0.934 1.00 0.00 O ATOM 745 OE2 GLU A 50 -9.056 14.975 2.235 1.00 0.00 O ATOM 0 H GLU A 50 -5.425 13.324 1.249 1.00 0.00 H new ATOM 0 HA GLU A 50 -5.845 14.025 3.293 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -7.381 11.501 3.862 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -7.710 13.140 4.389 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -8.055 12.021 1.572 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -9.327 12.524 2.668 1.00 0.00 H new ATOM 752 N GLU A 51 -5.304 12.436 5.543 1.00 0.00 N ATOM 753 CA GLU A 51 -4.534 12.044 6.711 1.00 0.00 C ATOM 754 C GLU A 51 -5.587 11.647 7.760 1.00 0.00 C ATOM 755 O GLU A 51 -6.292 10.656 7.551 1.00 0.00 O ATOM 756 CB GLU A 51 -3.578 13.204 7.063 1.00 0.00 C ATOM 757 CG GLU A 51 -2.491 12.895 8.109 1.00 0.00 C ATOM 758 CD GLU A 51 -2.896 13.178 9.548 1.00 0.00 C ATOM 759 OE1 GLU A 51 -3.811 14.013 9.719 1.00 0.00 O ATOM 760 OE2 GLU A 51 -2.281 12.561 10.443 1.00 0.00 O ATOM 0 H GLU A 51 -6.243 12.747 5.791 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.868 11.190 6.592 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -3.088 13.534 6.147 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.174 14.041 7.425 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.212 11.845 8.024 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.602 13.481 7.874 1.00 0.00 H new ATOM 767 N ASP A 52 -5.801 12.431 8.820 1.00 0.00 N ATOM 768 CA ASP A 52 -6.906 12.193 9.739 1.00 0.00 C ATOM 769 C ASP A 52 -8.233 12.548 9.070 1.00 0.00 C ATOM 770 O ASP A 52 -8.622 13.714 9.014 1.00 0.00 O ATOM 771 CB ASP A 52 -6.724 12.975 11.045 1.00 0.00 C ATOM 772 CG ASP A 52 -7.883 12.730 12.008 1.00 0.00 C ATOM 773 OD1 ASP A 52 -8.578 11.705 11.824 1.00 0.00 O ATOM 774 OD2 ASP A 52 -8.051 13.567 12.921 1.00 0.00 O ATOM 0 H ASP A 52 -5.221 13.235 9.059 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.916 11.133 9.993 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -5.787 12.682 11.519 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -6.650 14.040 10.826 1.00 0.00 H new ATOM 779 N ASN A 53 -8.924 11.538 8.537 1.00 0.00 N ATOM 780 CA ASN A 53 -10.269 11.697 8.000 1.00 0.00 C ATOM 781 C ASN A 53 -11.008 10.363 7.965 1.00 0.00 C ATOM 782 O ASN A 53 -12.178 10.286 8.335 1.00 0.00 O ATOM 783 CB ASN A 53 -10.223 12.342 6.611 1.00 0.00 C ATOM 784 CG ASN A 53 -11.612 12.808 6.182 1.00 0.00 C ATOM 785 OD1 ASN A 53 -11.940 13.984 6.281 1.00 0.00 O ATOM 786 ND2 ASN A 53 -12.458 11.897 5.707 1.00 0.00 N ATOM 0 H ASN A 53 -8.562 10.587 8.467 1.00 0.00 H new ATOM 0 HA ASN A 53 -10.823 12.362 8.663 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -9.538 13.189 6.621 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.835 11.627 5.886 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -13.396 12.174 5.418 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -12.168 10.922 5.631 1.00 0.00 H new ATOM 793 N THR A 54 -10.351 9.293 7.504 1.00 0.00 N ATOM 794 CA THR A 54 -10.989 7.990 7.312 1.00 0.00 C ATOM 795 C THR A 54 -11.151 7.232 8.645 1.00 0.00 C ATOM 796 O THR A 54 -10.850 6.046 8.749 1.00 0.00 O ATOM 797 CB THR A 54 -10.241 7.227 6.199 1.00 0.00 C ATOM 798 OG1 THR A 54 -11.070 6.269 5.572 1.00 0.00 O ATOM 799 CG2 THR A 54 -8.890 6.626 6.607 1.00 0.00 C ATOM 0 H THR A 54 -9.362 9.308 7.254 1.00 0.00 H new ATOM 0 HA THR A 54 -12.016 8.111 6.967 1.00 0.00 H new ATOM 0 HB THR A 54 -9.986 7.997 5.471 1.00 0.00 H new ATOM 0 HG1 THR A 54 -10.564 5.806 4.872 1.00 0.00 H new ATOM 0 HG21 THR A 54 -8.448 6.112 5.754 1.00 0.00 H new ATOM 0 HG22 THR A 54 -8.222 7.422 6.937 1.00 0.00 H new ATOM 0 HG23 THR A 54 -9.038 5.916 7.421 1.00 0.00 H new ATOM 807 N ALA A 55 -11.669 7.909 9.675 1.00 0.00 N ATOM 808 CA ALA A 55 -11.767 7.398 11.038 1.00 0.00 C ATOM 809 C ALA A 55 -12.403 6.007 11.092 1.00 0.00 C ATOM 810 O ALA A 55 -11.961 5.156 11.860 1.00 0.00 O ATOM 811 CB ALA A 55 -12.551 8.394 11.898 1.00 0.00 C ATOM 0 H ALA A 55 -12.041 8.854 9.576 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.757 7.290 11.434 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -12.626 8.015 12.917 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -12.035 9.354 11.905 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -13.551 8.523 11.485 1.00 0.00 H new ATOM 817 N GLY A 56 -13.430 5.777 10.267 1.00 0.00 N ATOM 818 CA GLY A 56 -14.086 4.483 10.131 1.00 0.00 C ATOM 819 C GLY A 56 -13.921 3.927 8.719 1.00 0.00 C ATOM 820 O GLY A 56 -14.863 3.363 8.170 1.00 0.00 O ATOM 0 H GLY A 56 -13.831 6.499 9.668 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -13.666 3.782 10.852 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -15.146 4.583 10.364 1.00 0.00 H new ATOM 824 N CYS A 57 -12.733 4.084 8.118 1.00 0.00 N ATOM 825 CA CYS A 57 -12.422 3.572 6.780 1.00 0.00 C ATOM 826 C CYS A 57 -13.397 4.113 5.726 1.00 0.00 C ATOM 827 O CYS A 57 -13.659 3.476 4.706 1.00 0.00 O ATOM 828 CB CYS A 57 -12.296 2.035 6.820 1.00 0.00 C ATOM 829 SG CYS A 57 -10.609 1.366 6.777 1.00 0.00 S ATOM 0 H CYS A 57 -11.953 4.576 8.554 1.00 0.00 H new ATOM 0 HA CYS A 57 -11.449 3.946 6.460 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -12.784 1.675 7.726 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -12.849 1.624 5.975 1.00 0.00 H new ATOM 834 N THR A 58 -13.892 5.332 5.962 1.00 0.00 N ATOM 835 CA THR A 58 -14.891 6.030 5.177 1.00 0.00 C ATOM 836 C THR A 58 -14.567 6.012 3.681 1.00 0.00 C ATOM 837 O THR A 58 -15.383 5.565 2.880 1.00 0.00 O ATOM 838 CB THR A 58 -14.982 7.460 5.738 1.00 0.00 C ATOM 839 OG1 THR A 58 -15.031 7.388 7.153 1.00 0.00 O ATOM 840 CG2 THR A 58 -16.197 8.218 5.195 1.00 0.00 C ATOM 0 H THR A 58 -13.579 5.885 6.760 1.00 0.00 H new ATOM 0 HA THR A 58 -15.856 5.530 5.259 1.00 0.00 H new ATOM 0 HB THR A 58 -14.101 8.016 5.418 1.00 0.00 H new ATOM 0 HG1 THR A 58 -15.087 8.293 7.525 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.219 9.222 5.619 1.00 0.00 H new ATOM 0 HG22 THR A 58 -16.129 8.284 4.109 1.00 0.00 H new ATOM 0 HG23 THR A 58 -17.109 7.688 5.470 1.00 0.00 H new ATOM 848 N SER A 59 -13.389 6.533 3.317 1.00 0.00 N ATOM 849 CA SER A 59 -12.913 6.707 1.944 1.00 0.00 C ATOM 850 C SER A 59 -11.695 7.630 1.955 1.00 0.00 C ATOM 851 O SER A 59 -10.660 7.286 1.387 1.00 0.00 O ATOM 852 CB SER A 59 -13.998 7.264 0.996 1.00 0.00 C ATOM 853 OG SER A 59 -14.563 6.225 0.208 1.00 0.00 O ATOM 0 H SER A 59 -12.712 6.859 4.006 1.00 0.00 H new ATOM 0 HA SER A 59 -12.645 5.723 1.558 1.00 0.00 H new ATOM 0 HB2 SER A 59 -14.780 7.751 1.578 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.564 8.024 0.346 1.00 0.00 H new ATOM 0 HG SER A 59 -15.065 5.613 0.785 1.00 0.00 H new ATOM 859 N ALA A 60 -11.830 8.800 2.594 1.00 0.00 N ATOM 860 CA ALA A 60 -10.859 9.889 2.541 1.00 0.00 C ATOM 861 C ALA A 60 -10.674 10.364 1.099 1.00 0.00 C ATOM 862 O ALA A 60 -11.368 11.274 0.658 1.00 0.00 O ATOM 863 CB ALA A 60 -9.536 9.509 3.223 1.00 0.00 C ATOM 0 H ALA A 60 -12.640 9.016 3.175 1.00 0.00 H new ATOM 0 HA ALA A 60 -11.250 10.731 3.112 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -8.841 10.347 3.161 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -9.722 9.268 4.270 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -9.105 8.642 2.723 1.00 0.00 H new ATOM 869 N GLY A 61 -9.770 9.723 0.361 1.00 0.00 N ATOM 870 CA GLY A 61 -9.452 10.059 -1.013 1.00 0.00 C ATOM 871 C GLY A 61 -9.016 8.788 -1.731 1.00 0.00 C ATOM 872 O GLY A 61 -8.751 7.774 -1.080 1.00 0.00 O ATOM 0 H GLY A 61 -9.228 8.936 0.717 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -10.320 10.495 -1.507 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -8.658 10.805 -1.047 1.00 0.00 H new ATOM 876 N PRO A 62 -8.957 8.808 -3.070 1.00 0.00 N ATOM 877 CA PRO A 62 -8.434 7.700 -3.847 1.00 0.00 C ATOM 878 C PRO A 62 -6.906 7.644 -3.718 1.00 0.00 C ATOM 879 O PRO A 62 -6.311 8.326 -2.882 1.00 0.00 O ATOM 880 CB PRO A 62 -8.923 7.970 -5.275 1.00 0.00 C ATOM 881 CG PRO A 62 -8.991 9.495 -5.347 1.00 0.00 C ATOM 882 CD PRO A 62 -9.374 9.906 -3.924 1.00 0.00 C ATOM 0 HA PRO A 62 -8.777 6.722 -3.510 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -8.237 7.563 -6.018 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -9.897 7.516 -5.458 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -8.035 9.925 -5.645 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -9.731 9.829 -6.074 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -8.879 10.834 -3.638 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -10.447 10.079 -3.842 1.00 0.00 H new ATOM 890 N HIS A 63 -6.279 6.793 -4.535 1.00 0.00 N ATOM 891 CA HIS A 63 -4.834 6.617 -4.573 1.00 0.00 C ATOM 892 C HIS A 63 -4.149 7.951 -4.897 1.00 0.00 C ATOM 893 O HIS A 63 -4.594 8.659 -5.796 1.00 0.00 O ATOM 894 CB HIS A 63 -4.471 5.625 -5.682 1.00 0.00 C ATOM 895 CG HIS A 63 -5.001 4.211 -5.591 1.00 0.00 C ATOM 896 ND1 HIS A 63 -4.604 3.133 -6.389 1.00 0.00 N ATOM 897 CD2 HIS A 63 -5.939 3.724 -4.728 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.301 2.043 -6.014 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.115 2.403 -5.011 1.00 0.00 N ATOM 0 H HIS A 63 -6.775 6.199 -5.199 1.00 0.00 H new ATOM 0 HA HIS A 63 -4.504 6.251 -3.601 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -4.812 6.046 -6.628 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -3.384 5.568 -5.732 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -6.450 4.285 -3.959 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -5.219 1.056 -6.444 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -6.767 1.782 -4.532 1.00 0.00 H new ATOM 907 N PHE A 64 -3.048 8.257 -4.206 1.00 0.00 N ATOM 908 CA PHE A 64 -2.337 9.526 -4.313 1.00 0.00 C ATOM 909 C PHE A 64 -1.832 9.763 -5.743 1.00 0.00 C ATOM 910 O PHE A 64 -0.821 9.188 -6.156 1.00 0.00 O ATOM 911 CB PHE A 64 -1.198 9.553 -3.279 1.00 0.00 C ATOM 912 CG PHE A 64 -0.413 10.846 -3.116 1.00 0.00 C ATOM 913 CD1 PHE A 64 -0.977 12.099 -3.435 1.00 0.00 C ATOM 914 CD2 PHE A 64 0.850 10.802 -2.492 1.00 0.00 C ATOM 915 CE1 PHE A 64 -0.289 13.286 -3.136 1.00 0.00 C ATOM 916 CE2 PHE A 64 1.544 11.991 -2.201 1.00 0.00 C ATOM 917 CZ PHE A 64 0.975 13.234 -2.525 1.00 0.00 C ATOM 0 H PHE A 64 -2.619 7.612 -3.542 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.021 10.346 -4.094 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.622 9.295 -2.308 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.492 8.764 -3.539 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.945 12.146 -3.912 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.288 9.849 -2.235 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.732 14.241 -3.376 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.514 11.948 -1.729 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.508 14.147 -2.305 1.00 0.00 H new ATOM 927 N ASN A 65 -2.547 10.600 -6.503 1.00 0.00 N ATOM 928 CA ASN A 65 -2.257 10.914 -7.901 1.00 0.00 C ATOM 929 C ASN A 65 -2.136 12.418 -8.090 1.00 0.00 C ATOM 930 O ASN A 65 -3.048 13.041 -8.627 1.00 0.00 O ATOM 931 CB ASN A 65 -3.396 10.404 -8.784 1.00 0.00 C ATOM 932 CG ASN A 65 -3.227 10.700 -10.276 