USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=30 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 -97:sc= -0.855 USER MOD Set 1.2: A 5 CYS SG : rot -92:sc= -6.15! USER MOD Set 1.3: A 7 SER OG : rot 180:sc= 0 USER MOD Set 1.4: A 14 CYS SG : rot -75:sc= -0.0947 USER MOD Set 1.5: A 15 CYS SG : rot -92:sc= -3.07! USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.758 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -29:sc= 0.154 USER MOD Single : A 24 SER OG : rot 130:sc= 0.792 USER MOD Single : A 27 SER OG : rot -142:sc= 0.578 USER MOD Single : A 32 MET CE :methyl -138:sc= -2.26 (180deg=-7.9!) USER MOD Single : A 34 SER OG : rot -93:sc= 0.919 USER MOD Single : A 36 TYR OH : rot 180:sc= -0.526 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 180:sc= -0.919 USER MOD Single : A 50 THR OG1 : rot -80:sc= 2.19 USER MOD Single : A 51 THR OG1 : rot -151:sc= 1.94 USER MOD Single : A 61 HIS : no HD1:sc= -0.339 K(o=-0.34,f=-1.6) USER MOD Single : A 64 ASN : amide:sc= -1.06 X(o=-1.1,f=-0.76) USER MOD Single : A 68 MET CE :methyl -166:sc= -1.3 (180deg=-1.57) USER MOD Single : A 71 SER OG : rot 86:sc= 0.193 USER MOD Single : A 81 SER OG : rot 140:sc= -0.0249 USER MOD Single : A 82 SER OG : rot 180:sc= 0 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 110:sc= -1.25 USER MOD Single : A 104 GLN :FLIP amide:sc= -0.206 F(o=-1.8,f=-0.21) USER MOD Single : A 105 SER OG : rot 37:sc= 0.413 USER MOD Single : A 106 HIS : no HE2:sc= 0.625 K(o=0.62,f=-2.9!) USER MOD Single : A 107 HIS : no HD1:sc= -0.474 K(o=-0.47,f=-3.1!) USER MOD Single : A 110 SER OG : rot 34:sc= -0.734 USER MOD Single : A 111 GLN : amide:sc= -2.57! C(o=-2.6!,f=-6.3!) USER MOD Single : A 114 LYS NZ :NH3+ 178:sc= 1.11 (180deg=1.1) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot -72:sc= -0.631 USER MOD ----------------------------------------------------------------- ATOM 34 N CYS A 3 -1.436 -4.962 -1.668 1.00 0.00 N ATOM 35 CA CYS A 3 -2.729 -5.533 -1.320 1.00 0.00 C ATOM 36 C CYS A 3 -2.554 -6.992 -0.929 1.00 0.00 C ATOM 37 O CYS A 3 -1.896 -7.743 -1.650 1.00 0.00 O ATOM 38 CB CYS A 3 -3.676 -5.450 -2.522 1.00 0.00 C ATOM 39 SG CYS A 3 -5.443 -5.578 -2.113 1.00 0.00 S ATOM 0 HA CYS A 3 -3.149 -4.973 -0.484 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -3.504 -4.505 -3.037 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -3.421 -6.245 -3.223 1.00 0.00 H new ATOM 0 HG CYS A 3 -5.842 -6.803 -2.290 1.00 0.00 H new ATOM 44 N VAL A 4 -3.128 -7.394 0.202 1.00 0.00 N ATOM 45 CA VAL A 4 -3.156 -8.806 0.575 1.00 0.00 C ATOM 46 C VAL A 4 -3.850 -9.617 -0.520 1.00 0.00 C ATOM 47 O VAL A 4 -5.064 -9.818 -0.507 1.00 0.00 O ATOM 48 CB VAL A 4 -3.842 -9.032 1.945 1.00 0.00 C ATOM 49 CG1 VAL A 4 -2.925 -8.570 3.075 1.00 0.00 C ATOM 50 CG2 VAL A 4 -5.185 -8.307 2.004 1.00 0.00 C ATOM 0 H VAL A 4 -3.576 -6.768 0.871 1.00 0.00 H new ATOM 0 HA VAL A 4 -2.126 -9.147 0.677 1.00 0.00 H new ATOM 0 HB VAL A 4 -4.032 -10.098 2.067 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -3.418 -8.734 4.033 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -1.995 -9.137 3.044 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -2.707 -7.509 2.956 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.649 -8.479 2.975 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -5.028 -7.238 1.862 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -5.838 -8.686 1.217 1.00 0.00 H new ATOM 60 N CYS A 5 -3.052 -10.028 -1.491 1.00 0.00 N ATOM 61 CA CYS A 5 -3.527 -10.703 -2.694 1.00 0.00 C ATOM 62 C CYS A 5 -2.350 -11.226 -3.510 1.00 0.00 C ATOM 63 O CYS A 5 -1.209 -10.808 -3.298 1.00 0.00 O ATOM 64 CB CYS A 5 -4.343 -9.745 -3.570 1.00 0.00 C ATOM 65 SG CYS A 5 -5.953 -9.268 -2.881 1.00 0.00 S ATOM 0 H CYS A 5 -2.040 -9.902 -1.468 1.00 0.00 H new ATOM 0 HA CYS A 5 -4.158 -11.534 -2.379 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -3.756 -8.843 -3.742 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -4.503 -10.211 -4.542 1.00 0.00 H new ATOM 0 HG CYS A 5 -6.867 -10.090 -3.305 1.00 0.00 H new ATOM 70 N GLY A 6 -2.632 -12.135 -4.445 1.00 0.00 N ATOM 71 CA GLY A 6 -1.637 -12.534 -5.429 1.00 0.00 C ATOM 72 C GLY A 6 -1.469 -11.461 -6.493 1.00 0.00 C ATOM 73 O GLY A 6 -1.705 -11.703 -7.679 1.00 0.00 O ATOM 0 H GLY A 6 -3.534 -12.602 -4.538 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -0.682 -12.715 -4.935 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -1.937 -13.472 -5.896 1.00 0.00 H new ATOM 77 N SER A 7 -1.091 -10.268 -6.041 1.00 0.00 N ATOM 78 CA SER A 7 -0.964 -9.085 -6.887 1.00 0.00 C ATOM 79 C SER A 7 -0.525 -7.896 -6.028 1.00 0.00 C ATOM 80 O SER A 7 -1.247 -7.477 -5.116 1.00 0.00 O ATOM 81 CB SER A 7 -2.292 -8.784 -7.607 1.00 0.00 C ATOM 82 OG SER A 7 -3.409 -9.007 -6.754 1.00 0.00 O ATOM 0 H SER A 7 -0.861 -10.094 -5.063 1.00 0.00 H new ATOM 0 HA SER A 7 -0.210 -9.269 -7.653 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.295 -7.749 -7.950 1.00 0.00 H new ATOM 0 HB3 SER A 7 -2.378 -9.413 -8.493 1.00 0.00 H new ATOM 0 HG SER A 7 -4.236 -8.806 -7.239 1.00 0.00 H new ATOM 88 N GLY A 8 0.657 -7.359 -6.325 1.00 0.00 N ATOM 89 CA GLY A 8 1.251 -6.313 -5.502 1.00 0.00 C ATOM 90 C GLY A 8 0.606 -4.946 -5.682 1.00 0.00 C ATOM 91 O GLY A 8 1.135 -3.941 -5.198 1.00 0.00 O ATOM 0 H GLY A 8 1.221 -7.633 -7.130 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.178 -6.603 -4.454 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.312 -6.237 -5.738 1.00 0.00 H new ATOM 95 N LYS A 9 -0.532 -4.899 -6.370 1.00 0.00 N ATOM 96 CA LYS A 9 -1.261 -3.646 -6.571 1.00 0.00 C ATOM 97 C LYS A 9 -1.885 -3.186 -5.253 1.00 0.00 C ATOM 98 O LYS A 9 -1.957 -3.962 -4.297 1.00 0.00 O ATOM 99 CB LYS A 9 -2.341 -3.818 -7.652 1.00 0.00 C ATOM 100 CG LYS A 9 -1.810 -4.454 -8.934 1.00 0.00 C ATOM 101 CD LYS A 9 -2.764 -4.292 -10.117 1.00 0.00 C ATOM 102 CE LYS A 9 -4.151 -4.855 -9.832 1.00 0.00 C ATOM 103 NZ LYS A 9 -5.057 -4.709 -11.002 1.00 0.00 N ATOM 0 H LYS A 9 -0.971 -5.714 -6.799 1.00 0.00 H new ATOM 0 HA LYS A 9 -0.561 -2.883 -6.910 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -3.148 -4.434 -7.256 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -2.769 -2.844 -7.887 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.849 -4.006 -9.185 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.631 -5.515 -8.760 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.850 -3.235 -10.368 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.344 -4.794 -10.989 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.068 -5.909 -9.566 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -4.582 -4.342 -8.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.991 -5.103 -10.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.156 -3.702 -11.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.658 -5.220 -11.816 1.00 0.00 H new ATOM 117 N THR A 10 -2.339 -1.937 -5.200 1.00 0.00 N ATOM 118 CA THR A 10 -2.884 -1.374 -3.965 1.00 0.00 C ATOM 119 C THR A 10 -4.265 -1.953 -3.648 1.00 0.00 C ATOM 120 O THR A 10 -4.816 -2.750 -4.421 1.00 0.00 O ATOM 121 CB THR A 10 -2.983 0.168 -4.036 1.00 0.00 C ATOM 122 OG1 THR A 10 -3.932 0.559 -5.037 1.00 0.00 O ATOM 123 CG2 THR A 10 -1.628 0.790 -4.350 1.00 0.00 C ATOM 0 H THR A 10 -2.341 -1.296 -5.994 1.00 0.00 H new ATOM 0 HA THR A 10 -2.192 -1.647 -3.168 1.00 0.00 H new ATOM 0 HB THR A 10 -3.314 0.527 -3.061 1.00 0.00 H new ATOM 0 HG1 THR A 10 -3.987 1.537 -5.071 1.00 0.00 H new ATOM 0 HG21 THR A 10 -1.727 1.875 -4.394 1.00 0.00 H new ATOM 0 HG22 THR A 10 -0.915 0.522 -3.570 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.271 0.419 -5.311 1.00 0.00 H new ATOM 131 N TYR A 11 -4.814 -1.567 -2.498 1.00 0.00 N ATOM 132 CA TYR A 11 -6.161 -1.968 -2.110 1.00 0.00 C ATOM 133 C TYR A 11 -7.178 -1.475 -3.136 1.00 0.00 C ATOM 134 O TYR A 11 -7.905 -2.275 -3.737 1.00 0.00 O ATOM 135 CB TYR A 11 -6.501 -1.422 -0.711 1.00 0.00 C ATOM 136 CG TYR A 11 -7.986 -1.454 -0.382 1.00 0.00 C ATOM 137 CD1 TYR A 11 -8.627 -2.646 -0.061 1.00 0.00 C ATOM 138 CD2 TYR A 11 -8.748 -0.287 -0.409 1.00 0.00 C ATOM 139 CE1 TYR A 11 -9.979 -2.673 0.224 1.00 0.00 C ATOM 140 CE2 TYR A 11 -10.101 -0.309 -0.127 1.00 0.00 C ATOM 141 CZ TYR A 11 -10.711 -1.504 0.188 1.00 0.00 C ATOM 142 OH TYR A 11 -12.060 -1.532 0.465 1.00 0.00 O ATOM 0 H TYR A 11 -4.342 -0.973 -1.816 1.00 0.00 H new ATOM 0 HA TYR A 11 -6.203 -3.057 -2.076 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -5.961 -2.003 0.036 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -6.144 -0.395 -0.636 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -8.059 -3.564 -0.034 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -8.273 0.651 -0.655 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -10.461 -3.606 0.474 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -10.676 0.605 -0.153 1.00 0.00 H new ATOM 0 HH TYR A 11 -12.427 -0.626 0.398 1.00 0.00 H new ATOM 152 N ASP A 12 -7.201 -0.159 -3.337 1.00 0.00 N ATOM 153 CA ASP A 12 -8.160 0.481 -4.238 1.00 0.00 C ATOM 154 C ASP A 12 -7.953 0.023 -5.673 1.00 0.00 C ATOM 155 O ASP A 12 -8.918 -0.237 -6.393 1.00 0.00 O ATOM 156 CB ASP A 12 -8.039 2.010 -4.165 1.00 0.00 C ATOM 157 CG ASP A 12 -8.447 2.569 -2.812 1.00 0.00 C ATOM 158 OD1 ASP A 12 -9.656 2.813 -2.605 1.00 0.00 O ATOM 159 OD2 ASP A 12 -7.565 2.772 -1.952 1.00 0.00 O ATOM 0 H ASP A 12 -6.560 0.492 -2.883 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.159 0.186 -3.916 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -7.010 2.299 -4.377 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -8.662 2.457 -4.940 1.00 0.00 H new ATOM 164 N ASP A 13 -6.692 -0.077 -6.078 1.00 0.00 N ATOM 165 CA ASP A 13 -6.350 -0.471 -7.444 1.00 0.00 C ATOM 166 C ASP A 13 -6.812 -1.896 -7.720 1.00 0.00 C ATOM 167 O ASP A 13 -7.427 -2.186 -8.746 1.00 0.00 O ATOM 168 CB ASP A 13 -4.836 -0.381 -7.663 1.00 0.00 C ATOM 169 CG ASP A 13 -4.459 -0.402 -9.134 1.00 0.00 C ATOM 170 OD1 ASP A 13 -4.493 0.669 -9.776 1.00 0.00 O ATOM 171 OD2 ASP A 13 -4.124 -1.485 -9.655 1.00 0.00 O ATOM 0 H ASP A 13 -5.887 0.109 -5.480 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.856 0.210 -8.128 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -4.460 0.535 -7.208 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -4.348 -1.213 -7.154 1.00 0.00 H new ATOM 176 N CYS A 14 -6.506 -2.785 -6.784 1.00 0.00 N ATOM 177 CA CYS A 14 -6.823 -4.201 -6.932 1.00 0.00 C ATOM 178 C CYS A 14 -8.259 -4.517 -6.488 1.00 0.00 C ATOM 179 O CYS A 14 -9.131 -4.747 -7.321 1.00 0.00 O ATOM 180 CB CYS A 14 -5.796 -5.048 -6.162 1.00 0.00 C ATOM 181 SG CYS A 14 -6.375 -6.710 -5.691 1.00 0.00 S ATOM 0 H CYS A 14 -6.036 -2.550 -5.910 1.00 0.00 H new ATOM 0 HA CYS A 14 -6.764 -4.455 -7.990 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -4.899 -5.151 -6.773 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -5.506 -4.510 -5.259 1.00 0.00 H new ATOM 0 HG CYS A 14 -7.202 -6.615 -4.692 1.00 0.00 H new ATOM 186 N CYS A 15 -8.505 -4.537 -5.179 1.00 0.00 N ATOM 187 CA CYS A 15 -9.814 -4.942 -4.648 1.00 0.00 C ATOM 188 C CYS A 15 -10.891 -3.880 -4.851 1.00 0.00 C ATOM 189 O CYS A 15 -12.072 -4.212 -4.889 1.00 0.00 O ATOM 190 CB CYS A 15 -9.717 -5.301 -3.162 1.00 0.00 C ATOM 191 SG CYS A 15 -8.944 -6.915 -2.848 1.00 0.00 S ATOM 0 H CYS A 15 -7.822 -4.280 -4.467 1.00 0.00 H new ATOM 0 HA CYS A 15 -10.111 -5.823 -5.217 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.146 -4.528 -2.647 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -10.718 -5.298 -2.731 1.00 0.00 H new ATOM 0 HG CYS A 15 -9.864 -7.831 -2.778 1.00 0.00 H new ATOM 196 N GLY A 16 -10.484 -2.620 -4.990 1.00 0.00 N ATOM 197 CA GLY A 16 -11.435 -1.513 -4.965 1.00 0.00 C ATOM 198 C GLY A 16 -12.640 -1.694 -5.884 1.00 0.00 C ATOM 199 O GLY A 16 -13.776 -1.654 -5.411 1.00 0.00 O ATOM 0 H GLY A 16 -9.511 -2.342 -5.120 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -11.790 -1.378 -3.943 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -10.915 -0.597 -5.245 1.00 0.00 H new ATOM 203 N PRO A 17 -12.437 -1.936 -7.197 1.00 0.00 N ATOM 204 CA PRO A 17 -13.550 -2.100 -8.148 1.00 0.00 C ATOM 205 C PRO A 17 -14.414 -3.326 -7.836 1.00 0.00 C ATOM 206 O PRO A 17 -15.619 -3.337 -8.108 1.00 0.00 O ATOM 207 CB PRO A 17 -12.847 -2.251 -9.509 1.00 0.00 C ATOM 208 CG PRO A 17 -11.455 -2.678 -9.183 1.00 0.00 C ATOM 209 CD PRO A 17 -11.123 -2.036 -7.864 1.00 0.00 C ATOM 0 HA PRO A 17 -14.243 -1.259 -8.111 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -13.350 -2.990 -10.133 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -12.852 -1.311 -10.061 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.385 -3.764 -9.117 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -10.758 -2.360 -9.958 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.423 -2.641 -7.287 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -10.663 -1.057 -7.997 1.00 0.00 H new ATOM 217 N LEU A 18 -13.793 -4.352 -7.260 1.00 0.00 N ATOM 