USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 928 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 3 CYS SG : rot -96:sc= -1.25 USER MOD Set 1.2: A 5 CYS SG : rot -94:sc= -7.39! USER MOD Set 1.3: A 7 SER OG : rot 180:sc= -0.0502 USER MOD Set 1.4: A 14 CYS SG : rot -76:sc= -0.0483 USER MOD Set 1.5: A 15 CYS SG : rot -90:sc= -3.05! USER MOD Set 1.6: A 34 SER OG : rot 98:sc= 0.926 USER MOD Single : A 9 LYS NZ :NH3+ 175:sc= 0.799 (180deg=0.782) USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.433 USER MOD Single : A 11 TYR OH : rot 180:sc= -0.334 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= -0.0845 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 32 MET CE :methyl -126:sc= -1.34 (180deg=-4.57!) USER MOD Single : A 36 TYR OH : rot 30:sc= -0.234 USER MOD Single : A 39 TYR OH : rot -84:sc= 1.14 USER MOD Single : A 42 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0488) USER MOD Single : A 46 TYR OH : rot 24:sc= -1.46! USER MOD Single : A 50 THR OG1 : rot -72:sc= 1.44 USER MOD Single : A 51 THR OG1 : rot -152:sc= 1.34 USER MOD Single : A 61 HIS : no HD1:sc= 0.897 K(o=0.9,f=-2.7!) USER MOD Single : A 64 ASN : amide:sc= 0.00492 K(o=0.0049,f=-0.61) USER MOD Single : A 68 MET CE :methyl -126:sc= -2.25 (180deg=-3.04!) USER MOD Single : A 71 SER OG : rot -179:sc= 0.184 USER MOD Single : A 81 SER OG : rot -152:sc= 0.905 USER MOD Single : A 82 SER OG : rot 180:sc= -0.104 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0199 USER MOD Single : A 104 GLN : amide:sc= -0.207 X(o=-0.21,f=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-3.4!) USER MOD Single : A 107 HIS : no HD1:sc= 0.466 K(o=0.47,f=-2.9!) USER MOD Single : A 110 SER OG : rot 119:sc= 0.865 USER MOD Single : A 111 GLN :FLIP amide:sc= -1.28 F(o=-1.9!,f=-1.3) USER MOD Single : A 114 LYS NZ :NH3+ 156:sc= 0.826 (180deg=0.193) USER MOD Single : A 120 TYR OH : rot 30:sc= 0.00363 USER MOD Single : A 122 SER OG : rot -65:sc= 0.615 USER MOD ----------------------------------------------------------------- ATOM 34 N CYS A 3 -1.480 -4.477 -1.589 1.00 0.00 N ATOM 35 CA CYS A 3 -2.666 -5.273 -1.280 1.00 0.00 C ATOM 36 C CYS A 3 -2.279 -6.728 -1.063 1.00 0.00 C ATOM 37 O CYS A 3 -1.543 -7.298 -1.872 1.00 0.00 O ATOM 38 CB CYS A 3 -3.674 -5.189 -2.431 1.00 0.00 C ATOM 39 SG CYS A 3 -5.412 -5.412 -1.940 1.00 0.00 S ATOM 0 HA CYS A 3 -3.119 -4.877 -0.371 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -3.570 -4.219 -2.917 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -3.421 -5.946 -3.173 1.00 0.00 H new ATOM 0 HG CYS A 3 -5.758 -6.652 -2.119 1.00 0.00 H new ATOM 44 N VAL A 4 -2.780 -7.329 0.012 1.00 0.00 N ATOM 45 CA VAL A 4 -2.562 -8.751 0.266 1.00 0.00 C ATOM 46 C VAL A 4 -3.269 -9.594 -0.799 1.00 0.00 C ATOM 47 O VAL A 4 -4.358 -10.128 -0.591 1.00 0.00 O ATOM 48 CB VAL A 4 -3.023 -9.165 1.687 1.00 0.00 C ATOM 49 CG1 VAL A 4 -2.084 -8.574 2.734 1.00 0.00 C ATOM 50 CG2 VAL A 4 -4.465 -8.726 1.944 1.00 0.00 C ATOM 0 H VAL A 4 -3.339 -6.855 0.721 1.00 0.00 H new ATOM 0 HA VAL A 4 -1.489 -8.935 0.210 1.00 0.00 H new ATOM 0 HB VAL A 4 -2.988 -10.252 1.759 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -2.416 -8.870 3.729 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -1.072 -8.942 2.564 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -2.092 -7.487 2.658 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -4.764 -9.028 2.948 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -4.537 -7.642 1.855 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -5.124 -9.194 1.213 1.00 0.00 H new ATOM 60 N CYS A 5 -2.643 -9.656 -1.962 1.00 0.00 N ATOM 61 CA CYS A 5 -3.179 -10.373 -3.114 1.00 0.00 C ATOM 62 C CYS A 5 -2.084 -10.587 -4.151 1.00 0.00 C ATOM 63 O CYS A 5 -1.295 -9.673 -4.408 1.00 0.00 O ATOM 64 CB CYS A 5 -4.316 -9.591 -3.785 1.00 0.00 C ATOM 65 SG CYS A 5 -5.700 -9.125 -2.706 1.00 0.00 S ATOM 0 H CYS A 5 -1.743 -9.209 -2.138 1.00 0.00 H new ATOM 0 HA CYS A 5 -3.562 -11.327 -2.750 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -3.899 -8.683 -4.221 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -4.707 -10.190 -4.608 1.00 0.00 H new ATOM 0 HG CYS A 5 -6.633 -10.027 -2.783 1.00 0.00 H new ATOM 70 N GLY A 6 -2.046 -11.774 -4.756 1.00 0.00 N ATOM 71 CA GLY A 6 -1.164 -12.005 -5.889 1.00 0.00 C ATOM 72 C GLY A 6 -1.441 -11.016 -7.011 1.00 0.00 C ATOM 73 O GLY A 6 -2.244 -11.288 -7.905 1.00 0.00 O ATOM 0 H GLY A 6 -2.610 -12.579 -4.482 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -0.126 -11.915 -5.569 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -1.298 -13.023 -6.256 1.00 0.00 H new ATOM 77 N SER A 7 -0.803 -9.849 -6.928 1.00 0.00 N ATOM 78 CA SER A 7 -1.035 -8.754 -7.867 1.00 0.00 C ATOM 79 C SER A 7 -0.078 -7.595 -7.573 1.00 0.00 C ATOM 80 O SER A 7 0.535 -7.035 -8.480 1.00 0.00 O ATOM 81 CB SER A 7 -2.494 -8.279 -7.769 1.00 0.00 C ATOM 82 OG SER A 7 -2.866 -8.074 -6.411 1.00 0.00 O ATOM 0 H SER A 7 -0.112 -9.637 -6.209 1.00 0.00 H new ATOM 0 HA SER A 7 -0.849 -9.111 -8.880 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.618 -7.352 -8.329 1.00 0.00 H new ATOM 0 HB3 SER A 7 -3.154 -9.018 -8.224 1.00 0.00 H new ATOM 0 HG SER A 7 -3.797 -7.771 -6.369 1.00 0.00 H new ATOM 88 N GLY A 8 0.030 -7.234 -6.293 1.00 0.00 N ATOM 89 CA GLY A 8 0.942 -6.178 -5.877 1.00 0.00 C ATOM 90 C GLY A 8 0.300 -4.803 -5.907 1.00 0.00 C ATOM 91 O GLY A 8 0.865 -3.837 -5.394 1.00 0.00 O ATOM 0 H GLY A 8 -0.502 -7.658 -5.533 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.297 -6.387 -4.868 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.816 -6.181 -6.529 1.00 0.00 H new ATOM 95 N LYS A 9 -0.891 -4.719 -6.498 1.00 0.00 N ATOM 96 CA LYS A 9 -1.599 -3.444 -6.640 1.00 0.00 C ATOM 97 C LYS A 9 -2.115 -2.957 -5.285 1.00 0.00 C ATOM 98 O LYS A 9 -2.067 -3.695 -4.298 1.00 0.00 O ATOM 99 CB LYS A 9 -2.764 -3.587 -7.632 1.00 0.00 C ATOM 100 CG LYS A 9 -2.391 -4.340 -8.910 1.00 0.00 C ATOM 101 CD LYS A 9 -3.266 -3.936 -10.097 1.00 0.00 C ATOM 102 CE LYS A 9 -4.742 -4.238 -9.860 1.00 0.00 C ATOM 103 NZ LYS A 9 -5.606 -3.625 -10.904 1.00 0.00 N ATOM 0 H LYS A 9 -1.388 -5.520 -6.888 1.00 0.00 H new ATOM 0 HA LYS A 9 -0.897 -2.705 -7.027 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -3.587 -4.107 -7.141 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -3.128 -2.594 -7.898 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.345 -4.148 -9.150 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -2.487 -5.412 -8.739 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -3.142 -2.870 -10.290 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.929 -4.463 -10.990 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.895 -5.317 -9.849 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.036 -3.865 -8.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.592 -3.922 -10.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.544 -2.589 -10.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -5.287 -3.935 -11.844 1.00 0.00 H new ATOM 117 N THR A 10 -2.619 -1.724 -5.242 1.00 0.00 N ATOM 118 CA THR A 10 -3.124 -1.142 -4.000 1.00 0.00 C ATOM 119 C THR A 10 -4.462 -1.770 -3.605 1.00 0.00 C ATOM 120 O THR A 10 -5.039 -2.558 -4.365 1.00 0.00 O ATOM 121 CB THR A 10 -3.295 0.393 -4.121 1.00 0.00 C ATOM 122 OG1 THR A 10 -4.316 0.704 -5.078 1.00 0.00 O ATOM 123 CG2 THR A 10 -1.990 1.056 -4.543 1.00 0.00 C ATOM 0 H THR A 10 -2.688 -1.109 -6.053 1.00 0.00 H new ATOM 0 HA THR A 10 -2.385 -1.352 -3.226 1.00 0.00 H new ATOM 0 HB THR A 10 -3.583 0.776 -3.142 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.416 1.677 -5.145 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.138 2.133 -4.621 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.219 0.848 -3.801 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.678 0.662 -5.510 1.00 0.00 H new ATOM 131 N TYR A 11 -4.945 -1.437 -2.411 1.00 0.00 N ATOM 132 CA TYR A 11 -6.253 -1.891 -1.950 1.00 0.00 C ATOM 133 C TYR A 11 -7.329 -1.453 -2.934 1.00 0.00 C ATOM 134 O TYR A 11 -8.095 -2.277 -3.446 1.00 0.00 O ATOM 135 CB TYR A 11 -6.548 -1.328 -0.550 1.00 0.00 C ATOM 136 CG TYR A 11 -7.923 -1.683 -0.009 1.00 0.00 C ATOM 137 CD1 TYR A 11 -8.209 -2.974 0.421 1.00 0.00 C ATOM 138 CD2 TYR A 11 -8.930 -0.725 0.080 1.00 0.00 C ATOM 139 CE1 TYR A 11 -9.455 -3.299 0.921 1.00 0.00 C ATOM 140 CE2 TYR A 11 -10.178 -1.045 0.583 1.00 0.00 C ATOM 141 CZ TYR A 11 -10.435 -2.333 1.002 1.00 0.00 C ATOM 142 OH TYR A 11 -11.674 -2.661 1.509 1.00 0.00 O ATOM 0 H TYR A 11 -4.446 -0.851 -1.742 1.00 0.00 H new ATOM 0 HA TYR A 11 -6.250 -2.979 -1.892 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -5.792 -1.696 0.143 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -6.452 -0.243 -0.580 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -7.445 -3.735 0.363 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -8.733 0.285 -0.249 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -9.661 -4.308 1.248 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -10.947 -0.290 0.647 1.00 0.00 H new ATOM 0 HH TYR A 11 -12.251 -1.869 1.500 1.00 0.00 H new ATOM 152 N ASP A 12 -7.349 -0.154 -3.208 1.00 0.00 N ATOM 153 CA ASP A 12 -8.309 0.443 -4.130 1.00 0.00 C ATOM 154 C ASP A 12 -8.139 -0.133 -5.531 1.00 0.00 C ATOM 155 O ASP A 12 -9.069 -0.709 -6.092 1.00 0.00 O ATOM 156 CB ASP A 12 -8.119 1.968 -4.177 1.00 0.00 C ATOM 157 CG ASP A 12 -8.320 2.638 -2.825 1.00 0.00 C ATOM 158 OD1 ASP A 12 -7.519 2.376 -1.899 1.00 0.00 O ATOM 159 OD2 ASP A 12 -9.263 3.449 -2.686 1.00 0.00 O ATOM 0 H ASP A 12 -6.699 0.516 -2.797 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.313 0.213 -3.773 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -7.116 2.192 -4.541 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -8.821 2.393 -4.894 1.00 0.00 H new ATOM 164 N ASP A 13 -6.923 -0.013 -6.066 1.00 0.00 N ATOM 165 CA ASP A 13 -6.628 -0.422 -7.443 1.00 0.00 C ATOM 166 C ASP A 13 -6.987 -1.887 -7.662 1.00 0.00 C ATOM 167 O ASP A 13 -7.373 -2.296 -8.758 1.00 0.00 O ATOM 168 CB ASP A 13 -5.139 -0.211 -7.761 1.00 0.00 C ATOM 169 CG ASP A 13 -4.879 -0.070 -9.255 1.00 0.00 C ATOM 170 OD1 ASP A 13 -4.752 -1.101 -9.946 1.00 0.00 O ATOM 171 OD2 ASP A 13 -4.815 1.076 -9.747 1.00 0.00 O ATOM 0 H ASP A 13 -6.121 0.367 -5.564 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.230 0.195 -8.109 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -4.784 0.682 -7.247 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -4.565 -1.052 -7.373 1.00 0.00 H new ATOM 176 N CYS A 14 -6.840 -2.676 -6.605 1.00 0.00 N ATOM 177 CA CYS A 14 -7.112 -4.106 -6.667 1.00 0.00 C ATOM 178 C CYS A 14 -8.514 -4.445 -6.138 1.00 0.00 C ATOM 179 O CYS A 14 -9.441 -4.638 -6.921 1.00 0.00 O ATOM 180 CB CYS A 14 -6.019 -4.875 -5.908 1.00 0.00 C ATOM 181 SG CYS A 14 -6.455 -6.581 -5.454 1.00 0.00 S ATOM 0 H CYS A 14 -6.532 -2.347 -5.690 1.00 0.00 H new ATOM 0 HA CYS A 14 -7.095 -4.415 -7.712 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -5.118 -4.897 -6.522 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -5.773 -4.325 -5.000 1.00 0.00 H new ATOM 0 HG CYS A 14 -7.272 -6.566 -4.443 1.00 0.00 H new ATOM 186 N CYS A 15 -8.672 -4.510 -4.815 1.00 0.00 N ATOM 187 CA CYS A 15 -9.929 -4.972 -4.207 1.00 0.00 C ATOM 188 C CYS A 15 -11.060 -3.944 -4.301 1.00 0.00 C ATOM 189 O CYS A 15 -12.228 -4.323 -4.255 1.00 0.00 O ATOM 190 CB CYS A 15 -9.716 -5.365 -2.740 1.00 0.00 C ATOM 191 SG CYS A 15 -8.858 -6.954 -2.508 1.00 0.00 S ATOM 0 H CYS A 15 -7.950 -4.250 -4.143 1.00 0.00 H new ATOM 0 HA CYS A 15 -10.234 -5.845 -4.784 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.143 -4.580 -2.245 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -10.686 -5.413 -2.244 1.00 0.00 H new ATOM 0 HG CYS A 15 -9.732 -7.915 -2.457 1.00 0.00 H new ATOM 196 N GLY A 16 -10.715 -2.662 -4.442 1.00 0.00 N ATOM 197 CA GLY A 16 -11.699 -1.590 -4.292 1.00 0.00 C ATOM 198 C GLY A 16 -12.982 -1.788 -5.099 1.00 0.00 C ATOM 199 O GLY A 16 -14.072 -1.808 -4.521 1.00 0.00 O ATOM 0 H GLY A 16 -9.770 -2.344 -4.658 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -11.959 -1.498 -3.237 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.239 -0.648 -4.590 1.00 0.00 H new ATOM 203 N PRO A 17 -12.893 -1.977 -6.431 1.00 0.00 N ATOM 204 CA PRO A 17 -14.082 -2.151 -7.274 1.00 0.00 C ATOM 205 C PRO A 17 -14.776 -3.499 -7.048 1.00 0.00 C ATOM 206 O PRO A 17 -15.987 -3.631 -7.260 1.00 0.00 O ATOM 207 CB PRO A 17 -13.529 -2.045 -8.704 1.00 0.00 C ATOM 208 CG PRO A 17 -12.088 -2.418 -8.595 1.00 0.00 C ATOM 209 CD PRO A 17 -11.643 -1.988 -7.221 1.00 0.00 C ATOM 0 HA PRO A 17 -14.850 -1.410 -7.051 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -14.059 -2.714 -9.382 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -13.646 -1.035 -9.097 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.953 -3.491 -8.729 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -11.499 -1.923 -9.367 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.912 -2.680 -6.803 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -11.175 -1.004 -7.242 1.00 0.00 H new ATOM 217 N LEU A 18 -14.006 -4.495 -6.612 1.00 0.00 N ATOM 218 CA LEU A 18 -14.533 -5.843 -6.399 1.00 0.00 C ATOM 219 C LEU A 18 -15.359 -5.924 -5.117 1.00 0.00 C ATOM 220 O LEU A 18 -16.464 -6.466 -5.118 1.00 0.00 O ATOM 221 CB LEU A 18 -13.397 -6.881 -6.362 1.00 0.00 C ATOM 222 CG LEU A 18 -12.750 -7.210 -7.720 1.00 0.00 C ATOM 223 CD1 LEU A 18 -13.811 -7.592 -8.746 1.00 0.00 C ATOM 224 CD2 LEU A 18 -11.902 -6.048 -8.226 1.00 0.00 C ATOM 0 H LEU A 18 -13.014 -4.394 -6.399 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.187 -6.071 -7.241 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.620 -6.519 -5.688 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -13.787 -7.804 -5.933 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.090 -8.065 -7.575 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -13.331 -7.820 -9.698 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -14.357 -8.468 -8.396 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.504 -6.761 -8.879 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.459 -6.312 -9.186 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -12.530 -5.165 -8.346 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.110 -5.835 -7.508 1.00 0.00 H new ATOM 236 N LEU A 19 -14.818 -5.380 -4.032 1.00 0.00 N ATOM 237 CA LEU A 19 -15.474 -5.426 -2.722 1.00 0.00 C ATOM 238 C LEU A 19 -16.815 -4.693 -2.744 1.00 0.00 C ATOM 239 O LEU A 19 -17.744 -5.065 -2.028 1.00 0.00 O ATOM 240 CB LEU A 19 -14.546 -4.844 -1.642 1.00 0.00 C ATOM 241 CG LEU A 19 -13.492 -5.827 -1.092 1.00 0.00 C ATOM 242 CD1 LEU A 19 -12.342 -5.083 -0.425 1.00 0.00 C ATOM 243 CD2 LEU A 19 -14.129 -6.797 -0.103 1.00 0.00 C ATOM 0 H LEU A 19 -13.919 -4.897 -4.031 1.00 0.00 H new ATOM 0 HA LEU A 19 -15.677 -6.469 -2.480 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -14.032 -3.976 -2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -15.157 -4.488 -0.813 1.00 0.00 H new ATOM 0 HG LEU A 19 -13.093 -6.392 -1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -11.615 -5.801 -0.047 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -11.861 -4.429 -1.152 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -12.726 -4.486 0.402 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.370 -7.483 0.274 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -14.559 -6.239 0.728 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -14.914 -7.364 -0.604 1.00 0.00 H new ATOM 255 N ALA A 20 -16.913 -3.660 -3.573 1.00 0.00 N ATOM 256 CA ALA A 20 -18.173 -2.938 -3.753 1.00 0.00 C ATOM 257 C ALA A 20 -19.098 -3.698 -4.706 1.00 0.00 C ATOM 258 O ALA A 20 -20.304 -3.448 -4.757 1.00 0.00 O ATOM 259 CB ALA A 20 -17.902 -1.533 -4.280 1.00 0.00 C ATOM 0 H ALA A 20 -16.138 -3.302 -4.131 1.00 0.00 H new ATOM 0 HA ALA A 20 -18.670 -2.859 -2.786 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -18.847 -1.005 -4.410 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -17.279 -0.992 -3.569 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -17.387 -1.597 -5.239 1.00 0.00 H new ATOM 265 N ARG A 21 -18.506 -4.635 -5.451 1.00 0.00 N ATOM 266 CA ARG A 21 -19.207 -5.420 -6.474 1.00 0.00 C ATOM 267 C ARG A 21 -19.711 -4.531 -7.610 1.00 0.00 C ATOM 268 O ARG A 21 -20.500 -4.969 -8.447 1.00 0.00 O ATOM 269 CB ARG A 21 -20.367 -6.251 -5.880 1.00 0.00 C ATOM 270 CG ARG A 21 -19.909 -7.422 -5.005 1.00 0.00 C ATOM 271 CD ARG A 21 -19.694 -7.020 -3.548 1.00 0.00 C ATOM 272 NE ARG A 21 -20.938 -7.070 -2.774 1.00 0.00 N ATOM 273 CZ ARG A 21 -21.113 -6.492 -1.584 1.00 0.00 C ATOM 274 NH1 ARG A 21 -20.172 -5.713 -1.063 1.00 0.00 N ATOM 275 NH2 ARG A 21 -22.240 -6.693 -0.918 1.00 0.00 N ATOM 0 H ARG A 21 -17.518 -4.873 -5.361 1.00 0.00 H new ATOM 0 HA ARG A 21 -18.478 -6.120 -6.883 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -21.004 -5.595 -5.287 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -20.979 -6.637 -6.695 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -20.652 -8.218 -5.052 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -18.981 -7.829 -5.406 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -18.958 -7.683 -3.094 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -19.282 -6.012 -3.507 1.00 0.00 H new ATOM 0 HE ARG A 21 -21.725 -7.582 -3.173 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -19.304 -5.551 -1.573 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -20.317 -5.277 -0.153 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -22.968 -7.287 -1.315 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -22.380 -6.254 -0.008 1.00 0.00 H new ATOM 289 N THR A 22 -19.222 -3.293 -7.653 1.00 0.00 N ATOM 290 CA THR A 22 -19.602 -2.349 -8.698 1.00 0.00 C ATOM 291 C THR A 22 -19.049 -2.800 -10.050 1.00 0.00 C ATOM 292 O THR A 22 -19.664 -2.578 -11.097 1.00 0.00 O ATOM 293 CB THR A 22 -19.102 -0.916 -8.375 1.00 0.00 C ATOM 294 OG1 THR A 22 -19.456 -0.009 -9.430 1.00 0.00 O ATOM 295 CG2 THR A 22 -17.591 -0.884 -8.165 1.00 0.00 C ATOM 0 H THR A 22 -18.559 -2.921 -6.973 1.00 0.00 H new ATOM 0 HA THR A 22 -20.691 -2.327 -8.744 1.00 0.00 H new ATOM 0 HB THR A 22 -19.586 -0.605 -7.449 1.00 0.00 H new ATOM 0 HG1 THR A 22 -19.135 0.890 -9.210 1.00 0.00 H new ATOM 0 HG21 THR A 22 -17.276 0.135 -7.941 1.00 0.00 H new ATOM 0 HG22 THR A 22 -17.325 -1.537 -7.334 1.00 0.00 H new ATOM 0 HG23 THR A 22 -17.090 -1.227 -9.070 1.00 0.00 H new ATOM 303 N ARG A 23 -17.896 -3.461 -10.014 1.00 0.00 N ATOM 304 CA ARG A 23 -17.226 -3.924 -11.224 1.00 0.00 C ATOM 305 C ARG A 23 -17.039 -5.437 -11.190 1.00 0.00 C ATOM 306 O ARG A 23 -16.571 -5.993 -10.193 1.00 0.00 O ATOM 307 CB ARG A 23 -15.871 -3.223 -11.373 1.00 0.00 C ATOM 308 CG ARG A 23 -15.001 -3.768 -12.503 1.00 0.00 C ATOM 309 CD ARG A 23 -13.697 -2.992 -12.623 1.00 0.00 C ATOM 310 NE ARG A 23 -12.752 -3.619 -13.547 1.00 0.00 N ATOM 311 CZ ARG A 23 -11.451 -3.330 -13.580 1.00 0.00 C ATOM 312 NH1 ARG A 23 -10.959 -2.384 -12.788 1.00 0.00 N ATOM 313 NH2 ARG A 23 -10.644 -3.968 -14.417 1.00 0.00 N ATOM 0 H ARG A 23 -17.403 -3.690 -9.151 1.00 0.00 H new ATOM 0 HA ARG A 23 -17.849 -3.676 -12.083 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -16.042 -2.160 -11.543 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -15.324 -3.312 -10.434 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.784 -4.821 -12.322 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -15.547 -3.712 -13.444 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -13.912 -1.978 -12.961 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -13.236 -2.909 -11.639 1.00 0.00 H new ATOM 0 HE ARG A 23 -13.108 -4.315 -14.202 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.577 -1.878 -12.154 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -9.963 -2.164 -12.814 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -11.018 -4.684 -15.040 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.649 -3.743 -14.438 1.00 0.00 H new ATOM 327 N SER A 24 -17.413 -6.092 -12.280 1.00 0.00 N ATOM 328 CA SER A 24 -17.255 -7.532 -12.409 1.00 0.00 C ATOM 329 C SER A 24 -15.854 -7.860 -12.932 1.00 0.00 C ATOM 330 O SER A 24 -15.480 -7.437 -14.027 1.00 0.00 O ATOM 331 CB SER A 24 -18.327 -8.090 -13.354 1.00 0.00 C ATOM 332 OG SER A 24 -19.630 -7.743 -12.905 1.00 0.00 O ATOM 0 H SER A 24 -17.832 -5.643 -13.094 1.00 0.00 H new ATOM 0 HA SER A 24 -17.376 -7.996 -11.430 1.00 0.00 H new ATOM 0 HB2 SER A 24 -18.169 -7.701 -14.360 1.00 0.00 H new ATOM 0 HB3 SER A 24 -18.236 -9.175 -13.414 1.00 0.00 H new ATOM 0 HG SER A 24 -20.297 -8.108 -13.523 1.00 0.00 H new ATOM 338 N ALA A 25 -15.082 -8.600 -12.130 1.00 0.00 N ATOM 339 CA ALA A 25 -13.714 -8.986 -12.493 1.00 0.00 C ATOM 340 C ALA A 25 -13.662 -9.638 -13.874 1.00 0.00 C ATOM 341 O ALA A 25 -12.716 -9.427 -14.634 1.00 0.00 O ATOM 342 CB ALA A 25 -13.138 -9.933 -11.445 1.00 0.00 C ATOM 0 H ALA A 25 -15.384 -8.946 -11.219 1.00 0.00 H new ATOM 0 HA ALA A 25 -13.111 -8.078 -12.529 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -12.122 -10.212 -11.726 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.123 -9.436 -10.475 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.757 -10.828 -11.384 1.00 0.00 H new ATOM 348 N ALA A 26 -14.678 -10.449 -14.171 1.00 0.00 N ATOM 349 CA ALA A 26 -14.796 -11.131 -15.462 1.00 0.00 C ATOM 350 C ALA A 26 -13.631 -12.095 -15.709 1.00 0.00 C ATOM 351 O ALA A 26 -13.452 -12.590 -16.820 1.00 0.00 O ATOM 352 CB ALA A 26 -14.908 -10.115 -16.596 1.00 0.00 C ATOM 0 H ALA A 26 -15.441 -10.652 -13.525 1.00 0.00 H new ATOM 0 HA ALA A 26 -15.708 -11.727 -15.435 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -14.995 -10.640 -17.547 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -15.790 -9.494 -16.442 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -14.019 -9.485 -16.609 1.00 0.00 H new ATOM 358 N SER A 27 -12.860 -12.374 -14.662 1.00 0.00 N ATOM 359 CA SER A 27 -11.726 -13.293 -14.743 1.00 0.00 C ATOM 360 C SER A 27 -11.585 -14.054 -13.419 1.00 0.00 C ATOM 361 O SER A 27 -11.607 -13.440 -12.348 1.00 0.00 O ATOM 362 CB SER A 27 -10.439 -12.520 -15.060 1.00 0.00 C ATOM 363 OG SER A 27 -10.551 -11.815 -16.288 1.00 0.00 O ATOM 0 H SER A 27 -13.002 -11.971 -13.736 1.00 0.00 H new ATOM 0 HA SER A 27 -11.901 -14.010 -15.545 1.00 0.00 H new ATOM 0 HB2 SER A 27 -10.225 -11.819 -14.253 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.599 -13.213 -15.111 1.00 0.00 H new ATOM 0 HG SER A 27 -9.718 -11.330 -16.464 1.00 0.00 H new ATOM 369 N PRO A 28 -11.447 -15.399 -13.472 1.00 0.00 N ATOM 370 CA PRO A 28 -11.438 -16.252 -12.271 1.00 0.00 C ATOM 371 C PRO A 28 -10.399 -15.803 -11.240 1.00 0.00 C ATOM 372 O PRO A 28 -10.728 -15.578 -10.073 1.00 0.00 O ATOM 373 CB PRO A 28 -11.112 -17.663 -12.812 1.00 0.00 C ATOM 374 CG PRO A 28 -10.622 -17.453 -14.208 1.00 0.00 C ATOM 375 CD PRO A 28 -11.286 -16.195 -14.701 1.00 0.00 C ATOM 0 HA PRO A 28 -12.390 -16.208 -11.741 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -10.354 -18.152 -12.200 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.995 -18.302 -12.798 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.537 -17.354 -14.229 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.877 -18.302 -14.842 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.673 -15.678 -15.439 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -12.245 -16.404 -15.174 1.00 0.00 H new ATOM 383 N GLU A 29 -9.152 -15.654 -11.679 1.00 0.00 N ATOM 384 CA GLU A 29 -8.069 -15.249 -10.784 1.00 0.00 C ATOM 385 C GLU A 29 -8.271 -13.814 -10.294 1.00 0.00 C ATOM 386 O GLU A 29 -7.989 -13.504 -9.136 1.00 0.00 O ATOM 387 CB GLU A 29 -6.709 -15.368 -11.482 1.00 0.00 C ATOM 388 CG GLU A 29 -6.635 -14.604 -12.796 1.00 0.00 C ATOM 389 CD GLU A 29 -5.209 -14.308 -13.227 1.00 0.00 C ATOM 390 OE1 GLU A 29 -4.595 -15.158 -13.900 1.00 0.00 O ATOM 391 OE2 GLU A 29 -4.705 -13.215 -12.899 1.00 0.00 O ATOM 0 H GLU A 29 -8.866 -15.807 -12.646 1.00 0.00 H new ATOM 0 HA GLU A 29 -8.085 -15.920 -9.925 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.932 -15.000 -10.812 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.496 -16.420 -11.670 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.132 -15.182 -13.575 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.181 -13.666 -12.697 1.00 0.00 H new ATOM 398 N ALA A 30 -8.765 -12.949 -11.183 1.00 0.00 N ATOM 399 CA ALA A 30 -8.977 -11.537 -10.861 1.00 0.00 C ATOM 400 C ALA A 30 -9.945 -11.390 -9.695 1.00 0.00 C ATOM 401 O ALA A 30 -9.756 -10.552 -8.808 1.00 0.00 O ATOM 402 CB ALA A 30 -9.488 -10.779 -12.079 1.00 0.00 C ATOM 0 H ALA A 30 -9.026 -13.204 -12.135 1.00 0.00 H new ATOM 0 HA ALA A 30 -8.019 -11.108 -10.567 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.639 -9.731 -11.819 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.758 -10.851 -12.885 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.433 -11.212 -12.406 1.00 0.00 H new ATOM 408 N LEU A 31 -10.976 -12.220 -9.702 1.00 0.00 N ATOM 409 CA LEU A 31 -11.957 -12.243 -8.629 1.00 0.00 C ATOM 410 C LEU A 31 -11.361 -12.925 -7.399 1.00 0.00 C ATOM 411 O LEU A 31 -11.474 -12.425 -6.281 1.00 0.00 O ATOM 412 CB LEU A 31 -13.230 -12.970 -9.117 1.00 0.00 C ATOM 413 CG LEU A 31 -14.444 -12.985 -8.160 1.00 0.00 C ATOM 414 CD1 LEU A 31 -14.296 -14.054 -7.075 1.00 0.00 C ATOM 415 CD2 LEU A 31 -14.664 -11.605 -7.540 1.00 0.00 C ATOM 0 H LEU A 31 -11.156 -12.893 -10.447 1.00 0.00 H new ATOM 0 HA LEU A 31 -12.229 -11.225 -8.348 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -13.544 -12.510 -10.054 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -12.964 -14.003 -9.342 1.00 0.00 H new ATOM 0 HG LEU A 31 -15.324 -13.240 -8.751 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.169 -14.033 -6.422 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -14.214 -15.036 -7.541 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.399 -13.855 -6.488 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -15.523 -11.640 -6.870 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -13.777 -11.313 -6.977 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -14.849 -10.877 -8.330 1.00 0.00 H new ATOM 427 N MET A 32 -10.692 -14.052 -7.628 1.00 0.00 N ATOM 428 CA MET A 32 -10.191 -14.894 -6.544 1.00 0.00 C ATOM 429 C MET A 32 -9.171 -14.156 -5.668 1.00 0.00 C ATOM 430 O MET A 32 -9.301 -14.148 -4.443 1.00 0.00 O ATOM 431 CB MET A 32 -9.592 -16.191 -7.111 1.00 0.00 C ATOM 432 CG MET A 32 -9.200 -17.219 -6.050 1.00 0.00 C ATOM 433 SD MET A 32 -7.685 -16.786 -5.173 1.00 0.00 S ATOM 434 CE MET A 32 -6.480 -16.954 -6.487 1.00 0.00 C ATOM 0 H MET A 32 -10.483 -14.406 -8.562 1.00 0.00 H new ATOM 0 HA MET A 32 -11.036 -15.147 -5.904 1.00 0.00 H new ATOM 0 HB2 MET A 32 -10.314 -16.644 -7.790 1.00 0.00 H new ATOM 0 HB3 MET A 32 -8.711 -15.942 -7.702 1.00 0.00 H new ATOM 0 HG2 MET A 32 -10.013 -17.319 -5.331 1.00 0.00 H new ATOM 0 HG3 MET A 32 -9.073 -18.192 -6.525 1.00 0.00 H new ATOM 0 HE1 MET A 32 -5.685 -17.628 -6.168 1.00 0.00 H new ATOM 0 HE2 MET A 32 -6.965 -17.359 -7.375 1.00 0.00 H new ATOM 0 HE3 MET A 32 -6.056 -15.977 -6.719 1.00 0.00 H new ATOM 444 N ARG A 33 -8.171 -13.514 -6.283 1.00 0.00 N ATOM 445 CA ARG A 33 -7.116 -12.861 -5.501 1.00 0.00 C ATOM 446 C ARG A 33 -7.671 -11.653 -4.742 1.00 0.00 C ATOM 447 O ARG A 33 -7.142 -11.265 -3.699 1.00 0.00 O ATOM 448 CB ARG A 33 -5.895 -12.461 -6.367 1.00 0.00 C ATOM 449 CG ARG A 33 -5.913 -11.027 -6.896 1.00 0.00 C ATOM 450 CD ARG A 33 -6.711 -10.883 -8.182 1.00 0.00 C ATOM 451 NE ARG A 33 -5.942 -11.308 -9.360 1.00 0.00 N ATOM 452 CZ ARG A 33 -5.666 -10.516 -10.405 1.00 0.00 C ATOM 453 NH1 ARG A 33 -6.118 -9.268 -10.438 1.00 0.00 N ATOM 454 NH2 ARG A 33 -4.953 -10.973 -11.425 1.00 0.00 N ATOM 0 H ARG A 33 -8.070 -13.433 -7.295 1.00 0.00 H new ATOM 0 HA ARG A 33 -6.759 -13.593 -4.776 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -4.990 -12.602 -5.777 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -5.832 -13.143 -7.215 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -6.336 -10.370 -6.136 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -4.889 -10.696 -7.070 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -7.622 -11.477 -8.111 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -7.016 -9.844 -8.304 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.596 -12.267 -9.384 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -6.678 -8.908 -9.665 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -5.905 -8.669 -11.236 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -4.610 -11.934 -11.418 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -4.747 -10.364 -12.217 1.00 0.00 H new ATOM 468 N SER A 34 -8.732 -11.056 -5.278 1.00 0.00 N ATOM 469 CA SER A 34 -9.424 -9.957 -4.610 1.00 0.00 C ATOM 470 C SER A 34 -10.302 -10.499 -3.484 1.00 0.00 C ATOM 471 O SER A 34 -10.453 -9.866 -2.437 1.00 0.00 O ATOM 472 CB SER A 34 -10.262 -9.177 -5.628 1.00 0.00 C ATOM 473 OG SER A 34 -9.443 -8.694 -6.682 1.00 0.00 O ATOM 0 H SER A 34 -9.133 -11.317 -6.179 1.00 0.00 H new ATOM 0 HA SER A 34 -8.690 -9.279 -4.174 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.044 -9.820 -6.033 1.00 0.00 H new ATOM 0 HB3 SER A 34 -10.759 -8.342 -5.135 1.00 0.00 H new ATOM 0 HG SER A 34 -9.508 -9.299 -7.450 1.00 0.00 H new ATOM 479 N ARG A 35 -10.854 -11.688 -3.712 1.00 0.00 N ATOM 480 CA ARG A 35 -11.718 -12.355 -2.746 1.00 0.00 C ATOM 481 C ARG A 35 -10.925 -12.711 -1.488 1.00 0.00 C ATOM 482 O ARG A 35 -11.374 -12.468 -0.368 1.00 0.00 O ATOM 483 CB ARG A 35 -12.314 -13.623 -3.382 1.00 0.00 C ATOM 484 CG ARG A 35 -13.436 -14.268 -2.577 1.00 0.00 C ATOM 485 CD ARG A 35 -13.923 -15.561 -3.227 1.00 0.00 C ATOM 486 NE ARG A 35 -15.144 -16.074 -2.596 1.00 0.00 N ATOM 487 CZ ARG A 35 -15.340 -17.349 -2.250 1.00 0.00 C ATOM 488 NH1 ARG A 35 -14.370 -18.245 -2.411 1.00 0.00 N ATOM 489 NH2 ARG A 35 -16.506 -17.723 -1.733 1.00 0.00 N ATOM 0 H ARG A 35 -10.714 -12.216 -4.574 1.00 0.00 H new ATOM 0 HA ARG A 35 -12.529 -11.684 -2.462 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -12.693 -13.373 -4.373 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.517 -14.354 -3.520 