1.00 0.00 C ATOM 933 OD1 ASN A 65 -1.998 10.659 -10.787 1.00 0.00 O flip ATOM 934 ND2 ASN A 65 -4.198 10.939 -10.982 1.00 0.00 N flip ATOM 0 H ASN A 65 -3.368 11.091 -6.149 1.00 0.00 H new ATOM 0 HA ASN A 65 -1.318 10.435 -8.178 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.488 9.326 -8.649 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -4.330 10.849 -8.442 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.132 10.966 -10.573 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.073 11.111 -11.980 1.00 0.00 H new ATOM 941 N PRO A 66 -1.020 13.025 -7.680 1.00 0.00 N ATOM 942 CA PRO A 66 -0.914 14.461 -7.752 1.00 0.00 C ATOM 943 C PRO A 66 -0.688 14.945 -9.173 1.00 0.00 C ATOM 944 O PRO A 66 -1.281 15.929 -9.598 1.00 0.00 O ATOM 945 CB PRO A 66 0.208 14.839 -6.785 1.00 0.00 C ATOM 946 CG PRO A 66 1.099 13.593 -6.771 1.00 0.00 C ATOM 947 CD PRO A 66 0.116 12.439 -6.990 1.00 0.00 C ATOM 0 HA PRO A 66 -1.842 14.954 -7.461 1.00 0.00 H new ATOM 0 HB2 PRO A 66 0.753 15.719 -7.126 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -0.178 15.068 -5.792 1.00 0.00 H new ATOM 0 HG2 PRO A 66 1.853 13.631 -7.557 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.630 13.492 -5.825 1.00 0.00 H new ATOM 0 HD2 PRO A 66 0.569 11.645 -7.583 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.187 11.995 -6.041 1.00 0.00 H new ATOM 955 N LEU A 67 0.168 14.221 -9.884 1.00 0.00 N ATOM 956 CA LEU A 67 0.668 14.515 -11.218 1.00 0.00 C ATOM 957 C LEU A 67 1.332 13.239 -11.723 1.00 0.00 C ATOM 958 O LEU A 67 2.301 13.292 -12.476 1.00 0.00 O ATOM 959 CB LEU A 67 1.674 15.686 -11.167 1.00 0.00 C ATOM 960 CG LEU A 67 0.995 17.055 -11.319 1.00 0.00 C ATOM 961 CD1 LEU A 67 1.355 17.975 -10.149 1.00 0.00 C ATOM 962 CD2 LEU A 67 1.387 17.712 -12.648 1.00 0.00 C ATOM 0 H LEU A 67 0.557 13.353 -9.516 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.136 14.819 -11.888 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.214 15.655 -10.221 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.412 15.561 -11.959 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.083 16.896 -11.315 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.862 18.939 -10.279 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.024 17.522 -9.215 1.00 0.00 H new ATOM 0 HD13 LEU A 67 2.435 18.121 -10.120 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.894 18.681 -12.734 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.468 17.850 -12.681 1.00 0.00 H new ATOM 0 HD23 LEU A 67 1.078 17.073 -13.475 1.00 0.00 H new ATOM 974 N SER A 68 0.826 12.081 -11.276 1.00 0.00 N ATOM 975 CA SER A 68 1.340 10.831 -11.778 1.00 0.00 C ATOM 976 C SER A 68 0.552 10.458 -13.020 1.00 0.00 C ATOM 977 O SER A 68 0.533 11.181 -14.012 1.00 0.00 O ATOM 978 CB SER A 68 1.452 9.743 -10.698 1.00 0.00 C ATOM 979 OG SER A 68 2.181 8.656 -11.241 1.00 0.00 O ATOM 0 H SER A 68 0.080 11.999 -10.585 1.00 0.00 H new ATOM 0 HA SER A 68 2.381 10.943 -12.079 1.00 0.00 H new ATOM 0 HB2 SER A 68 1.955 10.135 -9.814 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.461 9.417 -10.382 1.00 0.00 H new ATOM 0 HG SER A 68 1.713 7.818 -11.045 1.00 0.00 H new ATOM 985 N ARG A 69 -0.091 9.305 -12.953 1.00 0.00 N ATOM 986 CA ARG A 69 -0.753 8.648 -14.052 1.00 0.00 C ATOM 987 C ARG A 69 -1.967 7.956 -13.460 1.00 0.00 C ATOM 988 O ARG A 69 -2.246 8.109 -12.274 1.00 0.00 O ATOM 989 CB ARG A 69 0.210 7.631 -14.680 1.00 0.00 C ATOM 990 CG ARG A 69 1.636 8.182 -14.805 1.00 0.00 C ATOM 991 CD ARG A 69 2.540 7.156 -15.506 1.00 0.00 C ATOM 992 NE ARG A 69 3.405 7.772 -16.527 1.00 0.00 N ATOM 993 CZ ARG A 69 4.297 8.753 -16.314 1.00 0.00 C ATOM 994 NH1 ARG A 69 4.526 9.182 -15.069 1.00 0.00 N ATOM 995 NH2 ARG A 69 4.944 9.304 -17.347 1.00 0.00 N ATOM 0 H ARG A 69 -0.166 8.780 -12.082 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.055 9.345 -14.834 1.00 0.00 H new ATOM 0 HB2 ARG A 69 0.224 6.725 -14.074 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.156 7.348 -15.667 1.00 0.00 H new ATOM 0 HG2 ARG A 69 1.626 9.114 -15.369 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.033 8.412 -13.816 1.00 0.00 H new ATOM 0 HD2 ARG A 69 3.160 6.655 -14.763 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.921 6.390 -15.973 1.00 0.00 H new ATOM 0 HE ARG A 69 3.319 7.422 -17.481 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.024 8.764 -14.285 1.00 0.00 H new ATOM 0 HH12 ARG A 69 5.203 9.927 -14.903 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.760 8.979 -18.296 1.00 0.00 H new ATOM 0 HH22 ARG A 69 5.622 10.049 -17.186 1.00 0.00 H new ATOM 1009 N LYS A 70 -2.678 7.176 -14.262 1.00 0.00 N ATOM 1010 CA LYS A 70 -3.768 6.374 -13.775 1.00 0.00 C ATOM 1011 C LYS A 70 -3.237 5.221 -12.921 1.00 0.00 C ATOM 1012 O LYS A 70 -2.028 5.057 -12.738 1.00 0.00 O ATOM 1013 CB LYS A 70 -4.506 5.883 -15.010 1.00 0.00 C ATOM 1014 CG LYS A 70 -5.271 7.052 -15.655 1.00 0.00 C ATOM 1015 CD LYS A 70 -5.434 6.841 -17.165 1.00 0.00 C ATOM 1016 CE LYS A 70 -5.391 8.190 -17.896 1.00 0.00 C ATOM 1017 NZ LYS A 70 -5.299 8.007 -19.357 1.00 0.00 N ATOM 0 H LYS A 70 -2.508 7.088 -15.264 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.442 6.938 -13.130 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.799 5.460 -15.724 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.200 5.087 -14.739 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.252 7.148 -15.190 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.738 7.985 -15.471 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.641 6.192 -17.537 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.379 6.338 -17.369 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -6.285 8.765 -17.655 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.536 8.769 -17.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.272 8.937 -19.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.433 7.479 -19.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.127 7.476 -19.693 1.00 0.00 H new ATOM 1031 N HIS A 71 -4.163 4.437 -12.373 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.815 3.303 -11.547 1.00 0.00 C ATOM 1033 C HIS A 71 -2.978 2.301 -12.327 1.00 0.00 C ATOM 1034 O HIS A 71 -3.202 2.087 -13.516 1.00 0.00 O ATOM 1035 CB HIS A 71 -5.081 2.617 -11.035 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.774 1.539 -10.038 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -3.902 1.599 -8.949 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -5.322 0.297 -10.014 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.786 0.361 -8.443 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.753 -0.374 -8.978 1.00 0.00 N ATOM 0 H HIS A 71 -5.166 4.576 -12.493 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.230 3.667 -10.702 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.735 3.359 -10.576 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.626 2.188 -11.876 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -6.070 -0.086 -10.692 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -3.044 0.026 -7.733 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -5.028 -1.303 -8.659 1.00 0.00 H new ATOM 1048 N GLY A 72 -2.056 1.649 -11.628 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.373 0.486 -12.137 1.00 0.00 C ATOM 1050 C GLY A 72 -0.589 -0.129 -10.992 1.00 0.00 C ATOM 1051 O GLY A 72 -0.949 0.086 -9.834 1.00 0.00 O ATOM 0 H GLY A 72 -1.766 1.921 -10.689 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -2.088 -0.232 -12.539 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.705 0.762 -12.953 1.00 0.00 H new ATOM 1055 N GLY A 73 0.460 -0.891 -11.293 1.00 0.00 N ATOM 1056 CA GLY A 73 1.293 -1.514 -10.274 1.00 0.00 C ATOM 1057 C GLY A 73 2.754 -1.409 -10.677 1.00 0.00 C ATOM 1058 O GLY A 73 3.051 -1.004 -11.799 1.00 0.00 O ATOM 0 H GLY A 73 0.754 -1.092 -12.249 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.135 -1.026 -9.312 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.013 -2.560 -10.151 1.00 0.00 H new ATOM 1062 N PRO A 74 3.675 -1.804 -9.787 1.00 0.00 N ATOM 1063 CA PRO A 74 5.106 -1.681 -10.013 1.00 0.00 C ATOM 1064 C PRO A 74 5.569 -2.440 -11.262 1.00 0.00 C ATOM 1065 O PRO A 74 6.595 -2.089 -11.836 1.00 0.00 O ATOM 1066 CB PRO A 74 5.769 -2.172 -8.721 1.00 0.00 C ATOM 1067 CG PRO A 74 4.716 -3.079 -8.082 1.00 0.00 C ATOM 1068 CD PRO A 74 3.401 -2.424 -8.503 1.00 0.00 C ATOM 0 HA PRO A 74 5.392 -0.650 -10.223 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.691 -2.716 -8.928 1.00 0.00 H new ATOM 0 HB3 PRO A 74 6.029 -1.341 -8.066 1.00 0.00 H new ATOM 0 HG2 PRO A 74 4.791 -4.104 -8.445 1.00 0.00 H new ATOM 0 HG3 PRO A 74 4.820 -3.117 -6.998 1.00 0.00 H new ATOM 0 HD2 PRO A 74 2.603 -3.162 -8.585 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.078 -1.685 -7.770 1.00 0.00 H new ATOM 1076 N LYS A 75 4.817 -3.458 -11.700 1.00 0.00 N ATOM 1077 CA LYS A 75 5.139 -4.178 -12.927 1.00 0.00 C ATOM 1078 C LYS A 75 4.833 -3.379 -14.204 1.00 0.00 C ATOM 1079 O LYS A 75 5.354 -3.724 -15.262 1.00 0.00 O ATOM 1080 CB LYS A 75 4.444 -5.550 -12.966 1.00 0.00 C ATOM 1081 CG LYS A 75 2.915 -5.476 -13.119 1.00 0.00 C ATOM 1082 CD LYS A 75 2.340 -6.829 -13.575 1.00 0.00 C ATOM 1083 CE LYS A 75 1.248 -6.672 -14.647 1.00 0.00 C ATOM 1084 NZ LYS A 75 1.762 -6.156 -15.936 1.00 0.00 N ATOM 0 H LYS A 75 3.984 -3.797 -11.220 1.00 0.00 H new ATOM 0 HA LYS A 75 6.218 -4.329 -12.909 1.00 0.00 H new ATOM 0 HB2 LYS A 75 4.853 -6.129 -13.794 1.00 0.00 H new ATOM 0 HB3 LYS A 75 4.681 -6.091 -12.050 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.465 -5.187 -12.169 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.655 -4.704 -13.843 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.146 -7.449 -13.969 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.927 -7.354 -12.714 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.772 -7.638 -14.814 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.478 -5.997 -14.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.264 -5.277 -16.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.781 -5.965 -15.