218 CA LEU A 18 -14.497 -5.588 -6.921 1.00 0.00 C ATOM 219 C LEU A 18 -15.364 -5.393 -5.678 1.00 0.00 C ATOM 220 O LEU A 18 -16.549 -5.732 -5.677 1.00 0.00 O ATOM 221 CB LEU A 18 -13.506 -6.746 -6.704 1.00 0.00 C ATOM 222 CG LEU A 18 -12.830 -7.301 -7.975 1.00 0.00 C ATOM 223 CD1 LEU A 18 -13.870 -7.653 -9.032 1.00 0.00 C ATOM 224 CD2 LEU A 18 -11.799 -6.323 -8.532 1.00 0.00 C ATOM 0 H LEU A 18 -12.802 -4.353 -7.017 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.144 -5.844 -7.760 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.728 -6.409 -6.019 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -14.033 -7.562 -6.210 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.302 -8.213 -7.697 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -13.370 -8.042 -9.919 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -14.549 -8.409 -8.637 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.436 -6.760 -9.297 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.342 -6.746 -9.427 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -12.289 -5.383 -8.784 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.028 -6.141 -7.783 1.00 0.00 H new ATOM 236 N LEU A 19 -14.766 -4.834 -4.630 1.00 0.00 N ATOM 237 CA LEU A 19 -15.468 -4.577 -3.373 1.00 0.00 C ATOM 238 C LEU A 19 -16.506 -3.473 -3.554 1.00 0.00 C ATOM 239 O LEU A 19 -17.499 -3.415 -2.828 1.00 0.00 O ATOM 240 CB LEU A 19 -14.464 -4.208 -2.269 1.00 0.00 C ATOM 241 CG LEU A 19 -13.645 -5.386 -1.706 1.00 0.00 C ATOM 242 CD1 LEU A 19 -12.531 -4.887 -0.792 1.00 0.00 C ATOM 243 CD2 LEU A 19 -14.550 -6.360 -0.958 1.00 0.00 C ATOM 0 H LEU A 19 -13.787 -4.547 -4.626 1.00 0.00 H new ATOM 0 HA LEU A 19 -15.990 -5.485 -3.073 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -13.774 -3.462 -2.662 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -15.007 -3.739 -1.448 1.00 0.00 H new ATOM 0 HG LEU A 19 -13.188 -5.911 -2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -11.968 -5.737 -0.407 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -11.864 -4.234 -1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -12.964 -4.333 0.040 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.953 -7.185 -0.568 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -15.038 -5.842 -0.132 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -15.307 -6.750 -1.639 1.00 0.00 H new ATOM 255 N ALA A 20 -16.276 -2.604 -4.537 1.00 0.00 N ATOM 256 CA ALA A 20 -17.248 -1.574 -4.898 1.00 0.00 C ATOM 257 C ALA A 20 -18.450 -2.202 -5.604 1.00 0.00 C ATOM 258 O ALA A 20 -19.432 -1.523 -5.901 1.00 0.00 O ATOM 259 CB ALA A 20 -16.603 -0.513 -5.783 1.00 0.00 C ATOM 0 H ALA A 20 -15.424 -2.593 -5.098 1.00 0.00 H new ATOM 0 HA ALA A 20 -17.595 -1.092 -3.984 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -17.343 0.245 -6.041 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -15.777 -0.046 -5.247 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -16.228 -0.978 -6.694 1.00 0.00 H new ATOM 265 N ARG A 21 -18.340 -3.505 -5.895 1.00 0.00 N ATOM 266 CA ARG A 21 -19.430 -4.284 -6.491 1.00 0.00 C ATOM 267 C ARG A 21 -19.816 -3.733 -7.865 1.00 0.00 C ATOM 268 O ARG A 21 -20.849 -4.104 -8.423 1.00 0.00 O ATOM 269 CB ARG A 21 -20.655 -4.291 -5.554 1.00 0.00 C ATOM 270 CG ARG A 21 -20.350 -4.794 -4.142 1.00 0.00 C ATOM 271 CD ARG A 21 -19.975 -6.272 -4.124 1.00 0.00 C ATOM 272 NE ARG A 21 -21.141 -7.145 -4.303 1.00 0.00 N ATOM 273 CZ ARG A 21 -21.330 -7.959 -5.344 1.00 0.00 C ATOM 274 NH1 ARG A 21 -20.447 -8.005 -6.334 1.00 0.00 N ATOM 275 NH2 ARG A 21 -22.405 -8.732 -5.394 1.00 0.00 N ATOM 0 H ARG A 21 -17.493 -4.047 -5.724 1.00 0.00 H new ATOM 0 HA ARG A 21 -19.080 -5.308 -6.625 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -21.058 -3.280 -5.490 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -21.432 -4.917 -5.992 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -19.534 -4.209 -3.718 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -21.220 -4.634 -3.506 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -19.251 -6.470 -4.914 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -19.488 -6.509 -3.178 1.00 0.00 H new ATOM 0 HE ARG A 21 -21.859 -7.129 -3.579 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -19.615 -7.415 -6.303 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -20.600 -8.630 -7.125 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -23.088 -8.705 -4.637 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -22.549 -9.354 -6.189 1.00 0.00 H new ATOM 289 N THR A 22 -18.964 -2.874 -8.421 1.00 0.00 N ATOM 290 CA THR A 22 -19.287 -2.162 -9.652 1.00 0.00 C ATOM 291 C THR A 22 -18.526 -2.737 -10.852 1.00 0.00 C ATOM 292 O THR A 22 -18.760 -2.340 -11.996 1.00 0.00 O ATOM 293 CB THR A 22 -18.983 -0.648 -9.508 1.00 0.00 C ATOM 294 OG1 THR A 22 -19.630 0.088 -10.557 1.00 0.00 O ATOM 295 CG2 THR A 22 -17.479 -0.374 -9.537 1.00 0.00 C ATOM 0 H THR A 22 -18.045 -2.655 -8.037 1.00 0.00 H new ATOM 0 HA THR A 22 -20.354 -2.294 -9.832 1.00 0.00 H new ATOM 0 HB THR A 22 -19.369 -0.322 -8.542 1.00 0.00 H new ATOM 0 HG1 THR A 22 -19.710 -0.479 -11.353 1.00 0.00 H new ATOM 0 HG21 THR A 22 -17.302 0.697 -9.434 1.00 0.00 H new ATOM 0 HG22 THR A 22 -16.997 -0.902 -8.714 1.00 0.00 H new ATOM 0 HG23 THR A 22 -17.064 -0.721 -10.484 1.00 0.00 H new ATOM 303 N ARG A 23 -17.616 -3.672 -10.593 1.00 0.00 N ATOM 304 CA ARG A 23 -16.851 -4.308 -11.663 1.00 0.00 C ATOM 305 C ARG A 23 -16.883 -5.823 -11.526 1.00 0.00 C ATOM 306 O ARG A 23 -16.715 -6.364 -10.431 1.00 0.00 O ATOM 307 CB ARG A 23 -15.396 -3.819 -11.667 1.00 0.00 C ATOM 308 CG ARG A 23 -14.519 -4.521 -12.705 1.00 0.00 C ATOM 309 CD ARG A 23 -13.099 -3.974 -12.717 1.00 0.00 C ATOM 310 NE ARG A 23 -12.237 -4.683 -13.668 1.00 0.00 N ATOM 311 CZ ARG A 23 -11.073 -4.209 -14.117 1.00 0.00 C ATOM 312 NH1 ARG A 23 -10.669 -2.990 -13.772 1.00 0.00 N ATOM 313 NH2 ARG A 23 -10.329 -4.948 -14.932 1.00 0.00 N ATOM 0 H ARG A 23 -17.390 -4.005 -9.656 1.00 0.00 H new ATOM 0 HA ARG A 23 -17.316 -4.029 -12.609 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -15.382 -2.746 -11.858 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.967 -3.972 -10.677 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.494 -5.590 -12.494 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.962 -4.401 -13.694 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -13.122 -2.914 -12.972 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -12.674 -4.052 -11.716 1.00 0.00 H new ATOM 0 HE ARG A 23 -12.546 -5.594 -14.007 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.249 -2.414 -13.162 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -9.779 -2.631 -14.117 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -10.648 -5.875 -15.213 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.439 -4.588 -15.277 1.00 0.00 H new ATOM 327 N SER A 24 -17.106 -6.496 -12.647 1.00 0.00 N ATOM 328 CA SER A 24 -17.072 -7.948 -12.701 1.00 0.00 C ATOM 329 C SER A 24 -15.654 -8.415 -13.029 1.00 0.00 C ATOM 330 O SER A 24 -15.082 -8.007 -14.042 1.00 0.00 O ATOM 331 CB SER A 24 -18.065 -8.449 -13.756 1.00 0.00 C ATOM 332 OG SER A 24 -19.356 -7.902 -13.533 1.00 0.00 O ATOM 0 H SER A 24 -17.315 -6.051 -13.541 1.00 0.00 H new ATOM 0 HA SER A 24 -17.359 -8.358 -11.733 1.00 0.00 H new ATOM 0 HB2 SER A 24 -17.715 -8.174 -14.751 1.00 0.00 H new ATOM 0 HB3 SER A 24 -18.116 -9.537 -13.726 1.00 0.00 H new ATOM 0 HG SER A 24 -19.697 -7.518 -14.368 1.00 0.00 H new ATOM 338 N ALA A 25 -15.079 -9.241 -12.153 1.00 0.00 N ATOM 339 CA ALA A 25 -13.728 -9.768 -12.354 1.00 0.00 C ATOM 340 C ALA A 25 -13.619 -10.523 -13.680 1.00 0.00 C ATOM 341 O ALA A 25 -12.570 -10.515 -14.322 1.00 0.00 O ATOM 342 CB ALA A 25 -13.333 -10.667 -11.188 1.00 0.00 C ATOM 0 H ALA A 25 -15.529 -9.560 -11.295 1.00 0.00 H new ATOM 0 HA ALA A 25 -13.038 -8.925 -12.395 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -12.326 -11.052 -11.350 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.357 -10.093 -10.262 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.033 -11.500 -11.117 1.00 0.00 H new ATOM 348 N ALA A 26 -14.711 -11.191 -14.061 1.00 0.00 N ATOM 349 CA ALA A 26 -14.810 -11.887 -15.351 1.00 0.00 C ATOM 350 C ALA A 26 -13.778 -13.014 -15.491 1.00 0.00 C ATOM 351 O ALA A 26 -13.666 -13.635 -16.549 1.00 0.00 O ATOM 352 CB ALA A 26 -14.676 -10.893 -16.502 1.00 0.00 C ATOM 0 H ALA A 26 -15.551 -11.266 -13.487 1.00 0.00 H new ATOM 0 HA ALA A 26 -15.795 -12.352 -15.390 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -14.751 -11.423 -17.451 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -15.472 -10.151 -16.437 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -13.709 -10.394 -16.441 1.00 0.00 H new ATOM 358 N SER A 27 -13.060 -13.307 -14.414 1.00 0.00 N ATOM 359 CA SER A 27 -12.017 -14.324 -14.439 1.00 0.00 C ATOM 360 C SER A 27 -11.875 -14.962 -13.055 1.00 0.00 C ATOM 361 O SER A 27 -11.889 -14.256 -12.044 1.00 0.00 O ATOM 362 CB SER A 27 -10.688 -13.698 -14.889 1.00 0.00 C ATOM 363 OG SER A 27 -9.661 -14.671 -14.980 1.00 0.00 O ATOM 0 H SER A 27 -13.182 -12.853 -13.509 1.00 0.00 H new ATOM 0 HA SER A 27 -12.291 -15.103 -15.150 1.00 0.00 H new ATOM 0 HB2 SER A 27 -10.821 -13.216 -15.857 1.00 0.00 H new ATOM 0 HB3 SER A 27 -10.393 -12.921 -14.184 1.00 0.00 H new ATOM 0 HG SER A 27 -8.816 -14.285 -14.668 1.00 0.00 H new ATOM 369 N PRO A 28 -11.747 -16.307 -12.989 1.00 0.00 N ATOM 370 CA PRO A 28 -11.641 -17.028 -11.715 1.00 0.00 C ATOM 371 C PRO A 28 -10.452 -16.552 -10.878 1.00 0.00 C ATOM 372 O PRO A 28 -10.573 -16.361 -9.666 1.00 0.00 O ATOM 373 CB PRO A 28 -11.474 -18.506 -12.129 1.00 0.00 C ATOM 374 CG PRO A 28 -11.109 -18.481 -13.579 1.00 0.00 C ATOM 375 CD PRO A 28 -11.705 -17.221 -14.146 1.00 0.00 C ATOM 0 HA PRO A 28 -12.513 -16.862 -11.083 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -10.698 -18.993 -11.538 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.396 -19.065 -11.967 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -10.027 -18.490 -13.707 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -11.498 -19.360 -14.093 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -11.095 -16.817 -14.954 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -12.700 -17.397 -14.555 1.00 0.00 H new ATOM 383 N GLU A 29 -9.312 -16.332 -11.533 1.00 0.00 N ATOM 384 CA GLU A 29 -8.099 -15.908 -10.836 1.00 0.00 C ATOM 385 C GLU A 29 -8.212 -14.456 -10.363 1.00 0.00 C ATOM 386 O GLU A 29 -7.654 -14.083 -9.327 1.00 0.00 O ATOM 387 CB GLU A 29 -6.854 -16.136 -11.718 1.00 0.00 C ATOM 388 CG GLU A 29 -6.952 -15.589 -13.144 1.00 0.00 C ATOM 389 CD GLU A 29 -6.634 -14.105 -13.252 1.00 0.00 C ATOM 390 OE1 GLU A 29 -5.473 -13.725 -13.001 1.00 0.00 O ATOM 391 OE2 GLU A 29 -7.540 -13.315 -13.592 1.00 0.00 O ATOM 0 H GLU A 29 -9.204 -16.440 -12.541 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.983 -16.524 -9.944 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.994 -15.678 -11.229 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.658 -17.207 -11.770 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.269 -16.146 -13.785 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.959 -15.764 -13.523 1.00 0.00 H new ATOM 398 N ALA A 30 -8.960 -13.648 -11.109 1.00 0.00 N ATOM 399 CA ALA A 30 -9.213 -12.262 -10.724 1.00 0.00 C ATOM 400 C ALA A 30 -10.188 -12.198 -9.552 1.00 0.00 C ATOM 401 O ALA A 30 -10.058 -11.357 -8.657 1.00 0.00 O ATOM 402 CB ALA A 30 -9.752 -11.473 -11.912 1.00 0.00 C ATOM 0 H ALA A 30 -9.402 -13.929 -11.984 1.00 0.00 H new ATOM 0 HA ALA A 30 -8.271 -11.814 -10.408 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.936 -10.442 -11.611 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -9.022 -11.490 -12.721 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.684 -11.923 -12.255 1.00 0.00 H new ATOM 408 N LEU A 31 -11.151 -13.110 -9.559 1.00 0.00 N ATOM 409 CA LEU A 31 -12.203 -13.148 -8.550 1.00 0.00 C ATOM 410 C LEU A 31 -11.665 -13.712 -7.232 1.00 0.00 C ATOM 411 O LEU A 31 -12.012 -13.236 -6.149 1.00 0.00 O ATOM 412 CB LEU A 31 -13.380 -13.989 -9.088 1.00 0.00 C ATOM 413 CG LEU A 31 -14.704 -13.940 -8.294 1.00 0.00 C ATOM 414 CD1 LEU A 31 -14.666 -14.848 -7.069 1.00 0.00 C ATOM 415 CD2 LEU A 31 -15.048 -12.505 -7.897 1.00 0.00 C ATOM 0 H LEU A 31 -11.226 -13.844 -10.263 1.00 0.00 H new ATOM 0 HA LEU A 31 -12.556 -12.137 -8.345 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -13.586 -13.667 -10.109 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -13.056 -15.028 -9.141 1.00 0.00 H new ATOM 0 HG LEU A 31 -15.490 -14.313 -8.951 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.616 -14.784 -6.539 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -14.495 -15.877 -7.384 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.859 -14.533 -6.407 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -15.984 -12.496 -7.339 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -14.251 -12.099 -7.274 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -15.155 -11.895 -8.794 1.00 0.00 H new ATOM 427 N MET A 32 -10.803 -14.718 -7.330 1.00 0.00 N ATOM 428 CA MET A 32 -10.276 -15.387 -6.143 1.00 0.00 C ATOM 429 C MET A 32 -9.429 -14.446 -5.277 1.00 0.00 C ATOM 430 O MET A 32 -9.652 -14.351 -4.070 1.00 0.00 O ATOM 431 CB MET A 32 -9.456 -16.632 -6.517 1.00 0.00 C ATOM 432 CG MET A 32 -8.192 -16.331 -7.309 1.00 0.00 C ATOM 433 SD MET A 32 -7.074 -17.737 -7.394 1.00 0.00 S ATOM 434 CE MET A 32 -6.719 -17.971 -5.656 1.00 0.00 C ATOM 0 H MET A 32 -10.455 -15.088 -8.214 1.00 0.00 H new ATOM 0 HA MET A 32 -11.141 -15.699 -5.557 1.00 0.00 H new ATOM 0 HB2 MET A 32 -9.182 -17.161 -5.604 1.00 0.00 H new ATOM 0 HB3 MET A 32 -10.084 -17.306 -7.099 1.00 0.00 H new ATOM 0 HG2 MET A 32 -8.465 -16.028 -8.320 1.00 0.00 H new ATOM 0 HG3 MET A 32 -7.674 -15.488 -6.852 1.00 0.00 H new ATOM 0 HE1 MET A 32 -5.657 -18.179 -5.526 1.00 0.00 H new ATOM 0 HE2 MET A 32 -6.982 -17.067 -5.106 1.00 0.00 H new ATOM 0 HE3 MET A 32 -7.302 -18.810 -5.275 1.00 0.00 H new ATOM 444 N ARG A 33 -8.464 -13.737 -5.878 1.00 0.00 N ATOM 445 CA ARG A 33 -7.527 -12.942 -5.080 1.00 0.00 C ATOM 446 C ARG A 33 -8.195 -11.674 -4.554 1.00 0.00 C ATOM 447 O ARG A 33 -7.768 -11.114 -3.545 1.00 0.00 O ATOM 448 CB ARG A 33 -6.233 -12.598 -5.853 1.00 0.00 C ATOM 449 CG ARG A 33 -6.223 -11.217 -6.510 1.00 0.00 C ATOM 450 CD ARG A 33 -6.946 -11.206 -7.843 1.00 0.00 C ATOM 451 NE ARG A 33 -6.132 -11.806 -8.897 1.00 0.00 N ATOM 452 CZ ARG A 33 -5.990 -11.299 -10.121 1.00 0.00 C ATOM 453 NH1 ARG A 33 -6.607 -10.174 -10.459 1.00 0.00 N ATOM 454 NH2 ARG A 33 -5.230 -11.918 -11.007 1.00 0.00 N ATOM 0 H ARG A 33 -8.315 -13.698 -6.886 1.00 0.00 H new ATOM 0 HA ARG A 33 -7.236 -13.561 -4.231 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -5.389 -12.664 -5.167 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.076 -13.352 -6.624 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -6.691 -10.496 -5.840 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -5.192 -10.895 -6.656 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -7.886 -11.750 -7.753 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -7.196 -10.180 -8.114 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.639 -12.672 -8.681 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -7.195 -9.691 -9.780 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -6.493 -9.792 -11.398 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -4.753 -12.783 -10.754 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -5.121 -11.531 -11.944 1.00 0.00 H new ATOM 468 N SER A 34 -9.239 -11.222 -5.237 1.00 0.00 N ATOM 469 CA SER A 34 -9.967 -10.035 -4.811 1.00 0.00 C ATOM 470 C SER A 34 -10.786 -10.348 -3.563 1.00 0.00 C ATOM 471 O SER A 34 -10.741 -9.608 -2.575 1.00 0.00 O ATOM 472 CB SER A 34 -10.863 -9.532 -5.946 1.00 0.00 C ATOM 473 OG SER A 34 -11.638 -10.585 -6.482 1.00 0.00 O ATOM 0 H SER A 34 -9.599 -11.658 -6.086 1.00 0.00 H new ATOM 0 HA SER A 34 -9.257 -9.246 -4.565 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.519 -8.745 -5.575 1.00 0.00 H new ATOM 0 HB3 SER A 34 -10.249 -9.091 -6.731 1.00 0.00 H new ATOM 0 HG SER A 34 -11.173 -10.975 -7.251 1.00 0.00 H new ATOM 479 N ARG A 35 -11.507 -11.467 -3.609 1.00 0.00 N ATOM 480 CA ARG A 35 -12.312 -11.913 -2.478 1.00 0.00 C ATOM 481 C ARG A 35 -11.405 -12.363 -1.327 1.00 0.00 C ATOM 482 O ARG A 35 -11.750 -12.204 -0.160 1.00 0.00 O ATOM 483 CB ARG A 35 -13.275 -13.039 -2.903 1.00 0.00 C ATOM 484 CG ARG A 35 -12.638 -14.424 -2.984 1.00 0.00 C ATOM 485 CD ARG A 35 -13.564 -15.444 -3.643 1.00 0.00 C ATOM 486 NE ARG A 35 -14.935 -15.395 -3.113 1.00 0.00 N ATOM 487 CZ ARG A 35 -15.588 -16.437 -2.594 1.00 0.00 C ATOM 488 NH1 ARG A 35 -14.966 -17.600 -2.417 1.00 0.00 N ATOM 489 NH2 ARG A 35 -16.860 -16.306 -2.238 1.00 0.00 N ATOM 0 H ARG A 35 -11.549 -12.082 -4.422 1.00 0.00 H new ATOM 0 HA ARG A 35 -12.917 -11.076 -2.128 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -14.104 -13.076 -2.196 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -13.697 -12.790 -3.877 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -11.707 -14.362 -3.548 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -12.381 -14.764 -1.981 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -13.588 -15.265 -4.718 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -13.158 -16.445 -3.496 1.00 0.00 H new ATOM 0 HE ARG A 35 -15.422 -14.499 -3.144 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -13.985 -17.699 -2.678 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -15.470 -18.393 -2.020 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -17.335 -15.412 -2.361 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -17.363 -17.100 -1.841 1.00 0.00 H new ATOM 503 N TYR A 36 -10.236 -12.914 -1.666 1.00 0.00 N ATOM 504 CA TYR A 36 -9.246 -13.318 -0.660 1.00 0.00 C ATOM 505 C TYR A 36 -8.960 -12.169 0.307 1.00 0.00 C ATOM 506 O TYR A 36 -8.896 -12.364 1.523 1.00 0.00 O ATOM 507 CB TYR A 36 -7.942 -13.773 -1.341 1.00 0.00 C ATOM 508 CG TYR A 36 -6.753 -13.891 -0.396 1.00 0.00 C ATOM 509 CD1 TYR A 36 -6.645 -14.949 0.503 1.00 0.00 C ATOM 510 CD2 TYR A 36 -5.738 -12.937 -0.405 1.00 0.00 C ATOM 511 CE1 TYR A 36 -5.564 -15.048 1.362 1.00 0.00 C ATOM 512 CE2 TYR A 36 -4.657 -13.032 0.450 1.00 0.00 C ATOM 513 CZ TYR A 36 -4.574 -14.088 1.331 1.00 0.00 C ATOM 514 OH TYR A 36 -3.495 -14.187 2.184 1.00 0.00 O ATOM 0 H TYR A 36 -9.951 -13.091 -2.629 1.00 0.00 H new ATOM 0 HA TYR A 36 -9.657 -14.154 -0.094 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.111 -14.739 -1.816 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.693 -13.067 -2.133 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -7.417 -15.704 0.530 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -5.797 -12.107 -1.094 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -5.496 -15.874 2.054 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -3.880 -12.282 0.428 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.889 -13.432 2.034 1.00 0.00 H new ATOM 524 N ALA A 37 -8.801 -10.971 -0.245 1.00 0.00 N ATOM 525 CA ALA A 37 -8.513 -9.787 0.555 1.00 0.00 C ATOM 526 C ALA A 37 -9.671 -9.474 1.498 1.00 0.00 C ATOM 527 O ALA A 37 -9.462 -8.956 2.594 1.00 0.00 O ATOM 528 CB ALA A 37 -8.213 -8.596 -0.344 1.00 0.00 C ATOM 0 H ALA A 37 -8.867 -10.794 -1.247 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.630 -9.991 1.161 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.000 -7.721 0.270 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.348 -8.820 -0.968 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.076 -8.393 -0.979 1.00 0.00 H new ATOM 534 N ALA A 38 -10.889 -9.798 1.068 1.00 0.00 N ATOM 535 CA ALA A 38 -12.077 -9.574 1.886 1.00 0.00 C ATOM 536 C ALA A 38 -12.002 -10.389 3.175 1.00 0.00 C ATOM 537 O ALA A 38 -12.404 -9.919 4.238 1.00 0.00 O ATOM 538 CB ALA A 38 -13.342 -9.909 1.102 1.00 0.00 C ATOM 0 H ALA A 38 -11.078 -10.217 0.157 1.00 0.00 H new ATOM 0 HA ALA A 38 -12.116 -8.518 2.154 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -14.216 -9.735 1.730 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.400 -9.276 0.217 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -13.316 -10.956 0.799 1.00 0.00 H new ATOM 544 N TYR A 39 -11.463 -11.607 3.080 1.00 0.00 N ATOM 545 CA TYR A 39 -11.247 -12.443 4.263 1.00 0.00 C ATOM 546 C TYR A 39 -10.261 -11.768 5.213 1.00 0.00 C ATOM 547 O TYR A 39 -10.455 -11.764 6.426 1.00 0.00 O ATOM 548 CB TYR A 39 -10.734 -13.843 3.876 1.00 0.00 C ATOM 549 CG TYR A 39 -11.809 -14.912 3.918 1.00 0.00 C ATOM 550 CD1 TYR A 39 -12.635 -15.133 2.829 1.00 0.00 C ATOM 551 CD2 TYR A 39 -12.004 -15.689 5.058 1.00 0.00 C ATOM 552 CE1 TYR A 39 -13.624 -16.096 2.867 1.00 0.00 C ATOM 553 CE2 TYR A 39 -12.993 -16.655 5.104 1.00 0.00 C ATOM 554 CZ TYR A 39 -13.801 -16.854 4.006 1.00 0.00 C ATOM 555 OH TYR A 39 -14.788 -17.814 4.044 1.00 0.00 O ATOM 0 H TYR A 39 -11.170 -12.034 2.201 1.00 0.00 H new ATOM 0 HA TYR A 39 -12.206 -12.563 4.767 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -10.312 -13.802 2.872 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.925 -14.125 4.551 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -12.504 -14.542 1.935 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -11.372 -15.534 5.920 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -14.258 -16.255 2.007 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -13.131 -17.249 5.995 1.00 0.00 H new ATOM 0 HH TYR A 39 -14.778 -18.259 4.917 1.00 0.00 H new ATOM 565 N ALA A 40 -9.205 -11.191 4.647 1.00 0.00 N ATOM 566 CA ALA A 40 -8.197 -10.487 5.434 1.00 0.00 C ATOM 567 C ALA A 40 -8.791 -9.225 6.062 1.00 0.00 C ATOM 568 O ALA A 40 -8.371 -8.791 7.135 1.00 0.00 O ATOM 569 CB ALA A 40 -6.988 -10.151 4.567 1.00 0.00 C ATOM 0 H ALA A 40 -9.025 -11.197 3.643 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.865 -11.139 6.242 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.245 -9.626 5.167 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.554 -11.071 4.175 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.300 -9.515 3.738 1.00 0.00 H new ATOM 575 N LEU A 41 -9.783 -8.650 5.387 1.00 0.00 N ATOM 576 CA LEU A 41 -10.495 -7.473 5.888 1.00 0.00 C ATOM 577 C LEU A 41 -11.713 -7.896 6.711 1.00 0.00 C ATOM 578 O LEU A 41 -12.593 -7.081 6.994 1.00 0.00 O ATOM 579 CB LEU A 41 -10.937 -6.583 4.716 1.00 0.00 C ATOM 580 CG LEU A 41 -9.800 -6.036 3.836 1.00 0.00 C ATOM 581 CD1 LEU A 41 -10.362 -5.232 2.667 1.00 0.00 C ATOM 582 CD2 LEU A 41 -8.834 -5.189 4.663 1.00 0.00 C ATOM 0 H LEU A 41 -10.116 -8.983 4.482 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.819 -6.906 6.529 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.619 -7.154 4.086 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -11.502 -5.741 5.115 1.00 0.00 H new ATOM 0 HG LEU A 41 -9.246 -6.883 3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.541 -4.854 2.057 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -11.001 -5.872 2.059 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -10.946 -4.394 3.049 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.038 -4.813 4.020 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -9.372 -4.350 5.104 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.402 -5.800 5.456 1.00 0.00 H new ATOM 594 N LYS A 42 -11.739 -9.181 7.092 1.00 0.00 N ATOM 595 CA LYS A 42 -12.837 -9.803 7.854 1.00 0.00 C ATOM 596 C LYS A 42 -14.219 -9.434 7.303 1.00 0.00 C ATOM 597 O LYS A 42 -15.227 -9.528 8.010 1.00 0.00 O ATOM 598 CB LYS A 42 -12.747 -9.504 9.374 1.00 0.00 C ATOM 599 CG LYS A 42 -12.886 -8.032 9.784 1.00 0.00 C ATOM 600 CD LYS A 42 -11.531 -7.356 10.010 1.00 0.00 C ATOM 601 CE LYS A 42 -10.763 -7.995 11.164 1.00 0.00 C ATOM 602 NZ LYS A 42 -9.466 -7.314 11.414 1.00 0.00 N ATOM 0 H LYS A 42 -10.984 -9.832 6.876 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.713 -10.878 7.724 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -13.523 -10.076 9.882 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -11.789 -9.872 9.740 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -13.433 -7.493 9.011 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -13.478 -7.967 10.697 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -10.937 -7.420 9.099 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -11.684 -6.297 10.217 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -11.371 -7.960 12.068 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -10.583 -9.047 10.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -8.977 -7.779 12.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -8.875 -7.369 10.