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -13.085 -14.478 -1.567 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -14.268 -13.570 -2.487 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -14.110 -15.385 -4.286 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -13.139 -16.315 -3.163 1.00 0.00 H new ATOM 0 HE ARG A 35 -15.896 -15.411 -2.408 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -13.471 -17.959 -2.800 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -14.525 -19.218 -2.145 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -17.249 -17.037 -1.601 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -16.658 -18.696 -1.468 1.00 0.00 H new ATOM 503 N TYR A 36 -9.733 -13.271 -1.695 1.00 0.00 N ATOM 504 CA TYR A 36 -8.841 -13.658 -0.598 1.00 0.00 C ATOM 505 C TYR A 36 -8.601 -12.494 0.364 1.00 0.00 C ATOM 506 O TYR A 36 -8.633 -12.668 1.585 1.00 0.00 O ATOM 507 CB TYR A 36 -7.499 -14.155 -1.157 1.00 0.00 C ATOM 508 CG TYR A 36 -6.407 -14.296 -0.107 1.00 0.00 C ATOM 509 CD1 TYR A 36 -6.330 -15.423 0.706 1.00 0.00 C ATOM 510 CD2 TYR A 36 -5.458 -13.292 0.076 1.00 0.00 C ATOM 511 CE1 TYR A 36 -5.343 -15.543 1.666 1.00 0.00 C ATOM 512 CE2 TYR A 36 -4.469 -13.407 1.033 1.00 0.00 C ATOM 513 CZ TYR A 36 -4.417 -14.534 1.826 1.00 0.00 C ATOM 514 OH TYR A 36 -3.435 -14.652 2.785 1.00 0.00 O ATOM 0 H TYR A 36 -9.358 -13.469 -2.623 1.00 0.00 H new ATOM 0 HA TYR A 36 -9.325 -14.463 -0.044 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -7.653 -15.121 -1.639 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.160 -13.464 -1.929 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -7.053 -16.216 0.585 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -5.497 -12.407 -0.542 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -5.297 -16.424 2.289 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -3.741 -12.619 1.160 1.00 0.00 H new ATOM 0 HH TYR A 36 -3.219 -15.599 2.917 1.00 0.00 H new ATOM 524 N ALA A 37 -8.361 -11.311 -0.197 1.00 0.00 N ATOM 525 CA ALA A 37 -8.055 -10.127 0.601 1.00 0.00 C ATOM 526 C ALA A 37 -9.150 -9.861 1.628 1.00 0.00 C ATOM 527 O ALA A 37 -8.870 -9.425 2.742 1.00 0.00 O ATOM 528 CB ALA A 37 -7.861 -8.914 -0.299 1.00 0.00 C ATOM 0 H ALA A 37 -8.373 -11.147 -1.204 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.126 -10.313 1.140 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.634 -8.040 0.312 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.037 -9.100 -0.987 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.774 -8.732 -0.867 1.00 0.00 H new ATOM 534 N ALA A 38 -10.393 -10.149 1.251 1.00 0.00 N ATOM 535 CA ALA A 38 -11.532 -9.945 2.139 1.00 0.00 C ATOM 536 C ALA A 38 -11.395 -10.799 3.400 1.00 0.00 C ATOM 537 O ALA A 38 -11.747 -10.368 4.496 1.00 0.00 O ATOM 538 CB ALA A 38 -12.832 -10.263 1.411 1.00 0.00 C ATOM 0 H ALA A 38 -10.636 -10.525 0.335 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.552 -8.898 2.441 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -13.674 -10.107 2.085 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -12.934 -9.608 0.545 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -12.819 -11.302 1.081 1.00 0.00 H new ATOM 544 N TYR A 39 -10.854 -12.001 3.234 1.00 0.00 N ATOM 545 CA TYR A 39 -10.678 -12.931 4.347 1.00 0.00 C ATOM 546 C TYR A 39 -9.581 -12.424 5.286 1.00 0.00 C ATOM 547 O TYR A 39 -9.718 -12.475 6.509 1.00 0.00 O ATOM 548 CB TYR A 39 -10.331 -14.338 3.813 1.00 0.00 C ATOM 549 CG TYR A 39 -11.205 -15.454 4.363 1.00 0.00 C ATOM 550 CD1 TYR A 39 -12.552 -15.241 4.636 1.00 0.00 C ATOM 551 CD2 TYR A 39 -10.688 -16.723 4.595 1.00 0.00 C ATOM 552 CE1 TYR A 39 -13.354 -16.255 5.122 1.00 0.00 C ATOM 553 CE2 TYR A 39 -11.486 -17.744 5.078 1.00 0.00 C ATOM 554 CZ TYR A 39 -12.817 -17.504 5.340 1.00 0.00 C ATOM 555 OH TYR A 39 -13.618 -18.517 5.810 1.00 0.00 O ATOM 0 H TYR A 39 -10.528 -12.357 2.335 1.00 0.00 H new ATOM 0 HA TYR A 39 -11.610 -12.995 4.908 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -10.414 -14.331 2.726 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.290 -14.557 4.052 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -12.979 -14.264 4.465 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -9.644 -16.915 4.394 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -14.397 -16.069 5.330 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -11.068 -18.725 5.249 1.00 0.00 H new ATOM 0 HH TYR A 39 -13.680 -18.458 6.786 1.00 0.00 H new ATOM 565 N ALA A 40 -8.501 -11.918 4.697 1.00 0.00 N ATOM 566 CA ALA A 40 -7.374 -11.389 5.464 1.00 0.00 C ATOM 567 C ALA A 40 -7.745 -10.069 6.143 1.00 0.00 C ATOM 568 O ALA A 40 -7.230 -9.739 7.212 1.00 0.00 O ATOM 569 CB ALA A 40 -6.161 -11.204 4.556 1.00 0.00 C ATOM 0 H ALA A 40 -8.381 -11.863 3.686 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.122 -12.107 6.244 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.328 -10.810 5.138 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.880 -12.165 4.124 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.408 -10.505 3.757 1.00 0.00 H new ATOM 575 N LEU A 41 -8.653 -9.327 5.519 1.00 0.00 N ATOM 576 CA LEU A 41 -9.103 -8.034 6.037 1.00 0.00 C ATOM 577 C LEU A 41 -10.404 -8.193 6.824 1.00 0.00 C ATOM 578 O LEU A 41 -11.141 -7.230 7.026 1.00 0.00 O ATOM 579 CB LEU A 41 -9.284 -7.042 4.879 1.00 0.00 C ATOM 580 CG LEU A 41 -8.008 -6.755 4.068 1.00 0.00 C ATOM 581 CD1 LEU A 41 -8.308 -5.830 2.893 1.00 0.00 C ATOM 582 CD2 LEU A 41 -6.920 -6.160 4.961 1.00 0.00 C ATOM 0 H LEU A 41 -9.098 -9.601 4.643 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.346 -7.643 6.716 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -10.047 -7.429 4.204 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -9.661 -6.102 5.281 1.00 0.00 H new ATOM 0 HG LEU A 41 -7.641 -7.701 3.669 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.391 -5.642 2.335 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.041 -6.300 2.238 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.706 -4.886 3.265 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.027 -5.965 4.366 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.277 -5.227 5.396 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.679 -6.863 5.758 1.00 0.00 H new ATOM 594 N LYS A 42 -10.665 -9.429 7.259 1.00 0.00 N ATOM 595 CA LYS A 42 -11.847 -9.800 8.059 1.00 0.00 C ATOM 596 C LYS A 42 -13.165 -9.254 7.489 1.00 0.00 C ATOM 597 O LYS A 42 -14.163 -9.154 8.204 1.00 0.00 O ATOM 598 CB LYS A 42 -11.696 -9.433 9.562 1.00 0.00 C ATOM 599 CG LYS A 42 -11.628 -7.938 9.904 1.00 0.00 C ATOM 600 CD LYS A 42 -10.192 -7.411 9.982 1.00 0.00 C ATOM 601 CE LYS A 42 -9.353 -8.162 11.013 1.00 0.00 C ATOM 602 NZ LYS A 42 -9.931 -8.083 12.383 1.00 0.00 N ATOM 0 H LYS A 42 -10.051 -10.220 7.063 1.00 0.00 H new ATOM 0 HA LYS A 42 -11.899 -10.887 7.990 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -12.535 -9.868 10.104 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -10.791 -9.910 9.939 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -12.177 -7.373 9.151 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -12.126 -7.765 10.858 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -9.722 -7.498 9.002 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -10.210 -6.351 10.234 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -9.269 -9.208 10.717 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -8.343 -7.752 11.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -9.275 -8.520 13.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -10.082 -7.086 12.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -10.840 -8.588 12.406 1.00 0.00 H new ATOM 616 N ASP A 43 -13.179 -8.938 6.197 1.00 0.00 N ATOM 617 CA ASP A 43 -14.423 -8.627 5.494 1.00 0.00 C ATOM 618 C ASP A 43 -14.913 -9.889 4.789 1.00 0.00 C ATOM 619 O ASP A 43 -15.137 -9.908 3.576 1.00 0.00 O ATOM 620 CB ASP A 43 -14.228 -7.470 4.491 1.00 0.00 C ATOM 621 CG ASP A 43 -14.254 -6.098 5.158 1.00 0.00 C ATOM 622 OD1 ASP A 43 -15.282 -5.759 5.788 1.00 0.00 O ATOM 623 OD2 ASP A 43 -13.267 -5.338 5.039 1.00 0.00 O ATOM 0 H ASP A 43 -12.343 -8.890 5.614 1.00 0.00 H new ATOM 0 HA ASP A 43 -15.172 -8.296 6.214 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -13.277 -7.600 3.974 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -15.011 -7.516 3.734 1.00 0.00 H new ATOM 628 N PHE A 44 -15.111 -10.937 5.587 1.00 0.00 N ATOM 629 CA PHE A 44 -15.434 -12.268 5.076 1.00 0.00 C ATOM 630 C PHE A 44 -16.835 -12.315 4.468 1.00 0.00 C ATOM 631 O PHE A 44 -17.182 -13.266 3.765 1.00 0.00 O ATOM 632 CB PHE A 44 -15.293 -13.319 6.191 1.00 0.00 C ATOM 633 CG PHE A 44 -16.128 -13.039 7.420 1.00 0.00 C ATOM 634 CD1 PHE A 44 -15.624 -12.266 8.458 1.00 0.00 C ATOM 635 CD2 PHE A 44 -17.414 -13.551 7.539 1.00 0.00 C ATOM 636 CE1 PHE A 44 -16.382 -12.010 9.584 1.00 0.00 C ATOM 637 CE2 PHE A 44 -18.175 -13.296 8.664 1.00 0.00 C ATOM 638 CZ PHE A 44 -17.658 -12.525 9.687 1.00 0.00 C ATOM 0 H PHE A 44 -15.052 -10.888 6.604 1.00 0.00 H new ATOM 0 HA PHE A 44 -14.724 -12.499 4.282 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -15.571 -14.294 5.792 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -14.245 -13.382 6.485 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -14.626 -11.860 8.384 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -17.824 -14.155 6.743 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -15.976 -11.407 10.383 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -19.174 -13.699 8.743 1.00 0.00 H new ATOM 0 HZ PHE A 44 -18.252 -12.325 10.567 1.00 0.00 H new ATOM 648 N ASP A 45 -17.635 -11.289 4.740 1.00 0.00 N ATOM 649 CA ASP A 45 -18.972 -11.184 4.158 1.00 0.00 C ATOM 650 C ASP A 45 -18.878 -11.193 2.632 1.00 0.00 C ATOM 651 O ASP A 45 -19.715 -11.782 1.943 1.00 0.00 O ATOM 652 CB ASP A 45 -19.667 -9.902 4.636 1.00 0.00 C ATOM 653 CG ASP A 45 -21.130 -9.840 4.221 1.00 0.00 C ATOM 654 OD1 ASP A 45 -21.977 -10.410 4.939 1.00 0.00 O ATOM 655 OD2 ASP A 45 -21.444 -9.223 3.181 1.00 0.00 O ATOM 0 H ASP A 45 -17.383 -10.518 5.359 1.00 0.00 H new ATOM 0 HA ASP A 45 -19.563 -12.040 4.484 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -19.598 -9.839 5.722 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -19.142 -9.036 4.233 1.00 0.00 H new ATOM 660 N TYR A 46 -17.819 -10.567 2.118 1.00 0.00 N ATOM 661 CA TYR A 46 -17.585 -10.494 0.680 1.00 0.00 C ATOM 662 C TYR A 46 -17.347 -11.887 0.099 1.00 0.00 C ATOM 663 O TYR A 46 -17.707 -12.159 -1.048 1.00 0.00 O ATOM 664 CB TYR A 46 -16.398 -9.569 0.365 1.00 0.00 C ATOM 665 CG TYR A 46 -16.064 -9.490 -1.114 1.00 0.00 C ATOM 666 CD1 TYR A 46 -16.970 -8.955 -2.019 1.00 0.00 C ATOM 667 CD2 TYR A 46 -14.842 -9.949 -1.602 1.00 0.00 C ATOM 668 CE1 TYR A 46 -16.672 -8.879 -3.363 1.00 0.00 C ATOM 669 CE2 TYR A 46 -14.538 -9.874 -2.947 1.00 0.00 C ATOM 670 CZ TYR A 46 -15.457 -9.339 -3.822 1.00 0.00 C ATOM 671 OH TYR A 46 -15.164 -9.263 -5.163 1.00 0.00 O ATOM 0 H TYR A 46 -17.108 -10.102 2.682 1.00 0.00 H new ATOM 0 HA TYR A 46 -18.477 -10.075 0.214 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -16.621 -8.567 0.732 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -15.521 -9.920 0.909 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -17.924 -8.592 -1.665 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -14.121 -10.370 -0.917 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -17.389 -8.460 -4.054 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -13.586 -10.232 -3.310 1.00 0.00 H new ATOM 0 HH TYR A 46 -15.700 -8.554 -5.575 1.00 0.00 H new ATOM 681 N ILE A 47 -16.740 -12.766 0.896 1.00 0.00 N ATOM 682 CA ILE A 47 -16.495 -14.145 0.475 1.00 0.00 C ATOM 683 C ILE A 47 -17.808 -14.809 0.081 1.00 0.00 C ATOM 684 O ILE A 47 -17.891 -15.508 -0.932 1.00 0.00 O ATOM 685 CB ILE A 47 -15.832 -14.980 1.598 1.00 0.00 C ATOM 686 CG1 ILE A 47 -14.512 -14.334 2.046 1.00 0.00 C ATOM 687 CG2 ILE A 47 -15.606 -16.424 1.140 1.00 0.00 C ATOM 688 CD1 ILE A 47 -13.442 -14.296 0.977 1.00 0.00 C ATOM 0 H ILE A 47 -16.409 -12.548 1.836 1.00 0.00 H new ATOM 0 HA ILE A 47 -15.816 -14.109 -0.377 1.00 0.00 H new ATOM 0 HB ILE A 47 -16.507 -15.000 2.453 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -14.714 -13.315 2.378 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.128 -14.880 2.908 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.139 -16.992 1.945 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.563 -16.878 0.883 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -14.955 -16.431 0.266 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -12.544 -13.824 1.377 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -13.208 -15.312 0.661 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -13.802 -13.724 0.122 1.00 0.00 H new ATOM 700 N VAL A 48 -18.834 -14.571 0.891 1.00 0.00 N ATOM 701 CA VAL A 48 -20.161 -15.111 0.639 1.00 0.00 C ATOM 702 C VAL A 48 -20.757 -14.460 -0.609 1.00 0.00 C ATOM 703 O VAL A 48 -21.305 -15.143 -1.474 1.00 0.00 O ATOM 704 CB VAL A 48 -21.099 -14.890 1.852 1.00 0.00 C ATOM 705 CG1 VAL A 48 -22.448 -15.568 1.626 1.00 0.00 C ATOM 706 CG2 VAL A 48 -20.444 -15.391 3.140 1.00 0.00 C ATOM 0 H VAL A 48 -18.768 -14.002 1.735 1.00 0.00 H new ATOM 0 HA VAL A 48 -20.066 -16.185 0.479 1.00 0.00 H new ATOM 0 HB VAL A 48 -21.275 -13.819 1.956 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -23.090 -15.399 2.491 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -22.920 -15.151 0.737 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -22.299 -16.639 1.489 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -21.119 -15.226 3.980 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -20.231 -16.456 3.049 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -19.514 -14.848 3.310 1.00 0.00 H new ATOM 716 N GLU A 49 -20.604 -13.140 -0.706 1.00 0.00 N ATOM 717 CA GLU A 49 -21.083 -12.373 -1.860 1.00 0.00 C ATOM 718 C GLU A 49 -20.492 -12.901 -3.173 1.00 0.00 C ATOM 719 O GLU A 49 -21.101 -12.767 -4.238 1.00 0.00 O ATOM 720 CB GLU A 49 -20.722 -10.888 -1.692 1.00 0.00 C ATOM 721 CG GLU A 49 -21.447 -10.196 -0.542 1.00 0.00 C ATOM 722 CD GLU A 49 -22.943 -10.059 -0.786 1.00 0.00 C ATOM 723 OE1 GLU A 49 -23.342 -9.144 -1.541 1.00 0.00 O ATOM 724 OE2 GLU A 49 -23.724 -10.854 -0.221 1.00 0.00 O ATOM 0 H GLU A 49 -20.147 -12.573 0.008 1.00 0.00 H new ATOM 0 HA GLU A 49 -22.166 -12.486 -1.906 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -19.647 -10.802 -1.533 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -20.950 -10.363 -2.619 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -21.283 -10.760 0.376 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -21.016 -9.206 -0.390 1.00 0.00 H new ATOM 731 N THR A 50 -19.304 -13.496 -3.090 1.00 0.00 N ATOM 732 CA THR A 50 -18.612 -14.029 -4.263 1.00 0.00 C ATOM 733 C THR A 50 -18.694 -15.554 -4.322 1.00 0.00 C ATOM 734 O THR A 50 -17.863 -16.208 -4.956 1.00 0.00 O ATOM 735 CB THR A 50 -17.135 -13.582 -4.274 1.00 0.00 C ATOM 736 OG1 THR A 50 -16.569 -13.727 -2.962 1.00 0.00 O ATOM 737 CG2 THR A 50 -17.008 -12.136 -4.736 1.00 0.00 C ATOM 0 H