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.603 -6.864 -16.681 1.00 0.00 H new ATOM 1098 N ASP A 76 3.932 -2.392 -14.135 1.00 0.00 N ATOM 1099 CA ASP A 76 3.462 -1.636 -15.291 1.00 0.00 C ATOM 1100 C ASP A 76 4.106 -0.253 -15.281 1.00 0.00 C ATOM 1101 O ASP A 76 4.725 0.170 -14.305 1.00 0.00 O ATOM 1102 CB ASP A 76 1.920 -1.589 -15.312 1.00 0.00 C ATOM 1103 CG ASP A 76 1.294 -2.946 -15.622 1.00 0.00 C ATOM 1104 OD1 ASP A 76 1.784 -3.640 -16.539 1.00 0.00 O ATOM 1105 OD2 ASP A 76 0.324 -3.326 -14.939 1.00 0.00 O ATOM 0 H ASP A 76 3.505 -2.095 -13.258 1.00 0.00 H new ATOM 0 HA ASP A 76 3.762 -2.129 -16.215 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.558 -1.239 -14.345 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.593 -0.864 -16.057 1.00 0.00 H new ATOM 1110 N GLU A 77 3.973 0.456 -16.399 1.00 0.00 N ATOM 1111 CA GLU A 77 4.416 1.838 -16.489 1.00 0.00 C ATOM 1112 C GLU A 77 3.476 2.717 -15.671 1.00 0.00 C ATOM 1113 O GLU A 77 3.923 3.617 -14.959 1.00 0.00 O ATOM 1114 CB GLU A 77 4.470 2.318 -17.948 1.00 0.00 C ATOM 1115 CG GLU A 77 5.830 2.042 -18.610 1.00 0.00 C ATOM 1116 CD GLU A 77 6.202 3.144 -19.600 1.00 0.00 C ATOM 1117 OE1 GLU A 77 6.209 4.316 -19.161 1.00 0.00 O ATOM 1118 OE2 GLU A 77 6.474 2.797 -20.767 1.00 0.00 O ATOM 0 H GLU A 77 3.560 0.091 -17.257 1.00 0.00 H new ATOM 0 HA GLU A 77 5.427 1.908 -16.088 1.00 0.00 H new ATOM 0 HB2 GLU A 77 3.685 1.823 -18.519 1.00 0.00 H new ATOM 0 HB3 GLU A 77 4.263 3.388 -17.983 1.00 0.00 H new ATOM 0 HG2 GLU A 77 6.601 1.965 -17.843 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.797 1.083 -19.127 1.00 0.00 H new ATOM 1125 N GLU A 78 2.174 2.451 -15.786 1.00 0.00 N ATOM 1126 CA GLU A 78 1.167 3.215 -15.067 1.00 0.00 C ATOM 1127 C GLU A 78 1.157 2.779 -13.604 1.00 0.00 C ATOM 1128 O GLU A 78 1.413 1.617 -13.296 1.00 0.00 O ATOM 1129 CB GLU A 78 -0.206 3.120 -15.756 1.00 0.00 C ATOM 1130 CG GLU A 78 -0.358 4.290 -16.743 1.00 0.00 C ATOM 1131 CD GLU A 78 -1.570 4.162 -17.658 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -1.700 3.084 -18.277 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -2.326 5.158 -17.740 1.00 0.00 O ATOM 0 H GLU A 78 1.796 1.708 -16.374 1.00 0.00 H new ATOM 0 HA GLU A 78 1.418 4.276 -15.087 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.297 2.170 -16.283 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.002 3.150 -15.012 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.434 5.221 -16.181 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.542 4.359 -17.354 1.00 0.00 H new ATOM 1140 N ARG A 79 0.921 3.749 -12.718 1.00 0.00 N ATOM 1141 CA ARG A 79 1.007 3.660 -11.269 1.00 0.00 C ATOM 1142 C ARG A 79 0.896 5.075 -10.704 1.00 0.00 C ATOM 1143 O ARG A 79 1.550 6.004 -11.177 1.00 0.00 O ATOM 1144 CB ARG A 79 2.264 2.924 -10.773 1.00 0.00 C ATOM 1145 CG ARG A 79 3.591 3.329 -11.432 1.00 0.00 C ATOM 1146 CD ARG A 79 4.366 2.049 -11.764 1.00 0.00 C ATOM 1147 NE ARG A 79 5.641 2.326 -12.435 1.00 0.00 N ATOM 1148 CZ ARG A 79 6.804 2.579 -11.815 1.00 0.00 C ATOM 1149 NH1 ARG A 79 6.850 2.625 -10.477 1.00 0.00 N ATOM 1150 NH2 ARG A 79 7.912 2.794 -12.531 1.00 0.00 N ATOM 0 H ARG A 79 0.645 4.683 -13.022 1.00 0.00 H new ATOM 0 HA ARG A 79 0.183 3.048 -10.903 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.353 3.083 -9.698 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.118 1.855 -10.926 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.406 3.908 -12.337 1.00 0.00 H new ATOM 0 HG3 ARG A 79 4.171 3.963 -10.762 1.00 0.00 H new ATOM 0 HD2 ARG A 79 4.555 1.493 -10.846 1.00 0.00 H new ATOM 0 HD3 ARG A 79 3.754 1.412 -12.402 1.00 0.00 H new ATOM 0 HE ARG A 79 5.644 2.326 -13.455 1.00 0.00 H new ATOM 0 HH11 ARG A 79 6.002 2.468 -9.932 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.733 2.817 -10.003 1.00 0.00 H new ATOM 0 HH21 ARG A 79 7.874 2.766 -13.550 1.00 0.00 H new ATOM 0 HH22 ARG A 79 8.795 2.986 -12.058 1.00 0.00 H new ATOM 1164 N HIS A 80 0.041 5.245 -9.699 1.00 0.00 N ATOM 1165 CA HIS A 80 -0.052 6.474 -8.922 1.00 0.00 C ATOM 1166 C HIS A 80 1.244 6.670 -8.111 1.00 0.00 C ATOM 1167 O HIS A 80 2.096 5.784 -8.101 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.298 6.407 -8.032 1.00 0.00 C ATOM 1169 CG HIS A 80 -2.583 6.070 -8.750 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.437 4.987 -8.526 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -3.224 6.868 -9.653 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -4.604 5.259 -9.125 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -4.448 6.326 -9.905 1.00 0.00 N ATOM 0 H HIS A 80 -0.614 4.523 -9.399 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.156 7.340 -9.576 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.129 5.663 -7.254 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.421 7.368 -7.533 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.829 7.772 -10.092 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.521 4.703 -8.996 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -5.129 6.678 -10.577 1.00 0.00 H new ATOM 1181 N VAL A 81 1.412 7.806 -7.416 1.00 0.00 N ATOM 1182 CA VAL A 81 2.656 8.066 -6.678 1.00 0.00 C ATOM 1183 C VAL A 81 2.886 6.987 -5.617 1.00 0.00 C ATOM 1184 O VAL A 81 4.014 6.542 -5.426 1.00 0.00 O ATOM 1185 CB VAL A 81 2.681 9.507 -6.113 1.00 0.00 C ATOM 1186 CG1 VAL A 81 3.397 9.656 -4.763 1.00 0.00 C ATOM 1187 CG2 VAL A 81 3.402 10.438 -7.094 1.00 0.00 C ATOM 0 H VAL A 81 0.714 8.547 -7.350 1.00 0.00 H new ATOM 0 HA VAL A 81 3.499 8.005 -7.367 1.00 0.00 H new ATOM 0 HB VAL A 81 1.632 9.765 -5.970 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.364 10.699 -4.447 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.901 9.035 -4.017 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.435 9.341 -4.865 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.416 11.451 -6.691 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.425 10.091 -7.240 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.878 10.435 -8.050 1.00 0.00 H new ATOM 1197 N GLY A 82 1.818 6.559 -4.939 1.00 0.00 N ATOM 1198 CA GLY A 82 1.885 5.524 -3.921 1.00 0.00 C ATOM 1199 C GLY A 82 0.986 4.347 -4.285 1.00 0.00 C ATOM 1200 O GLY A 82 -0.027 4.114 -3.624 1.00 0.00 O ATOM 0 H GLY A 82 0.879 6.928 -5.087 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.914 5.181 -3.812 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.582 5.935 -2.958 1.00 0.00 H new ATOM 1204 N ASP A 83 1.361 3.617 -5.342 1.00 0.00 N ATOM 1205 CA ASP A 83 0.613 2.506 -5.911 1.00 0.00 C ATOM 1206 C ASP A 83 1.440 1.221 -5.868 1.00 0.00 C ATOM 1207 O ASP A 83 1.996 0.772 -6.871 1.00 0.00 O ATOM 1208 CB ASP A 83 0.292 2.939 -7.351 1.00 0.00 C ATOM 1209 CG ASP A 83 -1.095 2.592 -7.808 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -1.907 2.165 -6.965 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.399 2.897 -8.979 1.00 0.00 O ATOM 0 H ASP A 83 2.232 3.798 -5.840 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.298 2.286 -5.354 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.429 4.017 -7.432 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.011 2.474 -8.026 1.00 0.00 H new ATOM 1216 N LEU A 84 1.516 0.597 -4.696 1.00 0.00 N ATOM 1217 CA LEU A 84 2.450 -0.489 -4.446 1.00 0.00 C ATOM 1218 C LEU A 84 1.822 -1.828 -4.840 1.00 0.00 C ATOM 1219 O LEU A 84 1.997 -2.819 -4.134 1.00 0.00 O ATOM 1220 CB LEU A 84 2.858 -0.461 -2.965 1.00 0.00 C ATOM 1221 CG LEU A 84 3.588 0.808 -2.489 1.00 0.00 C ATOM 1222 CD1 LEU A 84 4.877 1.065 -3.276 1.00 0.00 C ATOM 1223 CD2 LEU A 84 2.744 2.084 -2.456 1.00 0.00 C ATOM 0 H LEU A 84 0.930 0.832 -3.895 1.00 0.00 H new ATOM 0 HA LEU A 84 3.346 -0.364 -5.054 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.961 -0.589 -2.359 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.500 -1.320 -2.769 1.00 0.00 H new ATOM 0 HG LEU A 84 3.827 0.578 -1.451 1.00 0.00 H new ATOM 0 HD11 LEU A 84 5.356 1.971 -2.904 1.00 0.00 H new ATOM 0 HD12 LEU A 84 5.554 0.219 -3.152 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.640 1.188 -4.333 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.356 2.916 -2.106 1.00 0.00 H new ATOM 0 HD22 LEU A 84 2.374 2.302 -3.458 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.900 1.945 -1.780 1.00 0.00 H new ATOM 1235 N GLY A 85 1.101 -1.850 -5.969 1.00 0.00 N ATOM 1236 CA GLY A 85 0.211 -2.935 -6.366 1.00 0.00 C ATOM 1237 C GLY A 85 -0.418 -3.634 -5.157 1.00 0.00 C ATOM 1238 O GLY A 85 -0.988 -2.983 -4.281 1.00 0.00 O ATOM 0 H GLY A 85 1.126 -1.088 -6.647 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.577 -2.541 -7.007 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.768 -3.663 -6.956 1.00 0.00 H new ATOM 1242 N ASN A 86 -0.258 -4.958 -5.088 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.790 -5.801 -4.025 1.00 0.00 C ATOM 1244 C ASN A 86 0.329 -6.500 -3.268 1.00 0.00 C ATOM 1245 O ASN A 86 1.464 -6.570 -3.732 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.788 -6.837 -4.569 1.00 0.00 C ATOM 1247 CG ASN A 86 -1.307 -7.490 -5.856 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -0.532 -8.438 -5.827 1.00 0.00 O ATOM 1249 ND2 ASN A 86 -1.760 -6.974 -6.993 1.00 0.00 N ATOM 0 H ASN A 86 0.260 -5.484 -5.792 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.323 -5.147 -3.335 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -1.955 -7.607 -3.815 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.748 -6.353 -4.748 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.463 -7.368 -7.886 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.405 -6.184 -6.973 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.030 -7.027 -2.096 1.00 0.00 N ATOM 1257 CA VAL A 87 0.817 -7.846 -1.243 1.00 0.00 C ATOM 1258 C VAL A 87 0.184 -9.226 -1.178 1.00 0.00 C ATOM 1259 O VAL A 87 -0.968 -9.375 -1.581 1.00 0.00 O ATOM 1260 CB VAL A 87 0.929 -7.235 0.164 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.465 -5.804 0.072 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.405 -7.265 0.923 1.00 0.00 C ATOM 0 H VAL A 87 -0.961 -6.885 -1.703 1.00 0.00 H new ATOM 0 HA VAL A 87 1.827 -7.903 -1.648 1.00 0.00 H new ATOM 0 HB VAL A 87 1.629 -7.848 0.732 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.541 -5.379 1.073 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.450 -5.814 -0.394 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.786 -5.199 -0.528 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.272 -6.822 1.910 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.152 -6.697 0.368 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.739 -8.297 1.030 1.00 0.00 H new ATOM 1272 N THR A 88 0.905 -10.204 -0.637 1.00 0.00 N ATOM 1273 CA THR A 88 0.473 -11.592 -0.514 1.00 0.00 C ATOM 1274 C THR A 88 0.332 -11.920 0.969 1.00 0.00 C ATOM 1275 O THR A 88 1.298 -11.766 1.710 1.00 0.00 O ATOM 1276 CB THR A 88 1.508 -12.488 -1.208 1.00 0.00 C ATOM 1277 OG1 THR A 88 1.877 -11.910 -2.447 1.00 0.00 O ATOM 1278 CG2 THR A 88 0.952 -13.888 -1.475 1.00 0.00 C ATOM 0 H THR A 88 1.839 -10.046 -0.259 1.00 0.00 H new ATOM 0 HA THR A 88 -0.492 -11.760 -0.993 1.00 0.00 H new ATOM 0 HB THR A 88 2.370 -12.573 -0.546 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.539 -12.481 -2.890 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.713 -14.494 -1.967 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.672 -14.354 -0.531 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.075 -13.815 -2.118 1.00 0.00 H new ATOM 1286 N ALA A 89 -0.860 -12.335 1.406 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.085 -12.815 2.761 1.00 0.00 C ATOM 1288 C ALA A 89 -0.882 -14.324 2.832 1.00 0.00 C ATOM 1289 O ALA A 89 -1.167 -15.038 1.868 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.479 -12.416 3.248 1.00 0.00 C ATOM 0 H ALA A 89 -1.697 -12.345 0.823 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.356 -12.348 3.423 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -2.629 -12.784 4.263 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.571 -11.330 3.238 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.232 -12.850 2.590 