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -9.638 -6.316 11.652 1.00 0.00 H new ATOM 616 N ASP A 43 -14.266 -9.059 6.029 1.00 0.00 N ATOM 617 CA ASP A 43 -15.524 -8.725 5.369 1.00 0.00 C ATOM 618 C ASP A 43 -16.015 -9.914 4.553 1.00 0.00 C ATOM 619 O ASP A 43 -15.723 -10.038 3.361 1.00 0.00 O ATOM 620 CB ASP A 43 -15.372 -7.487 4.473 1.00 0.00 C ATOM 621 CG ASP A 43 -16.684 -7.084 3.806 1.00 0.00 C ATOM 622 OD1 ASP A 43 -17.640 -6.738 4.533 1.00 0.00 O ATOM 623 OD2 ASP A 43 -16.759 -7.093 2.556 1.00 0.00 O ATOM 0 H ASP A 43 -13.444 -8.978 5.430 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.260 -8.491 6.138 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -15.001 -6.654 5.070 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -14.624 -7.687 3.705 1.00 0.00 H new ATOM 628 N PHE A 44 -16.731 -10.810 5.219 1.00 0.00 N ATOM 629 CA PHE A 44 -17.285 -11.989 4.565 1.00 0.00 C ATOM 630 C PHE A 44 -18.444 -11.599 3.648 1.00 0.00 C ATOM 631 O PHE A 44 -18.874 -12.389 2.812 1.00 0.00 O ATOM 632 CB PHE A 44 -17.729 -13.033 5.605 1.00 0.00 C ATOM 633 CG PHE A 44 -18.667 -12.503 6.666 1.00 0.00 C ATOM 634 CD1 PHE A 44 -20.043 -12.532 6.479 1.00 0.00 C ATOM 635 CD2 PHE A 44 -18.170 -11.982 7.854 1.00 0.00 C ATOM 636 CE1 PHE A 44 -20.899 -12.053 7.452 1.00 0.00 C ATOM 637 CE2 PHE A 44 -19.023 -11.502 8.828 1.00 0.00 C ATOM 638 CZ PHE A 44 -20.389 -11.537 8.627 1.00 0.00 C ATOM 0 H PHE A 44 -16.942 -10.743 6.215 1.00 0.00 H new ATOM 0 HA PHE A 44 -16.505 -12.440 3.951 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -18.217 -13.859 5.087 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -16.843 -13.441 6.092 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -20.449 -12.934 5.562 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -17.103 -11.952 8.018 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -21.967 -12.082 7.294 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -18.622 -11.099 9.747 1.00 0.00 H new ATOM 0 HZ PHE A 44 -21.057 -11.161 9.388 1.00 0.00 H new ATOM 648 N ASP A 45 -18.924 -10.367 3.809 1.00 0.00 N ATOM 649 CA ASP A 45 -20.026 -9.830 3.006 1.00 0.00 C ATOM 650 C ASP A 45 -19.777 -10.033 1.508 1.00 0.00 C ATOM 651 O ASP A 45 -20.596 -10.637 0.810 1.00 0.00 O ATOM 652 CB ASP A 45 -20.215 -8.339 3.320 1.00 0.00 C ATOM 653 CG ASP A 45 -21.307 -7.679 2.492 1.00 0.00 C ATOM 654 OD1 ASP A 45 -22.500 -7.968 2.730 1.00 0.00 O ATOM 655 OD2 ASP A 45 -20.979 -6.846 1.620 1.00 0.00 O ATOM 0 H ASP A 45 -18.561 -9.711 4.500 1.00 0.00 H new ATOM 0 HA ASP A 45 -20.935 -10.372 3.265 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -20.453 -8.226 4.378 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -19.274 -7.817 3.148 1.00 0.00 H new ATOM 660 N TYR A 46 -18.633 -9.548 1.022 1.00 0.00 N ATOM 661 CA TYR A 46 -18.281 -9.697 -0.391 1.00 0.00 C ATOM 662 C TYR A 46 -18.098 -11.170 -0.749 1.00 0.00 C ATOM 663 O TYR A 46 -18.399 -11.594 -1.869 1.00 0.00 O ATOM 664 CB TYR A 46 -17.007 -8.903 -0.728 1.00 0.00 C ATOM 665 CG TYR A 46 -16.606 -8.990 -2.192 1.00 0.00 C ATOM 666 CD1 TYR A 46 -17.423 -8.461 -3.184 1.00 0.00 C ATOM 667 CD2 TYR A 46 -15.416 -9.600 -2.580 1.00 0.00 C ATOM 668 CE1 TYR A 46 -17.070 -8.537 -4.517 1.00 0.00 C ATOM 669 CE2 TYR A 46 -15.055 -9.678 -3.914 1.00 0.00 C ATOM 670 CZ TYR A 46 -15.887 -9.145 -4.878 1.00 0.00 C ATOM 671 OH TYR A 46 -15.538 -9.224 -6.208 1.00 0.00 O ATOM 0 H TYR A 46 -17.939 -9.052 1.581 1.00 0.00 H new ATOM 0 HA TYR A 46 -19.102 -9.295 -0.985 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -17.160 -7.857 -0.463 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -16.186 -9.271 -0.112 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -18.351 -7.982 -2.908 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -14.764 -10.019 -1.828 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -17.719 -8.121 -5.274 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -14.128 -10.153 -4.199 1.00 0.00 H new ATOM 0 HH TYR A 46 -14.675 -9.681 -6.293 1.00 0.00 H new ATOM 681 N ILE A 47 -17.614 -11.950 0.212 1.00 0.00 N ATOM 682 CA ILE A 47 -17.372 -13.373 0.002 1.00 0.00 C ATOM 683 C ILE A 47 -18.669 -14.098 -0.317 1.00 0.00 C ATOM 684 O ILE A 47 -18.773 -14.798 -1.326 1.00 0.00 O ATOM 685 CB ILE A 47 -16.729 -14.030 1.245 1.00 0.00 C ATOM 686 CG1 ILE A 47 -15.415 -13.324 1.598 1.00 0.00 C ATOM 687 CG2 ILE A 47 -16.500 -15.522 1.004 1.00 0.00 C ATOM 688 CD1 ILE A 47 -14.395 -13.350 0.484 1.00 0.00 C ATOM 0 H ILE A 47 -17.381 -11.619 1.148 1.00 0.00 H new ATOM 0 HA ILE A 47 -16.684 -13.457 -0.839 1.00 0.00 H new ATOM 0 HB ILE A 47 -17.411 -13.926 2.089 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -15.628 -12.288 1.860 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.986 -13.794 2.483 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -16.047 -15.968 1.889 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -17.454 -16.008 0.800 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.836 -15.655 0.150 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.492 -12.832 0.806 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.152 -14.384 0.237 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.804 -12.853 -0.396 1.00 0.00 H new ATOM 700 N VAL A 48 -19.652 -13.912 0.547 1.00 0.00 N ATOM 701 CA VAL A 48 -20.938 -14.582 0.416 1.00 0.00 C ATOM 702 C VAL A 48 -21.555 -14.313 -0.958 1.00 0.00 C ATOM 703 O VAL A 48 -22.079 -15.225 -1.603 1.00 0.00 O ATOM 704 CB VAL A 48 -21.915 -14.134 1.531 1.00 0.00 C ATOM 705 CG1 VAL A 48 -23.216 -14.920 1.462 1.00 0.00 C ATOM 706 CG2 VAL A 48 -21.270 -14.287 2.907 1.00 0.00 C ATOM 0 H VAL A 48 -19.584 -13.295 1.357 1.00 0.00 H new ATOM 0 HA VAL A 48 -20.763 -15.653 0.518 1.00 0.00 H new ATOM 0 HB VAL A 48 -22.145 -13.080 1.373 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -23.885 -14.587 2.255 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -23.690 -14.755 0.494 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -23.006 -15.982 1.587 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -21.973 -13.967 3.676 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -21.004 -15.331 3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -20.372 -13.672 2.958 1.00 0.00 H new ATOM 716 N GLU A 49 -21.457 -13.067 -1.415 1.00 0.00 N ATOM 717 CA GLU A 49 -22.006 -12.683 -2.713 1.00 0.00 C ATOM 718 C GLU A 49 -21.237 -13.335 -3.863 1.00 0.00 C ATOM 719 O GLU A 49 -21.814 -13.630 -4.912 1.00 0.00 O ATOM 720 CB GLU A 49 -21.993 -11.160 -2.886 1.00 0.00 C ATOM 721 CG GLU A 49 -22.849 -10.417 -1.867 1.00 0.00 C ATOM 722 CD GLU A 49 -23.125 -8.982 -2.281 1.00 0.00 C ATOM 723 OE1 GLU A 49 -24.055 -8.764 -3.086 1.00 0.00 O ATOM 724 OE2 GLU A 49 -22.422 -8.066 -1.812 1.00 0.00 O ATOM 0 H GLU A 49 -21.004 -12.307 -0.907 1.00 0.00 H new ATOM 0 HA GLU A 49 -23.037 -13.037 -2.741 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.965 -10.804 -2.812 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -22.343 -10.915 -3.889 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -23.795 -10.943 -1.738 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -22.346 -10.423 -0.900 1.00 0.00 H new ATOM 731 N THR A 50 -19.941 -13.560 -3.663 1.00 0.00 N ATOM 732 CA THR A 50 -19.088 -14.151 -4.697 1.00 0.00 C ATOM 733 C THR A 50 -19.036 -15.673 -4.570 1.00 0.00 C ATOM 734 O THR A 50 -18.129 -16.322 -5.094 1.00 0.00 O ATOM 735 CB THR A 50 -17.655 -13.574 -4.633 1.00 0.00 C ATOM 736 OG1 THR A 50 -17.145 -13.662 -3.292 1.00 0.00 O ATOM 737 CG2 THR A 50 -17.632 -12.121 -5.095 1.00 0.00 C ATOM 0 H THR A 50 -19.455 -13.342 -2.793 1.00 0.00 H new ATOM 0 HA THR A 50 -19.528 -13.896 -5.661 1.00 0.00 H new ATOM 0 HB THR A 50 -17.024 -14.161 -5.300 1.00 0.00 H new ATOM 0 HG1 THR A 50 -17.511 -12.929 -2.754 1.00 0.00 H new ATOM 0 HG21 THR A 50 -16.613 -11.738 -5.041 1.00 0.00 H new ATOM 0 HG22 THR A 50 -17.988 -12.061 -6.123 1.00 0.00 H new ATOM 0 HG23 THR A 50 -18.279 -11.524 -4.452 1.00 0.00 H new ATOM 745 N THR A 51 -20.014 -16.239 -3.875 1.00 0.00 N ATOM 746 CA THR A 51 -20.116 -17.683 -3.720 1.00 0.00 C ATOM 747 C THR A 51 -21.309 -18.218 -4.513 1.00 0.00 C ATOM 748 O THR A 51 -22.282 -17.494 -4.751 1.00 0.00 O ATOM 749 CB THR A 51 -20.257 -18.072 -2.233 1.00 0.00 C ATOM 750 OG1 THR A 51 -19.174 -17.494 -1.486 1.00 0.00 O ATOM 751 CG2 THR A 51 -20.248 -19.589 -2.057 1.00 0.00 C ATOM 0 H THR A 51 -20.753 -15.715 -3.407 1.00 0.00 H new ATOM 0 HA THR A 51 -19.200 -18.129 -4.107 1.00 0.00 H new ATOM 0 HB THR A 51 -21.210 -17.692 -1.865 1.00 0.00 H new ATOM 0 HG1 THR A 51 -18.968 -18.063 -0.715 1.00 0.00 H new ATOM 0 HG21 THR A 51 -20.349 -19.833 -1.000 1.00 0.00 H new ATOM 0 HG22 THR A 51 -21.080 -20.024 -2.611 1.00 0.00 H new ATOM 0 HG23 THR A 51 -19.309 -19.994 -2.435 1.00 0.00 H new ATOM 759 N ASP A 52 -21.208 -19.476 -4.936 1.00 0.00 N ATOM 760 CA ASP A 52 -22.270 -20.161 -5.671 1.00 0.00 C ATOM 761 C ASP A 52 -23.604 -20.004 -4.939 1.00 0.00 C ATOM 762 O ASP A 52 -23.654 -20.163 -3.720 1.00 0.00 O ATOM 763 CB ASP A 52 -21.921 -21.651 -5.789 1.00 0.00 C ATOM 764 CG ASP A 52 -22.816 -22.415 -6.754 1.00 0.00 C ATOM 765 OD1 ASP A 52 -23.971 -22.708 -6.396 1.00 0.00 O ATOM 766 OD2 ASP A 52 -22.358 -22.750 -7.865 1.00 0.00 O ATOM 0 H ASP A 52 -20.382 -20.053 -4.778 1.00 0.00 H new ATOM 0 HA ASP A 52 -22.360 -19.722 -6.665 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -20.885 -21.748 -6.114 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -21.990 -22.110 -4.803 1.00 0.00 H new ATOM 771 N PRO A 53 -24.696 -19.698 -5.663 1.00 0.00 N ATOM 772 CA PRO A 53 -26.021 -19.494 -5.056 1.00 0.00 C ATOM 773 C PRO A 53 -26.445 -20.680 -4.184 1.00 0.00 C ATOM 774 O PRO A 53 -27.099 -20.509 -3.154 1.00 0.00 O ATOM 775 CB PRO A 53 -26.961 -19.333 -6.270 1.00 0.00 C ATOM 776 CG PRO A 53 -26.175 -19.818 -7.447 1.00 0.00 C ATOM 777 CD PRO A 53 -24.736 -19.532 -7.124 1.00 0.00 C ATOM 0 HA PRO A 53 -26.037 -18.634 -4.386 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -27.874 -19.915 -6.140 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -27.261 -18.293 -6.399 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -26.335 -20.884 -7.611 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -26.480 -19.305 -8.359 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -24.062 -20.224 -7.629 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -24.445 -18.526 -7.426 1.00 0.00 H new ATOM 785 N GLU A 54 -26.042 -21.878 -4.594 1.00 0.00 N ATOM 786 CA GLU A 54 -26.388 -23.101 -3.877 1.00 0.00 C ATOM 787 C GLU A 54 -25.499 -23.279 -2.643 1.00 0.00 C ATOM 788 O GLU A 54 -25.946 -23.785 -1.611 1.00 0.00 O ATOM 789 CB GLU A 54 -26.257 -24.303 -4.820 1.00 0.00 C ATOM 790 CG GLU A 54 -27.156 -24.201 -6.050 1.00 0.00 C ATOM 791 CD GLU A 54 -26.849 -25.256 -7.098 1.00 0.00 C ATOM 792 OE1 GLU A 54 -27.175 -26.440 -6.872 1.00 0.00 O ATOM 793 OE2 GLU A 54 -26.291 -24.903 -8.163 1.00 0.00 O ATOM 0 H GLU A 54 -25.471 -22.029 -5.426 1.00 0.00 H new ATOM 0 HA GLU A 54 -27.420 -23.030 -3.534 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -25.220 -24.393 -5.142 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -26.501 -25.214 -4.274 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -28.197 -24.296 -5.741 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -27.044 -23.212 -6.494 1.00 0.00 H new ATOM 800 N ARG A 55 -24.245 -22.845 -2.747 1.00 0.00 N ATOM 801 CA ARG A 55 -23.302 -22.941 -1.629 1.00 0.00 C ATOM 802 C ARG A 55 -23.541 -21.805 -0.642 1.00 0.00 C ATOM 803 O ARG A 55 -23.249 -21.922 0.550 1.00 0.00 O ATOM 804 CB ARG A 55 -21.850 -22.885 -2.126 1.00 0.00 C ATOM 805 CG ARG A 55 -21.492 -23.958 -3.145 1.00 0.00 C ATOM 806 CD ARG A 55 -21.832 -25.357 -2.650 1.00 0.00 C ATOM 807 NE ARG A 55 -21.276 -26.395 -3.519 1.00 0.00 N ATOM 808 CZ ARG A 55 -21.688 -26.650 -4.764 1.00 0.00 C ATOM 809 NH1 ARG A 55 -22.683 -25.952 -5.306 1.00 0.00 N ATOM 810 NH2 ARG A 55 -21.097 -27.610 -5.464 1.00 0.00 N ATOM 0 H ARG A 55 -23.856 -22.424 -3.591 1.00 0.00 H new ATOM 0 HA ARG A 55 -23.466 -23.898 -1.134 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.668 -21.906 -2.569 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -21.182 -22.977 -1.270 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -22.024 -23.764 -4.076 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -20.427 -23.903 -3.369 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -21.448 -25.487 -1.638 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -22.915 -25.470 -2.597 1.00 0.00 H new ATOM 0 HE ARG A 55 -20.518 -26.966 -3.146 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -23.139 -25.214 -4.770 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -22.989 -26.155 -6.257 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -20.334 -28.147 -5.051 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -21.405 -27.811 -6.415 1.00 0.00 H new ATOM 824 N ARG A 56 -24.091 -20.710 -1.154 1.00 0.00 N ATOM 825 CA ARG A 56 -24.318 -19.507 -0.364 1.00 0.00 C ATOM 826 C ARG A 56 -25.252 -19.805 0.805 1.00 0.00 C ATOM 827 O ARG A 56 -25.196 -19.149 1.846 1.00 0.00 O ATOM 828 CB ARG A 56 -24.897 -18.397 -1.249 1.00 0.00 C ATOM 829 CG ARG A 56 -24.858 -17.018 -0.605 1.00 0.00 C ATOM 830 CD ARG A 56 -25.396 -15.940 -1.535 1.00 0.00 C ATOM 831 NE ARG A 56 -26.833 -16.076 -1.757 1.00 0.00 N ATOM 832 CZ ARG A 56 -27.473 -15.619 -2.832 1.00 0.00 C ATOM 833 NH1 ARG A 56 -26.797 -15.085 -3.845 1.00 0.00 N ATOM 834 NH2 ARG A 56 -28.791 -15.730 -2.903 1.00 0.00 N ATOM 0 H ARG A 56 -24.391 -20.632 -2.126 1.00 0.00 H new ATOM 0 HA ARG A 56 -23.364 -19.167 0.040 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -24.343 -18.366 -2.187 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -25.929 -18.643 -1.497 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -25.444 -17.030 0.314 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -23.832 -16.777 -0.325 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -25.186 -14.958 -1.111 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -24.875 -15.993 -2.491 1.00 0.00 H new ATOM 0 HE ARG A 56 -27.383 -16.552 -1.042 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -25.780 -15.023 -3.803 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -27.296 -14.738 -4.664 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -29.308 -16.163 -2.138 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -29.289 -15.383 -3.723 1.00 0.00 H new ATOM 848 N ASP A 57 -26.104 -20.809 0.624 1.00 0.00 N ATOM 849 CA ASP A 57 -26.987 -21.274 1.689 1.00 0.00 C ATOM 850 C ASP A 57 -26.167 -21.828 2.848 1.00 0.00 C ATOM 851 O ASP A 57 -26.438 -21.533 4.012 1.00 0.00 O ATOM 852 CB ASP A 57 -27.938 -22.357 1.167 1.00 0.00 C ATOM 853 CG ASP A 57 -28.861 -22.890 2.254 1.00 0.00 C ATOM 854 OD1 ASP A 57 -29.953 -22.313 2.451 1.00 0.00 O ATOM 855 OD2 ASP A 57 -28.501 -23.886 2.916 1.00 0.00 O ATOM 0 H ASP A 57 -26.202 -21.318 -0.254 1.00 0.00 H new ATOM 0 HA ASP A 57 -27.577 -20.426 2.038 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -28.537 -21.949 0.353 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -27.355 -23.180 0.753 1.00 0.00 H new ATOM 860 N LEU A 58 -25.155 -22.621 2.508 1.00 0.00 N ATOM 861 CA LEU A 58 -24.291 -23.250 3.502 1.00 0.00 C ATOM 862 C LEU A 58 -23.368 -22.212 4.136 1.00 0.00 C ATOM 863 O LEU A 58 -22.903 -22.379 5.265 1.00 0.00 O ATOM 864 CB LEU A 58 -23.474 -24.375 2.852 1.00 0.00 C ATOM 865 CG LEU A 58 -24.308 -25.462 2.147 1.00 0.00 C ATOM 866 CD1 LEU A 58 -23.404 -26.516 1.511 1.00 0.00 C ATOM 867 CD2 LEU A 58 -25.292 -26.108 3.123 1.00 0.00 C ATOM 0 H LEU A 58 -24.912 -22.845 1.543 1.00 0.00 H new ATOM 0 HA LEU A 58 -24.912 -23.681 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.791 -23.934 2.126 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -22.862 -24.849 3.619 1.00 0.00 H new ATOM 0 HG LEU A 58 -24.881 -24.985 1.352 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -24.016 -27.272 1.020 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -22.754 -26.042 0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.796 -26.987 2.283 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -25.870 -26.872 2.604 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -24.742 -26.565 3.945 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -25.966 -25.347 3.516 1.00 0.00 H new ATOM 879 N PHE A 59 -23.098 -21.143 3.391 1.00 0.00 N ATOM 880 CA PHE A 59 -22.335 -20.013 3.909 1.00 0.00 C ATOM 881 C PHE A 59 -23.123 -19.296 5.002 1.00 0.00 C ATOM 882 O PHE A 59 -24.069 -18.559 4.718 1.00 0.00 O ATOM 883 CB PHE A 59 -21.979 -19.035 2.776 1.00 0.00 C ATOM 884 CG PHE A 59 -20.663 -19.336 2.104 1.00 0.00 C ATOM 885 CD1 PHE A 59 -20.344 -20.625 1.698 1.00 0.00 C ATOM 886 CD2 PHE A 59 -19.742 -18.323 1.886 1.00 0.00 C ATOM 887 CE1 PHE A 59 -19.131 -20.895 1.091 1.00 0.00 C ATOM 888 CE2 PHE A 59 -18.532 -18.586 1.280 1.00 0.00 C ATOM 889 CZ PHE A 59 -18.224 -19.873 0.881 1.00 0.00 C ATOM 0 H PHE A 59 -23.398 -21.037 2.422 1.00 0.00 H new ATOM 0 HA PHE A 59 -21.408 -20.392 4.340 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -22.772 -19.056 2.028 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -21.948 -18.023 3.179 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -21.051 -21.426 1.858 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -19.975 -17.315 2.195 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -18.893 -21.902 0.782 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -17.825 -17.786 1.117 1.00 0.00 H new ATOM 0 HZ PHE A 59 -17.276 -20.080 0.406 1.00 0.00 H new ATOM 899 N ASP A 60 -22.745 -19.538 6.251 1.00 0.00 N ATOM 900 CA ASP A 60 -23.399 -18.908 7.394 1.00 0.00 C ATOM 901 C ASP A 60 -22.461 -17.870 8.010 1.00 0.00 C ATOM 902 O ASP A 60 -21.246 -18.084 8.058 1.00 0.00 O ATOM 903 CB ASP A 60 -23.792 -19.971 8.427 1.00 0.00 C ATOM 904 CG ASP A 60 -24.871 -19.488 9.381 1.00 0.00 C ATOM 905 OD1 ASP A 60 -24.529 -18.883 10.417 1.00 0.00 O ATOM 906 OD2 ASP A 60 -26.070 -19.717 9.096 1.00 0.00 O ATOM 0 H ASP A 60 -21.984 -20.170 6.500 1.00 0.00 H new ATOM 0 HA ASP A 60 -24.308 -18.405 7.063 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -24.143 -20.863 7.909 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.910 -20.261 8.998 1.00 0.00 H new ATOM 911 N HIS A 61 -23.025 -16.757 8.482 1.00 0.00 N ATOM 912 CA HIS A 61 -22.228 -15.599 8.912 1.00 0.00 C ATOM 913 C HIS A 61 -21.179 -15.982 9.961 1.00 0.00 C ATOM 914 O HIS A 61 -20.011 -15.602 9.844 1.00 0.00 O ATOM 915 CB HIS A 61 -23.127 -14.479 9.459 1.00 0.00 C ATOM 916 CG HIS A 61 -24.153 -13.974 8.482 1.00 0.00 C ATOM 917 ND1 HIS A 61 -23.834 -13.504 7.224 1.00 0.00 N ATOM 918 CD2 HIS A 61 -25.499 -13.859 8.589 1.00 0.00 C ATOM 919 CE1 HIS A 61 -24.936 -13.119 6.606 1.00 0.00 C ATOM 920 NE2 HIS A 61 -25.958 -13.326 7.411 1.00 0.00 N ATOM 0 H HIS A 61 -24.032 -16.630 8.578 1.00 0.00 H new ATOM 0 HA HIS A 61 -21.705 -15.234 8.028 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -23.639 -14.843 10.350 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -22.499 -13.645 9.771 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -26.099 -14.136 9.443 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -24.990 -12.705 5.610 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -26.934 -13.123 7.194 1.00 0.00 H new ATOM 929 N ASP A 62 -21.598 -16.738 10.976 1.00 0.00 N ATOM 930 CA ASP A 62 -20.693 -17.158 12.054 1.00 0.00 C ATOM 931 C ASP A 62 -19.513 -17.954 11.502 1.00 0.00 C ATOM 932 O ASP A 62 -18.356 -17.686 11.832 1.00 0.00 O ATOM 933 CB ASP A 62 -21.434 -18.012 13.098 1.00 0.00 C ATOM 934 CG ASP A 62 -22.370 -17.202 13.983 1.00 0.00 C ATOM 935 OD1 ASP A 62 -21.900 -16.629 14.988 1.00 0.00 O ATOM 936 OD2 ASP A 62 -23.584 -17.144 13.691 1.00 0.00 O ATOM 0 H ASP A 62 -22.556 -17.073 11.077 1.00 0.00 H new ATOM 0 HA ASP A 62 -20.321 -16.252 12.532 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -22.008 -18.784 12.585 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -20.703 -18.522 13.725 1.00 0.00 H new ATOM 941 N VAL A 63 -19.819 -18.920 10.645 1.00 0.00 N ATOM 942 CA VAL A 63 -18.819 -19.848 10.125 1.00 0.00 C ATOM 943 C VAL A 63 -17.812 -19.133 9.220 1.00 0.00 C ATOM 944 O VAL A 63 -16.605 -19.373 9.307 1.00 0.00 O ATOM 945 CB VAL A 63 -19.494 -20.999 9.340 1.00 0.00 C ATOM 946 CG1 VAL A 63 -18.461 -22.017 8.857 1.00 0.00 C ATOM 947 CG2 VAL A 63 -20.571 -21.669 10.195 1.00 0.00 C ATOM 0 H VAL A 63 -20.762 -19.083 10.291 1.00 0.00 H new ATOM 0 HA VAL A 63 -18.285 -20.262 10.980 1.00 0.00 H new ATOM 0 HB VAL A 63 -19.974 -20.575 8.458 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -18.964 -22.814 8.309 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -17.743 -21.524 8.202 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -17.939 -22.440 9.715 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -21.036 -22.476 9.628 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -20.117 -22.075 11.099 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -21.328 -20.934 10.468 1.00 0.00 H new ATOM 957 N ASN A 64 -18.319 -18.247 8.364 1.00 0.00 N ATOM 958 CA ASN A 64 -17.474 -17.512 7.419 1.00 0.00 C ATOM 959 C ASN A 64 -16.403 -16.710 8.154 1.00 0.00 C ATOM 960 O ASN A 64 -15.270 -16.594 7.686 1.00 0.00 O ATOM 961 CB ASN A 64 -18.325 -16.582 6.537 1.00 0.00 C ATOM 962 CG ASN A 64 -19.224 -17.337 5.566 1.00 0.00 C ATOM 963 OD1 ASN A 64 -20.326 -16.888 5.244 1.00 0.00 O ATOM 964 ND2 ASN A 64 -18.757 -18.478 5.072 1.00 0.00 N ATOM 0 H ASN A 64 -19.311 -18.019 8.304 1.00 0.00 H new ATOM 0 HA ASN A 64 -16.978 -18.240 6.778 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -18.941 -15.949 7.176 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -17.666 -15.922 5.974 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -19.315 -19.011 4.405 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -17.841 -18.821 5.360 1.00 0.00 H new ATOM 971 N ARG A 65 -16.768 -16.168 9.311 1.00 0.00 N ATOM 972 CA ARG A 65 -15.832 -15.410 10.136 1.00 0.00 C ATOM 973 C ARG A 65 -14.897 -16.362 10.880 1.00 0.00 C ATOM 974 O ARG A 65 -13.680 -16.173 10.894 1.00 0.00 O ATOM 975 CB ARG A 65 -16.591 -14.537 11.144 1.00 0.00 C ATOM 976 CG ARG A 65 -15.696 -13.576 11.924 1.00 0.00 C ATOM 977 CD ARG A 65 -16.429 -12.946 13.102 1.00 0.00 C ATOM 978 NE ARG A 65 -16.744 -13.934 14.137 1.00 0.00 N ATOM 979 CZ ARG A 65 -17.921 -14.025 14.757 1.00 0.00 C ATOM 980 NH1 ARG A 65 -18.918 -13.214 14.427 1.00 0.00 N ATOM 981 NH2 ARG A 65 -18.105 -14.937 15.701 1.00 0.00 N ATOM 0 H ARG A 65 -17.708 -16.239 9.700 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.243 -14.765 9.485 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.350 -13.962 10.613 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -17.115 -15.183 11.848 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -14.818 -14.111 12.287 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -15.338 -12.791 11.257 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -15.815 -12.154 13.530 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.350 -12.481 12.751 1.00 0.00 H new ATOM 0 HE ARG A 65 -16.014 -14.596 14.401 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -18.787 -12.516 13.695 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -19.816 -13.289 14.905 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -17.346 -15.570 15.954 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -19.006 -15.006 16.175 1.00 0.00 H new ATOM 995 N ALA A 66 -15.484 -17.400 11.470 1.00 0.00 N ATOM 996 CA ALA A 66 -14.756 -18.349 12.314 1.00 0.00 C ATOM 997 C ALA A 66 -13.474 -18.854 11.650 1.00 0.00 C ATOM 998 O ALA A 66 -12.435 -18.984 12.306 1.00 0.00 O ATOM 999 CB ALA A 66 -15.663 -19.519 12.673 1.00 0.00 C ATOM 0 H ALA A 66 -16.478 -17.609 11.378 1.00 0.00 H new ATOM 0 HA ALA A 66 -14.458 -17.823 13.221 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -15.117 -20.223 13.301 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -16.535 -19.151 13.213 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -15.987 -20.022 11.761 1.00 0.00 H new ATOM 1005 N TRP A 67 -13.551 -19.123 10.349 1.00 0.00 N ATOM 1006 CA TRP A 67 -12.414 -19.651 9.597 1.00 0.00 C ATOM 1007 C TRP A 67 -11.204 -18.718 9.676 1.00 0.00 C ATOM 1008 O TRP A 67 -10.114 -19.136 10.079 1.00 0.00 O ATOM 1009 CB TRP A 67 -12.809 -19.887 8.131 1.00 0.00 C ATOM 1010 CG TRP A 67 -11.668 -20.342 7.264 1.00 0.00 C ATOM 1011 CD1 TRP A 67 -11.080 -19.644 6.246 1.00 0.00 C ATOM 1012 CD2 TRP A 67 -10.971 -21.593 7.345 1.00 0.00 C ATOM 1013 NE1 TRP A 67 -10.068 -20.385 5.688 1.00 0.00 N ATOM 1014 CE2 TRP A 67 -9.980 -21.584 6.345 1.00 0.00 C ATOM 1015 CE3 TRP A 67 -11.090 -22.720 8.164 1.00 0.00 C ATOM 1016 CZ2 TRP A 67 -9.114 -22.656 6.144 1.00 0.00 C ATOM 1017 CZ3 TRP A 67 -10.229 -23.783 7.964 1.00 0.00 C ATOM 1018 CH2 TRP A 67 -9.252 -23.744 6.962 1.00 0.00 C ATOM 0 H TRP A 67 -14.393 -18.983 9.791 1.00 0.00 H new ATOM 0 HA TRP A 67 -12.130 -20.602 10.048 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.603 -20.633 8.093 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -13.220 -18.964 7.721 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -11.370 -18.654 5.927 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -9.477 -20.091 4.910 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -11.841 -22.759 8.939 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -8.361 -22.629 5.370 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -10.311 -24.658 8.591 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -8.594 -24.590 6.832 1.00 0.00 H new ATOM 1029 N MET A 68 -11.401 -17.454 9.307 1.00 0.00 N ATOM 1030 CA MET A 68 -10.294 -16.498 9.233 1.00 0.00 C ATOM 1031 C MET A 68 -9.694 -16.236 10.612 1.00 0.00 C ATOM 1032 O MET A 68 -8.500 -15.963 10.735 1.00 0.00 O ATOM 1033 CB MET A 68 -10.745 -15.165 8.618 1.00 0.00 C ATOM 1034 CG MET A 68 -11.759 -14.403 9.464 1.00 0.00 C ATOM 1035 SD MET A 68 -11.846 -12.655 9.041 1.00 0.00 S ATOM 1036 CE MET A 68 -10.184 -12.123 9.462 1.00 0.00 C ATOM 0 H MET A 68 -12.311 -17.068 9.055 1.00 0.00 H new ATOM 0 HA MET A 68 -9.534 -16.946 8.592 1.00 0.00 H new ATOM 0 HB2 MET A 68 -9.870 -14.534 8.462 1.00 0.00 H new ATOM 0 HB3 MET A 68 -11.178 -15.358 7.636 1.00 0.00 H new ATOM 0 HG2 MET A 68 -12.744 -14.853 9.336 1.00 0.00 H new ATOM 0 HG3 MET A 68 -11.497 -14.505 10.517 1.00 0.00 H new ATOM 0 HE1 MET A 68 -10.148 -11.034 9.495 1.00 0.00 H new ATOM 0 HE2 MET A 68 -9.909 -12.525 10.437 1.00 0.00 H new ATOM 0 HE3 MET A 68 -9.484 -12.486 8.709 1.00 0.00 H new ATOM 1046 N GLU A 69 -10.523 -16.333 11.648 1.00 0.00 N ATOM 1047 CA GLU A 69 -10.093 -16.006 13.006 1.00 0.00 C ATOM 1048 C GLU A 69 -8.986 -16.953 13.479 1.00 0.00 C ATOM 1049 O GLU A 69 -8.128 -16.567 14.277 1.00 0.00 O ATOM 1050 CB GLU A 69 -11.287 -16.038 13.970 1.00 0.00 C ATOM 1051 CG GLU A 69 -12.429 -15.119 13.546 1.00 0.00 C ATOM 1052 CD GLU A 69 -13.502 -14.966 14.614 1.00 0.00 C ATOM 1053 OE1 GLU A 69 -14.454 -15.777 14.636 1.00 0.00 O ATOM 1054 OE2 GLU A 69 -13.401 -14.026 15.432 1.00 0.00 O ATOM 0 H GLU A 69 -11.495 -16.635 11.574 