THR A 50 -18.796 -13.622 -2.214 1.00 0.00 H new ATOM 0 HA THR A 50 -19.113 -13.629 -5.144 1.00 0.00 H new ATOM 0 HB THR A 50 -16.591 -14.216 -4.974 1.00 0.00 H new ATOM 0 HG1 THR A 50 -16.930 -13.033 -2.372 1.00 0.00 H new ATOM 0 HG21 THR A 50 -15.958 -11.845 -4.735 1.00 0.00 H new ATOM 0 HG22 THR A 50 -17.410 -12.040 -5.744 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.565 -11.488 -4.060 1.00 0.00 H new ATOM 745 N THR A 51 -19.693 -16.121 -3.661 1.00 0.00 N ATOM 746 CA THR A 51 -19.932 -17.556 -3.726 1.00 0.00 C ATOM 747 C THR A 51 -21.056 -17.850 -4.718 1.00 0.00 C ATOM 748 O THR A 51 -21.947 -17.020 -4.909 1.00 0.00 O ATOM 749 CB THR A 51 -20.294 -18.128 -2.342 1.00 0.00 C ATOM 750 OG1 THR A 51 -19.282 -17.755 -1.397 1.00 0.00 O ATOM 751 CG2 THR A 51 -20.420 -19.650 -2.389 1.00 0.00 C ATOM 0 H THR A 51 -20.351 -15.609 -3.073 1.00 0.00 H new ATOM 0 HA THR A 51 -19.013 -18.037 -4.061 1.00 0.00 H new ATOM 0 HB THR A 51 -21.258 -17.718 -2.039 1.00 0.00 H new ATOM 0 HG1 THR A 51 -19.238 -18.425 -0.683 1.00 0.00 H new ATOM 0 HG21 THR A 51 -20.676 -20.025 -1.398 1.00 0.00 H new ATOM 0 HG22 THR A 51 -21.202 -19.929 -3.095 1.00 0.00 H new ATOM 0 HG23 THR A 51 -19.472 -20.084 -2.707 1.00 0.00 H new ATOM 759 N ASP A 52 -20.997 -19.024 -5.350 1.00 0.00 N ATOM 760 CA ASP A 52 -21.989 -19.436 -6.347 1.00 0.00 C ATOM 761 C ASP A 52 -23.397 -19.228 -5.805 1.00 0.00 C ATOM 762 O ASP A 52 -23.689 -19.640 -4.684 1.00 0.00 O ATOM 763 CB ASP A 52 -21.799 -20.919 -6.701 1.00 0.00 C ATOM 764 CG ASP A 52 -22.428 -21.312 -8.033 1.00 0.00 C ATOM 765 OD1 ASP A 52 -23.664 -21.194 -8.180 1.00 0.00 O ATOM 766 OD2 ASP A 52 -21.684 -21.741 -8.936 1.00 0.00 O ATOM 0 H ASP A 52 -20.264 -19.714 -5.187 1.00 0.00 H new ATOM 0 HA ASP A 52 -21.851 -18.828 -7.241 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -20.733 -21.143 -6.732 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -22.231 -21.531 -5.910 1.00 0.00 H new ATOM 771 N PRO A 53 -24.292 -18.597 -6.585 1.00 0.00 N ATOM 772 CA PRO A 53 -25.678 -18.363 -6.162 1.00 0.00 C ATOM 773 C PRO A 53 -26.374 -19.661 -5.740 1.00 0.00 C ATOM 774 O PRO A 53 -27.387 -19.634 -5.036 1.00 0.00 O ATOM 775 CB PRO A 53 -26.351 -17.754 -7.408 1.00 0.00 C ATOM 776 CG PRO A 53 -25.408 -18.018 -8.538 1.00 0.00 C ATOM 777 CD PRO A 53 -24.034 -18.060 -7.930 1.00 0.00 C ATOM 0 HA PRO A 53 -25.735 -17.713 -5.289 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -27.323 -18.211 -7.593 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -26.521 -16.685 -7.280 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -25.645 -18.960 -9.032 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -25.476 -17.236 -9.294 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -23.359 -18.699 -8.499 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -23.578 -17.071 -7.890 1.00 0.00 H new ATOM 785 N GLU A 54 -25.822 -20.791 -6.177 1.00 0.00 N ATOM 786 CA GLU A 54 -26.359 -22.103 -5.830 1.00 0.00 C ATOM 787 C GLU A 54 -25.680 -22.662 -4.571 1.00 0.00 C ATOM 788 O GLU A 54 -26.304 -23.371 -3.783 1.00 0.00 O ATOM 789 CB GLU A 54 -26.170 -23.071 -7.005 1.00 0.00 C ATOM 790 CG GLU A 54 -26.656 -22.523 -8.347 1.00 0.00 C ATOM 791 CD GLU A 54 -28.091 -22.020 -8.305 1.00 0.00 C ATOM 792 OE1 GLU A 54 -29.006 -22.838 -8.071 1.00 0.00 O ATOM 793 OE2 GLU A 54 -28.316 -20.806 -8.520 1.00 0.00 O ATOM 0 H GLU A 54 -24.997 -20.823 -6.776 1.00 0.00 H new ATOM 0 HA GLU A 54 -27.423 -21.993 -5.620 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -25.113 -23.323 -7.088 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -26.702 -23.997 -6.788 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -26.001 -21.709 -8.658 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -26.574 -23.304 -9.102 1.00 0.00 H new ATOM 800 N ARG A 55 -24.400 -22.333 -4.384 1.00 0.00 N ATOM 801 CA ARG A 55 -23.619 -22.849 -3.250 1.00 0.00 C ATOM 802 C ARG A 55 -23.679 -21.894 -2.059 1.00 0.00 C ATOM 803 O ARG A 55 -23.342 -22.268 -0.935 1.00 0.00 O ATOM 804 CB ARG A 55 -22.147 -23.046 -3.649 1.00 0.00 C ATOM 805 CG ARG A 55 -21.923 -23.998 -4.820 1.00 0.00 C ATOM 806 CD ARG A 55 -22.316 -25.435 -4.491 1.00 0.00 C ATOM 807 NE ARG A 55 -22.076 -26.338 -5.624 1.00 0.00 N ATOM 808 CZ ARG A 55 -21.196 -27.349 -5.616 1.00 0.00 C ATOM 809 NH1 ARG A 55 -20.470 -27.606 -4.535 1.00 0.00 N ATOM 810 NH2 ARG A 55 -21.038 -28.104 -6.697 1.00 0.00 N ATOM 0 H ARG A 55 -23.879 -21.711 -5.002 1.00 0.00 H new ATOM 0 HA ARG A 55 -24.056 -23.807 -2.966 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.721 -22.075 -3.902 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -21.598 -23.420 -2.785 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -22.501 -23.655 -5.678 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -20.873 -23.970 -5.111 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -21.749 -25.778 -3.626 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -23.370 -25.470 -4.215 1.00 0.00 H new ATOM 0 HE ARG A 55 -22.616 -26.185 -6.476 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -20.579 -27.032 -3.699 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -19.803 -28.378 -4.540 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -21.587 -27.915 -7.536 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -20.368 -28.873 -6.689 1.00 0.00 H new ATOM 824 N ARG A 56 -24.115 -20.663 -2.310 1.00 0.00 N ATOM 825 CA ARG A 56 -24.065 -19.601 -1.303 1.00 0.00 C ATOM 826 C ARG A 56 -24.955 -19.931 -0.105 1.00 0.00 C ATOM 827 O ARG A 56 -24.766 -19.398 0.991 1.00 0.00 O ATOM 828 CB ARG A 56 -24.484 -18.260 -1.922 1.00 0.00 C ATOM 829 CG ARG A 56 -23.865 -17.053 -1.228 1.00 0.00 C ATOM 830 CD ARG A 56 -24.397 -15.732 -1.771 1.00 0.00 C ATOM 831 NE ARG A 56 -25.717 -15.409 -1.225 1.00 0.00 N ATOM 832 CZ ARG A 56 -26.111 -14.171 -0.919 1.00 0.00 C ATOM 833 NH1 ARG A 56 -25.350 -13.129 -1.231 1.00 0.00 N ATOM 834 NH2 ARG A 56 -27.281 -13.975 -0.328 1.00 0.00 N ATOM 0 H ARG A 56 -24.509 -20.373 -3.205 1.00 0.00 H new ATOM 0 HA ARG A 56 -23.037 -19.523 -0.948 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -24.200 -18.250 -2.974 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -25.570 -18.174 -1.884 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -24.066 -17.110 -0.158 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -22.782 -17.083 -1.351 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -23.698 -14.932 -1.528 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -24.457 -15.784 -2.858 1.00 0.00 H new ATOM 0 HE ARG A 56 -26.373 -16.174 -1.070 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -24.459 -13.272 -1.707 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -25.656 -12.185 -0.995 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -27.880 -14.770 -0.107 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -27.582 -13.029 -0.094 1.00 0.00 H new ATOM 848 N ASP A 57 -25.919 -20.819 -0.323 1.00 0.00 N ATOM 849 CA ASP A 57 -26.832 -21.251 0.731 1.00 0.00 C ATOM 850 C ASP A 57 -26.081 -22.053 1.794 1.00 0.00 C ATOM 851 O ASP A 57 -26.439 -22.039 2.971 1.00 0.00 O ATOM 852 CB ASP A 57 -27.964 -22.096 0.130 1.00 0.00 C ATOM 853 CG ASP A 57 -29.018 -22.490 1.155 1.00 0.00 C ATOM 854 OD1 ASP A 57 -29.840 -21.625 1.528 1.00 0.00 O ATOM 855 OD2 ASP A 57 -29.047 -23.670 1.569 1.00 0.00 O ATOM 0 H ASP A 57 -26.090 -21.257 -1.228 1.00 0.00 H new ATOM 0 HA ASP A 57 -27.262 -20.368 1.205 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -28.439 -21.537 -0.676 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -27.541 -22.997 -0.314 1.00 0.00 H new ATOM 860 N LEU A 58 -25.016 -22.728 1.365 1.00 0.00 N ATOM 861 CA LEU A 58 -24.214 -23.575 2.249 1.00 0.00 C ATOM 862 C LEU A 58 -23.182 -22.748 3.023 1.00 0.00 C ATOM 863 O LEU A 58 -22.432 -23.282 3.841 1.00 0.00 O ATOM 864 CB LEU A 58 -23.501 -24.677 1.439 1.00 0.00 C ATOM 865 CG LEU A 58 -24.420 -25.689 0.721 1.00 0.00 C ATOM 866 CD1 LEU A 58 -25.141 -25.050 -0.464 1.00 0.00 C ATOM 867 CD2 LEU A 58 -23.623 -26.915 0.272 1.00 0.00 C ATOM 0 H LEU A 58 -24.685 -22.704 0.400 1.00 0.00 H new ATOM 0 HA LEU A 58 -24.890 -24.040 2.967 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.866 -24.199 0.693 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -22.843 -25.227 2.112 1.00 0.00 H new ATOM 0 HG LEU A 58 -25.180 -26.010 1.434 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -25.779 -25.792 -0.945 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -25.753 -24.219 -0.113 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -24.407 -24.683 -1.181 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -24.288 -27.617 -0.232 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -22.835 -26.605 -0.414 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -23.178 -27.398 1.142 1.00 0.00 H new ATOM 879 N PHE A 59 -23.147 -21.444 2.758 1.00 0.00 N ATOM 880 CA PHE A 59 -22.195 -20.545 3.411 1.00 0.00 C ATOM 881 C PHE A 59 -22.818 -19.864 4.628 1.00 0.00 C ATOM 882 O PHE A 59 -23.899 -19.278 4.540 1.00 0.00 O ATOM 883 CB PHE A 59 -21.681 -19.490 2.414 1.00 0.00 C ATOM 884 CG PHE A 59 -20.435 -19.911 1.673 1.00 0.00 C ATOM 885 CD1 PHE A 59 -20.349 -21.161 1.073 1.00 0.00 C ATOM 886 CD2 PHE A 59 -19.346 -19.055 1.586 1.00 0.00 C ATOM 887 CE1 PHE A 59 -19.201 -21.546 0.404 1.00 0.00 C ATOM 888 CE2 PHE A 59 -18.199 -19.435 0.918 1.00 0.00 C ATOM 889 CZ PHE A 59 -18.125 -20.681 0.327 1.00 0.00 C ATOM 0 H PHE A 59 -23.769 -20.984 2.093 1.00 0.00 H new ATOM 0 HA PHE A 59 -21.353 -21.145 3.756 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -22.467 -19.273 1.691 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -21.478 -18.564 2.951 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -21.187 -21.839 1.129 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -19.396 -18.079 2.047 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -19.145 -22.521 -0.058 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -17.360 -18.758 0.858 1.00 0.00 H new ATOM 0 HZ PHE A 59 -17.228 -20.979 -0.195 1.00 0.00 H new ATOM 899 N ASP A 60 -22.123 -19.954 5.759 1.00 0.00 N ATOM 900 CA ASP A 60 -22.542 -19.299 6.997 1.00 0.00 C ATOM 901 C ASP A 60 -21.439 -18.368 7.490 1.00 0.00 C ATOM 902 O ASP A 60 -20.251 -18.668 7.338 1.00 0.00 O ATOM 903 CB ASP A 60 -22.865 -20.338 8.083 1.00 0.00 C ATOM 904 CG ASP A 60 -24.088 -21.181 7.758 1.00 0.00 C ATOM 905 OD1 ASP A 60 -23.964 -22.150 6.981 1.00 0.00 O ATOM 906 OD2 ASP A 60 -25.180 -20.889 8.293 1.00 0.00 O ATOM 0 H ASP A 60 -21.255 -20.482 5.844 1.00 0.00 H new ATOM 0 HA ASP A 60 -23.443 -18.721 6.791 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -22.005 -20.994 8.217 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -23.026 -19.825 9.031 1.00 0.00 H new ATOM 911 N HIS A 61 -21.835 -17.247 8.088 1.00 0.00 N ATOM 912 CA HIS A 61 -20.885 -16.251 8.585 1.00 0.00 C ATOM 913 C HIS A 61 -19.973 -16.849 9.658 1.00 0.00 C ATOM 914 O HIS A 61 -18.750 -16.699 9.600 1.00 0.00 O ATOM 915 CB HIS A 61 -21.627 -15.031 9.159 1.00 0.00 C ATOM 916 CG HIS A 61 -22.249 -14.138 8.124 1.00 0.00 C ATOM 917 ND1 HIS A 61 -23.593 -14.149 7.820 1.00 0.00 N ATOM 918 CD2 HIS A 61 -21.700 -13.179 7.338 1.00 0.00 C ATOM 919 CE1 HIS A 61 -23.841 -13.240 6.897 1.00 0.00 C ATOM 920 NE2 HIS A 61 -22.710 -12.638 6.587 1.00 0.00 N ATOM 0 H HIS A 61 -22.814 -17.003 8.242 1.00 0.00 H new ATOM 0 HA HIS A 61 -20.271 -15.931 7.743 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -22.407 -15.381 9.835 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -20.928 -14.444 9.755 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -20.659 -12.894 7.309 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -24.808 -13.025 6.467 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -22.604 -11.891 5.900 1.00 0.00 H new ATOM 929 N ASP A 62 -20.579 -17.537 10.623 1.00 0.00 N ATOM 930 CA ASP A 62 -19.845 -18.108 11.757 1.00 0.00 C ATOM 931 C ASP A 62 -18.816 -19.130 11.294 1.00 0.00 C ATOM 932 O ASP A 62 -17.668 -19.106 11.738 1.00 0.00 O ATOM 933 CB ASP A 62 -20.806 -18.767 12.757 1.00 0.00 C ATOM 934 CG ASP A 62 -21.669 -17.757 13.494 1.00 0.00 C ATOM 935 OD1 ASP A 62 -21.234 -17.250 14.549 1.00 0.00 O ATOM 936 OD2 ASP A 62 -22.788 -17.462 13.023 1.00 0.00 O ATOM 0 H ASP A 62 -21.583 -17.715 10.645 1.00 0.00 H new ATOM 0 HA ASP A 62 -19.325 -17.286 12.249 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -21.449 -19.470 12.227 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -20.231 -19.344 13.481 1.00 0.00 H new ATOM 941 N VAL A 63 -19.231 -20.022 10.401 1.00 0.00 N ATOM 942 CA VAL A 63 -18.351 -21.077 9.905 1.00 0.00 C ATOM 943 C VAL A 63 -17.123 -20.478 9.224 1.00 0.00 C ATOM 944 O VAL A 63 -15.986 -20.825 9.550 1.00 0.00 O ATOM 945 CB VAL A 63 -19.083 -22.013 8.913 1.00 0.00 C ATOM 946 CG1 VAL A 63 -18.148 -23.118 8.423 1.00 0.00 C ATOM 947 CG2 VAL A 63 -20.338 -22.605 9.552 1.00 0.00 C ATOM 0 H VAL A 63 -20.171 -20.037 10.005 1.00 0.00 H new ATOM 0 HA VAL A 63 -18.038 -21.666 10.768 1.00 0.00 H new ATOM 0 HB VAL A 63 -19.391 -21.422 8.050 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -18.682 -23.765 7.727 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -17.291 -22.672 7.919 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -17.803 -23.707 9.273 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -20.836 -23.259 8.837 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -20.060 -23.179 10.436 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -21.014 -21.800 9.839 1.00 0.00 H new ATOM 957 N ASN A 64 -17.363 -19.559 8.291 1.00 0.00 N ATOM 958 CA ASN A 64 -16.278 -18.892 7.570 1.00 0.00 C ATOM 959 C ASN A 64 -15.362 -18.165 8.551 1.00 0.00 C ATOM 960 O ASN A 64 -14.135 -18.174 8.404 1.00 0.00 O ATOM 961 CB ASN A 64 -16.837 -17.903 6.533 1.00 0.00 C ATOM 962 CG ASN A 64 -17.674 -18.581 5.458 1.00 0.00 C ATOM 963 OD1 ASN A 64 -17.462 -19.747 5.124 1.00 0.00 O ATOM 964 ND2 ASN A 64 -18.631 -17.852 4.902 1.00 0.00 N ATOM 0 H ASN A 64 -18.298 -19.259 8.016 1.00 0.00 H new ATOM 0 HA ASN A 64 -15.701 -19.651 7.042 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -17.445 -17.156 7.042 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -16.010 -17.373 6.061 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -19.220 -18.254 4.173 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -18.779 -16.889 5.203 1.00 0.00 H new ATOM 971 N ARG A 65 -15.967 -17.552 9.566 1.00 0.00 N ATOM 972 CA ARG A 65 -15.213 -16.856 10.602 1.00 0.00 C ATOM 973 C ARG A 65 -14.292 -17.831 11.334 1.00 0.00 C ATOM 974 O ARG A 65 -13.104 -17.562 11.505 1.00 0.00 O ATOM 975 CB ARG A 65 -16.163 -16.174 11.598 1.00 0.00 C ATOM 976 CG ARG A 65 -15.442 -15.379 12.682 1.00 0.00 C ATOM 977 CD ARG A 65 -16.414 -14.745 13.671 1.00 0.00 C ATOM 978 NE ARG A 65 -17.338 -13.811 13.022 1.00 0.00 N ATOM 979 CZ ARG A 65 -17.584 -12.574 13.455 1.00 0.00 C ATOM 980 NH1 ARG A 65 -16.990 -12.117 14.550 1.00 0.00 N ATOM 981 NH2 ARG A 65 -18.439 -11.804 12.797 1.00 0.00 N ATOM 0 H ARG A 65 -16.979 -17.524 9.692 1.00 0.00 H new ATOM 0 HA ARG A 65 -14.604 -16.088 10.125 