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.402 -14.783 3.990 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.268 -16.180 4.351 1.00 0.00 C ATOM 1298 C ASP A 90 -1.602 -16.774 4.795 1.00 0.00 C ATOM 1299 O ASP A 90 -2.631 -16.099 4.876 1.00 0.00 O ATOM 1300 CB ASP A 90 0.842 -16.348 5.404 1.00 0.00 C ATOM 1301 CG ASP A 90 0.470 -15.854 6.795 1.00 0.00 C ATOM 1302 OD1 ASP A 90 -0.700 -15.446 6.970 1.00 0.00 O ATOM 1303 OD2 ASP A 90 1.346 -15.951 7.676 1.00 0.00 O ATOM 0 H ASP A 90 -0.084 -14.156 4.729 1.00 0.00 H new ATOM 0 HA ASP A 90 0.030 -16.746 3.469 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.110 -17.403 5.466 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.730 -15.813 5.067 1.00 0.00 H new ATOM 1308 N LYS A 91 -1.549 -18.062 5.126 1.00 0.00 N ATOM 1309 CA LYS A 91 -2.657 -18.832 5.638 1.00 0.00 C ATOM 1310 C LYS A 91 -3.105 -18.356 7.020 1.00 0.00 C ATOM 1311 O LYS A 91 -4.183 -18.733 7.471 1.00 0.00 O ATOM 1312 CB LYS A 91 -2.239 -20.306 5.648 1.00 0.00 C ATOM 1313 CG LYS A 91 -1.201 -20.649 6.728 1.00 0.00 C ATOM 1314 CD LYS A 91 -0.874 -22.146 6.664 1.00 0.00 C ATOM 1315 CE LYS A 91 -0.175 -22.592 7.957 1.00 0.00 C ATOM 1316 NZ LYS A 91 0.077 -24.047 7.972 1.00 0.00 N ATOM 0 H LYS A 91 -0.694 -18.611 5.038 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.525 -18.696 4.993 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.124 -20.924 5.799 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -1.832 -20.565 4.671 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.296 -20.061 6.577 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.588 -20.392 7.714 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -1.790 -22.720 6.520 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.233 -22.349 5.806 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.770 -22.059 8.062 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.791 -22.321 8.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 0.550 -24.308 8.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -0.827 -24.557 7.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.685 -24.302 7.168 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.268 -17.568 7.701 1.00 0.00 N ATOM 1331 CA ASP A 92 -2.607 -17.000 9.002 1.00 0.00 C ATOM 1332 C ASP A 92 -3.381 -15.694 8.798 1.00 0.00 C ATOM 1333 O ASP A 92 -3.993 -15.174 9.731 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.333 -16.794 9.838 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.556 -17.116 11.311 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -1.623 -18.329 11.611 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.633 -16.161 12.117 1.00 0.00 O ATOM 0 H ASP A 92 -1.341 -17.309 7.365 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.246 -17.688 9.556 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.536 -17.426 9.446 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -0.998 -15.761 9.740 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.373 -15.158 7.570 1.00 0.00 N ATOM 1343 CA GLY A 93 -4.003 -13.891 7.254 1.00 0.00 C ATOM 1344 C GLY A 93 -3.064 -12.726 7.556 1.00 0.00 C ATOM 1345 O GLY A 93 -3.517 -11.621 7.877 1.00 0.00 O ATOM 0 H GLY A 93 -2.923 -15.603 6.770 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.285 -13.873 6.201 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.921 -13.783 7.832 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.756 -12.973 7.436 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.697 -12.001 7.623 1.00 0.00 C ATOM 1351 C VAL A 94 -0.013 -11.796 6.277 1.00 0.00 C ATOM 1352 O VAL A 94 0.518 -12.745 5.709 1.00 0.00 O ATOM 1353 CB VAL A 94 0.285 -12.505 8.696 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.555 -11.638 8.771 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.405 -12.565 10.064 1.00 0.00 C ATOM 0 H VAL A 94 -1.401 -13.898 7.195 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.091 -11.046 7.972 1.00 0.00 H new ATOM 0 HB VAL A 94 0.595 -13.510 8.408 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.219 -12.031 9.541 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.066 -11.657 7.808 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.281 -10.612 9.017 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.302 -12.923 10.813 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.753 -11.570 10.340 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.255 -13.245 10.013 1.00 0.00 H new ATOM 1365 N ALA A 95 -0.037 -10.565 5.754 1.00 0.00 N ATOM 1366 CA ALA A 95 0.807 -10.172 4.637 1.00 0.00 C ATOM 1367 C ALA A 95 1.971 -9.385 5.215 1.00 0.00 C ATOM 1368 O ALA A 95 1.760 -8.283 5.732 1.00 0.00 O ATOM 1369 CB ALA A 95 0.027 -9.341 3.606 1.00 0.00 C ATOM 0 H ALA A 95 -0.643 -9.820 6.097 1.00 0.00 H new ATOM 0 HA ALA A 95 1.166 -11.052 4.104 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.689 -9.065 2.785 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -0.805 -9.929 3.219 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.357 -8.439 4.082 1.00 0.00 H new ATOM 1375 N ASP A 96 3.172 -9.960 5.149 1.00 0.00 N ATOM 1376 CA ASP A 96 4.414 -9.254 5.370 1.00 0.00 C ATOM 1377 C ASP A 96 4.724 -8.462 4.099 1.00 0.00 C ATOM 1378 O ASP A 96 4.731 -9.004 2.995 1.00 0.00 O ATOM 1379 CB ASP A 96 5.531 -10.237 5.742 1.00 0.00 C ATOM 1380 CG ASP A 96 5.761 -11.309 4.684 1.00 0.00 C ATOM 1381 OD1 ASP A 96 4.752 -11.954 4.319 1.00 0.00 O ATOM 1382 OD2 ASP A 96 6.934 -11.476 4.287 1.00 0.00 O ATOM 0 H ASP A 96 3.301 -10.949 4.936 1.00 0.00 H new ATOM 0 HA ASP A 96 4.333 -8.562 6.209 1.00 0.00 H new ATOM 0 HB2 ASP A 96 6.457 -9.683 5.897 1.00 0.00 H new ATOM 0 HB3 ASP A 96 5.284 -10.717 6.689 1.00 0.00 H new ATOM 1387 N VAL A 97 4.925 -7.155 4.242 1.00 0.00 N ATOM 1388 CA VAL A 97 5.328 -6.275 3.155 1.00 0.00 C ATOM 1389 C VAL A 97 6.824 -6.052 3.313 1.00 0.00 C ATOM 1390 O VAL A 97 7.287 -5.977 4.447 1.00 0.00 O ATOM 1391 CB VAL A 97 4.557 -4.941 3.209 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.658 -4.209 1.864 1.00 0.00 C ATOM 1393 CG2 VAL A 97 3.089 -5.162 3.585 1.00 0.00 C ATOM 0 H VAL A 97 4.810 -6.672 5.133 1.00 0.00 H new ATOM 0 HA VAL A 97 5.102 -6.720 2.186 1.00 0.00 H new ATOM 0 HB VAL A 97 5.013 -4.323 3.982 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.108 -3.269 1.919 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.705 -4.005 1.639 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.233 -4.833 1.078 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.573 -4.203 3.615 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.616 -5.806 2.843 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.032 -5.635 4.565 1.00 0.00 H new ATOM 1403 N SER A 98 7.542 -5.910 2.196 1.00 0.00 N ATOM 1404 CA SER A 98 8.958 -5.574 2.121 1.00 0.00 C ATOM 1405 C SER A 98 9.260 -5.151 0.684 1.00 0.00 C ATOM 1406 O SER A 98 9.420 -6.013 -0.176 1.00 0.00 O ATOM 1407 CB SER A 98 9.835 -6.780 2.507 1.00 0.00 C ATOM 1408 OG SER A 98 10.065 -6.838 3.900 1.00 0.00 O ATOM 0 H SER A 98 7.125 -6.034 1.273 1.00 0.00 H new ATOM 0 HA SER A 98 9.182 -4.768 2.820 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.351 -7.700 2.180 1.00 0.00 H new ATOM 0 HB3 SER A 98 10.789 -6.718 1.983 1.00 0.00 H new ATOM 0 HG SER A 98 9.217 -6.722 4.377 1.00 0.00 H new ATOM 1414 N ILE A 99 9.334 -3.846 0.416 1.00 0.00 N ATOM 1415 CA ILE A 99 9.700 -3.309 -0.886 1.00 0.00 C ATOM 1416 C ILE A 99 10.475 -1.997 -0.678 1.00 0.00 C ATOM 1417 O ILE A 99 10.628 -1.541 0.453 1.00 0.00 O ATOM 1418 CB ILE A 99 8.434 -3.237 -1.773 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.778 -3.272 -3.269 1.00 0.00 C ATOM 1420 CG2 ILE A 99 7.507 -2.062 -1.451 1.00 0.00 C ATOM 1421 CD1 ILE A 99 7.569 -3.564 -4.162 1.00 0.00 C ATOM 0 H ILE A 99 9.137 -3.126 1.111 1.00 0.00 H new ATOM 0 HA ILE A 99 10.385 -3.952 -1.439 1.00 0.00 H new ATOM 0 HB ILE A 99 7.871 -4.137 -1.527 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.211 -2.314 -3.558 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.540 -4.032 -3.442 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.645 -2.085 -2.118 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.169 -2.138 -0.418 1.00 0.00 H new ATOM 0 HG23 ILE A 99 8.046 -1.125 -1.588 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.882 -3.574 -5.206 1.00 0.00 H new ATOM 0 HD12 ILE A 99 7.149 -4.535 -3.899 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.814 -2.791 -4.017 1.00 0.00 H new ATOM 1433 N GLU A 100 11.023 -1.423 -1.746 1.00 0.00 N ATOM 1434 CA GLU A 100 11.874 -0.244 -1.733 1.00 0.00 C ATOM 1435 C GLU A 100 11.492 0.602 -2.948 1.00 0.00 C ATOM 1436 O GLU A 100 11.488 0.068 -4.057 1.00 0.00 O ATOM 1437 CB GLU A 100 13.348 -0.683 -1.810 1.00 0.00 C ATOM 1438 CG GLU A 100 13.860 -1.295 -0.496 1.00 0.00 C ATOM 1439 CD GLU A 100 15.084 -2.180 -0.691 1.00 0.00 C ATOM 1440 OE1 GLU A 100 15.885 -1.875 -1.597 1.00 0.00 O ATOM 1441 OE2 GLU A 100 15.195 -3.157 0.087 1.00 0.00 O ATOM 0 H GLU A 100 10.877 -1.787 -2.687 1.00 0.00 H new ATOM 0 HA GLU A 100 11.743 0.337 -0.820 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.463 -1.411 -2.613 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.965 0.178 -2.069 1.00 0.00 H new ATOM 0 HG2 GLU A 100 14.105 -0.493 0.201 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.063 -1.882 -0.040 1.00 0.00 H new ATOM 1448 N ASP A 101 11.170 1.885 -2.751 1.00 0.00 N ATOM 1449 CA ASP A 101 10.792 2.798 -3.827 1.00 0.00 C ATOM 1450 C ASP A 101 11.619 4.072 -3.731 1.00 0.00 C ATOM 1451 O ASP A 101 12.002 4.494 -2.643 1.00 0.00 O ATOM 1452 CB ASP A 101 9.304 3.153 -3.741 1.00 0.00 C ATOM 1453 CG ASP A 101 8.430 2.199 -4.535 1.00 0.00 C ATOM 1454 OD1 ASP A 101 8.255 2.482 -5.742 1.00 0.00 O ATOM 1455 OD2 ASP A 101 7.942 1.224 -3.924 1.00 0.00 O ATOM 0 H ASP A 101 11.165 2.320 -1.829 1.00 0.00 H new ATOM 0 HA ASP A 101 10.980 2.304 -4.780 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.991 3.143 -2.697 1.00 0.00 H new ATOM 0 HB3 ASP A 101 9.155 4.168 -4.108 1.00 0.00 H new ATOM 1460 N SER A 102 11.868 4.702 -4.878 1.00 0.00 N ATOM 1461 CA SER A 102 12.570 5.970 -4.978 1.00 0.00 C ATOM 1462 C SER A 102 11.594 7.147 -5.068 1.00 0.00 C ATOM 1463 O SER A 102 11.950 8.266 -4.714 1.00 0.00 O ATOM 1464 CB SER A 102 13.504 5.932 -6.190 1.00 0.00 C ATOM 1465 OG SER A 102 12.784 5.562 -7.353 1.00 0.00 O ATOM 0 H SER A 102 11.578 4.331 -5.783 1.00 0.00 H new ATOM 0 HA SER A 102 13.160 6.119 -4.074 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.964 6.910 -6.334 1.00 0.00 H new ATOM 0 HB3 SER A 102 14.312 5.222 -6.013 1.00 0.00 H new ATOM 0 HG SER A 102 13.392 5.543 -8.122 1.00 0.00 H new ATOM 1471 N VAL A 103 10.383 6.913 -5.592 1.00 0.00 N ATOM 1472 CA VAL A 103 9.465 7.991 -5.927 1.00 0.00 C ATOM 1473 C VAL A 103 8.868 8.608 -4.658 1.00 0.00 C ATOM 1474 O VAL A 103 8.785 9.826 -4.532 1.00 0.00 O ATOM 1475 CB VAL A 103 8.415 7.499 -6.945 1.00 0.00 C ATOM 1476 CG1 VAL A 103 7.273 6.684 -6.322 1.00 0.00 C ATOM 1477 CG2 VAL A 103 7.831 8.682 -7.726 1.00 0.00 C ATOM 0 H VAL A 103 10.023 5.980 -5.791 1.00 0.00 H new ATOM 0 HA VAL A 103 10.006 8.800 -6.418 