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.684 -14.996 12.997 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.660 -17.060 14.042 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -10.949 -15.751 14.966 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.025 -14.136 13.302 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.884 -15.511 12.636 1.00 0.00 H new ATOM 1061 N GLU A 70 -9.000 -18.186 12.974 1.00 0.00 N ATOM 1062 CA GLU A 70 -7.967 -19.171 13.309 1.00 0.00 C ATOM 1063 C GLU A 70 -7.094 -19.474 12.093 1.00 0.00 C ATOM 1064 O GLU A 70 -6.286 -20.404 12.108 1.00 0.00 O ATOM 1065 CB GLU A 70 -8.604 -20.454 13.862 1.00 0.00 C ATOM 1066 CG GLU A 70 -9.608 -21.118 12.925 1.00 0.00 C ATOM 1067 CD GLU A 70 -10.384 -22.230 13.613 1.00 0.00 C ATOM 1068 OE1 GLU A 70 -11.356 -21.921 14.335 1.00 0.00 O ATOM 1069 OE2 GLU A 70 -10.012 -23.412 13.462 1.00 0.00 O ATOM 0 H GLU A 70 -9.714 -18.529 12.331 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.328 -18.749 14.084 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -7.813 -21.168 14.090 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -9.104 -20.220 14.802 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.305 -20.368 12.551 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -9.083 -21.524 12.061 1.00 0.00 H new ATOM 1076 N SER A 71 -7.259 -18.676 11.045 1.00 0.00 N ATOM 1077 CA SER A 71 -6.432 -18.781 9.849 1.00 0.00 C ATOM 1078 C SER A 71 -5.997 -17.386 9.400 1.00 0.00 C ATOM 1079 O SER A 71 -6.557 -16.819 8.458 1.00 0.00 O ATOM 1080 CB SER A 71 -7.198 -19.499 8.729 1.00 0.00 C ATOM 1081 OG SER A 71 -7.719 -20.741 9.181 1.00 0.00 O ATOM 0 H SER A 71 -7.966 -17.942 11.000 1.00 0.00 H new ATOM 0 HA SER A 71 -5.543 -19.369 10.080 1.00 0.00 H new ATOM 0 HB2 SER A 71 -8.012 -18.866 8.377 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.535 -19.666 7.880 1.00 0.00 H new ATOM 0 HG SER A 71 -8.593 -20.596 9.600 1.00 0.00 H new ATOM 1087 N ASP A 72 -5.020 -16.821 10.111 1.00 0.00 N ATOM 1088 CA ASP A 72 -4.516 -15.481 9.809 1.00 0.00 C ATOM 1089 C ASP A 72 -3.833 -15.466 8.446 1.00 0.00 C ATOM 1090 O ASP A 72 -2.650 -15.789 8.332 1.00 0.00 O ATOM 1091 CB ASP A 72 -3.533 -15.002 10.895 1.00 0.00 C ATOM 1092 CG ASP A 72 -4.201 -14.777 12.245 1.00 0.00 C ATOM 1093 OD1 ASP A 72 -4.347 -15.748 13.015 1.00 0.00 O ATOM 1094 OD2 ASP A 72 -4.576 -13.624 12.549 1.00 0.00 O ATOM 0 H ASP A 72 -4.561 -17.272 10.902 1.00 0.00 H new ATOM 0 HA ASP A 72 -5.366 -14.799 9.789 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -2.738 -15.739 11.008 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -3.064 -14.074 10.569 1.00 0.00 H new ATOM 1099 N PHE A 73 -4.599 -15.121 7.413 1.00 0.00 N ATOM 1100 CA PHE A 73 -4.089 -15.076 6.043 1.00 0.00 C ATOM 1101 C PHE A 73 -2.916 -14.105 5.926 1.00 0.00 C ATOM 1102 O PHE A 73 -2.987 -12.966 6.395 1.00 0.00 O ATOM 1103 CB PHE A 73 -5.208 -14.689 5.069 1.00 0.00 C ATOM 1104 CG PHE A 73 -6.336 -15.691 5.027 1.00 0.00 C ATOM 1105 CD1 PHE A 73 -6.191 -16.889 4.340 1.00 0.00 C ATOM 1106 CD2 PHE A 73 -7.535 -15.442 5.681 1.00 0.00 C ATOM 1107 CE1 PHE A 73 -7.218 -17.814 4.303 1.00 0.00 C ATOM 1108 CE2 PHE A 73 -8.564 -16.365 5.647 1.00 0.00 C ATOM 1109 CZ PHE A 73 -8.405 -17.551 4.957 1.00 0.00 C ATOM 0 H PHE A 73 -5.583 -14.867 7.500 1.00 0.00 H new ATOM 0 HA PHE A 73 -3.729 -16.071 5.782 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.607 -13.715 5.353 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.789 -14.582 4.069 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.264 -17.101 3.828 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -7.666 -14.517 6.223 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.092 -18.741 3.763 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -9.492 -16.159 6.160 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.209 -18.272 4.929 1.00 0.00 H new ATOM 1119 N LEU A 74 -1.838 -14.571 5.302 1.00 0.00 N ATOM 1120 CA LEU A 74 -0.601 -13.803 5.191 1.00 0.00 C ATOM 1121 C LEU A 74 -0.290 -13.479 3.733 1.00 0.00 C ATOM 1122 O LEU A 74 -0.040 -12.323 3.378 1.00 0.00 O ATOM 1123 CB LEU A 74 0.562 -14.603 5.796 1.00 0.00 C ATOM 1124 CG LEU A 74 0.381 -15.028 7.262 1.00 0.00 C ATOM 1125 CD1 LEU A 74 1.527 -15.932 7.704 1.00 0.00 C ATOM 1126 CD2 LEU A 74 0.269 -13.805 8.173 1.00 0.00 C ATOM 0 H LEU A 74 -1.797 -15.489 4.860 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.729 -12.867 5.736 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.717 -15.498 5.193 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.470 -14.005 5.719 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.548 -15.592 7.342 1.00 0.00 H new ATOM 0 HD11 LEU A 74 1.381 -16.222 8.744 1.00 0.00 H new ATOM 0 HD12 LEU A 74 1.549 -16.824 7.078 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.471 -15.397 7.606 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.142 -14.131 9.205 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.176 -13.206 8.091 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.590 -13.205 7.873 1.00 0.00 H new ATOM 1138 N GLU A 75 -0.308 -14.506 2.889 1.00 0.00 N ATOM 1139 CA GLU A 75 0.073 -14.359 1.490 1.00 0.00 C ATOM 1140 C GLU A 75 -0.670 -15.372 0.621 1.00 0.00 C ATOM 1141 O GLU A 75 -0.971 -16.481 1.065 1.00 0.00 O ATOM 1142 CB GLU A 75 1.593 -14.543 1.342 1.00 0.00 C ATOM 1143 CG GLU A 75 2.119 -14.287 -0.067 1.00 0.00 C ATOM 1144 CD GLU A 75 1.795 -12.887 -0.561 1.00 0.00 C ATOM 1145 OE1 GLU A 75 2.459 -11.926 -0.123 1.00 0.00 O ATOM 1146 OE2 GLU A 75 0.871 -12.737 -1.388 1.00 0.00 O ATOM 0 H GLU A 75 -0.584 -15.452 3.152 1.00 0.00 H new ATOM 0 HA GLU A 75 -0.199 -13.358 1.156 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.098 -13.870 2.034 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.855 -15.559 1.637 1.00 0.00 H new ATOM 0 HG2 GLU A 75 3.199 -14.433 -0.081 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.689 -15.019 -0.751 1.00 0.00 H new ATOM 1153 N LEU A 76 -0.954 -14.985 -0.619 1.00 0.00 N ATOM 1154 CA LEU A 76 -1.649 -15.853 -1.564 1.00 0.00 C ATOM 1155 C LEU A 76 -0.779 -16.098 -2.792 1.00 0.00 C ATOM 1156 O LEU A 76 -0.318 -15.152 -3.432 1.00 0.00 O ATOM 1157 CB LEU A 76 -2.980 -15.227 -1.997 1.00 0.00 C ATOM 1158 CG LEU A 76 -3.834 -16.105 -2.929 1.00 0.00 C ATOM 1159 CD1 LEU A 76 -4.310 -17.359 -2.202 1.00 0.00 C ATOM 1160 CD2 LEU A 76 -5.016 -15.320 -3.489 1.00 0.00 C ATOM 0 H LEU A 76 -0.711 -14.068 -0.995 1.00 0.00 H new ATOM 0 HA LEU A 76 -1.850 -16.802 -1.068 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.563 -14.994 -1.106 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.774 -14.282 -2.499 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.210 -16.414 -3.768 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -4.912 -17.966 -2.879 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.447 -17.936 -1.868 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -4.911 -17.073 -1.339 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.603 -15.964 -4.144 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.642 -14.970 -2.668 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.649 -14.464 -4.055 1.00 0.00 H new ATOM 1172 N ARG A 77 -0.572 -17.363 -3.130 1.00 0.00 N ATOM 1173 CA ARG A 77 0.250 -17.731 -4.272 1.00 0.00 C ATOM 1174 C ARG A 77 -0.611 -18.423 -5.319 1.00 0.00 C ATOM 1175 O ARG A 77 -0.916 -19.609 -5.205 1.00 0.00 O ATOM 1176 CB ARG A 77 1.407 -18.639 -3.826 1.00 0.00 C ATOM 1177 CG ARG A 77 2.329 -19.072 -4.961 1.00 0.00 C ATOM 1178 CD ARG A 77 3.533 -19.847 -4.442 1.00 0.00 C ATOM 1179 NE ARG A 77 4.442 -20.239 -5.520 1.00 0.00 N ATOM 1180 CZ ARG A 77 5.749 -20.450 -5.359 1.00 0.00 C ATOM 1181 NH1 ARG A 77 6.316 -20.279 -4.168 1.00 0.00 N ATOM 1182 NH2 ARG A 77 6.484 -20.842 -6.390 1.00 0.00 N ATOM 0 H ARG A 77 -0.966 -18.157 -2.624 1.00 0.00 H new ATOM 0 HA ARG A 77 0.679 -16.831 -4.712 1.00 0.00 H new ATOM 0 HB2 ARG A 77 1.996 -18.116 -3.073 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.994 -19.527 -3.348 1.00 0.00 H new ATOM 0 HG2 ARG A 77 1.773 -19.691 -5.665 1.00 0.00 H new ATOM 0 HG3 ARG A 77 2.670 -18.193 -5.509 1.00 0.00 H new ATOM 0 HD2 ARG A 77 4.072 -19.236 -3.718 1.00 0.00 H new ATOM 0 HD3 ARG A 77 3.191 -20.738 -3.915 1.00 0.00 H new ATOM 0 HE ARG A 77 4.051 -20.358 -6.454 1.00 0.00 H new ATOM 0 HH11 ARG A 77 5.751 -19.985 -3.372 1.00 0.00 H new ATOM 0 HH12 ARG A 77 7.316 -20.442 -4.051 1.00 0.00 H new ATOM 0 HH21 ARG A 77 6.050 -20.981 -7.302 1.00 0.00 H new ATOM 0 HH22 ARG A 77 7.484 -21.004 -6.271 1.00 0.00 H new ATOM 1196 N VAL A 78 -1.022 -17.662 -6.322 1.00 0.00 N ATOM 1197 CA VAL A 78 -1.858 -18.181 -7.395 1.00 0.00 C ATOM 1198 C VAL A 78 -0.990 -18.880 -8.436 1.00 0.00 C ATOM 1199 O VAL A 78 -0.019 -18.302 -8.935 1.00 0.00 O ATOM 1200 CB VAL A 78 -2.672 -17.045 -8.055 1.00 0.00 C ATOM 1201 CG1 VAL A 78 -3.473 -17.560 -9.252 1.00 0.00 C ATOM 1202 CG2 VAL A 78 -3.594 -16.383 -7.031 1.00 0.00 C ATOM 0 H VAL A 78 -0.788 -16.674 -6.416 1.00 0.00 H new ATOM 0 HA VAL A 78 -2.559 -18.900 -6.972 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.969 -16.297 -8.423 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -4.035 -16.738 -9.695 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.791 -17.975 -9.994 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -4.164 -18.335 -8.921 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.160 -15.585 -7.513 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -4.284 -17.125 -6.629 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.997 -15.966 -6.220 1.00 0.00 H new ATOM 1212 N LEU A 79 -1.332 -20.125 -8.749 1.00 0.00 N ATOM 1213 CA LEU A 79 -0.523 -20.946 -9.642 1.00 0.00 C ATOM 1214 C LEU A 79 -1.044 -20.873 -11.079 1.00 0.00 C ATOM 1215 O LEU A 79 -0.330 -20.434 -11.987 1.00 0.00 O ATOM 1216 CB LEU A 79 -0.506 -22.399 -9.141 1.00 0.00 C ATOM 1217 CG LEU A 79 -0.034 -22.580 -7.685 1.00 0.00 C ATOM 1218 CD1 LEU A 79 -0.035 -24.054 -7.291 1.00 0.00 C ATOM 1219 CD2 LEU A 79 1.351 -21.966 -7.480 1.00 0.00 C ATOM 0 H LEU A 79 -2.168 -20.589 -8.395 1.00 0.00 H new ATOM 0 HA LEU A 79 0.496 -20.560 -9.641 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.510 -22.812 -9.236 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.142 -22.985 -9.793 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.737 -22.056 -7.037 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.302 -24.155 -6.259 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.044 -24.455 -7.384 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.637 -24.607 -7.948 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.662 -22.107 -6.445 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.066 -22.453 -8.143 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.314 -20.900 -7.706 1.00 0.00 H new ATOM 1231 N GLY A 80 -2.292 -21.283 -11.282 1.00 0.00 N ATOM 1232 CA GLY A 80 -2.859 -21.298 -12.621 1.00 0.00 C ATOM 1233 C GLY A 80 -4.371 -21.327 -12.612 1.00 0.00 C ATOM 1234 O GLY A 80 -4.979 -21.735 -11.624 1.00 0.00 O ATOM 0 H GLY A 80 -2.921 -21.605 -10.546 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -2.519 -20.417 -13.165 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.486 -22.169 -13.160 1.00 0.00 H new ATOM 1238 N SER A 81 -4.978 -20.899 -13.714 1.00 0.00 N ATOM 1239 CA SER A 81 -6.429 -20.866 -13.839 1.00 0.00 C ATOM 1240 C SER A 81 -6.856 -21.374 -15.213 1.00 0.00 C ATOM 1241 O SER A 81 -6.065 -21.366 -16.162 1.00 0.00 O ATOM 1242 CB SER A 81 -6.942 -19.437 -13.618 1.00 0.00 C ATOM 1243 OG SER A 81 -6.374 -18.534 -14.555 1.00 0.00 O ATOM 0 H SER A 81 -4.481 -20.567 -14.540 1.00 0.00 H new ATOM 0 HA SER A 81 -6.861 -21.518 -13.080 1.00 0.00 H new ATOM 0 HB2 SER A 81 -8.028 -19.421 -13.707 1.00 0.00 H new ATOM 0 HB3 SER A 81 -6.700 -19.114 -12.606 1.00 0.00 H new ATOM 0 HG SER A 81 -7.058 -17.899 -14.854 1.00 0.00 H new ATOM 1249 N SER A 82 -8.097 -21.832 -15.314 1.00 0.00 N ATOM 1250 CA SER A 82 -8.656 -22.297 -16.576 1.00 0.00 C ATOM 1251 C SER A 82 -10.165 -22.060 -16.603 1.00 0.00 C ATOM 1252 O SER A 82 -10.859 -22.327 -15.617 1.00 0.00 O ATOM 1253 CB SER A 82 -8.346 -23.788 -16.779 1.00 0.00 C ATOM 1254 OG SER A 82 -6.944 -24.023 -16.819 1.00 0.00 O ATOM 0 H SER A 82 -8.742 -21.891 -14.526 1.00 0.00 H new ATOM 0 HA SER A 82 -8.199 -21.734 -17.390 1.00 0.00 H new ATOM 0 HB2 SER A 82 -8.791 -24.368 -15.970 1.00 0.00 H new ATOM 0 HB3 SER A 82 -8.802 -24.133 -17.707 1.00 0.00 H new ATOM 0 HG SER A 82 -6.776 -24.980 -16.947 1.00 0.00 H new ATOM 1260 N GLU A 83 -10.662 -21.542 -17.722 1.00 0.00 N ATOM 1261 CA GLU A 83 -12.093 -21.319 -17.908 1.00 0.00 C ATOM 1262 C GLU A 83 -12.661 -22.405 -18.821 1.00 0.00 C ATOM 1263 O GLU A 83 -12.283 -22.503 -19.990 1.00 0.00 O ATOM 1264 CB GLU A 83 -12.350 -19.928 -18.516 1.00 0.00 C ATOM 1265 CG GLU A 83 -13.830 -19.604 -18.715 1.00 0.00 C ATOM 1266 CD GLU A 83 -14.057 -18.262 -19.400 1.00 0.00 C ATOM 1267 OE1 GLU A 83 -13.925 -18.196 -20.641 1.00 0.00 O ATOM 1268 OE2 GLU A 83 -14.385 -17.271 -18.710 1.00 0.00 O ATOM 0 H GLU A 83 -10.090 -21.267 -18.520 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.588 -21.364 -16.938 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.906 -19.172 -17.869 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -11.841 -19.863 -19.478 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -14.292 -20.392 -19.309 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -14.329 -19.601 -17.746 1.00 0.00 H new ATOM 1275 N LYS A 84 -13.546 -23.236 -18.279 1.00 0.00 N ATOM 1276 CA LYS A 84 -14.159 -24.319 -19.047 1.00 0.00 C ATOM 1277 C LYS A 84 -15.602 -23.942 -19.390 1.00 0.00 C ATOM 1278 O LYS A 84 -16.546 -24.343 -18.701 1.00 0.00 O ATOM 1279 CB LYS A 84 -14.129 -25.646 -18.253 1.00 0.00 C ATOM 1280 CG LYS A 84 -12.914 -25.817 -17.337 1.00 0.00 C ATOM 1281 CD LYS A 84 -11.596 -25.820 -18.105 1.00 0.00 C ATOM 1282 CE LYS A 84 -11.462 -27.027 -19.025 1.00 0.00 C ATOM 1283 NZ LYS A 84 -10.194 -26.991 -19.801 1.00 0.00 N ATOM 0 H LYS A 84 -13.856 -23.181 -17.309 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.590 -24.464 -19.965 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -15.034 -25.713 -17.649 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -14.154 -26.476 -18.959 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -12.901 -25.011 -16.603 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -13.010 -26.751 -16.783 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -11.521 -24.907 -18.695 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.767 -25.812 -17.398 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.500 -27.941 -18.433 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -12.308 -27.056 -19.