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -16.830 -15.507 11.052 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -16.787 -16.933 12.070 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -14.757 -16.036 13.218 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -14.838 -14.599 12.218 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -16.984 -15.529 14.170 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -15.852 -14.219 14.443 1.00 0.00 H new ATOM 0 HE ARG A 65 -17.825 -14.128 12.184 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -16.342 -12.713 15.065 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -17.182 -11.170 14.877 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -18.906 -12.158 11.962 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -18.630 -10.857 13.125 1.00 0.00 H new ATOM 995 N ALA A 66 -14.844 -18.976 11.732 1.00 0.00 N ATOM 996 CA ALA A 66 -14.090 -19.990 12.468 1.00 0.00 C ATOM 997 C ALA A 66 -12.782 -20.325 11.753 1.00 0.00 C ATOM 998 O ALA A 66 -11.728 -20.440 12.382 1.00 0.00 O ATOM 999 CB ALA A 66 -14.934 -21.248 12.651 1.00 0.00 C ATOM 0 H ALA A 66 -15.817 -19.226 11.556 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.845 -19.586 13.450 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -14.360 -21.994 13.200 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -15.838 -21.002 13.209 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -15.208 -21.648 11.675 1.00 0.00 H new ATOM 1005 N TRP A 67 -12.860 -20.452 10.431 1.00 0.00 N ATOM 1006 CA TRP A 67 -11.691 -20.764 9.610 1.00 0.00 C ATOM 1007 C TRP A 67 -10.608 -19.692 9.757 1.00 0.00 C ATOM 1008 O TRP A 67 -9.439 -20.010 9.990 1.00 0.00 O ATOM 1009 CB TRP A 67 -12.097 -20.913 8.135 1.00 0.00 C ATOM 1010 CG TRP A 67 -12.860 -22.176 7.840 1.00 0.00 C ATOM 1011 CD1 TRP A 67 -13.801 -22.776 8.628 1.00 0.00 C ATOM 1012 CD2 TRP A 67 -12.748 -22.989 6.665 1.00 0.00 C ATOM 1013 NE1 TRP A 67 -14.270 -23.915 8.020 1.00 0.00 N ATOM 1014 CE2 TRP A 67 -13.643 -24.066 6.813 1.00 0.00 C ATOM 1015 CE3 TRP A 67 -11.976 -22.911 5.502 1.00 0.00 C ATOM 1016 CZ2 TRP A 67 -13.786 -25.055 5.843 1.00 0.00 C ATOM 1017 CZ3 TRP A 67 -12.120 -23.893 4.540 1.00 0.00 C ATOM 1018 CH2 TRP A 67 -13.019 -24.953 4.715 1.00 0.00 C ATOM 0 H TRP A 67 -13.725 -20.343 9.902 1.00 0.00 H new ATOM 0 HA TRP A 67 -11.278 -21.710 9.960 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -12.706 -20.056 7.847 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -11.200 -20.889 7.517 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -14.129 -22.408 9.589 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -14.972 -24.546 8.406 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -11.280 -22.098 5.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -14.478 -25.873 5.977 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -11.529 -23.842 3.637 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -13.108 -25.704 3.944 1.00 0.00 H new ATOM 1029 N MET A 68 -10.997 -18.423 9.632 1.00 0.00 N ATOM 1030 CA MET A 68 -10.033 -17.321 9.711 1.00 0.00 C ATOM 1031 C MET A 68 -9.535 -17.126 11.145 1.00 0.00 C ATOM 1032 O MET A 68 -8.495 -16.506 11.372 1.00 0.00 O ATOM 1033 CB MET A 68 -10.633 -16.007 9.183 1.00 0.00 C ATOM 1034 CG MET A 68 -11.682 -15.381 10.095 1.00 0.00 C ATOM 1035 SD MET A 68 -12.134 -13.708 9.591 1.00 0.00 S ATOM 1036 CE MET A 68 -10.538 -12.894 9.672 1.00 0.00 C ATOM 0 H MET A 68 -11.962 -18.132 9.477 1.00 0.00 H new ATOM 0 HA MET A 68 -9.187 -17.591 9.079 1.00 0.00 H new ATOM 0 HB2 MET A 68 -9.827 -15.289 9.031 1.00 0.00 H new ATOM 0 HB3 MET A 68 -11.082 -16.193 8.207 1.00 0.00 H new ATOM 0 HG2 MET A 68 -12.574 -16.008 10.100 1.00 0.00 H new ATOM 0 HG3 MET A 68 -11.302 -15.358 11.117 1.00 0.00 H new ATOM 0 HE1 MET A 68 -10.612 -12.010 10.306 1.00 0.00 H new ATOM 0 HE2 MET A 68 -9.801 -13.579 10.090 1.00 0.00 H new ATOM 0 HE3 MET A 68 -10.230 -12.597 8.670 1.00 0.00 H new ATOM 1046 N GLU A 69 -10.290 -17.640 12.113 1.00 0.00 N ATOM 1047 CA GLU A 69 -9.915 -17.528 13.520 1.00 0.00 C ATOM 1048 C GLU A 69 -8.837 -18.552 13.873 1.00 0.00 C ATOM 1049 O GLU A 69 -7.868 -18.232 14.569 1.00 0.00 O ATOM 1050 CB GLU A 69 -11.147 -17.705 14.422 1.00 0.00 C ATOM 1051 CG GLU A 69 -12.211 -16.625 14.231 1.00 0.00 C ATOM 1052 CD GLU A 69 -11.710 -15.229 14.569 1.00 0.00 C ATOM 1053 OE1 GLU A 69 -11.687 -14.874 15.767 1.00 0.00 O ATOM 1054 OE2 GLU A 69 -11.334 -14.478 13.642 1.00 0.00 O ATOM 0 H GLU A 69 -11.165 -18.138 11.949 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.507 -16.531 13.688 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.593 -18.680 14.225 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -10.826 -17.706 15.464 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.555 -16.641 13.197 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.073 -16.857 14.857 1.00 0.00 H new ATOM 1061 N GLU A 70 -9.001 -19.780 13.383 1.00 0.00 N ATOM 1062 CA GLU A 70 -8.027 -20.844 13.632 1.00 0.00 C ATOM 1063 C GLU A 70 -6.812 -20.700 12.714 1.00 0.00 C ATOM 1064 O GLU A 70 -5.724 -21.188 13.026 1.00 0.00 O ATOM 1065 CB GLU A 70 -8.667 -22.227 13.442 1.00 0.00 C ATOM 1066 CG GLU A 70 -9.266 -22.448 12.056 1.00 0.00 C ATOM 1067 CD GLU A 70 -9.737 -23.877 11.831 1.00 0.00 C ATOM 1068 OE1 GLU A 70 -10.493 -24.403 12.672 1.00 0.00 O ATOM 1069 OE2 GLU A 70 -9.356 -24.480 10.806 1.00 0.00 O ATOM 0 H GLU A 70 -9.797 -20.063 12.812 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.694 -20.752 14.666 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -7.914 -22.993 13.628 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -9.449 -22.360 14.190 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.107 -21.768 11.917 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.523 -22.193 11.301 1.00 0.00 H new ATOM 1076 N SER A 71 -7.001 -20.033 11.579 1.00 0.00 N ATOM 1077 CA SER A 71 -5.931 -19.861 10.603 1.00 0.00 C ATOM 1078 C SER A 71 -5.872 -18.414 10.109 1.00 0.00 C ATOM 1079 O SER A 71 -6.752 -17.962 9.375 1.00 0.00 O ATOM 1080 CB SER A 71 -6.151 -20.819 9.426 1.00 0.00 C ATOM 1081 OG SER A 71 -6.317 -22.153 9.884 1.00 0.00 O ATOM 0 H SER A 71 -7.887 -19.603 11.313 1.00 0.00 H new ATOM 0 HA SER A 71 -4.979 -20.091 11.081 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.031 -20.512 8.861 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.301 -20.767 8.745 1.00 0.00 H new ATOM 0 HG SER A 71 -6.442 -22.749 9.116 1.00 0.00 H new ATOM 1087 N ASP A 72 -4.837 -17.690 10.529 1.00 0.00 N ATOM 1088 CA ASP A 72 -4.627 -16.310 10.088 1.00 0.00 C ATOM 1089 C ASP A 72 -4.015 -16.316 8.692 1.00 0.00 C ATOM 1090 O ASP A 72 -2.906 -16.793 8.517 1.00 0.00 O ATOM 1091 CB ASP A 72 -3.687 -15.576 11.058 1.00 0.00 C ATOM 1092 CG ASP A 72 -3.654 -14.072 10.819 1.00 0.00 C ATOM 1093 OD1 ASP A 72 -2.883 -13.607 9.951 1.00 0.00 O ATOM 1094 OD2 ASP A 72 -4.397 -13.342 11.506 1.00 0.00 O ATOM 0 H ASP A 72 -4.128 -18.036 11.176 1.00 0.00 H new ATOM 0 HA ASP A 72 -5.586 -15.792 10.070 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -4.005 -15.770 12.082 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.679 -15.978 10.955 1.00 0.00 H new ATOM 1099 N PHE A 73 -4.734 -15.813 7.699 1.00 0.00 N ATOM 1100 CA PHE A 73 -4.251 -15.846 6.316 1.00 0.00 C ATOM 1101 C PHE A 73 -3.183 -14.776 6.077 1.00 0.00 C ATOM 1102 O PHE A 73 -3.455 -13.577 6.184 1.00 0.00 O ATOM 1103 CB PHE A 73 -5.424 -15.688 5.342 1.00 0.00 C ATOM 1104 CG PHE A 73 -6.356 -16.878 5.353 1.00 0.00 C ATOM 1105 CD1 PHE A 73 -7.303 -17.029 6.357 1.00 0.00 C ATOM 1106 CD2 PHE A 73 -6.270 -17.854 4.369 1.00 0.00 C ATOM 1107 CE1 PHE A 73 -8.142 -18.127 6.378 1.00 0.00 C ATOM 1108 CE2 PHE A 73 -7.110 -18.952 4.385 1.00 0.00 C ATOM 1109 CZ PHE A 73 -8.046 -19.089 5.392 1.00 0.00 C ATOM 0 H PHE A 73 -5.649 -15.379 7.818 1.00 0.00 H new ATOM 0 HA PHE A 73 -3.785 -16.815 6.137 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.985 -14.790 5.599 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.037 -15.544 4.333 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.385 -16.280 7.131 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -5.538 -17.754 3.581 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.873 -18.233 7.166 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.035 -19.702 3.611 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.702 -19.947 5.408 1.00 0.00 H new ATOM 1119 N LEU A 74 -1.963 -15.225 5.764 1.00 0.00 N ATOM 1120 CA LEU A 74 -0.818 -14.327 5.577 1.00 0.00 C ATOM 1121 C LEU A 74 -0.538 -14.048 4.098 1.00 0.00 C ATOM 1122 O LEU A 74 -0.293 -12.901 3.715 1.00 0.00 O ATOM 1123 CB LEU A 74 0.457 -14.905 6.233 1.00 0.00 C ATOM 1124 CG LEU A 74 0.626 -14.641 7.742 1.00 0.00 C ATOM 1125 CD1 LEU A 74 -0.475 -15.307 8.548 1.00 0.00 C ATOM 1126 CD2 LEU A 74 1.996 -15.113 8.222 1.00 0.00 C ATOM 0 H LEU A 74 -1.742 -16.212 5.634 1.00 0.00 H new ATOM 0 HA LEU A 74 -1.084 -13.387 6.061 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.467 -15.983 6.071 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.324 -14.496 5.715 1.00 0.00 H new ATOM 0 HG LEU A 74 0.553 -13.565 7.899 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.326 -15.101 9.608 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.443 -14.915 8.235 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.448 -16.384 8.381 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.095 -14.917 9.290 1.00 0.00 H new ATOM 0 HD22 LEU A 74 2.097 -16.183 8.038 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.776 -14.577 7.681 1.00 0.00 H new ATOM 1138 N GLU A 75 -0.567 -15.091 3.272 1.00 0.00 N ATOM 1139 CA GLU A 75 -0.123 -14.980 1.880 1.00 0.00 C ATOM 1140 C GLU A 75 -0.991 -15.818 0.947 1.00 0.00 C ATOM 1141 O GLU A 75 -1.419 -16.916 1.299 1.00 0.00 O ATOM 1142 CB GLU A 75 1.347 -15.428 1.764 1.00 0.00 C ATOM 1143 CG GLU A 75 1.852 -15.573 0.327 1.00 0.00 C ATOM 1144 CD GLU A 75 3.291 -16.062 0.251 1.00 0.00 C ATOM 1145 OE1 GLU A 75 3.523 -17.285 0.397 1.00 0.00 O ATOM 1146 OE2 GLU A 75 4.197 -15.227 0.049 1.00 0.00 O ATOM 0 H GLU A 75 -0.892 -16.021 3.539 1.00 0.00 H new ATOM 0 HA GLU A 75 -0.216 -13.936 1.580 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.976 -14.707 2.286 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.464 -16.383 2.276 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.208 -16.269 -0.210 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.773 -14.611 -0.179 1.00 0.00 H new ATOM 1153 N LEU A 76 -1.248 -15.283 -0.243 1.00 0.00 N ATOM 1154 CA LEU A 76 -1.898 -16.033 -1.310 1.00 0.00 C ATOM 1155 C LEU A 76 -0.895 -16.279 -2.432 1.00 0.00 C ATOM 1156 O LEU A 76 -0.179 -15.362 -2.841 1.00 0.00 O ATOM 1157 CB LEU A 76 -3.112 -15.273 -1.860 1.00 0.00 C ATOM 1158 CG LEU A 76 -3.870 -15.990 -2.990 1.00 0.00 C ATOM 1159 CD1 LEU A 76 -4.516 -17.276 -2.479 1.00 0.00 C ATOM 1160 CD2 LEU A 76 -4.912 -15.069 -3.617 1.00 0.00 C ATOM 0 H LEU A 76 -1.013 -14.323 -0.493 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.248 -16.983 -0.905 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.805 -15.084 -1.040 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.779 -14.302 -2.226 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.150 -16.258 -3.763 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -5.046 -17.766 -3.295 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.744 -17.943 -2.095 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.219 -17.038 -1.681 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.434 -15.599 -4.413 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.629 -14.759 -2.856 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.419 -14.189 -4.030 1.00 0.00 H new ATOM 1172 N ARG A 77 -0.855 -17.505 -2.931 1.00 0.00 N ATOM 1173 CA ARG A 77 0.085 -17.889 -3.972 1.00 0.00 C ATOM 1174 C ARG A 77 -0.679 -18.493 -5.143 1.00 0.00 C ATOM 1175 O ARG A 77 -1.066 -19.661 -5.110 1.00 0.00 O ATOM 1176 CB ARG A 77 1.105 -18.887 -3.404 1.00 0.00 C ATOM 1177 CG ARG A 77 2.138 -19.389 -4.410 1.00 0.00 C ATOM 1178 CD ARG A 77 3.151 -20.309 -3.738 1.00 0.00 C ATOM 1179 NE ARG A 77 4.095 -20.901 -4.687 1.00 0.00 N ATOM 1180 CZ ARG A 77 5.228 -21.505 -4.327 1.00 0.00 C ATOM 1181 NH1 ARG A 77 5.616 -21.494 -3.056 1.00 0.00 N ATOM 1182 NH2 ARG A 77 5.987 -22.086 -5.244 1.00 0.00 N ATOM 0 H ARG A 77 -1.471 -18.259 -2.627 1.00 0.00 H new ATOM 0 HA ARG A 77 0.627 -17.013 -4.327 1.00 0.00 H new ATOM 0 HB2 ARG A 77 1.628 -18.416 -2.572 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.567 -19.744 -2.999 1.00 0.00 H new ATOM 0 HG2 ARG A 77 1.636 -19.923 -5.217 1.00 0.00 H new ATOM 0 HG3 ARG A 77 2.654 -18.541 -4.861 1.00 0.00 H new ATOM 0 HD2 ARG A 77 3.704 -19.746 -2.986 1.00 0.00 H new ATOM 0 HD3 ARG A 77 2.621 -21.105 -3.215 1.00 0.00 H new ATOM 0 HE ARG A 77 3.873 -20.849 -5.681 1.00 0.00 H new ATOM 0 HH11 ARG A 77 5.047 -21.023 -2.353 1.00 0.00 H new ATOM 0 HH12 ARG A 77 6.483 -21.957 -2.783 1.00 0.00 H new ATOM 0 HH21 ARG A 77 5.705 -22.071 -6.224 1.00 0.00 H new ATOM 0 HH22 ARG A 77 6.854 -22.548 -4.970 1.00 0.00 H new ATOM 1196 N VAL A 78 -0.914 -17.679 -6.160 1.00 0.00 N ATOM 1197 CA VAL A 78 -1.676 -18.096 -7.329 1.00 0.00 C ATOM 1198 C VAL A 78 -0.789 -18.905 -8.271 1.00 0.00 C ATOM 1199 O VAL A 78 0.218 -18.401 -8.769 1.00 0.00 O ATOM 1200 CB VAL A 78 -2.252 -16.869 -8.076 1.00 0.00 C ATOM 1201 CG1 VAL A 78 -3.065 -17.299 -9.299 1.00 0.00 C ATOM 1202 CG2 VAL A 78 -3.092 -16.008 -7.133 1.00 0.00 C ATOM 0 H VAL A 78 -0.584 -16.715 -6.200 1.00 0.00 H new ATOM 0 HA VAL A 78 -2.505 -18.718 -6.992 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.416 -16.267 -8.431 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -3.457 -16.416 -9.804 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.425 -17.855 -9.984 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.893 -17.933 -8.981 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -3.487 -15.151 -7.678 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.918 -16.600 -6.739 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.470 -15.658 -6.309 1.00 0.00 H new ATOM 1212 N LEU A 79 -1.159 -20.159 -8.501 1.00 0.00 N ATOM 1213 CA LEU A 79 -0.356 -21.061 -9.322 1.00 0.00 C ATOM 1214 C LEU A 79 -0.754 -20.964 -10.794 1.00 0.00 C ATOM 1215 O LEU A 79 0.099 -20.790 -11.665 1.00 0.00 O ATOM 1216 CB LEU A 79 -0.508 -22.503 -8.818 1.00 0.00 C ATOM 1217 CG LEU A 79 -0.135 -22.719 -7.340 1.00 0.00 C ATOM 1218 CD1 LEU A 79 -0.326 -24.179 -6.941 1.00 0.00 C ATOM 1219 CD2 LEU A 79 1.299 -22.264 -7.069 1.00 0.00 C ATOM 0 H LEU A 79 -2.012 -20.577 -8.130 1.00 0.00 H new ATOM 0 HA LEU A 79 0.689 -20.764 -9.238 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.541 -22.816 -8.966 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.113 -23.154 -9.433 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.803 -22.111 -6.730 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.056 -24.308 -5.893 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.369 -24.462 -7.085 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.310 -24.812 -7.560 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.540 -22.426 -6.018 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.986 -22.837 -7.692 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.395 -21.204 -7.304 1.00 0.00 H new ATOM 1231 N GLY A 80 -2.051 -21.075 -11.068 1.00 0.00 N ATOM 1232 CA GLY A 80 -2.536 -20.996 -12.438 1.00 0.00 C ATOM 1233 C GLY A 80 -4.039 -20.815 -12.505 1.00 0.00 C ATOM 1234 O GLY A 80 -4.744 -21.126 -11.544 1.00 0.00 O ATOM 0 H GLY A 80 -2.777 -21.218 -10.366 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -2.049 -20.164 -12.946 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.257 -21.904 -12.973 1.00 0.00 H new ATOM 1238 N SER A 81 -4.533 -20.318 -13.636 1.00 0.00 N ATOM 1239 CA SER A 81 -5.960 -20.063 -13.817 1.00 0.00 C ATOM 1240 C SER A 81 -6.400 -20.430 -15.236 1.00 0.00 C ATOM 1241 O SER A 81 -5.580 -20.475 -16.157 1.00 0.00 O ATOM 1242 CB SER A 81 -6.258 -18.587 -13.532 1.00 0.00 C ATOM 1243 OG SER A 81 -5.475 -17.743 -14.359 1.00 0.00 O ATOM 0 H SER A 81 -3.961 -20.082 -14.447 1.00 0.00 H new ATOM 0 HA SER A 81 -6.520 -20.684 -13.118 1.00 0.00 H new ATOM 0 HB2 SER A 81 -7.316 -18.387 -13.700 1.00 0.00 H new ATOM 0 HB3 SER A 81 -6.054 -18.367 -12.484 1.00 0.00 H new ATOM 0 HG SER A 81 -5.321 -16.889 -13.903 1.00 0.00 H new ATOM 1249 N SER A 82 -7.692 -20.705 -15.404 1.00 0.00 N ATOM 1250 CA SER A 82 -8.251 -21.049 -16.708 1.00 0.00 C ATOM 1251 C SER A 82 -9.735 -20.666 -16.772 1.00 0.00 C ATOM 1252 O SER A 82 -10.540 -21.141 -15.965 1.00 0.00 O ATOM 1253 CB SER A 82 -8.082 -22.557 -16.967 1.00 0.00 C ATOM 1254 OG SER A 82 -6.725 -22.956 -16.815 1.00 0.00 O ATOM 0 H SER A 82 -8.375 -20.696 -14.647 1.00 0.00 H new ATOM 0 HA SER A 82 -7.716 -20.492 -17.478 1.00 0.00 H new ATOM 0 HB2 SER A 82 -8.709 -23.120 -16.276 1.00 0.00 H new ATOM 0 HB3 SER A 82 -8.424 -22.796 -17.974 1.00 0.00 H new ATOM 0 HG SER A 82 -6.646 -23.918 -16.984 1.00 0.00 H new ATOM 1260 N GLU A 83 -10.083 -19.782 -17.709 1.00 0.00 N ATOM 1261 CA GLU A 83 -11.480 -19.421 -17.960 1.00 0.00 C ATOM 1262 C GLU A 83 -11.983 -20.134 -19.212 1.00 0.00 C ATOM 1263 O GLU A 83 -11.474 -19.905 -20.312 1.00 0.00 O ATOM 1264 CB GLU A 83 -11.637 -17.898 -18.119 1.00 0.00 C ATOM 1265 CG GLU A 83 -13.045 -17.470 -18.535 1.00 0.00 C ATOM 1266 CD GLU A 83 -13.251 -15.959 -18.515 1.00 0.00 C ATOM 1267 OE1 GLU A 83 -13.584 -15.403 -17.447 1.00 0.00 O ATOM 1268 OE2 GLU A 83 -13.098 -15.320 -19.577 1.00 0.00 O ATOM 0 H GLU A 83 -9.413 -19.301 -18.309 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.075 -19.735 -17.103 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.382 -17.414 -17.176 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -10.923 -17.543 -18.862 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.248 -17.843 -19.539 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -13.770 -17.937 -17.868 1.00 0.00 H new ATOM 1275 N LYS A 84 -12.967 -21.013 -19.042 1.00 0.00 N ATOM 1276 CA LYS A 84 -13.510 -21.790 -20.153 1.00 0.00 C ATOM 1277 C LYS A 84 -14.970 -21.403 -20.406 1.00 0.00 C ATOM 1278 O LYS A 84 -15.895 -22.060 -19.916 1.00 0.00 O ATOM 1279 CB LYS A 84 -13.401 -23.301 -19.864 1.00 0.00 C ATOM 1280 CG LYS A 84 -12.082 -23.729 -19.217 1.00 0.00 C ATOM 1281 CD LYS A 84 -10.869 -23.377 -20.075 1.00 0.00 C ATOM 1282 CE LYS A 84 -10.827 -24.166 -21.379 1.00 0.00 C ATOM 1283 NZ LYS A 84 -9.623 -23.826 -22.184 1.00 0.00 N ATOM 0 H LYS A 84 -13.406 -21.206 -18.142 1.00 0.00 H new ATOM 0 HA LYS A 84 -12.927 -21.567 -21.047 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -14.223 -23.594 -19.211 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -13.527 -23.847 -20.799 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -11.986 -23.249 -18.243 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -12.099 -24.805 -19.042 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -10.884 -22.311 -20.300 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -9.958 -23.570 -19.508 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -10.830 -25.234 -21.160 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -11.725 -23.958 -21.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -9.626 -24.380 -23.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -9.634 -22.812 -22.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -8.766 -24.048 -21.638 1.00 0.00 H new ATOM 1297 N GLY A 85 -15.168 -20.309 -21.137 1.00 0.00 N ATOM 1298 CA GLY A 85 -16.510 -19.856 -21.476 1.00 0.00 C ATOM 1299 C GLY A 85 -17.262 -19.293 -20.280 1.00 0.00 C ATOM 1300 O GLY A 85 -17.422 -18.077 -20.152 1.00 0.00 O ATOM 0 H GLY A 85 -14.418 -19.723 -21.504 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.446 -19.092 -22.251 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -17.075 -20.689 -21.895 1.00 0.00 H new ATOM 1304 N SER A 86 -17.739 -20.176 -19.410 1.00 0.00 N ATOM 1305 CA SER A 86 -18.459 -19.767 -18.205 1.00 0.00 C ATOM 1306 C SER A 86 -18.008 -20.589 -16.997 1.00 0.00 C ATOM 1307 O SER A 86 -18.237 -20.204 -15.850 1.00 0.00 O ATOM 1308 CB SER A 86 -19.968 -19.909 -18.427 1.00 0.00 C ATOM 1309 OG SER A 86 -20.381 -19.135 -19.546 1.00 0.00 O ATOM 0 H SER A 86 -17.640 -21.186 -19.516 1.00 0.00 H new ATOM 0 HA SER A 86 -18.232 -18.721 -17.999 1.00 0.00 H new ATOM 0 HB2 SER A 86 -20.221 -20.957 -18.589 1.00 0.00 H new ATOM 0 HB3 SER A 86 -20.505 -19.585 -17.535 1.00 0.00 H new ATOM 0 HG SER A 86 -21.347 -19.237 -19.676 1.00 0.00 H new ATOM 1315 N ARG A 87 -17.369 -21.724 -17.263 1.00 0.00 N ATOM 1316 CA ARG A 87 -16.780 -22.544 -16.212 1.00 0.00 C ATOM 1317 C ARG A 87 -15.304 -22.190 -16.088 1.00 0.00 C ATOM 1318 O ARG A 87 -14.603 -22.092 -17.093 1.00 0.00 O ATOM 1319 CB ARG A 87 -16.944 -24.034 -16.547 1.00 0.00 C ATOM 1320 CG ARG A 87 -16.485 -24.988 -15.444 1.00 0.00 C ATOM 1321 CD ARG A 87 -17.335 -24.858 -14.183 1.00 0.00 C ATOM 1322 NE ARG A 87 -17.017 -25.901 -13.204 1.00 0.00 N ATOM 1323 CZ ARG A 87 -17.634 -26.056 -12.031 1.00 0.00 C ATOM 1324 NH1 ARG A 87 -18.610 -25.230 -11.664 1.00 0.00 N ATOM 1325 NH2 ARG A 87 -17.278 -27.055 -11.236 1.00 0.00 N ATOM 0 H ARG A 87 -17.246 -22.098 -18.204 1.00 0.00 H new ATOM 0 HA ARG A 87 -17.285 -22.351 -15.266 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -17.994 -24.230 -16.766 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -16.383 -24.253 -17.455 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -16.533 -26.014 -15.809 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -15.442 -24.785 -15.200 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -17.174 -23.877 -13.735 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -18.391 -24.918 -14.448 1.00 0.00 H new ATOM 0 HE ARG A 87 -16.270 -26.556 -13.436 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -18.893 -24.469 -12.281 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -19.075 -25.357 -10.765 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -16.539 -27.696 -11.523 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -17.743 -27.182 -10.337 1.00 0.00 H new ATOM 1339 N GLY A 88 -14.832 -21.985 -14.868 1.00 0.00 N ATOM 1340 CA GLY A 88 -13.448 -21.601 -14.669 1.00 0.00 C ATOM 1341 C GLY A 88 -12.819 -22.310 -13.499 1.00 0.00 C ATOM 1342 O GLY A 88 -13.517 -22.895 -12.667 1.00 0.00 O ATOM 0 H GLY A 88 -15.380 -22.077 -14.013 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.879 -21.821 -15.572 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.392 -20.524 -14.511 1.00 0.00 H new ATOM 1346 N THR A 89 -11.500 -22.271 -13.438 1.00 0.00 N ATOM 1347 CA THR A 89 -10.756 -22.897 -12.361 1.00 0.00 C ATOM 1348 C THR A 89 -9.447 -22.150 -12.124 1.00 0.00 C ATOM 1349 O THR A 89 -8.803 -21.698 -13.074 1.00 0.00 O ATOM 1350 CB THR A 89 -10.458 -24.382 -12.687 1.00 0.00 C ATOM 1351 OG1 THR A 89 -11.686 -25.091 -12.922 1.00 0.00 O ATOM 1352 CG2 THR A 89 -9.692 -25.058 -11.556 1.00 0.00 C ATOM 0 H THR A 89 -10.916 -21.805 -14.132 1.00 0.00 H new ATOM 0 HA THR A 89 -11.365 -22.855 -11.458 1.00 0.00 H new ATOM 0 HB THR A 89 -9.839 -24.407 -13.584 1.00 0.00 H new ATOM 0 HG1 THR A 89 -11.488 -26.028 -13.129 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.500 -26.098 -11.818 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.745 -24.542 -11.399 1.00 0.00 H new ATOM 0 HG23 THR A 89 -10.283 -25.017 -10.641 1.00 0.00 H new ATOM 1360 N VAL A 90 -9.075 -21.998 -10.860 1.00 0.00 N ATOM 1361 CA VAL A 90 -7.804 -21.385 -10.497 1.00 0.00 C ATOM 1362 C VAL A 90 -7.193 -22.132 -9.315 1.00 0.00 C ATOM 1363 O VAL A 90 -7.836 -22.320 -8.280 1.00 0.00 O ATOM 1364 CB VAL A 90 -7.952 -19.867 -10.178 1.00 0.00 C ATOM 1365 CG1 VAL A 90 -9.030 -19.616 -9.128 1.00 0.00 C ATOM 1366 CG2 VAL A 90 -6.615 -19.267 -9.736 1.00 0.00 C ATOM 0 H VAL A 90 -9.640 -22.293 -10.064 1.00 0.00 H new ATOM 0 HA VAL A 90 -7.137 -21.460 -11.356 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.264 -19.370 -11.097 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -9.104 -18.546 -8.931 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.988 -19.985 -9.495 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.769 -20.137 -8.207 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.746 -18.207 -9.519 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.264 -19.780 -8.840 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.881 -19.387 -10.533 1.00 0.00 H new ATOM 1376 N GLU A 91 -5.964 -22.595 -9.502 1.00 0.00 N ATOM 1377 CA GLU A 91 -5.250 -23.346 -8.480 1.00 0.00 C ATOM 1378 C GLU A 91 -4.319 -22.412 -7.721 1.00 0.00 C ATOM 1379 O GLU A 91 -3.604 -21.609 -8.330 1.00 0.00 O ATOM 1380 CB GLU A 91 -4.454 -24.490 -9.124 1.00 0.00 C ATOM 1381 CG GLU A 91 -3.799 -25.428 -8.116 1.00 0.00 C ATOM 1382 CD GLU A 91 -3.063 -26.583 -8.778 1.00 0.00 C ATOM 1383 OE1 GLU A 91 -3.728 -27.454 -9.371 1.00 0.00 O ATOM 1384 OE2 GLU A 91 -1.819 -26.634 -8.691 1.00 0.00 O ATOM 0 H GLU A 91 -5.436 -22.461 -10.364 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.967 -23.777 -7.782 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.120 -25.068 -9.764 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.682 -24.066 -9.767 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.099 -24.862 -7.501 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.562 -25.825 -7.447 1.00 0.00 H new ATOM 1391 N PHE A 92 -4.332 -22.510 -6.399 1.00 0.00 N ATOM 1392 CA PHE A 92 -3.537 -21.628 -5.558 1.00 0.00 C ATOM 1393 C PHE A 92 -3.104 -22.330 -4.276 1.00 0.00 C ATOM 1394 O PHE A 92 -3.567 -23.431 -3.958 1.00 0.00 O ATOM 1395 CB PHE A 92 -4.334 -20.356 -5.222 1.00 0.00 C ATOM 1396 CG PHE A 92 -5.668 -20.624 -4.564 1.00 0.00 C ATOM 1397 CD1 PHE A 92 -5.776 -20.707 -3.181 1.00 0.00 C ATOM 1398 CD2 PHE A 92 -6.814 -20.788 -5.330 1.00 0.00 C ATOM 1399 CE1 PHE A 92 -6.997 -20.950 -2.581 1.00 0.00 C ATOM 1400 CE2 PHE A 92 -8.036 -21.031 -4.734 1.00 0.00 C ATOM 1401 CZ PHE A 92 -8.128 -21.111 -3.358 1.00 0.00 C ATOM 0 H PHE A 92 -4.887 -23.194 -5.885 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.639 -21.352 -6.112 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.735 -19.727 -4.563 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -4.499 -19.790 -6.139 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -4.896 -20.580 -2.568 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.749 -20.725 -6.406 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -7.067 -21.014 -1.505 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.919 -21.158 -5.343 1.00 0.00 H new ATOM 0 HZ PHE A 92 -9.083 -21.299 -2.890 1.00 0.00 H new ATOM 1411 N ILE A 93 -2.197 -21.682 -3.559 1.00 0.00 N ATOM 1412 CA ILE A 93 -1.754 -22.130 -2.250 1.00 0.00 C ATOM 1413 C ILE A 93 -1.959 -21.002 -1.246 1.00 0.00 C ATOM 1414 O ILE A 93 -1.357 -19.932 -1.372 1.00 0.00 O ATOM 1415 CB ILE A 93 -0.259 -22.556 -2.263 1.00 0.00 C ATOM 1416 CG1 ILE A 93 -0.067 -23.831 -3.104 1.00 0.00 C ATOM 1417 CG2 ILE A 93 0.258 -22.768 -0.839 1.00 0.00 C ATOM 1418 CD1 ILE A 93 1.383 -24.214 -3.322 1.00 0.00 C ATOM 0 H ILE A 93 -1.745 -20.823 -3.874 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.343 -23.003 -1.968 1.00 0.00 H new ATOM 0 HB ILE A 93 0.320 -21.753 -2.719 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.581 -24.658 -2.614 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.544 -23.689 -4.074 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.306 -23.066 -0.873 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.162 -21.840 -0.275 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.325 -23.550 -0.353 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.433 -25.122 -3.923 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.899 -23.406 -3.841 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.862 -24.390 -2.359 1.00 0.00 H new ATOM 1430 N ALA A 94 -2.836 -21.227 -0.280 1.00 0.00 N ATOM 1431 CA ALA A 94 -3.110 -20.239 0.752 1.00 0.00 C ATOM 1432 C ALA A 94 -2.205 -20.474 1.955 1.00 0.00 C ATOM 1433 O ALA A 94 -2.260 -21.534 2.581 1.00 0.00 O ATOM 1434 CB ALA A 94 -4.578 -20.298 1.162 1.00 0.00 C ATOM 0 H ALA A 94 -3.373 -22.090 -0.189 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.905 -19.245 0.354 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.770 -19.554 1.935 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.206 -20.092 0.296 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.808 -21.291 1.549 1.00 0.00 H new ATOM 1440 N ARG A 95 -1.362 -19.495 2.263 1.00 0.00 N ATOM 1441 CA ARG A 95 -0.492 -19.572 3.429 1.00 0.00 C ATOM 1442 C ARG A 95 -1.151 -18.873 4.606 1.00 0.00 C ATOM 1443 O ARG A 95 -1.535 -17.704 4.510 1.00 0.00 O ATOM 1444 CB ARG A 95 0.868 -18.912 3.168 1.00 0.00 C ATOM 1445 CG ARG A 95 1.795 -18.959 4.387 1.00 0.00 C ATOM 1446 CD ARG A 95 2.761 -17.781 4.434 1.00 0.00 C ATOM 1447 NE ARG A 95 3.627 -17.713 3.259 1.00 0.00 N ATOM 1448 CZ ARG A 95 4.944 -17.523 3.312 1.00 0.00 C ATOM 1449 NH1 ARG A 95 5.566 -17.410 4.481 1.00 0.00 N ATOM 1450 NH2 ARG A 95 5.635 -17.433 2.188 1.00 0.00 N ATOM 0 H ARG A 95 -1.263 -18.637 1.720 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.330 -20.627 3.648 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.353 -19.410 2.329 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.713 -17.874 2.875 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.194 -18.968 5.296 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.363 -19.889 4.372 1.00 0.00 H new ATOM 0 HD2 ARG A 95 2.193 -16.854 4.516 1.00 0.00 H new ATOM 0 HD3 ARG A 95 3.377 -17.857 5.330 1.00 0.00 H new ATOM 0 HE ARG A 95 3.196 -17.818 2.341 1.00 0.00 H new ATOM 0 HH11 ARG A 95 5.034 -17.469 5.349 1.00 0.00 H new ATOM 0 HH12 ARG A 95 6.575 -17.265 4.510 1.00 0.00 H new ATOM 0 HH21 ARG A 95 5.159 -17.509 1.289 1.00 0.00 H new ATOM 0 HH22 ARG A 95 6.644 -17.287 2.220 1.00 0.00 H new ATOM 1464 N PHE A 96 -1.266 -19.582 5.713 1.00 0.00 N ATOM 1465 CA PHE A 96 -1.858 -19.034 6.917 1.00 0.00 C ATOM 1466 C PHE A 96 -1.103 -19.512 8.148 1.00 0.00 C ATOM 1467 O PHE A 96 -0.492 -20.579 8.139 1.00 0.00 O ATOM 1468 CB PHE A 96 -3.344 -19.414 7.002 1.00 0.00 C ATOM 1469 CG PHE A 96 -3.639 -20.844 6.613 1.00 0.00 C ATOM 1470 CD1 PHE A 96 -3.269 -21.901 7.435 1.00 0.00 C ATOM 1471 CD2 PHE A 96 -4.287 -21.128 5.419 1.00 0.00 C ATOM 1472 CE1 PHE A 96 -3.539 -23.207 7.072 1.00 0.00 C ATOM 1473 CE2 PHE A 96 -4.559 -22.431 5.055 1.00 0.00 C ATOM 1474 CZ PHE A 96 -4.185 -23.471 5.881 1.00 0.00 C ATOM 0 H PHE A 96 -0.953 -20.549 5.802 1.00 0.00 H new ATOM 0 HA PHE A 96 -1.786 -17.947 6.878 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -3.693 -19.247 8.021 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -3.916 -18.748 6.356 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -2.765 -21.700 8.369 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.582 -20.319 4.767 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -3.245 -24.020 7.719 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -5.065 -22.637 4.123 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.398 -24.491 5.596 1.00 0.00 H new ATOM 1484 N ARG A 97 -1.144 -18.716 9.201 1.00 0.00 N ATOM 1485 CA ARG A 97 -0.495 -19.062 10.450 1.00 0.00 C ATOM 1486 C ARG A 97 -1.473 -19.846 11.315 1.00 0.00 C ATOM 1487 O ARG A 97 -2.492 -19.310 11.758 1.00 0.00 O ATOM 1488 CB ARG A 97 -0.029 -17.792 11.169 1.00 0.00 C ATOM 1489 CG ARG A 97 0.777 -18.058 12.435 1.00 0.00 C ATOM 1490 CD ARG A 97 1.326 -16.767 13.041 1.00 0.00 C ATOM 1491 NE ARG A 97 0.338 -15.680 13.047 1.00 0.00 N ATOM 1492 CZ ARG A 97 -0.739 -15.630 13.835 1.00 0.00 C ATOM 1493 NH1 ARG A 97 -1.020 -16.632 14.660 1.00 0.00 N ATOM 1494 NH2 ARG A 97 -1.537 -14.573 13.782 1.00 0.00 N ATOM 0 H ARG A 97 -1.625 -17.817 9.214 1.00 0.00 H new ATOM 0 HA ARG A 97 0.382 -19.679 10.254 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.576 -17.199 10.483 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.901 -17.191 11.425 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.147 -18.564 13.167 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.603 -18.731 12.205 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.654 -16.960 14.062 1.00 0.00 H new ATOM 0 HD3 ARG A 97 2.205 -16.451 12.479 1.00 0.00 H new ATOM 0 HE ARG A 97 0.486 -14.905 12.401 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -0.411 -17.449 14.696 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -1.845 -16.584 15.258 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -1.326 -13.806 13.143 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -2.362 -14.526 14.380 1.00 0.00 H new ATOM 1508 N ARG A 98 -1.170 -21.121 11.523 1.00 0.00 N ATOM 1509 CA ARG A 98 -2.062 -22.016 12.246 1.00 0.00 C ATOM 1510 C ARG A 98 -2.043 -21.683 13.738 1.00 0.00 C ATOM 1511 O ARG A 98 -1.020 -21.851 14.408 1.00 0.00 O ATOM 1512 CB ARG A 98 -1.646 -23.477 12.009 1.00 0.00 C ATOM 1513 CG ARG A 98 -2.685 -24.505 12.456 1.00 0.00 C ATOM 1514 CD ARG A 98 -3.983 -24.389 11.658 1.00 0.00 C ATOM 1515 NE ARG A 98 -4.956 -25.417 12.036 1.00 0.00 N ATOM 1516 CZ ARG A 98 -6.211 -25.474 11.580 1.00 0.00 C ATOM 1517 NH1 ARG A 98 -6.654 -24.576 10.708 1.00 0.00 N ATOM 1518 NH2 ARG A 98 -7.024 -26.439 11.990 1.00 0.00 N ATOM 0 H ARG A 98 -0.308 -21.560 11.199 1.00 0.00 H new ATOM 0 HA ARG A 98 -3.079 -21.882 11.877 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -1.445 -23.618 10.947 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -0.712 -23.667 12.538 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -2.276 -25.509 12.339 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -2.898 -24.369 13.516 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -4.419 -23.402 11.816 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -3.763 -24.473 10.594 1.00 0.00 H new ATOM 0 HE ARG A 98 -4.655 -26.138 12.692 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -6.035 -23.835 10.380 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.613 -24.628 10.366 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -6.691 -27.138 12.654 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -7.982 -26.482 11.641 1.00 0.00 H new ATOM 1553 N PRO A 102 3.302 -21.917 13.708 1.00 0.00 N ATOM 1554 CA PRO A 102 3.872 -22.063 12.366 1.00 0.00 C ATOM 1555 C PRO A 102 2.928 -21.593 11.257 1.00 0.00 C ATOM 1556 O PRO A 102 1.713 -21.473 11.457 1.00 0.00 O ATOM 1557 CB PRO A 102 4.104 -23.573 12.274 1.00 0.00 C ATOM 1558 CG PRO A 102 2.994 -24.167 13.077 1.00 0.00 C ATOM 1559 CD PRO A 102 2.700 -23.181 14.186 1.00 0.00 C ATOM 0 HA PRO A 102 4.767 -21.456 12.229 1.00 0.00 H new ATOM 0 HB2 PRO A 102 4.075 -23.917 11.240 1.00 0.00 H new ATOM 0 HB3 PRO A 102 5.078 -23.851 12.676 1.00 0.00 H new ATOM 0 HG2 PRO A 102 2.112 -24.332 12.459 1.00 0.00 H new ATOM 0 HG3 PRO A 102 3.283 -25.136 13.484 1.00 0.00 H new ATOM 0 HD2 PRO A 102 1.628 -23.075 14.352 1.00 0.00 H new ATOM 0 HD3 PRO A 102 3.139 -23.500 15.131 1.00 0.00 H new ATOM 1567 N GLU A 103 3.503 -21.326 10.089 1.00 0.00 N ATOM 1568 CA GLU A 103 2.735 -20.966 8.904 1.00 0.00 C ATOM 1569 C GLU A 103 2.467 -22.217 8.075 1.00 0.00 C ATOM 1570 O GLU A 103 3.391 -22.803 7.509 1.00 0.00 O ATOM 1571 CB GLU A 103 3.496 -19.942 8.053 1.00 0.00 C ATOM 1572 CG GLU A 103 3.827 -18.646 8.776 1.00 0.00 C ATOM 1573 CD GLU A 103 4.819 -17.790 7.999 1.00 0.00 C ATOM 1574 OE1 GLU A 103 4.399 -17.047 7.088 1.00 0.00 O ATOM 1575 OE2 GLU A 103 6.032 -17.870 8.286 1.00 0.00 O ATOM 0 H GLU A 103 4.511 -21.353 9.938 1.00 0.00 H new ATOM 0 HA GLU A 103 1.792 -20.521 9.222 1.00 0.00 H new ATOM 0 HB2 GLU A 103 4.423 -20.396 7.703 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.902 -19.709 7.169 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.911 -18.079 8.939 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.239 -18.875 9.759 1.00 0.00 H new ATOM 1582 N GLN A 104 1.210 -22.624 8.020 1.00 0.00 N ATOM 1583 CA GLN A 104 0.807 -23.803 7.260 1.00 0.00 C ATOM 1584 C GLN A 104 0.186 -23.369 5.935 1.00 0.00 C ATOM 1585 O GLN A 104 -0.449 -22.316 5.855 1.00 0.00 O ATOM 1586 CB GLN A 104 -0.186 -24.649 8.071 1.00 0.00 C ATOM 1587 CG GLN A 104 -0.620 -25.935 7.373 1.00 0.00 C ATOM 1588 CD GLN A 104 -1.555 -26.778 8.223 1.00 0.00 C ATOM 1589 OE1 GLN A 104 -1.116 -27.641 8.986 1.00 0.00 O ATOM 1590 NE2 GLN A 104 -2.848 -26.535 8.101 1.00 0.00 N ATOM 0 H GLN A 104 0.442 -22.152 8.497 1.00 0.00 H new ATOM 0 HA GLN A 104 1.686 -24.415 7.056 1.00 0.00 H new ATOM 0 HB2 GLN A 104 0.267 -24.903 9.029 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -1.070 -24.048 8.285 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -1.115 -25.685 6.435 1.00 0.00 H new ATOM 0 HG3 GLN A 104 0.263 -26.522 7.121 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -3.173 -25.812 7.459 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -3.521 -27.070 8.649 1.00 0.00 H new ATOM 1599 N SER A 105 0.376 -24.170 4.900 1.00 0.00 N ATOM 1600 CA SER A 105 -0.118 -23.838 3.572 1.00 0.00 C ATOM 1601 C SER A 105 -1.175 -24.841 3.107 1.00 0.00 C ATOM 1602 O SER A 105 -1.095 -26.034 3.410 1.00 0.00 O ATOM 1603 CB SER A 105 1.059 -23.782 2.592 1.00 0.00 C ATOM 1604 OG SER A 105 1.904 -24.912 2.745 1.00 0.00 O ATOM 0 H SER A 105 0.872 -25.060 4.954 1.00 0.00 H new ATOM 0 HA SER A 105 -0.598 -22.860 3.608 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.684 -23.740 1.570 1.00 0.00 H new ATOM 0 HB3 SER A 105 1.632 -22.870 2.759 1.00 0.00 H new ATOM 0 HG SER A 105 2.646 -24.854 2.108 1.00 0.00 H new ATOM 1610 N HIS A 106 -2.174 -24.338 2.385 1.00 0.00 N ATOM 1611 CA HIS A 106 -3.255 -25.163 1.851 1.00 0.00 C ATOM 1612 C HIS A 106 -3.269 -25.070 0.324 1.00 0.00 C ATOM 1613 O HIS A 106 -3.656 -24.045 -0.241 1.00 0.00 O ATOM 1614 CB HIS A 106 -4.601 -24.701 2.435 1.00 0.00 C ATOM 1615 CG HIS A 106 -5.788 -25.524 2.017 1.00 0.00 C ATOM 1616 ND1 HIS A 106 -6.370 -26.474 2.827 1.00 0.00 N ATOM 1617 CD2 HIS A 106 -6.523 -25.509 0.880 1.00 0.00 C ATOM 1618 CE1 HIS A 106 -7.407 -27.005 2.209 1.00 0.00 C ATOM 1619 NE2 HIS A 106 -7.525 -26.436 1.025 1.00 0.00 N ATOM 0 H HIS A 106 -2.257 -23.348 2.154 1.00 0.00 H new ATOM 0 HA HIS A 106 -3.093 -26.203 2.135 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.533 -24.715 3.523 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.773 -23.666 2.140 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -6.352 -24.882 0.017 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -8.051 -27.776 2.606 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -8.242 -26.649 0.332 1.00 0.00 H new ATOM 1628 N HIS A 107 -2.824 -26.137 -0.329 1.00 0.00 N ATOM 1629 CA HIS A 107 -2.775 -26.206 -1.789 1.00 0.00 C ATOM 1630 C HIS A 107 -4.100 -26.739 -2.329 1.00 0.00 C ATOM 1631 O HIS A 107 -4.386 -27.933 -2.233 1.00 0.00 O ATOM 1632 CB HIS A 107 -1.597 -27.097 -2.222 1.00 0.00 C ATOM 1633 CG HIS A 107 -1.522 -27.392 -3.695 1.00 0.00 C ATOM 1634 ND1 HIS A 107 -1.047 -28.587 -4.193 1.00 0.00 N ATOM 1635 CD2 HIS A 107 -1.826 -26.633 -4.777 1.00 0.00 C ATOM 1636 CE1 HIS A 107 -1.056 -28.549 -5.512 1.00 0.00 C ATOM 1637 NE2 HIS A 107 -1.526 -27.376 -5.892 1.00 0.00 N ATOM 0 H HIS A 107 -2.487 -26.980 0.136 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.621 -25.208 -2.200 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -0.668 -26.616 -1.917 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -1.660 -28.042 -1.682 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.229 -25.631 -4.764 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -0.733 -29.343 -6.169 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.647 -27.071 -6.858 1.00 0.00 H new ATOM 1646 N GLU A 108 -4.910 -25.847 -2.888 1.00 0.00 N ATOM 1647 CA GLU A 108 -6.240 -26.207 -3.374 1.00 0.00 C ATOM 1648 C GLU A 108 -6.479 -25.670 -4.781 1.00 0.00 C ATOM 1649 O GLU A 108 -5.974 -24.609 -5.155 1.00 0.00 O ATOM 1650 CB GLU A 108 -7.317 -25.691 -2.402 1.00 0.00 C ATOM 1651 CG GLU A 108 -8.745 -25.764 -2.942 1.00 0.00 C ATOM 1652 CD GLU A 108 -9.801 -25.436 -1.895 1.00 0.00 C ATOM 1653 OE1 GLU A 108 -9.688 -25.939 -0.753 1.00 0.00 O ATOM 1654 OE2 GLU A 108 -10.751 -24.691 -2.211 1.00 0.00 O ATOM 0 H GLU A 108 -4.669 -24.864 -3.017 1.00 0.00 H new ATOM 0 HA GLU A 108 -6.303 -27.294 -3.422 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -7.261 -26.267 -1.479 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -7.091 -24.656 -2.146 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -8.846 -25.073 -3.779 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.928 -26.765 -3.332 1.00 0.00 H new ATOM 1661 N ARG A 109 -7.230 -26.438 -5.560 1.00 0.00 N ATOM 1662 CA ARG A 109 -7.640 -26.040 -6.897 1.00 0.00 C ATOM 1663 C ARG A 109 -9.155 -25.876 -6.916 1.00 0.00 C ATOM 1664 O ARG A 109 -9.896 -26.864 -6.948 1.00 0.00 O ATOM 1665 CB ARG A 109 -7.180 -27.089 -7.920 1.00 0.00 C ATOM 1666 CG ARG A 109 -7.601 -26.791 -9.355 1.00 0.00 C ATOM 1667 CD ARG A 109 -6.918 -27.725 -10.348 1.00 0.00 C ATOM 1668 NE ARG A 109 -7.161 -29.138 -10.045 1.00 0.00 N ATOM 1669 CZ ARG A 109 -6.207 -30.074 -10.014 1.00 0.00 C ATOM 1670 NH1 ARG A 109 -4.931 -29.741 -10.173 1.00 0.00 N ATOM 1671 NH2 ARG A 109 -6.526 -31.337 -9.784 1.00 0.00 N ATOM 0 H ARG A 109 -7.572 -27.357 -5.280 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.178 -25.090 -7.167 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -6.093 -27.166 -7.881 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.579 -28.061 -7.631 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.683 -26.892 -9.445 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.355 -25.757 -9.599 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.276 -27.505 -11.354 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -5.845 -27.535 -10.343 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.119 -29.426 -9.845 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -4.673 -28.765 -10.320 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -4.209 -30.461 -10.148 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -7.500 -31.597 -9.630 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -5.798 -32.051 -9.760 1.00 0.00 H new ATOM 1685 N SER A 110 -9.608 -24.630 -6.858 1.00 0.00 N ATOM 1686 CA SER A 110 -11.026 -24.328 -6.716 1.00 0.00 C ATOM 1687 C SER A 110 -11.676 -24.055 -8.075 1.00 0.00 C ATOM 1688 O SER A 110 -11.075 -23.424 -8.954 1.00 0.00 O ATOM 1689 CB SER A 110 -11.195 -23.116 -5.792 1.00 0.00 C ATOM 1690 OG SER A 110 -10.372 -23.238 -4.643 1.00 0.00 O ATOM 0 H SER A 110 -9.008 -23.807 -6.908 1.00 0.00 H new ATOM 0 HA SER A 110 -11.525 -25.194 -6.281 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.940 -22.204 -6.332 1.00 0.00 H new ATOM 0 HB3 SER A 110 -12.238 -23.027 -5.489 1.00 0.00 H new ATOM 0 HG SER A 110 -9.731 -22.497 -4.619 1.00 0.00 H new ATOM 1696 N GLN A 111 -12.896 -24.557 -8.247 1.00 0.00 N ATOM 1697 CA GLN A 111 -13.686 -24.296 -9.444 1.00 0.00 C ATOM 1698 C GLN A 111 -14.626 -23.121 -9.195 1.00 0.00 C ATOM 1699 O GLN A 111 -15.207 -22.992 -8.111 1.00 0.00 O ATOM 1700 CB GLN A 111 -14.507 -25.528 -9.857 1.00 0.00 C ATOM 1701 CG GLN A 111 -13.686 -26.721 -10.348 1.00 0.00 C ATOM 1702 CD GLN A 111 -12.827 -27.350 -9.264 1.00 0.00 C ATOM 1703 OE1 GLN A 111 -11.573 -26.940 -9.183 1.00 0.00 O flip ATOM 1704 NE2 GLN A 111 -13.283 -28.218 -8.521 1.00 0.00 N flip ATOM 0 H GLN A 111 -13.362 -25.153 -7.563 1.00 0.00 H new ATOM 0 HA GLN A 111 -12.997 -24.058 -10.254 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -15.108 -25.847 -9.005 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -15.201 -25.235 -10.645 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -14.361 -27.476 -10.750 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -13.044 -26.398 -11.168 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -14.256 -28.509 -8.613 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -12.688 -28.647 -7.812 1.00 0.00 H new ATOM 1713 N PHE A 112 -14.774 -22.276 -10.203 1.00 0.00 N ATOM 1714 CA PHE A 112 -15.623 -21.094 -10.118 1.00 0.00 C ATOM 1715 C PHE A 112 -16.613 -21.078 -11.283 1.00 0.00 C ATOM 1716 O PHE A 112 -16.378 -21.708 -12.322 1.00 0.00 O ATOM 1717 CB PHE A 112 -14.768 -19.813 -10.134 1.00 0.00 C ATOM 1718 CG PHE A 112 -13.944 -19.594 -8.886 1.00 0.00 C ATOM 1719 CD1 PHE A 112 -12.791 -20.331 -8.655 1.00 0.00 C ATOM 1720 CD2 PHE A 112 -14.321 -18.642 -7.948 1.00 0.00 C ATOM 1721 CE1 PHE A 112 -12.036 -20.124 -7.515 1.00 0.00 C ATOM 1722 CE2 PHE A 112 -13.569 -18.434 -6.807 1.00 0.00 C ATOM 1723 CZ PHE A 112 -12.426 -19.176 -6.590 1.00 0.00 C ATOM 0 H PHE A 112 -14.310 -22.389 -11.104 1.00 0.00 H new ATOM 0 HA PHE A 112 -16.176 -21.129 -9.180 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -14.099 -19.848 -10.994 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -15.425 -18.955 -10.276 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -12.480 -21.075 -9.374 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -15.213 -18.056 -8.112 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -11.141 -20.704 -7.348 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -13.876 -17.691 -6.086 1.00 0.00 H new ATOM 0 HZ PHE A 112 -11.838 -19.016 -5.699 1.00 0.00 H new ATOM 1733 N ARG A 113 -17.711 -20.359 -11.099 1.00 0.00 N ATOM 1734 CA ARG A 113 -18.744 -20.213 -12.118 1.00 0.00 C ATOM 1735 C ARG A 113 -18.923 -18.741 -12.476 1.00 0.00 C ATOM 1736 O ARG A 113 -18.981 -17.882 -11.594 1.00 0.00 O ATOM 1737 CB ARG A 113 -20.065 -20.797 -11.608 1.00 0.00 C ATOM 1738 CG ARG A 113 -21.275 -20.466 -12.475 1.00 0.00 C ATOM 1739 CD ARG A 113 -22.547 -21.081 -11.905 1.00 0.00 C ATOM 1740 NE ARG A 113 -23.742 -20.639 -12.621 1.00 0.00 N ATOM 1741 CZ ARG A 113 -24.945 -20.518 -12.060 1.00 0.00 C ATOM 1742 NH1 ARG A 113 -25.114 -20.784 -10.763 1.00 0.00 N ATOM 1743 NH2 ARG A 113 -25.975 -20.114 -12.796 1.00 0.00 N ATOM 0 H ARG A 113 -17.913 -19.857 -10.234 1.00 0.00 H new ATOM 0 HA ARG A 113 -18.439 -20.756 -13.013 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -19.967 -21.880 -11.540 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -20.245 -20.429 -10.598 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.391 -19.384 -12.545 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -21.112 -20.835 -13.488 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -22.477 -22.168 -11.954 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -22.637 -20.815 -10.852 1.00 0.00 H new ATOM 0 HE ARG A 113 -23.650 -20.409 -13.610 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -24.320 -21.082 -10.196 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -26.037 -20.690 -10.339 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -25.842 -19.899 -13.784 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -26.898 -20.019 -12.373 1.00 0.00 H new ATOM 1757 N LYS A 114 -19.002 -18.457 -13.770 1.00 0.00 N ATOM 1758 CA LYS A 114 -19.160 -17.092 -14.252 1.00 0.00 C ATOM 1759 C LYS A 114 -20.640 -16.766 -14.440 1.00 0.00 C ATOM 1760 O LYS A 114 -21.277 -17.247 -15.382 1.00 0.00 O ATOM 1761 CB LYS A 114 -18.397 -16.908 -15.568 1.00 0.00 C ATOM 1762 CG LYS A 114 -18.134 -15.450 -15.914 1.00 0.00 C ATOM 1763 CD LYS A 114 -17.153 -15.308 -17.073 1.00 0.00 C ATOM 1764 CE LYS A 114 -16.665 -13.876 -17.205 1.00 0.00 C ATOM 1765 NZ LYS A 114 -15.698 -13.710 -18.325 1.00 0.00 N ATOM 0 H LYS A 114 -18.959 -19.159 -14.508 1.00 0.00 H new ATOM 0 HA LYS A 114 -18.748 -16.406 -13.512 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -17.446 -17.436 -15.505 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -18.965 -17.369 -16.376 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -19.074 -14.963 -16.173 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -17.739 -14.935 -15.039 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -16.303 -15.972 -16.917 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -17.634 -15.618 -18.001 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -17.518 -13.217 -17.364 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -16.193 -13.568 -16.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -15.701 -12.720 -18.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -14.744 -13.966 -18.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -15.973 -14.328 -19.115 1.00 0.00 H new ATOM 1779 N ALA A 115 -21.183 -15.954 -13.539 1.00 0.00 N ATOM 1780 CA ALA A 115 -22.588 -15.567 -13.586 1.00 0.00 C ATOM 1781 C ALA A 115 -22.715 -14.047 -13.638 1.00 0.00 C ATOM 1782 O ALA A 115 -22.124 -13.341 -12.817 1.00 0.00 O ATOM 1783 CB ALA A 115 -23.338 -16.130 -12.382 1.00 0.00 C ATOM 0 H ALA A 115 -20.665 -15.548 -12.760 1.00 0.00 H new ATOM 0 HA ALA A 115 -23.034 -15.982 -14.490 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -24.385 -15.831 -12.433 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -23.270 -17.218 -12.387 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -22.895 -15.743 -11.464 1.00 0.00 H new ATOM 1789 N ARG A 116 -23.460 -13.554 -14.627 1.00 0.00 N ATOM 1790 CA ARG A 116 -23.684 -12.117 -14.810 1.00 0.00 C ATOM 1791 C ARG A 116 -22.352 -11.391 -15.054 1.00 0.00 C ATOM 1792 O ARG A 116 -22.242 -10.175 -14.878 1.00 0.00 O ATOM 1793 CB ARG A 116 -24.417 -11.526 -13.587 1.00 0.00 C ATOM 1794 CG ARG A 116 -25.063 -10.164 -13.845 1.00 0.00 C ATOM 1795 CD ARG A 116 -26.181 -10.259 -14.878 1.00 0.00 C ATOM 1796 NE ARG A 116 -27.278 -11.121 -14.422 1.00 0.00 N ATOM 1797 CZ ARG A 116 -27.587 -12.304 -14.959 1.00 0.00 C ATOM 1798 NH1 ARG A 116 -26.885 -12.790 -15.978 1.00 0.00 N ATOM 1799 NH2 ARG A 116 -28.603 -12.999 -14.471 1.00 0.00 N ATOM 0 H ARG A 116 -23.925 -14.136 -15.323 1.00 0.00 H new ATOM 0 HA ARG A 116 -24.314 -11.972 -15.687 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -25.188 -12.227 -13.265 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -23.709 -11.430 -12.764 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -25.462 -9.767 -12.911 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -24.305 -9.461 -14.192 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -26.567 -9.261 -15.088 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -25.779 -10.648 -15.813 1.00 0.00 H new ATOM 0 HE ARG A 116 -27.844 -10.793 -13.640 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -26.102 -12.258 -16.357 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -27.130 -13.695 -16.380 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -29.145 -12.630 -13.689 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -28.844 -13.903 -14.877 1.00 0.00 H new ATOM 1813 N GLY A 117 -21.344 -12.152 -15.477 1.00 0.00 N ATOM 1814 CA GLY A 117 -20.025 -11.593 -15.722 1.00 0.00 C ATOM 1815 C GLY A 117 -19.119 -11.669 -14.505 1.00 0.00 C ATOM 1816 O GLY A 117 -17.904 -11.486 -14.614 1.00 0.00 O ATOM 0 H GLY A 117 -21.419 -13.153 -15.655 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -19.558 -12.125 -16.551 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -20.128 -10.552 -16.029 1.00 0.00 H new ATOM 1820 N ARG A 118 -19.703 -11.942 -13.340 1.00 0.00 N ATOM 1821 CA ARG A 118 -18.927 -12.076 -12.109 1.00 0.00 C ATOM 1822 C ARG A 118 -18.503 -13.523 -11.934 1.00 0.00 C ATOM 1823 O ARG A 118 -19.124 -14.428 -12.490 1.00 0.00 O ATOM 1824 CB ARG A 118 -19.718 -11.645 -10.861 1.00 0.00 C ATOM 1825 CG ARG A 118 -20.252 -10.217 -10.883 1.00 0.00 C ATOM 1826 CD ARG A 118 -21.518 -10.098 -11.719 1.00 0.00 C ATOM 1827 NE ARG A 118 -22.143 -8.783 -11.583 1.00 0.00 N ATOM 1828 CZ ARG A 118 -23.254 -8.553 -10.878 1.00 0.00 C ATOM 1829 NH1 ARG A 118 -23.837 -9.541 -10.202 1.00 0.00 N ATOM 1830 NH2 ARG A 118 -23.771 -7.334 -10.836 1.00 0.00 N ATOM 0 H ARG A 118 -20.708 -12.074 -13.223 1.00 0.00 H new ATOM 0 HA ARG A 118 -18.062 -11.419 -12.204 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -20.559 -12.327 -10.732 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -19.076 -11.761 -9.988 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -20.458 -9.891 -9.864 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -19.489 -9.550 -11.283 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -21.279 -10.279 -12.767 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -22.226 -10.869 -11.416 1.00 0.00 H new ATOM 0 HE ARG A 118 -21.704 -7.993 -12.055 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -23.435 -10.478 -10.221 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -24.685 -9.360 -9.665 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -23.321 -6.571 -11.342 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -24.619 -7.158 -10.298 1.00 0.00 H new ATOM 1844 N TRP A 119 -17.449 -13.736 -11.168 1.00 0.00 N ATOM 1845 CA TRP A 119 -17.003 -15.080 -10.845 1.00 0.00 C ATOM 1846 C TRP A 119 -17.375 -15.437 -9.416 1.00 0.00 C ATOM 1847 O TRP A 119 -17.089 -14.690 -8.480 1.00 0.00 O ATOM 1848 CB TRP A 119 -15.498 -15.214 -11.078 1.00 0.00 C ATOM 1849 CG TRP A 119 -15.173 -15.424 -12.520 1.00 0.00 C ATOM 1850 CD1 TRP A 119 -14.808 -14.486 -13.440 1.00 0.00 C ATOM 1851 CD2 TRP A 119 -15.230 -16.666 -13.214 1.00 0.00 C ATOM 1852 NE1 TRP A 119 -14.603 -15.085 -14.661 1.00 0.00 N ATOM 1853 CE2 TRP A 119 -14.864 -16.422 -14.542 1.00 0.00 C ATOM 1854 CE3 TRP A 119 -15.546 -17.966 -12.831 1.00 0.00 C ATOM 1855 CZ2 TRP A 119 -14.811 -17.430 -15.493 1.00 0.00 C ATOM 1856 CZ3 TRP A 119 -15.494 -18.968 -13.777 1.00 0.00 C ATOM 1857 CH2 TRP A 119 -15.128 -18.694 -15.096 1.00 0.00 C ATOM 0 H TRP A 119 -16.884 -12.993 -10.756 1.00 0.00 H new ATOM 0 HA TRP A 119 -17.508 -15.784 -11.506 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -14.994 -14.316 -10.720 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -15.114 -16.050 -10.494 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -14.697 -13.431 -13.240 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -14.306 -14.611 -15.514 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.827 -18.186 -11.812 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -14.528 -17.220 -16.514 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.740 -19.980 -13.493 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -15.096 -19.499 -15.815 1.00 0.00 H new ATOM 1868 N TYR A 120 -18.034 -16.576 -9.268 1.00 0.00 N ATOM 1869 CA TYR A 120 -18.506 -17.048 -7.978 1.00 0.00 C ATOM 1870 C TYR A 120 -17.904 -18.416 -7.670 1.00 0.00 C ATOM 1871 O TYR A 120 -17.767 -19.253 -8.560 1.00 0.00 O ATOM 1872 CB TYR A 120 -20.037 -17.132 -7.981 1.00 0.00 C ATOM 1873 CG TYR A 120 -20.734 -15.797 -8.185 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -21.012 -14.964 -7.107 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -21.115 -15.373 -9.454 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -21.647 -13.750 -7.287 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -21.751 -14.159 -9.639 1.00 0.00 C ATOM 1878 CZ TYR A 120 -22.015 -13.351 -8.553 1.00 0.00 C ATOM 1879 OH TYR A 120 -22.641 -12.134 -8.735 1.00 0.00 O ATOM 0 H TYR A 120 -18.257 -17.200 -10.043 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.193 -16.345 -7.206 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -20.351 -17.817 -8.769 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -20.368 -17.561 -7.035 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -20.727 -15.271 -6.112 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -20.911 -16.002 -10.308 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -21.854 -13.116 -6.438 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -22.040 -13.845 -10.631 1.00 0.00 H new ATOM 0 HH TYR A 120 -22.341 -11.505 -8.046 1.00 0.00 H new ATOM 1889 N PHE A 121 -17.530 -18.630 -6.415 1.00 0.00 N ATOM 1890 CA PHE A 121 -16.966 -19.907 -5.981 1.00 0.00 C ATOM 1891 C PHE A 121 -18.002 -21.025 -6.074 1.00 0.00 C ATOM 1892 O PHE A 121 -19.048 -20.957 -5.432 1.00 0.00 O ATOM 1893 CB PHE A 121 -16.446 -19.789 -4.541 1.00 0.00 C ATOM 1894 CG PHE A 121 -16.163 -21.117 -3.881 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -14.933 -21.739 -4.030 1.00 0.00 C ATOM 1896 CD2 PHE A 121 -17.140 -21.748 -3.119 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -14.683 -22.958 -3.431 1.00 0.00 C ATOM 1898 CE2 PHE A 121 -16.896 -22.966 -2.520 1.00 0.00 C ATOM 1899 CZ PHE A 121 -15.665 -23.573 -2.676 1.00 0.00 C ATOM 0 H PHE A 121 -17.607 -17.933 -5.674 1.00 0.00 H new ATOM 0 HA PHE A 121 -16.137 -20.156 -6.644 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -15.533 -19.194 -4.543 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -17.179 -19.247 -3.944 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -14.163 -21.266 -4.620 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -18.104 -21.277 -2.994 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -13.720 -23.431 -3.552 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -17.665 -23.444 -1.931 1.00 0.00 H new ATOM 0 HZ PHE A 121 -15.470 -24.527 -2.209 1.00 0.00 H new ATOM 1909 N SER A 122 -17.694 -22.058 -6.849 1.00 0.00 N ATOM 1910 CA SER A 122 -18.596 -23.193 -7.012 1.00 0.00 C ATOM 1911 C SER A 122 -18.197 -24.333 -6.078 1.00 0.00 C ATOM 1912 O SER A 122 -19.024 -24.861 -5.334 1.00 0.00 O ATOM 1913 CB SER A 122 -18.580 -23.677 -8.466 1.00 0.00 C ATOM 1914 OG SER A 122 -18.905 -22.627 -9.359 1.00 0.00 O ATOM 0 H SER A 122 -16.824 -22.134 -7.376 1.00 0.00 H new ATOM 0 HA SER A 122 -19.605 -22.870 -6.757 1.00 0.00 H new ATOM 0 HB2 SER A 122 -17.594 -24.073 -8.709 1.00 0.00 H new ATOM 0 HB3 SER A 122 -19.291 -24.495 -8.588 1.00 0.00 H new ATOM 0 HG SER A 122 -19.831 -22.344 -9.208 1.00 0.00 H new ATOM 1920 N GLU A 123 -16.919 -24.696 -6.111 1.00 0.00 N ATOM 1921 CA GLU A 123 -16.422 -25.833 -5.345 1.00 0.00 C ATOM 1922 C GLU A 123 -14.901 -25.818 -5.291 1.00 0.00 C ATOM 1923 O GLU A 123 -14.256 -25.018 -5.969 1.00 0.00 O ATOM 1924 CB GLU A 123 -16.919 -27.142 -5.970 1.00 0.00 C ATOM 1925 CG GLU A 123 -16.588 -27.269 -7.454 1.00 0.00 C ATOM 1926 CD GLU A 123 -17.415 -28.330 -8.158 1.00 0.00 C ATOM 1927 OE1 GLU A 123 -17.118 -29.532 -7.991 1.00 0.00 O ATOM 1928 OE2 GLU A 123 -18.362 -27.965 -8.887 1.00 0.00 O ATOM 0 H GLU A 123 -16.207 -24.217 -6.662 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.802 -25.760 -4.326 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.478 -27.982 -5.434 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -17.999 -27.212 -5.839 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -16.751 -26.307 -7.940 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.530 -27.507 -7.566 1.00 0.00 H new ATOM 1935 N GLY A 124 -14.340 -26.702 -4.481 1.00 0.00 N ATOM 1936 CA GLY A 124 -12.901 -26.792 -4.345 1.00 0.00 C ATOM 1937 C GLY A 124 -12.509 -27.826 -3.315 1.00 0.00 C ATOM 1938 O GLY A 124 -13.370 -28.346 -2.601 1.00 0.00 O ATOM 0 H GLY A 124 -14.862 -27.366 -3.909 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.458 -27.049 -5.307 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -12.499 -25.820 -4.058 1.00 0.00 H new ATOM 1942 N GLU A 125 -11.222 -28.137 -3.249 1.00 0.00 N ATOM 1943 CA GLU A 125 -10.701 -29.100 -2.281 1.00 0.00 C ATOM 1944 C GLU A 125 -9.178 -29.123 -2.319 1.00 0.00 C ATOM 1945 O GLU A 125 -8.571 -28.794 -3.344 1.00 0.00 O ATOM 1946 CB GLU A 125 -11.249 -30.502 -2.567 1.00 0.00 C ATOM 1947 CG GLU A 125 -10.906 -31.026 -3.958 1.00 0.00 C ATOM 1948 CD GLU A 125 -11.580 -32.350 -4.268 1.00 0.00 C ATOM 1949 OE1 GLU A 125 -11.093 -33.398 -3.792 1.00 0.00 O ATOM 1950 OE2 GLU A 125 -12.605 -32.347 -4.985 1.00 0.00 O ATOM 0 H GLU A 125 -10.511 -27.734 -3.859 1.00 0.00 H new ATOM 0 HA GLU A 125 -11.026 -28.792 -1.287 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -10.857 -31.194 -1.822 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -12.333 -30.489 -2.451 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -11.204 -30.288 -4.703 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -9.826 -31.145 -4.041 1.00 0.00 H new ATOM 1957 N ALA A 126 -8.569 -29.501 -1.198 1.00 0.00 N ATOM 1958 CA ALA A 126 -7.119 -29.623 -1.112 1.00 0.00 C ATOM 1959 C ALA A 126 -6.615 -30.630 -2.141 1.00 0.00 C ATOM 1960 O ALA A 126 -6.831 -31.837 -2.006 1.00 0.00 O ATOM 1961 CB ALA A 126 -6.699 -30.029 0.296 1.00 0.00 C ATOM 0 H ALA A 126 -9.061 -29.729 -0.334 1.00 0.00 H new ATOM 0 HA ALA A 126 -6.672 -28.653 -1.331 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -5.613 -30.115 0.341 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.033 -29.274 1.007 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.150 -30.989 0.548 1.00 0.00 H new