1.00 0.00 H new ATOM 0 HB VAL A 103 8.950 6.825 -7.615 1.00 0.00 H new ATOM 0 HG11 VAL A 103 6.578 6.376 -7.103 1.00 0.00 H new ATOM 0 HG12 VAL A 103 7.682 5.801 -5.831 1.00 0.00 H new ATOM 0 HG13 VAL A 103 6.747 7.296 -5.589 1.00 0.00 H new ATOM 0 HG21 VAL A 103 7.092 8.318 -8.440 1.00 0.00 H new ATOM 0 HG22 VAL A 103 7.355 9.376 -7.033 1.00 0.00 H new ATOM 0 HG23 VAL A 103 8.630 9.195 -8.261 1.00 0.00 H new ATOM 1487 N ILE A 104 8.446 7.771 -3.710 1.00 0.00 N ATOM 1488 CA ILE A 104 7.984 8.206 -2.409 1.00 0.00 C ATOM 1489 C ILE A 104 9.194 8.591 -1.553 1.00 0.00 C ATOM 1490 O ILE A 104 10.273 8.019 -1.698 1.00 0.00 O ATOM 1491 CB ILE A 104 7.152 7.084 -1.776 1.00 0.00 C ATOM 1492 CG1 ILE A 104 7.744 5.700 -2.087 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.696 7.166 -2.258 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.085 4.608 -1.275 1.00 0.00 C ATOM 0 H ILE A 104 8.418 6.759 -3.835 1.00 0.00 H new ATOM 0 HA ILE A 104 7.345 9.086 -2.491 1.00 0.00 H new ATOM 0 HB ILE A 104 7.176 7.218 -0.695 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.625 5.485 -3.149 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.814 5.709 -1.882 1.00 0.00 H new ATOM 0 HG21 ILE A 104 5.116 6.364 -1.801 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.272 8.129 -1.972 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.666 7.064 -3.343 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.534 3.647 -1.526 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.227 4.808 -0.213 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.019 4.581 -1.500 1.00 0.00 H new ATOM 1506 N SER A 105 9.028 9.566 -0.657 1.00 0.00 N ATOM 1507 CA SER A 105 10.031 9.953 0.321 1.00 0.00 C ATOM 1508 C SER A 105 9.306 10.677 1.440 1.00 0.00 C ATOM 1509 O SER A 105 8.103 10.899 1.353 1.00 0.00 O ATOM 1510 CB SER A 105 11.154 10.776 -0.323 1.00 0.00 C ATOM 1511 OG SER A 105 12.107 9.920 -0.921 1.00 0.00 O ATOM 0 H SER A 105 8.172 10.117 -0.595 1.00 0.00 H new ATOM 0 HA SER A 105 10.539 9.082 0.735 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.737 11.448 -1.073 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.636 11.399 0.431 1.00 0.00 H new ATOM 0 HG SER A 105 11.655 9.131 -1.285 1.00 0.00 H new ATOM 1517 N LEU A 106 10.027 11.048 2.494 1.00 0.00 N ATOM 1518 CA LEU A 106 9.503 11.793 3.621 1.00 0.00 C ATOM 1519 C LEU A 106 9.759 13.288 3.363 1.00 0.00 C ATOM 1520 O LEU A 106 10.033 14.039 4.293 1.00 0.00 O ATOM 1521 CB LEU A 106 10.162 11.269 4.911 1.00 0.00 C ATOM 1522 CG LEU A 106 9.771 9.819 5.280 1.00 0.00 C ATOM 1523 CD1 LEU A 106 10.373 8.739 4.367 1.00 0.00 C ATOM 1524 CD2 LEU A 106 10.222 9.513 6.713 1.00 0.00 C ATOM 0 H LEU A 106 11.019 10.830 2.585 1.00 0.00 H new ATOM 0 HA LEU A 106 8.428 11.661 3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 106 11.245 11.324 4.800 1.00 0.00 H new ATOM 0 HB3 LEU A 106 9.892 11.927 5.737 1.00 0.00 H new ATOM 0 HG LEU A 106 8.688 9.778 5.162 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.044 7.755 4.702 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.041 8.903 3.342 1.00 0.00 H new ATOM 0 HD13 LEU A 106 11.461 8.792 4.409 1.00 0.00 H new ATOM 0 HD21 LEU A 106 9.945 8.491 6.971 1.00 0.00 H new ATOM 0 HD22 LEU A 106 11.304 9.626 6.786 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.738 10.205 7.402 1.00 0.00 H new ATOM 1536 N SER A 107 9.714 13.696 2.083 1.00 0.00 N ATOM 1537 CA SER A 107 10.185 15.000 1.621 1.00 0.00 C ATOM 1538 C SER A 107 9.176 16.143 1.805 1.00 0.00 C ATOM 1539 O SER A 107 9.018 16.639 2.916 1.00 0.00 O ATOM 1540 CB SER A 107 10.752 14.864 0.201 1.00 0.00 C ATOM 1541 OG SER A 107 11.630 13.754 0.175 1.00 0.00 O ATOM 0 H SER A 107 9.342 13.114 1.333 1.00 0.00 H new ATOM 0 HA SER A 107 10.999 15.316 2.274 1.00 0.00 H new ATOM 0 HB2 SER A 107 9.945 14.726 -0.518 1.00 0.00 H new ATOM 0 HB3 SER A 107 11.281 15.773 -0.085 1.00 0.00 H new ATOM 0 HG SER A 107 12.001 13.651 -0.726 1.00 0.00 H new ATOM 1547 N GLY A 108 8.505 16.586 0.735 1.00 0.00 N ATOM 1548 CA GLY A 108 7.515 17.658 0.783 1.00 0.00 C ATOM 1549 C GLY A 108 6.317 17.208 -0.037 1.00 0.00 C ATOM 1550 O GLY A 108 5.426 16.560 0.500 1.00 0.00 O ATOM 0 H GLY A 108 8.640 16.201 -0.200 1.00 0.00 H new ATOM 0 HA2 GLY A 108 7.220 17.863 1.812 1.00 0.00 H new ATOM 0 HA3 GLY A 108 7.930 18.582 0.381 1.00 0.00 H new ATOM 1554 N ASP A 109 6.340 17.446 -1.350 1.00 0.00 N ATOM 1555 CA ASP A 109 5.358 16.901 -2.277 1.00 0.00 C ATOM 1556 C ASP A 109 5.188 15.400 -2.063 1.00 0.00 C ATOM 1557 O ASP A 109 4.080 14.895 -1.897 1.00 0.00 O ATOM 1558 CB ASP A 109 5.815 17.195 -3.712 1.00 0.00 C ATOM 1559 CG ASP A 109 5.875 18.690 -3.974 1.00 0.00 C ATOM 1560 OD1 ASP A 109 6.730 19.319 -3.311 1.00 0.00 O ATOM 1561 OD2 ASP A 109 5.069 19.162 -4.802 1.00 0.00 O ATOM 0 H ASP A 109 7.048 18.027 -1.799 1.00 0.00 H new ATOM 0 HA ASP A 109 4.391 17.371 -2.099 1.00 0.00 H new ATOM 0 HB2 ASP A 109 6.797 16.754 -3.881 1.00 0.00 H new ATOM 0 HB3 ASP A 109 5.129 16.727 -4.418 1.00 0.00 H new ATOM 1566 N HIS A 110 6.318 14.694 -2.060 1.00 0.00 N ATOM 1567 CA HIS A 110 6.339 13.252 -1.905 1.00 0.00 C ATOM 1568 C HIS A 110 6.202 12.794 -0.452 1.00 0.00 C ATOM 1569 O HIS A 110 5.880 11.623 -0.273 1.00 0.00 O ATOM 1570 CB HIS A 110 7.579 12.665 -2.582 1.00 0.00 C ATOM 1571 CG HIS A 110 7.482 12.747 -4.084 1.00 0.00 C ATOM 1572 ND1 HIS A 110 6.851 11.832 -4.896 1.00 0.00 N ATOM 1573 CD2 HIS A 110 7.919 13.772 -4.880 1.00 0.00 C ATOM 1574 CE1 HIS A 110 6.928 12.288 -6.157 1.00 0.00 C ATOM 1575 NE2 HIS A 110 7.565 13.469 -6.198 1.00 0.00 N ATOM 0 H HIS A 110 7.242 15.112 -2.166 1.00 0.00 H new ATOM 0 HA HIS A 110 5.454 12.862 -2.407 1.00 0.00 H new ATOM 0 HB2 HIS A 110 8.466 13.200 -2.244 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.701 11.624 -2.281 1.00 0.00 H new ATOM 0 HD2 HIS A 110 8.443 14.656 -4.549 1.00 0.00 H new ATOM 0 HE1 HIS A 110 6.531 11.774 -7.020 1.00 0.00 H new ATOM 0 HE2 HIS A 110 7.753 14.033 -7.027 1.00 0.00 H new ATOM 1583 N SER A 111 6.445 13.664 0.551 1.00 0.00 N ATOM 1584 CA SER A 111 6.286 13.343 1.976 1.00 0.00 C ATOM 1585 C SER A 111 5.134 12.373 2.235 1.00 0.00 C ATOM 1586 O SER A 111 3.968 12.769 2.313 1.00 0.00 O ATOM 1587 CB SER A 111 6.096 14.585 2.862 1.00 0.00 C ATOM 1588 OG SER A 111 5.715 14.206 4.175 1.00 0.00 O ATOM 0 H SER A 111 6.761 14.620 0.387 1.00 0.00 H new ATOM 0 HA SER A 111 7.226 12.864 2.250 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.022 15.159 2.897 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.335 15.234 2.429 1.00 0.00 H new ATOM 0 HG SER A 111 5.599 15.008 4.726 1.00 0.00 H new ATOM 1594 N ILE A 112 5.491 11.111 2.453 1.00 0.00 N ATOM 1595 CA ILE A 112 4.543 10.096 2.863 1.00 0.00 C ATOM 1596 C ILE A 112 4.064 10.316 4.297 1.00 0.00 C ATOM 1597 O ILE A 112 3.019 9.803 4.683 1.00 0.00 O ATOM 1598 CB ILE A 112 5.134 8.699 2.666 1.00 0.00 C ATOM 1599 CG1 ILE A 112 6.363 8.475 3.562 1.00 0.00 C ATOM 1600 CG2 ILE A 112 5.467 8.493 1.186 1.00 0.00 C ATOM 1601 CD1 ILE A 112 6.728 6.998 3.609 1.00 0.00 C ATOM 0 H ILE A 112 6.446 10.769 2.349 1.00 0.00 H new ATOM 0 HA ILE A 112 3.663 10.179 2.226 1.00 0.00 H new ATOM 0 HB ILE A 112 4.394 7.956 2.965 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.206 9.052 3.183 1.00 0.00 H new ATOM 0 HG13 ILE A 112 6.156 8.837 4.569 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.888 7.498 1.043 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.559 8.591 0.592 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.191 9.243 0.868 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.600 6.859 4.248 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.890 6.429 4.010 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.956 6.647 2.602 1.00 0.00 H new ATOM 1613 N ILE A 113 4.829 11.066 5.094 1.00 0.00 N ATOM 1614 CA ILE A 113 4.445 11.436 6.439 1.00 0.00 C ATOM 1615 C ILE A 113 3.165 12.243 6.309 1.00 0.00 C ATOM 1616 O ILE A 113 3.118 13.230 5.573 1.00 0.00 O ATOM 1617 CB ILE A 113 5.568 12.233 7.127 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.871 11.424 7.227 1.00 0.00 C ATOM 1619 CG2 ILE A 113 5.133 12.728 8.512 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.733 10.109 8.000 1.00 0.00 C ATOM 0 H ILE A 113 5.738 11.432 4.812 1.00 0.00 H new ATOM 0 HA ILE A 113 4.277 10.560 7.066 1.00 0.00 H new ATOM 0 HB ILE A 113 5.767 13.102 6.499 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.229 11.206 6.221 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.631 12.038 7.709 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.948 13.287 8.971 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.262 13.375 8.410 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.879 11.874 9.140 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.696 9.599 8.025 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.407 10.318 9.019 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.998 9.473 7.507 1.00 0.00 H new ATOM 1632 N GLY A 114 2.122 11.775 6.986 1.00 0.00 N ATOM 1633 CA GLY A 114 0.801 12.340 6.892 1.00 0.00 C ATOM 1634 C GLY A 114 0.108 11.980 5.578 1.00 0.00 C ATOM 1635 O GLY A 114 -0.541 12.825 4.968 1.00 0.00 O ATOM 0 H GLY A 114 2.182 10.980 7.622 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.197 11.986 7.728 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.865 13.424 6.981 1.00 0.00 H new ATOM 1639 N ARG A 115 0.235 10.718 5.153 1.00 0.00 N ATOM 1640 CA ARG A 115 -0.646 10.102 4.166 1.00 0.00 C ATOM 1641 C ARG A 115 -1.507 9.043 4.841 1.00 0.00 C ATOM 1642 O ARG A 115 -1.190 8.602 5.947 1.00 0.00 O ATOM 1643 CB ARG A 115 0.168 9.383 3.093 1.00 0.00 C ATOM 1644 CG ARG A 115 1.023 10.299 2.226 1.00 0.00 C ATOM 1645 CD ARG A 115 0.179 11.130 1.259 1.00 0.00 C ATOM 1646 NE ARG A 115 0.533 12.550 1.370 1.00 0.00 N ATOM 1647 CZ ARG A 115 -0.259 13.556 0.973 1.00 0.00 C ATOM 1648 NH1 ARG A 115 -1.358 13.295 0.258 1.00 0.00 N ATOM 1649 NH2 ARG A 115 0.060 14.812 1.296 1.00 0.00 N ATOM 0 H ARG A 115 0.964 10.091 5.492 1.00 0.00 H new ATOM 0 HA ARG A 115 -1.253 10.892 3.724 1.00 0.00 H new ATOM 0 HB2 ARG A 115 0.817 8.652 3.576 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -0.514 8.828 2.449 1.00 0.00 H new ATOM 0 HG2 ARG A 115 1.602 10.965 2.865 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.737 9.700 1.660 1.00 0.00 H new ATOM 0 HD2 ARG A 115 0.339 10.786 0.237 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -0.880 10.993 1.479 1.00 0.00 H new ATOM 0 HE ARG A 115 1.439 12.786 1.775 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -1.592 12.332 0.016 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -1.962 14.059 -0.045 1.00 0.00 H new ATOM 0 HH21 ARG A 115 0.901 15.000 1.841 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -0.538 15.583 0.998 1.00 0.00 H new ATOM 1663 N THR A 116 -2.531 8.571 4.121 1.00 0.00 N ATOM 1664 CA THR A 116 -3.432 7.527 4.552 1.00 0.00 C ATOM 1665 C THR A 116 -3.100 6.234 3.796 1.00 0.00 C ATOM 1666 O THR A 116 -3.473 6.096 2.636 1.00 0.00 O ATOM 1667 CB THR A 116 -4.870 7.992 4.295 1.00 0.00 C ATOM 1668 OG1 THR A 116 -5.033 9.332 4.697 