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -10.139 -27.828 -20.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.169 -26.131 -20.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -9.386 -26.989 -19.146 1.00 0.00 H new ATOM 1297 N GLY A 85 -15.762 -23.131 -20.430 1.00 0.00 N ATOM 1298 CA GLY A 85 -17.083 -22.680 -20.839 1.00 0.00 C ATOM 1299 C GLY A 85 -17.740 -21.781 -19.802 1.00 0.00 C ATOM 1300 O GLY A 85 -17.503 -20.570 -19.783 1.00 0.00 O ATOM 0 H GLY A 85 -14.996 -22.775 -21.002 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -17.003 -22.141 -21.783 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -17.719 -23.546 -21.019 1.00 0.00 H new ATOM 1304 N SER A 86 -18.557 -22.375 -18.932 1.00 0.00 N ATOM 1305 CA SER A 86 -19.269 -21.628 -17.892 1.00 0.00 C ATOM 1306 C SER A 86 -18.838 -22.082 -16.494 1.00 0.00 C ATOM 1307 O SER A 86 -19.372 -21.613 -15.487 1.00 0.00 O ATOM 1308 CB SER A 86 -20.784 -21.795 -18.066 1.00 0.00 C ATOM 1309 OG SER A 86 -21.215 -21.264 -19.310 1.00 0.00 O ATOM 0 H SER A 86 -18.744 -23.378 -18.926 1.00 0.00 H new ATOM 0 HA SER A 86 -19.015 -20.573 -17.995 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.046 -22.851 -18.007 1.00 0.00 H new ATOM 0 HB3 SER A 86 -21.305 -21.291 -17.252 1.00 0.00 H new ATOM 0 HG SER A 86 -22.184 -21.384 -19.399 1.00 0.00 H new ATOM 1315 N ARG A 87 -17.873 -22.993 -16.438 1.00 0.00 N ATOM 1316 CA ARG A 87 -17.298 -23.435 -15.170 1.00 0.00 C ATOM 1317 C ARG A 87 -15.784 -23.323 -15.260 1.00 0.00 C ATOM 1318 O ARG A 87 -15.192 -23.737 -16.245 1.00 0.00 O ATOM 1319 CB ARG A 87 -17.728 -24.883 -14.845 1.00 0.00 C ATOM 1320 CG ARG A 87 -17.373 -25.345 -13.424 1.00 0.00 C ATOM 1321 CD ARG A 87 -15.951 -25.906 -13.304 1.00 0.00 C ATOM 1322 NE ARG A 87 -15.855 -27.285 -13.801 1.00 0.00 N ATOM 1323 CZ ARG A 87 -14.990 -28.196 -13.336 1.00 0.00 C ATOM 1324 NH1 ARG A 87 -14.049 -27.848 -12.465 1.00 0.00 N ATOM 1325 NH2 ARG A 87 -15.045 -29.449 -13.769 1.00 0.00 N ATOM 0 H ARG A 87 -17.470 -23.443 -17.260 1.00 0.00 H new ATOM 0 HA ARG A 87 -17.663 -22.802 -14.361 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -18.806 -24.969 -14.984 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -17.260 -25.558 -15.561 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -17.483 -24.505 -12.738 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -18.085 -26.108 -13.110 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -15.263 -25.271 -13.863 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -15.637 -25.875 -12.261 1.00 0.00 H new ATOM 0 HE ARG A 87 -16.488 -27.567 -14.549 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -13.982 -26.882 -12.146 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -13.394 -28.547 -12.115 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -15.747 -29.720 -14.457 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -14.385 -30.141 -13.413 1.00 0.00 H new ATOM 1339 N GLY A 88 -15.162 -22.759 -14.242 1.00 0.00 N ATOM 1340 CA GLY A 88 -13.724 -22.571 -14.259 1.00 0.00 C ATOM 1341 C GLY A 88 -13.073 -23.135 -13.025 1.00 0.00 C ATOM 1342 O GLY A 88 -13.758 -23.618 -12.121 1.00 0.00 O ATOM 0 H GLY A 88 -15.627 -22.425 -13.398 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -13.305 -23.051 -15.143 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.497 -21.508 -14.336 1.00 0.00 H new ATOM 1346 N THR A 89 -11.754 -23.088 -12.986 1.00 0.00 N ATOM 1347 CA THR A 89 -11.001 -23.582 -11.848 1.00 0.00 C ATOM 1348 C THR A 89 -9.655 -22.873 -11.761 1.00 0.00 C ATOM 1349 O THR A 89 -9.026 -22.591 -12.785 1.00 0.00 O ATOM 1350 CB THR A 89 -10.783 -25.113 -11.945 1.00 0.00 C ATOM 1351 OG1 THR A 89 -12.051 -25.783 -12.031 1.00 0.00 O ATOM 1352 CG2 THR A 89 -10.013 -25.637 -10.738 1.00 0.00 C ATOM 0 H THR A 89 -11.178 -22.709 -13.737 1.00 0.00 H new ATOM 0 HA THR A 89 -11.578 -23.374 -10.947 1.00 0.00 H new ATOM 0 HB THR A 89 -10.198 -25.314 -12.842 1.00 0.00 H new ATOM 0 HG1 THR A 89 -12.165 -26.154 -12.931 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.875 -26.714 -10.834 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.039 -25.150 -10.688 1.00 0.00 H new ATOM 0 HG23 THR A 89 -10.573 -25.423 -9.828 1.00 0.00 H new ATOM 1360 N VAL A 90 -9.233 -22.566 -10.541 1.00 0.00 N ATOM 1361 CA VAL A 90 -7.941 -21.945 -10.301 1.00 0.00 C ATOM 1362 C VAL A 90 -7.237 -22.644 -9.142 1.00 0.00 C ATOM 1363 O VAL A 90 -7.837 -22.897 -8.091 1.00 0.00 O ATOM 1364 CB VAL A 90 -8.072 -20.422 -10.023 1.00 0.00 C ATOM 1365 CG1 VAL A 90 -8.980 -20.149 -8.828 1.00 0.00 C ATOM 1366 CG2 VAL A 90 -6.697 -19.782 -9.822 1.00 0.00 C ATOM 0 H VAL A 90 -9.775 -22.740 -9.695 1.00 0.00 H new ATOM 0 HA VAL A 90 -7.343 -22.056 -11.205 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.534 -19.966 -10.899 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -9.049 -19.074 -8.662 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -9.974 -20.550 -9.027 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.567 -20.628 -7.940 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.817 -18.716 -9.629 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.198 -20.251 -8.974 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -6.095 -19.923 -10.720 1.00 0.00 H new ATOM 1376 N GLU A 91 -5.977 -22.992 -9.364 1.00 0.00 N ATOM 1377 CA GLU A 91 -5.160 -23.661 -8.365 1.00 0.00 C ATOM 1378 C GLU A 91 -4.247 -22.643 -7.693 1.00 0.00 C ATOM 1379 O GLU A 91 -3.689 -21.768 -8.366 1.00 0.00 O ATOM 1380 CB GLU A 91 -4.330 -24.766 -9.030 1.00 0.00 C ATOM 1381 CG GLU A 91 -3.548 -25.627 -8.048 1.00 0.00 C ATOM 1382 CD GLU A 91 -2.735 -26.707 -8.739 1.00 0.00 C ATOM 1383 OE1 GLU A 91 -3.337 -27.574 -9.403 1.00 0.00 O ATOM 1384 OE2 GLU A 91 -1.492 -26.689 -8.625 1.00 0.00 O ATOM 0 H GLU A 91 -5.493 -22.817 -10.245 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.802 -24.114 -7.610 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.994 -25.406 -9.610 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.633 -24.310 -9.733 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.881 -24.992 -7.465 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.240 -26.092 -7.346 1.00 0.00 H new ATOM 1391 N PHE A 92 -4.093 -22.753 -6.378 1.00 0.00 N ATOM 1392 CA PHE A 92 -3.312 -21.781 -5.621 1.00 0.00 C ATOM 1393 C PHE A 92 -2.759 -22.383 -4.334 1.00 0.00 C ATOM 1394 O PHE A 92 -2.969 -23.562 -4.038 1.00 0.00 O ATOM 1395 CB PHE A 92 -4.172 -20.550 -5.296 1.00 0.00 C ATOM 1396 CG PHE A 92 -5.366 -20.839 -4.413 1.00 0.00 C ATOM 1397 CD1 PHE A 92 -6.500 -21.452 -4.929 1.00 0.00 C ATOM 1398 CD2 PHE A 92 -5.358 -20.481 -3.071 1.00 0.00 C ATOM 1399 CE1 PHE A 92 -7.595 -21.703 -4.126 1.00 0.00 C ATOM 1400 CE2 PHE A 92 -6.454 -20.727 -2.266 1.00 0.00 C ATOM 1401 CZ PHE A 92 -7.573 -21.339 -2.794 1.00 0.00 C ATOM 0 H PHE A 92 -4.497 -23.502 -5.816 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.467 -21.481 -6.240 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.546 -19.803 -4.808 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -4.523 -20.110 -6.229 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.526 -21.736 -5.971 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.484 -20.004 -2.651 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.469 -22.184 -4.540 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.435 -20.441 -1.225 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.430 -21.533 -2.166 1.00 0.00 H new ATOM 1411 N ILE A 93 -2.027 -21.554 -3.598 1.00 0.00 N ATOM 1412 CA ILE A 93 -1.501 -21.902 -2.287 1.00 0.00 C ATOM 1413 C ILE A 93 -1.753 -20.746 -1.322 1.00 0.00 C ATOM 1414 O ILE A 93 -1.198 -19.654 -1.492 1.00 0.00 O ATOM 1415 CB ILE A 93 0.021 -22.203 -2.337 1.00 0.00 C ATOM 1416 CG1 ILE A 93 0.303 -23.447 -3.194 1.00 0.00 C ATOM 1417 CG2 ILE A 93 0.581 -22.385 -0.925 1.00 0.00 C ATOM 1418 CD1 ILE A 93 1.773 -23.791 -3.309 1.00 0.00 C ATOM 0 H ILE A 93 -1.781 -20.611 -3.900 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.011 -22.804 -1.948 1.00 0.00 H new ATOM 0 HB ILE A 93 0.521 -21.351 -2.798 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.227 -24.298 -2.767 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.102 -23.288 -4.193 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.649 -22.595 -0.981 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.421 -21.473 -0.350 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.073 -23.216 -0.436 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.891 -24.680 -3.929 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.307 -22.957 -3.765 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.180 -23.984 -2.317 1.00 0.00 H new ATOM 1430 N ALA A 94 -2.608 -20.976 -0.335 1.00 0.00 N ATOM 1431 CA ALA A 94 -2.915 -19.965 0.669 1.00 0.00 C ATOM 1432 C ALA A 94 -1.989 -20.114 1.874 1.00 0.00 C ATOM 1433 O ALA A 94 -2.034 -21.126 2.578 1.00 0.00 O ATOM 1434 CB ALA A 94 -4.377 -20.071 1.093 1.00 0.00 C ATOM 0 H ALA A 94 -3.104 -21.858 -0.207 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.753 -18.978 0.235 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.594 -19.311 1.843 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.019 -19.919 0.226 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.563 -21.059 1.513 1.00 0.00 H new ATOM 1440 N ARG A 95 -1.133 -19.118 2.092 1.00 0.00 N ATOM 1441 CA ARG A 95 -0.242 -19.109 3.246 1.00 0.00 C ATOM 1442 C ARG A 95 -0.865 -18.297 4.373 1.00 0.00 C ATOM 1443 O ARG A 95 -1.153 -17.107 4.212 1.00 0.00 O ATOM 1444 CB ARG A 95 1.133 -18.529 2.887 1.00 0.00 C ATOM 1445 CG ARG A 95 2.097 -18.471 4.074 1.00 0.00 C ATOM 1446 CD ARG A 95 3.440 -17.858 3.694 1.00 0.00 C ATOM 1447 NE ARG A 95 4.361 -17.796 4.835 1.00 0.00 N ATOM 1448 CZ ARG A 95 5.681 -17.990 4.751 1.00 0.00 C ATOM 1449 NH1 ARG A 95 6.244 -18.331 3.596 1.00 0.00 N ATOM 1450 NH2 ARG A 95 6.438 -17.855 5.830 1.00 0.00 N ATOM 0 H ARG A 95 -1.039 -18.306 1.482 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.100 -20.140 3.571 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.578 -19.132 2.096 1.00 0.00 H new ATOM 0 HB3 ARG A 95 1.002 -17.524 2.486 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.647 -17.887 4.877 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.255 -19.478 4.461 1.00 0.00 H new ATOM 0 HD2 ARG A 95 3.893 -18.445 2.895 1.00 0.00 H new ATOM 0 HD3 ARG A 95 3.282 -16.854 3.302 1.00 0.00 H new ATOM 0 HE ARG A 95 3.968 -17.591 5.754 1.00 0.00 H new ATOM 0 HH11 ARG A 95 5.668 -18.447 2.762 1.00 0.00 H new ATOM 0 HH12 ARG A 95 7.252 -18.476 3.543 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.013 -17.603 6.723 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.445 -18.003 5.768 1.00 0.00 H new ATOM 1464 N PHE A 96 -1.063 -18.946 5.508 1.00 0.00 N ATOM 1465 CA PHE A 96 -1.684 -18.327 6.667 1.00 0.00 C ATOM 1466 C PHE A 96 -1.037 -18.843 7.944 1.00 0.00 C ATOM 1467 O PHE A 96 -0.471 -19.937 7.962 1.00 0.00 O ATOM 1468 CB PHE A 96 -3.198 -18.613 6.675 1.00 0.00 C ATOM 1469 CG PHE A 96 -3.562 -20.028 6.279 1.00 0.00 C ATOM 1470 CD1 PHE A 96 -3.198 -21.110 7.070 1.00 0.00 C ATOM 1471 CD2 PHE A 96 -4.266 -20.273 5.106 1.00 0.00 C ATOM 1472 CE1 PHE A 96 -3.526 -22.400 6.700 1.00 0.00 