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.874 7.157 5.079 1.00 0.00 C ATOM 0 H THR A 116 -2.752 8.926 3.191 1.00 0.00 H new ATOM 0 HA THR A 116 -3.323 7.324 5.617 1.00 0.00 H new ATOM 0 HB THR A 116 -5.050 7.882 3.226 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.395 9.855 3.952 1.00 0.00 H new ATOM 0 HG21 THR A 116 -6.883 7.514 4.873 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.791 6.112 4.780 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.668 7.247 6.146 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.397 5.278 4.405 1.00 0.00 N ATOM 1678 CA LEU A 117 -2.038 4.025 3.744 1.00 0.00 C ATOM 1679 C LEU A 117 -3.163 3.015 3.977 1.00 0.00 C ATOM 1680 O LEU A 117 -3.577 2.823 5.120 1.00 0.00 O ATOM 1681 CB LEU A 117 -0.681 3.533 4.265 1.00 0.00 C ATOM 1682 CG LEU A 117 0.224 2.989 3.149 1.00 0.00 C ATOM 1683 CD1 LEU A 117 1.614 2.704 3.717 1.00 0.00 C ATOM 1684 CD2 LEU A 117 -0.294 1.693 2.526 1.00 0.00 C ATOM 0 H LEU A 117 -2.062 5.351 5.366 1.00 0.00 H new ATOM 0 HA LEU A 117 -1.928 4.166 2.669 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.172 4.353 4.771 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.844 2.752 5.008 1.00 0.00 H new ATOM 0 HG LEU A 117 0.245 3.754 2.373 1.00 0.00 H new ATOM 0 HD11 LEU A 117 2.258 2.318 2.927 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.040 3.625 4.115 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.537 1.966 4.515 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.392 1.365 1.746 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.365 0.923 3.294 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.279 1.866 2.093 1.00 0.00 H new ATOM 1696 N VAL A 118 -3.705 2.410 2.914 1.00 0.00 N ATOM 1697 CA VAL A 118 -4.911 1.592 2.997 1.00 0.00 C ATOM 1698 C VAL A 118 -4.731 0.309 2.170 1.00 0.00 C ATOM 1699 O VAL A 118 -4.122 0.349 1.097 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.118 2.435 2.539 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.448 1.752 2.839 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.166 3.823 3.195 1.00 0.00 C ATOM 0 H VAL A 118 -3.316 2.476 1.973 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.096 1.278 4.024 1.00 0.00 H new ATOM 0 HB VAL A 118 -5.977 2.541 1.463 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.267 2.385 2.498 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.490 0.794 2.321 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.539 1.588 3.913 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.038 4.367 2.832 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.232 3.712 4.277 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.262 4.376 2.942 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.253 -0.816 2.683 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.242 -2.124 2.027 1.00 0.00 C ATOM 1714 C VAL A 119 -6.640 -2.429 1.480 1.00 0.00 C ATOM 1715 O VAL A 119 -7.620 -1.878 1.982 1.00 0.00 O ATOM 1716 CB VAL A 119 -4.762 -3.209 3.014 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -5.698 -3.388 4.212 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.640 -4.580 2.345 1.00 0.00 C ATOM 0 H VAL A 119 -5.708 -0.836 3.596 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.544 -2.115 1.190 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.790 -2.852 3.353 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.305 -4.165 4.868 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -5.768 -2.450 4.762 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.688 -3.677 3.860 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.299 -5.313 3.077 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.612 -4.882 1.954 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.922 -4.523 1.527 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.748 -3.313 0.480 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.005 -3.689 -0.164 1.00 0.00 C ATOM 1730 C HIS A 120 -8.353 -5.154 0.038 1.00 0.00 C ATOM 1731 O HIS A 120 -7.494 -5.996 0.302 1.00 0.00 O ATOM 1732 CB HIS A 120 -7.999 -3.341 -1.656 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.010 -1.859 -1.836 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.104 -1.037 -1.888 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -6.876 -1.125 -1.745 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.654 0.222 -1.905 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.306 0.192 -1.828 1.00 0.00 N ATOM 0 H HIS A 120 -5.940 -3.797 0.089 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.782 -3.102 0.326 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.116 -3.767 -2.133 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.869 -3.781 -2.144 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.081 -1.331 -1.910 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -5.864 -1.484 -1.633 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.264 1.111 -1.969 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.647 -5.446 -0.094 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.181 -6.779 0.068 1.00 0.00 C ATOM 1747 C GLU A 121 -9.578 -7.737 -0.945 1.00 0.00 C ATOM 1748 O GLU A 121 -9.109 -8.805 -0.568 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.707 -6.737 -0.060 1.00 0.00 C ATOM 1750 CG GLU A 121 -12.327 -8.124 0.127 1.00 0.00 C ATOM 1751 CD GLU A 121 -13.837 -8.000 0.218 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.444 -7.844 -0.862 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -14.337 -8.010 1.361 1.00 0.00 O ATOM 0 H GLU A 121 -10.355 -4.747 -0.320 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.917 -7.146 1.060 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.116 -6.052 0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.980 -6.345 -1.040 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -12.055 -8.770 -0.708 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -11.935 -8.589 1.031 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.591 -7.365 -2.222 1.00 0.00 N ATOM 1761 CA LYS A 122 -9.024 -8.207 -3.268 1.00 0.00 C ATOM 1762 C LYS A 122 -7.731 -7.603 -3.816 1.00 0.00 C ATOM 1763 O LYS A 122 -7.230 -6.591 -3.312 1.00 0.00 O ATOM 1764 CB LYS A 122 -10.075 -8.462 -4.353 1.00 0.00 C ATOM 1765 CG LYS A 122 -11.417 -8.888 -3.729 1.00 0.00 C ATOM 1766 CD LYS A 122 -12.314 -9.589 -4.754 1.00 0.00 C ATOM 1767 CE LYS A 122 -11.913 -11.070 -4.874 1.00 0.00 C ATOM 1768 NZ LYS A 122 -12.589 -11.745 -5.999 1.00 0.00 N ATOM 0 H LYS A 122 -9.988 -6.487 -2.556 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.749 -9.175 -2.849 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.216 -7.559 -4.948 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.722 -9.239 -5.031 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.233 -9.556 -2.888 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -11.930 -8.012 -3.334 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -13.358 -9.509 -4.451 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -12.225 -9.099 -5.724 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -10.833 -11.142 -5.006 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.156 -11.586 -3.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.287 -12.739 -6.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.619 -11.701 -5.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -12.338 -11.271 -6.890 1.00 0.00 H new ATOM 1782 N ALA A 123 -7.194 -8.237 -4.858 1.00 0.00 N ATOM 1783 CA ALA A 123 -6.067 -7.726 -5.608 1.00 0.00 C ATOM 1784 C ALA A 123 -6.508 -6.498 -6.389 1.00 0.00 C ATOM 1785 O ALA A 123 -7.643 -6.442 -6.859 1.00 0.00 O ATOM 1786 CB ALA A 123 -5.601 -8.784 -6.610 1.00 0.00 C ATOM 0 H ALA A 123 -7.541 -9.132 -5.203 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.259 -7.475 -4.921 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.752 -8.400 -7.176 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -5.303 -9.686 -6.075 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.416 -9.021 -7.294 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.600 -5.548 -6.575 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.762 -4.509 -7.570 1.00 0.00 C ATOM 1794 C ASP A 124 -5.521 -5.059 -8.981 1.00 0.00 C ATOM 1795 O ASP A 124 -4.513 -5.706 -9.247 1.00 0.00 O ATOM 1796 CB ASP A 124 -4.850 -3.306 -7.310 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.551 -3.539 -6.583 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -3.108 -4.704 -6.474 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.031 -2.489 -6.160 1.00 0.00 O ATOM 0 H ASP A 124 -4.735 -5.481 -6.039 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.793 -4.162 -7.495 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.615 -2.852 -8.273 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.422 -2.572 -6.742 1.00 0.00 H new ATOM 1804 N ASP A 125 -6.406 -4.693 -9.913 1.00 0.00 N ATOM 1805 CA ASP A 125 -6.349 -4.992 -11.345 1.00 0.00 C ATOM 1806 C ASP A 125 -5.333 -4.126 -12.109 1.00 0.00 C ATOM 1807 O ASP A 125 -5.313 -4.090 -13.337 1.00 0.00 O ATOM 1808 CB ASP A 125 -7.783 -4.792 -11.861 1.00 0.00 C ATOM 1809 CG ASP A 125 -7.946 -4.820 -13.369 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -7.804 -5.914 -13.952 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -8.238 -3.725 -13.904 1.00 0.00 O ATOM 0 H ASP A 125 -7.232 -4.146 -9.671 1.00 0.00 H new ATOM 0 HA ASP A 125 -5.996 -6.010 -11.510 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -8.417 -5.567 -11.430 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -8.153 -3.836 -11.491 1.00 0.00 H new ATOM 1816 N LEU A 126 -4.470 -3.405 -11.392 1.00 0.00 N ATOM 1817 CA LEU A 126 -3.490 -2.484 -11.950 1.00 0.00 C ATOM 1818 C LEU A 126 -4.061 -1.655 -13.114 1.00 0.00 C ATOM 1819 O LEU A 126 -3.405 -1.429 -14.129 1.00 0.00 O ATOM 1820 CB LEU A 126 -2.225 -3.256 -12.329 1.00 0.00 C ATOM 1821 CG LEU A 126 -1.735 -4.195 -11.211 1.00 0.00 C ATOM 1822 CD1 LEU A 126 -0.367 -4.736 -11.597 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -1.686 -3.573 -9.811 1.00 0.00 C ATOM 0 H LEU A 126 -4.436 -3.451 -10.374 1.00 0.00 H new ATOM 0 HA LEU A 126 -3.224 -1.750 -11.189 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.419 -3.841 -13.228 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.433 -2.548 -12.574 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.475 -4.991 -11.131 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -0.006 -5.403 -10.815 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.444 -5.285 -12.535 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.331 -3.908 -11.718 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.329 -4.314 -9.096 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.010 -2.718 -9.816 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -2.685 -3.244 -9.524 1.00 0.00 H new ATOM 1835 N GLY A 127 -5.296 -1.194 -12.928 1.00 0.00 N ATOM 1836 CA GLY A 127 -6.027 -0.338 -13.847 1.00 0.00 C ATOM 1837 C GLY A 127 -6.147 -0.916 -15.257 1.00 0.00 C ATOM 1838 O GLY A 127 -6.241 -0.159 -16.221 1.00 0.00 O ATOM 0 H GLY A 127 -5.835 -1.420 -12.092 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -7.026 -0.162 -13.449 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -5.530 0.631 -13.901 1.00 0.00 H new ATOM 1842 N LYS A 128 -6.170 -2.245 -15.398 1.00 0.00 N ATOM 1843 CA LYS A 128 -6.243 -2.886 -16.704 1.00 0.00 C ATOM 1844 C LYS A 128 -7.693 -2.983 -17.199 1.00 0.00 C ATOM 1845 O LYS A 128 -7.914 -3.159 -18.395 1.00 0.00 O ATOM 1846 CB LYS A 128 -5.523 -4.240 -16.657 1.00 0.00 C ATOM 1847 CG LYS A 128 -4.015 -4.060 -16.403 1.00 0.00 C ATOM 1848 CD LYS A 128 -3.231 -3.607 -17.651 1.00 0.00 C ATOM 1849 CE LYS A 128 -2.306 -2.420 -17.322 1.00 0.00 C ATOM 1850 NZ LYS A 128 -1.302 -2.175 -18.379 1.00 0.00 N ATOM 0 H LYS A 128 -6.139 -2.897 -14.614 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.726 -2.271 -17.440 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -5.956 -4.858 -15.870 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -5.675 -4.769 -17.598 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -3.873 -3.327 -15.609 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -3.600 -5.002 -16.045 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -2.639 -4.438 -18.034 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -3.928 -3.322 -18.439 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -2.908 -1.522 -17.182 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -1.796 -2.612 -16.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -0.705 -1.367 -18.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -0.708 -3.021 -18.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -1.786 -1.965 -19.275 1.00 0.00 H new ATOM 1864 N GLY A 129 -8.685 -2.810 -16.319 1.00 0.00 N ATOM 1865 CA GLY A 129 -10.097 -2.917 -16.646 1.00 0.00 C ATOM 1866 C GLY A 129 -10.600 -1.830 -17.600 1.00 0.00 C ATOM 1867 O GLY A 129 -11.742 -1.905 -18.047 1.00 0.00 O ATOM 0 H GLY A 129 -8.516 -2.587 -15.338 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -10.283 -3.893 -17.094 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -10.677 -2.874 -15.724 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.790 -0.805 -17.894 1.00 0.00 N ATOM 1872 CA GLY A 130 -10.145 0.241 -18.848 1.00 0.00 C ATOM 1873 C GLY A 130 -11.427 0.970 -18.444 1.00 0.00 C ATOM 1874 O GLY A 130 -12.241 1.335 -19.288 1.00 0.00 O ATOM 0 H GLY A 130 -8.869 -0.682 -17.473 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -9.327 0.958 -18.921 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -10.274 -0.198 -19.837 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.605 1.174 -17.138 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.806 1.726 -16.537 1.00 0.00 C ATOM 1880 C ASN A 131 -12.366 2.575 -15.364 1.00 0.00 C ATOM 1881 O ASN A 131 -11.545 2.077 -14.599 1.00 0.00 O ATOM 1882 CB ASN A 131 -13.751 0.569 -16.159 1.00 0.00 C ATOM 1883 CG ASN A 131 -14.560 0.852 -14.902 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -13.858 0.894 -13.779 1.00 0.00 O flip ATOM 1885 ND2 ASN A 131 -15.765 1.061 -14.934 1.00 0.00 N flip ATOM 0 H ASN A 131 -10.886 0.949 -16.450 1.00 0.00 H new ATOM 0 HA ASN A 131 -13.371 2.364 -17.216 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.432 0.377 -16.988 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -13.165 -0.338 -16.011 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -16.267 1.018 -15.821 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -16.268 1.278 -14.074 1.00 0.00 H new ATOM 1892 N GLU A 132 -12.928 3.779 -15.197 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.571 4.725 -14.145 1.00 0.00 C ATOM 1894 C GLU A 132 -12.312 4.021 -12.813 1.00 0.00 C ATOM 1895 O GLU A 132 -11.191 4.047 -12.329 1.00 0.00 O ATOM 1896 CB GLU A 132 -13.638 5.829 -14.013 1.00 0.00 C ATOM 1897 CG GLU A 132 -12.986 7.218 -14.013 1.00 0.00 C ATOM 1898 CD GLU A 132 -12.025 7.391 -12.839 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -12.506 7.266 -11.688 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -10.828 7.609 -13.118 1.00 0.00 O ATOM 0 H GLU A 132 -13.665 4.127 -15.811 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.635 5.204 -14.433 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.348 5.755 -14.837 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -14.203 5.687 -13.092 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.448 7.367 -14.949 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.760 7.984 -13.965 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.322 3.336 -12.259 1.00 0.00 N ATOM 1908 CA GLN A 133 -13.206 2.629 -10.986 1.00 0.00 C ATOM 1909 C GLN A 133 -11.888 1.836 -10.887 1.00 0.00 C ATOM 1910 O GLN A 133 -11.035 2.215 -10.101 1.00 0.00 O ATOM 1911 CB GLN A 133 -14.470 1.801 -10.679 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.851 1.856 -9.192 1.00 0.00 C ATOM 1913 CD GLN A 133 -13.706 1.496 -8.271 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.380 2.237 -7.348 1.00 0.00 O ATOM 1915 NE2 GLN A 133 -13.058 0.382 -8.560 1.00 0.00 N ATOM 0 H GLN A 133 -14.245 3.259 -12.687 1.00 0.00 H new ATOM 0 HA GLN A 133 -13.148 3.372 -10.190 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -15.301 2.172 -11.279 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -14.304 0.764 -10.972 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -15.202 2.859 -8.950 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.683 1.175 -9.011 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -13.368 -0.201 -9.338 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -12.248 0.105 -8.006 1.00 0.00 H new ATOM 1924 N SER A 134 -11.668 0.776 -11.672 1.00 0.00 N ATOM 1925 CA SER A 134 -10.392 0.087 -11.752 1.00 0.00 C ATOM 1926 C SER A 134 -9.227 1.042 -11.977 1.00 0.00 C ATOM 1927 O SER A 134 -8.233 1.001 -11.261 1.00 0.00 O ATOM 1928 CB SER A 134 -10.378 -0.980 -12.854 1.00 0.00 C ATOM 1929 OG SER A 134 -9.340 -1.855 -12.478 1.00 0.00 O ATOM 0 H SER A 134 -12.386 0.373 -12.274 1.00 0.00 H new ATOM 0 HA SER A 134 -10.267 -0.398 -10.784 1.00 0.00 H new ATOM 0 HB2 SER A 134 -11.334 -1.500 -12.916 1.00 0.00 H new ATOM 0 HB3 SER A 134 -10.191 -0.538 -13.833 1.00 0.00 H new ATOM 0 HG SER A 134 -9.229 -2.545 -13.165 1.00 0.00 H new ATOM 1935 N THR A 135 -9.351 1.920 -12.965 1.00 0.00 N ATOM 1936 CA THR A 135 -8.283 2.820 -13.370 1.00 0.00 C ATOM 1937 C THR A 135 -7.973 3.854 -12.269 1.00 0.00 C ATOM 1938 O THR A 135 -6.965 4.558 -12.342 1.00 0.00 O ATOM 1939 CB THR A 135 -8.648 3.400 -14.745 1.00 0.00 C ATOM 1940 OG1 THR A 135 -9.051 2.345 -15.596 1.00 0.00 O ATOM 1941 CG2 THR A 135 -7.477 4.083 -15.434 1.00 0.00 C ATOM 0 H THR A 135 -10.205 2.027 -13.512 1.00 0.00 H new ATOM 0 HA THR A 135 -7.336 2.293 -13.490 1.00 0.00 H new ATOM 0 HB THR A 135 -9.435 4.134 -14.571 1.00 0.00 H new ATOM 0 HG1 THR A 135 -9.913 1.991 -15.293 1.00 0.00 H new ATOM 0 HG21 THR A 135 -7.799 4.471 -16.400 1.00 0.00 H new ATOM 0 HG22 THR A 135 -7.119 4.905 -14.814 1.00 0.00 H new ATOM 0 HG23 THR A 135 -6.672 3.363 -15.583 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.793 3.881 -11.212 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.644 4.642 -9.991 1.00 0.00 C ATOM 1951 C LYS A 136 -8.268 3.739 -8.807 1.00 0.00 C ATOM 1952 O LYS A 136 -7.536 4.212 -7.938 1.00 0.00 O ATOM 1953 CB LYS A 136 -9.974 5.359 -9.742 1.00 0.00 C ATOM 1954 CG LYS A 136 -9.967 6.260 -8.505 1.00 0.00 C ATOM 1955 CD LYS A 136 -11.327 6.951 -8.346 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.471 5.953 -8.085 1.00 0.00 C ATOM 1957 NZ LYS A 136 -13.726 6.656 -7.762 1.00 0.00 N ATOM 0 H LYS A 136 -9.645 3.320 -11.200 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.833 5.363 -10.091 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.221 5.960 -10.617 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.763 4.615 -9.634 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -9.745 5.669 -7.617 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -9.179 7.008 -8.595 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.275 7.662 -7.522 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.547 7.523 -9.247 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.618 5.326 -8.964 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.200 5.291 -7.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.480 5.960 -7.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.590 7.236 -6.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -13.995 7.269 -8.558 1.00 0.00 H new ATOM 1971 N THR A 137 -8.771 2.494 -8.714 1.00 0.00 N ATOM 1972 CA THR A 137 -8.541 1.680 -7.503 1.00 0.00 C ATOM 1973 C THR A 137 -7.920 0.312 -7.758 1.00 0.00 C ATOM 1974 O THR A 137 -7.224 -0.227 -6.896 1.00 0.00 O ATOM 1975 CB THR A 137 -9.799 1.520 -6.638 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.683 0.535 -7.138 1.00 0.00 O ATOM 1977 CG2 THR A 137 -10.528 2.850 -6.443 1.00 0.00 C ATOM 0 H THR A 137 -9.324 2.038 -9.440 1.00 0.00 H new ATOM 0 HA THR A 137 -7.804 2.265 -6.953 1.00 0.00 H new ATOM 0 HB THR A 137 -9.451 1.177 -5.664 1.00 0.00 H new ATOM 0 HG1 THR A 137 -11.230 0.184 -6.405 1.00 0.00 H new ATOM 0 HG21 THR A 137 -11.412 2.693 -5.825 1.00 0.00 H new ATOM 0 HG22 THR A 137 -9.863 3.560 -5.951 1.00 0.00 H new ATOM 0 HG23 THR A 137 -10.829 3.246 -7.413 1.00 0.00 H new ATOM 1985 N GLY A 138 -8.226 -0.273 -8.908 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.921 -1.644 -9.248 1.00 0.00 C ATOM 1987 C GLY A 138 -9.152 -2.520 -9.091 1.00 0.00 C ATOM 1988 O GLY A 138 -9.024 -3.734 -9.215 1.00 0.00 O ATOM 0 H GLY A 138 -8.713 0.220 -9.656 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.558 -1.698 -10.274 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -7.121 -2.014 -8.607 1.00 0.00 H new ATOM 1992 N ASN A 139 -10.331 -1.943 -8.798 1.00 0.00 N ATOM 1993 CA ASN A 139 -11.586 -2.679 -8.830 1.00 0.00 C ATOM 1994 C ASN A 139 -11.598 -3.848 -7.855 1.00 0.00 C ATOM 1995 O ASN A 139 -12.393 -4.773 -7.994 1.00 0.00 O ATOM 1996 CB ASN A 139 -11.909 -3.135 -10.258 1.00 0.00 C ATOM 1997 CG ASN A 139 -13.401 -3.068 -10.546 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -14.021 -2.031 -10.311 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -13.975 -4.138 -11.090 1.00 0.00 N ATOM 0 H ASN A 139 -10.430 -0.962 -8.536 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.371 -1.997 -8.502 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -11.372 -2.508 -10.970 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -11.556 -4.156 -10.403 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -14.966 -4.119 -11.329 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -13.424 -4.977 -11.268 1.00 0.00 H new ATOM 2006 N ALA A 140 -10.705 -3.785 -6.867 1.00 0.00 N ATOM 2007 CA ALA A 140 -10.465 -4.860 -5.938 1.00 0.00 C ATOM 2008 C ALA A 140 -11.723 -5.071 -5.113 1.00 0.00 C ATOM 2009 O ALA A 140 -12.256 -6.173 -5.020 1.00 0.00 O ATOM 2010 CB ALA A 140 -9.281 -4.464 -5.052 1.00 0.00 C ATOM 0 H ALA A 140 -10.123 -2.964 -6.697 1.00 0.00 H new ATOM 0 HA ALA A 140 -10.227 -5.792 -6.451 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -9.078 -5.262 -4.338 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -8.401 -4.300 -5.673 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -9.520 -3.547 -4.513 1.00 0.00 H new ATOM 2016 N GLY A 141 -12.179 -3.983 -4.497 1.00 0.00 N ATOM 2017 CA GLY A 141 -13.267 -4.003 -3.548 1.00 0.00 C ATOM 2018 C GLY A 141 -12.966 -3.012 -2.436 1.00 0.00 C ATOM 2019 O GLY A 141 -12.137 -2.104 -2.591 1.00 0.00 O ATOM 0 H GLY A 141 -11.791 -3.053 -4.652 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.203 -3.743 -4.042 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.391 -5.005 -3.137 1.00 0.00 H new ATOM 2023 N SER A 142 -13.654 -3.189 -1.311 1.00 0.00 N ATOM 2024 CA SER A 142 -13.536 -2.281 -0.189 1.00 0.00 C ATOM 2025 C SER A 142 -12.185 -2.427 0.506 1.00 0.00 C ATOM 2026 O SER A 142 -11.324 -3.204 0.090 1.00 0.00 O ATOM 2027 CB SER A 142 -14.698 -2.482 0.784 1.00 0.00 C ATOM 2028 OG SER A 142 -14.849 -1.291 1.537 1.00 0.00 O ATOM 0 H SER A 142 -14.302 -3.962 -1.158 1.00 0.00 H new ATOM 0 HA SER A 142 -13.588 -1.260 -0.568 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.615 -2.708 0.241 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.501 -3.327 1.443 1.00 0.00 H new ATOM 0 HG SER A 142 -15.591 -1.395 2.168 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.004 -1.620 1.547 1.00 0.00 N ATOM 2035 CA ARG A 143 -10.760 -1.491 2.282 1.00 0.00 C ATOM 2036 C ARG A 143 -10.808 -2.271 3.595 1.00 0.00 C ATOM 2037 O ARG A 143 -11.477 -1.847 4.532 1.00 0.00 O ATOM 2038 CB ARG A 143 -10.440 -0.011 2.507 1.00 0.00 C ATOM 2039 CG ARG A 143 -10.406 0.747 1.164 1.00 0.00 C ATOM 2040 CD ARG A 143 -11.558 1.757 1.015 1.00 0.00 C ATOM 2041 NE ARG A 143 -12.328 1.535 -0.219 1.00 0.00 N ATOM 2042 CZ ARG A 143 -13.460 2.187 -0.535 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -13.949 3.121 0.291 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -14.083 1.897 -1.684 1.00 0.00 N ATOM 0 H ARG A 143 -12.745 -1.021 1.910 1.00 0.00 H new ATOM 0 HA ARG A 143 -9.955 -1.926 1.690 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.189 0.433 3.163 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -9.478 0.086 3.010 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -9.455 1.272 1.073 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -10.452 0.028 0.346 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -12.222 1.679 1.876 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -11.155 2.770 1.014 1.00 0.00 H new ATOM 0 HE ARG A 143 -11.979 0.840 -0.879 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -13.462 3.338 1.161 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -14.808 3.615 0.050 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -13.698 1.188 -2.308 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -14.943 2.385 -1.935 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.087 -3.397 3.667 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.002 -4.223 4.875 1.00 0.00 C ATOM 2060 C LEU A 144 -9.435 -3.425 6.060 1.00 0.00 C ATOM 2061 O LEU A 144 -9.827 -3.668 7.198 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.154 -5.490 4.620 1.00 0.00 C ATOM 2063 CG LEU A 144 -9.865 -6.756 4.090 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -10.232 -7.694 5.244 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.148 -6.433 3.319 1.00 0.00 C ATOM 0 H LEU A 144 -9.544 -3.761 2.884 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.015 -4.533 5.132 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.370 -5.227 3.910 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.661 -5.753 5.556 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.158 -7.234 3.412 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -10.731 -8.579 4.849 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.326 -7.994 5.771 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -10.900 -7.178 5.934 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -11.606 -7.359 2.970 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -11.844 -5.909 3.974 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.909 -5.801 2.463 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.502 -2.497 5.817 1.00 0.00 N ATOM 2078 CA ALA A 145 -7.979 -1.617 6.852 1.00 0.00 C ATOM 2079 C ALA A 145 -7.356 -0.376 6.228 1.00 0.00 C ATOM 2080 O ALA A 145 -6.911 -0.401 5.079 1.00 0.00 O ATOM 2081 CB ALA A 145 -6.964 -2.343 7.738 1.00 0.00 C ATOM 0 H ALA A 145 -8.093 -2.340 4.896 1.00 0.00 H new ATOM 0 HA ALA A 145 -8.812 -1.309 7.485 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.592 -1.659 8.501 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.444 -3.196 8.218 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.132 -2.692 7.127 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.343 0.697 7.017 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.866 2.030 6.716 1.00 0.00 C ATOM 2089 C CYS A 146 -5.956 2.446 7.866 1.00 0.00 C ATOM 2090 O CYS A 146 -6.229 2.138 9.023 1.00 0.00 O ATOM 2091 CB CYS A 146 -8.046 3.012 6.602 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.407 2.753 7.775 1.00 0.00 S ATOM 0 H CYS A 146 -7.701 0.641 7.970 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.332 2.041 5.766 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.665 4.025 6.735 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.447 2.952 5.590 1.00 0.00 H new ATOM 2097 N GLY A 147 -4.846 3.113 7.564 1.00 0.00 N ATOM 2098 CA GLY A 147 -3.922 3.615 8.564 1.00 0.00 C ATOM 2099 C GLY A 147 -3.314 4.916 8.086 1.00 0.00 C ATOM 2100 O GLY A 147 -3.451 5.274 6.917 1.00 0.00 O ATOM 0 H GLY A 147 -4.564 3.320 6.606 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.442 3.771 9.509 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.137 2.882 8.749 1.00 0.00 H new ATOM 2104 N VAL A 148 -2.637 5.618 8.993 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.014 6.901 8.724 1.00 0.00 C ATOM 2106 C VAL A 148 -0.507 6.744 8.915 1.00 0.00 C ATOM 2107 O VAL A 148 -0.082 6.090 9.865 1.00 0.00 O ATOM 2108 CB VAL A 148 -2.655 7.969 9.623 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -2.224 7.862 11.093 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -2.361 9.370 9.084 1.00 0.00 C ATOM 0 H VAL A 148 -2.507 5.299 9.953 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.175 7.235 7.699 1.00 0.00 H new ATOM 0 HB VAL A 148 -3.729 7.787 9.599 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -2.712 8.645 11.673 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -2.511 6.887 11.486 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -1.143 7.978 11.164 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -2.823 10.114 9.733 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -1.283 9.531 9.057 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -2.767 9.465 8.077 1.00 0.00 H new ATOM 2120 N ILE A 149 0.294 7.282 7.995 1.00 0.00 N ATOM 2121 CA ILE A 149 1.747 7.164 8.032 1.00 0.00 C ATOM 2122 C ILE A 149 2.307 8.298 8.898 1.00 0.00 C ATOM 2123 O ILE A 149 2.023 9.465 8.629 1.00 0.00 O ATOM 2124 CB ILE A 149 2.324 7.224 6.606 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.571 6.299 5.631 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.825 6.896 6.616 1.00 0.00 C ATOM 2127 CD1 ILE A 149 2.205 6.254 4.240 1.00 0.00 C ATOM 0 H ILE A 149 -0.053 7.816 7.198 1.00 0.00 H new ATOM 0 HA ILE A 149 2.033 6.205 8.463 1.00 0.00 H new ATOM 0 HB ILE A 149 2.188 8.244 6.247 1.00 0.00 H new ATOM 0 HG12 ILE A 149 1.543 5.291 6.044 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.538 6.637 5.543 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.215 6.944 5.599 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.351 7.618 7.240 1.00 0.00 H new ATOM 0 HG23 ILE A 149 3.976 5.893 7.016 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.629 5.586 3.599 1.00 0.00 H new ATOM 0 HD12 ILE A 149 2.209 7.255 3.809 1.00 0.00 H new ATOM 0 HD13 ILE A 149 3.229 5.889 4.318 1.00 0.00 H new ATOM 2139 N GLY A 150 3.114 7.969 9.911 1.00 0.00 N ATOM 2140 CA GLY A 150 3.708 8.929 10.825 1.00 0.00 C ATOM 2141 C GLY A 150 5.112 8.471 11.210 1.00 0.00 C ATOM 2142 O GLY A 150 5.607 7.473 10.692 1.00 0.00 O ATOM 0 H GLY A 150 3.374 7.004 10.117 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.751 9.913 10.357 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.090 9.027 11.717 1.00 0.00 H new ATOM 2146 N ILE A 151 5.766 9.202 12.112 1.00 0.00 N ATOM 2147 CA ILE A 151 7.091 8.879 12.609 1.00 0.00 C ATOM 2148 C ILE A 151 6.963 7.721 13.595 1.00 0.00 C ATOM 2149 O ILE A 151 5.954 7.594 14.283 1.00 0.00 O ATOM 2150 CB ILE A 151 7.718 10.123 13.262 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.758 11.325 12.296 1.00 0.00 C ATOM 2152 CG2 ILE A 151 9.123 9.826 13.804 1.00 0.00 C ATOM 2153 CD1 ILE A 151 8.680 11.135 11.085 1.00 0.00 C ATOM 0 H ILE A 151 5.377 10.051 12.522 1.00 0.00 H new ATOM 0 HA ILE A 151 7.749 8.575 11.795 1.00 0.00 H new ATOM 0 HB ILE A 151 7.076 10.391 14.101 1.00 0.00 H new ATOM 0 HG12 ILE A 151 6.747 11.523 11.940 1.00 0.00 H new ATOM 0 HG13 ILE A 151 8.080 12.208 12.848 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.536 10.727 14.258 1.00 0.00 H new ATOM 0 HG22 ILE A 151 9.065 9.036 14.553 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.768 9.504 12.986 1.00 0.00 H new ATOM 0 HD11 ILE A 151 8.647 12.027 10.459 1.00 0.00 H new ATOM 0 HD12 ILE A 151 9.701 10.969 11.428 1.00 0.00 H new ATOM 0 HD13 ILE A 151 8.347 10.274 10.506 1.00 0.00 H new ATOM 2165 N ALA A 152 7.987 6.870 13.673 1.00 0.00 N ATOM 2166 CA ALA A 152 7.990 5.742 14.601 1.00 0.00 C ATOM 2167 C ALA A 152 8.387 6.199 16.017 1.00 0.00 C ATOM 2168 O ALA A 152 9.294 5.623 16.622 1.00 0.00 O ATOM 2169 CB ALA A 152 8.866 4.602 14.053 1.00 0.00 C ATOM 0 H ALA A 152 8.828 6.943 13.101 1.00 0.00 H new ATOM 0 HA ALA A 152 6.980 5.341 14.689 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.859 3.768 14.755 1.00 0.00 H new ATOM 0 HB2 ALA A 152 8.473 4.271 13.092 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.888 4.958 13.923 1.00 0.00 H new ATOM 2175 N GLN A 153 7.719 7.235 16.544 1.00 0.00 N ATOM 2176 CA GLN A 153 7.854 7.707 17.910 1.00 0.00 C ATOM 2177 C GLN A 153 6.716 8.682 18.158 1.00 0.00 C ATOM 2178 O GLN A 153 6.122 9.116 17.156 1.00 0.00 O ATOM 2179 CB GLN A 153 9.223 8.378 18.131 1.00 0.00 C ATOM 2180 CG GLN A 153 9.667 8.324 19.608 1.00 0.00 C ATOM 2181 CD GLN A 153 9.661 9.681 20.305 1.00 0.00 C ATOM 2182 OE1 GLN A 153 10.720 10.225 20.597 1.00 0.00 O ATOM 2183 NE2 GLN A 153 8.489 10.219 20.599 1.00 0.00 N ATOM 2184 OXT GLN A 153 6.473 8.984 19.350 1.00 0.00 O ATOM 0 H GLN A 153 7.048 7.780 16.003 1.00 0.00 H new ATOM 0 HA GLN A 153 7.803 6.875 18.612 1.00 0.00 H new ATOM 0 HB2 GLN A 153 9.971 7.886 17.510 1.00 0.00 H new ATOM 0 HB3 GLN A 153 9.173 9.417 17.806 1.00 0.00 H new ATOM 0 HG2 GLN A 153 9.009 7.645 20.150 1.00 0.00 H new ATOM 0 HG3 GLN A 153 10.672 7.904 19.660 1.00 0.00 H new ATOM 0 HE21 GLN A 153 7.628 9.738 20.340 1.00 0.00 H new ATOM 0 HE22 GLN A 153 8.447 11.115 21.084 1.00 0.00 H new TER 2193 GLN A 153 HETATM 2194 ZN ZN A 154 -3.197 3.132 -7.819 1.00 0.00 ZN HETATM 2195 CU CU1 A 155 -5.901 1.606 -1.678 1.00 0.00 CU