C ATOM 1473 CE2 PHE A 96 -4.597 -21.561 4.734 1.00 0.00 C ATOM 1474 CZ PHE A 96 -4.226 -22.626 5.531 1.00 0.00 C ATOM 0 H PHE A 96 -0.797 -19.920 5.652 1.00 0.00 H new ATOM 0 HA PHE A 96 -1.536 -17.248 6.614 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -3.589 -18.414 7.673 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -3.692 -17.919 5.995 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -2.652 -20.941 7.986 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.558 -19.445 4.477 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -3.235 -23.232 7.325 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -5.146 -21.735 3.820 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.483 -23.634 5.241 1.00 0.00 H new ATOM 1484 N ARG A 97 -1.108 -18.058 9.006 1.00 0.00 N ATOM 1485 CA ARG A 97 -0.641 -18.506 10.305 1.00 0.00 C ATOM 1486 C ARG A 97 -1.804 -19.174 11.023 1.00 0.00 C ATOM 1487 O ARG A 97 -2.750 -18.505 11.445 1.00 0.00 O ATOM 1488 CB ARG A 97 -0.099 -17.331 11.129 1.00 0.00 C ATOM 1489 CG ARG A 97 0.591 -17.758 12.423 1.00 0.00 C ATOM 1490 CD ARG A 97 1.011 -16.559 13.263 1.00 0.00 C ATOM 1491 NE ARG A 97 -0.141 -15.773 13.711 1.00 0.00 N ATOM 1492 CZ ARG A 97 -0.197 -14.440 13.691 1.00 0.00 C ATOM 1493 NH1 ARG A 97 0.811 -13.732 13.196 1.00 0.00 N ATOM 1494 NH2 ARG A 97 -1.269 -13.814 14.156 1.00 0.00 N ATOM 0 H ARG A 97 -1.484 -17.110 8.993 1.00 0.00 H new ATOM 0 HA ARG A 97 0.177 -19.215 10.178 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.607 -16.766 10.520 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.921 -16.658 11.371 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -0.082 -18.390 13.002 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.468 -18.360 12.186 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.574 -16.903 14.130 1.00 0.00 H new ATOM 0 HD3 ARG A 97 1.679 -15.924 12.681 1.00 0.00 H new ATOM 0 HE ARG A 97 -0.955 -16.278 14.062 1.00 0.00 H new ATOM 0 HH11 ARG A 97 1.635 -14.207 12.828 1.00 0.00 H new ATOM 0 HH12 ARG A 97 0.761 -12.713 13.184 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -2.051 -14.351 14.529 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -1.311 -12.795 14.141 1.00 0.00 H new ATOM 1508 N ARG A 98 -1.743 -20.493 11.136 1.00 0.00 N ATOM 1509 CA ARG A 98 -2.850 -21.261 11.690 1.00 0.00 C ATOM 1510 C ARG A 98 -2.934 -21.054 13.199 1.00 0.00 C ATOM 1511 O ARG A 98 -1.906 -20.875 13.859 1.00 0.00 O ATOM 1512 CB ARG A 98 -2.683 -22.751 11.361 1.00 0.00 C ATOM 1513 CG ARG A 98 -3.903 -23.597 11.715 1.00 0.00 C ATOM 1514 CD ARG A 98 -3.692 -25.069 11.382 1.00 0.00 C ATOM 1515 NE ARG A 98 -4.907 -25.855 11.598 1.00 0.00 N ATOM 1516 CZ ARG A 98 -4.918 -27.150 11.916 1.00 0.00 C ATOM 1517 NH1 ARG A 98 -3.780 -27.803 12.116 1.00 0.00 N ATOM 1518 NH2 ARG A 98 -6.071 -27.788 12.050 1.00 0.00 N ATOM 0 H ARG A 98 -0.940 -21.054 10.852 1.00 0.00 H new ATOM 0 HA ARG A 98 -3.778 -20.910 11.240 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -2.474 -22.858 10.297 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -1.816 -23.137 11.897 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -4.120 -23.493 12.778 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -4.773 -23.224 11.174 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -3.377 -25.165 10.343 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -2.886 -25.469 11.998 1.00 0.00 H new ATOM 0 HE ARG A 98 -5.805 -25.381 11.499 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -2.889 -27.314 12.027 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -3.796 -28.794 12.359 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -6.949 -27.289 11.910 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -6.081 -28.779 12.293 1.00 0.00 H new ATOM 1553 N PRO A 102 2.610 -22.177 13.891 1.00 0.00 N ATOM 1554 CA PRO A 102 3.352 -22.113 12.623 1.00 0.00 C ATOM 1555 C PRO A 102 2.525 -21.571 11.452 1.00 0.00 C ATOM 1556 O PRO A 102 1.289 -21.589 11.473 1.00 0.00 O ATOM 1557 CB PRO A 102 3.739 -23.578 12.379 1.00 0.00 C ATOM 1558 CG PRO A 102 2.647 -24.364 13.023 1.00 0.00 C ATOM 1559 CD PRO A 102 2.206 -23.561 14.224 1.00 0.00 C ATOM 0 HA PRO A 102 4.196 -21.426 12.688 1.00 0.00 H new ATOM 0 HB2 PRO A 102 3.811 -23.798 11.314 1.00 0.00 H new ATOM 0 HB3 PRO A 102 4.709 -23.811 12.819 1.00 0.00 H new ATOM 0 HG2 PRO A 102 1.818 -24.519 12.332 1.00 0.00 H new ATOM 0 HG3 PRO A 102 3.001 -25.351 13.322 1.00 0.00 H new ATOM 0 HD2 PRO A 102 1.130 -23.637 14.383 1.00 0.00 H new ATOM 0 HD3 PRO A 102 2.688 -23.910 15.137 1.00 0.00 H new ATOM 1567 N GLU A 103 3.230 -21.085 10.433 1.00 0.00 N ATOM 1568 CA GLU A 103 2.610 -20.624 9.197 1.00 0.00 C ATOM 1569 C GLU A 103 2.350 -21.810 8.278 1.00 0.00 C ATOM 1570 O GLU A 103 3.288 -22.431 7.772 1.00 0.00 O ATOM 1571 CB GLU A 103 3.518 -19.616 8.486 1.00 0.00 C ATOM 1572 CG GLU A 103 3.787 -18.353 9.289 1.00 0.00 C ATOM 1573 CD GLU A 103 4.861 -17.485 8.654 1.00 0.00 C ATOM 1574 OE1 GLU A 103 4.582 -16.839 7.621 1.00 0.00 O ATOM 1575 OE2 GLU A 103 5.997 -17.457 9.168 1.00 0.00 O ATOM 0 H GLU A 103 4.246 -21.000 10.443 1.00 0.00 H new ATOM 0 HA GLU A 103 1.666 -20.137 9.442 1.00 0.00 H new ATOM 0 HB2 GLU A 103 4.468 -20.098 8.256 1.00 0.00 H new ATOM 0 HB3 GLU A 103 3.062 -19.340 7.535 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.865 -17.779 9.379 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.093 -18.625 10.299 1.00 0.00 H new ATOM 1582 N GLN A 104 1.084 -22.122 8.066 1.00 0.00 N ATOM 1583 CA GLN A 104 0.703 -23.242 7.219 1.00 0.00 C ATOM 1584 C GLN A 104 0.288 -22.741 5.843 1.00 0.00 C ATOM 1585 O GLN A 104 -0.330 -21.686 5.713 1.00 0.00 O ATOM 1586 CB GLN A 104 -0.432 -24.048 7.865 1.00 0.00 C ATOM 1587 CG GLN A 104 -0.951 -25.194 6.997 1.00 0.00 C ATOM 1588 CD GLN A 104 -1.936 -26.104 7.718 1.00 0.00 C ATOM 1589 OE1 GLN A 104 -1.721 -26.326 9.007 1.00 0.00 O flip ATOM 1590 NE2 GLN A 104 -2.867 -26.632 7.110 1.00 0.00 N flip ATOM 0 H GLN A 104 0.298 -21.614 8.470 1.00 0.00 H new ATOM 0 HA GLN A 104 1.564 -23.900 7.105 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -0.081 -24.454 8.814 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -1.258 -23.375 8.092 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -1.433 -24.779 6.112 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -0.106 -25.789 6.651 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -3.003 -26.439 6.118 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -3.502 -27.263 7.598 1.00 0.00 H new ATOM 1599 N SER A 105 0.644 -23.499 4.822 1.00 0.00 N ATOM 1600 CA SER A 105 0.303 -23.162 3.450 1.00 0.00 C ATOM 1601 C SER A 105 -0.536 -24.281 2.851 1.00 0.00 C ATOM 1602 O SER A 105 -0.064 -25.411 2.707 1.00 0.00 O ATOM 1603 CB SER A 105 1.578 -22.938 2.627 1.00 0.00 C ATOM 1604 OG SER A 105 2.433 -24.069 2.687 1.00 0.00 O ATOM 0 H SER A 105 1.176 -24.364 4.919 1.00 0.00 H new ATOM 0 HA SER A 105 -0.275 -22.238 3.434 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.313 -22.734 1.590 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.105 -22.060 3.000 1.00 0.00 H new ATOM 0 HG SER A 105 1.893 -24.887 2.699 1.00 0.00 H new ATOM 1610 N HIS A 106 -1.785 -23.979 2.534 1.00 0.00 N ATOM 1611 CA HIS A 106 -2.693 -24.976 1.988 1.00 0.00 C ATOM 1612 C HIS A 106 -2.709 -24.869 0.470 1.00 0.00 C ATOM 1613 O HIS A 106 -3.030 -23.817 -0.077 1.00 0.00 O ATOM 1614 CB HIS A 106 -4.106 -24.792 2.561 1.00 0.00 C ATOM 1615 CG HIS A 106 -5.019 -25.957 2.306 1.00 0.00 C ATOM 1616 ND1 HIS A 106 -6.296 -25.825 1.810 1.00 0.00 N ATOM 1617 CD2 HIS A 106 -4.837 -27.284 2.510 1.00 0.00 C ATOM 1618 CE1 HIS A 106 -6.860 -27.014 1.721 1.00 0.00 C ATOM 1619 NE2 HIS A 106 -5.995 -27.915 2.139 1.00 0.00 N ATOM 0 H HIS A 106 -2.194 -23.051 2.645 1.00 0.00 H new ATOM 0 HA HIS A 106 -2.345 -25.970 2.271 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.034 -24.627 3.636 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.549 -23.894 2.130 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -6.738 -24.943 1.551 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -3.945 -27.756 2.894 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -7.860 -27.214 1.366 1.00 0.00 H new ATOM 1628 N HIS A 107 -2.314 -25.948 -0.196 1.00 0.00 N ATOM 1629 CA HIS A 107 -2.303 -26.004 -1.654 1.00 0.00 C ATOM 1630 C HIS A 107 -3.506 -26.794 -2.156 1.00 0.00 C ATOM 1631 O HIS A 107 -3.507 -28.029 -2.129 1.00 0.00 O ATOM 1632 CB HIS A 107 -0.993 -26.641 -2.145 1.00 0.00 C ATOM 1633 CG HIS A 107 -0.921 -26.871 -3.628 1.00 0.00 C ATOM 1634 ND1 HIS A 107 -0.088 -27.809 -4.196 1.00 0.00 N ATOM 1635 CD2 HIS A 107 -1.564 -26.272 -4.660 1.00 0.00 C ATOM 1636 CE1 HIS A 107 -0.218 -27.778 -5.506 1.00 0.00 C ATOM 1637 NE2 HIS A 107 -1.107 -26.856 -5.814 1.00 0.00 N ATOM 0 H HIS A 107 -1.994 -26.805 0.256 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.366 -24.991 -2.051 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -0.161 -26.001 -1.850 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -0.857 -27.595 -1.636 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.298 -25.483 -4.587 1.00 0.00 H new ATOM 0 HE1 HIS A 107 0.314 -28.402 -6.209 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.407 -26.615 -6.759 1.00 0.00 H new ATOM 1646 N GLU A 108 -4.527 -26.077 -2.606 1.00 0.00 N ATOM 1647 CA GLU A 108 -5.745 -26.693 -3.112 1.00 0.00 C ATOM 1648 C GLU A 108 -6.077 -26.163 -4.505 1.00 0.00 C ATOM 1649 O GLU A 108 -5.313 -25.389 -5.092 1.00 0.00 O ATOM 1650 CB GLU A 108 -6.931 -26.453 -2.157 1.00 0.00 C ATOM 1651 CG GLU A 108 -7.384 -24.995 -2.045 1.00 0.00 C ATOM 1652 CD GLU A 108 -6.455 -24.132 -1.204 1.00 0.00 C ATOM 1653 OE1 GLU A 108 -5.420 -23.676 -1.725 1.00 0.00 O ATOM 1654 OE2 GLU A 108 -6.766 -23.907 -0.014 1.00 0.00 O ATOM 0 H GLU A 108 -4.534 -25.057 -2.630 1.00 0.00 H new ATOM 0 HA GLU A 108 -5.571 -27.767 -3.176 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -7.775 -27.056 -2.491 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -6.657 -26.810 -1.164 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.457 -24.568 -3.045 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.384 -24.966 -1.612 1.00 0.00 H new ATOM 1661 N ARG A 109 -7.213 -26.600 -5.029 1.00 0.00 N ATOM 1662 CA ARG A 109 -7.657 -26.228 -6.362 1.00 0.00 C ATOM 1663 C ARG A 109 -9.149 -25.907 -6.310 1.00 0.00 C ATOM 1664 O ARG A 109 -9.980 -26.811 -6.200 1.00 0.00 O ATOM 1665 CB ARG A 109 -7.371 -27.384 -7.335 1.00 0.00 C ATOM 1666 CG ARG A 109 -7.400 -26.997 -8.806 1.00 0.00 C ATOM 1667 CD ARG A 109 -6.968 -28.154 -9.704 1.00 0.00 C ATOM 1668 NE ARG A 109 -7.124 -27.833 -11.128 1.00 0.00 N ATOM 1669 CZ ARG A 109 -6.110 -27.730 -11.996 1.00 0.00 C ATOM 1670 NH1 ARG A 109 -4.852 -27.847 -11.587 1.00 0.00 N ATOM 1671 NH2 ARG A 109 -6.354 -27.490 -13.279 1.00 0.00 N ATOM 0 H ARG A 109 -7.854 -27.224 -4.539 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.120 -25.347 -6.714 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -6.392 -27.803 -7.103 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.104 -28.173 -7.166 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.407 -26.681 -9.079 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.742 -26.144 -8.971 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -5.926 -28.402 -9.500 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.558 -29.038 -9.465 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.069 -27.678 -11.480 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -4.650 -28.017 -10.602 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -4.088 -27.767 -12.258 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -7.315 -27.384 -13.604 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -5.581 -27.412 -13.939 1.00 0.00 H new ATOM 1685 N SER A 110 -9.477 -24.620 -6.355 1.00 0.00 N ATOM 1686 CA SER A 110 -10.853 -24.165 -6.175 1.00 0.00 C ATOM 1687 C SER A 110 -11.577 -24.039 -7.514 1.00 0.00 C ATOM 1688 O SER A 110 -11.053 -23.449 -8.465 1.00 0.00 O ATOM 1689 CB SER A 110 -10.859 -22.820 -5.440 1.00 0.00 C ATOM 1690 OG SER A 110 -10.024 -21.876 -6.093 1.00 0.00 O ATOM 0 H SER A 110 -8.805 -23.869 -6.515 1.00 0.00 H new ATOM 0 HA SER A 110 -11.384 -24.907 -5.579 1.00 0.00 H new ATOM 0 HB2 SER A 110 -11.877 -22.435 -5.389 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.520 -22.962 -4.414 1.00 0.00 H new ATOM 0 HG SER A 110 -10.048 -22.032 -7.060 1.00 0.00 H new ATOM 1696 N GLN A 111 -12.779 -24.603 -7.578 1.00 0.00 N ATOM 1697 CA GLN A 111 -13.611 -24.531 -8.771 1.00 0.00 C ATOM 1698 C GLN A 111 -14.622 -23.398 -8.645 1.00 0.00 C ATOM 1699 O GLN A 111 -15.259 -23.220 -7.600 1.00 0.00 O ATOM 1700 CB GLN A 111 -14.337 -25.862 -9.018 1.00 0.00 C ATOM 1701 CG GLN A 111 -13.407 -27.025 -9.353 1.00 0.00 C ATOM 1702 CD GLN A 111 -12.500 -27.422 -8.198 1.00 0.00 C ATOM 1703 OE1 GLN A 111 -12.869 -27.296 -7.030 1.00 0.00 O ATOM 1704 NE2 GLN A 111 -11.302 -27.891 -8.513 1.00 0.00 N ATOM 0 H GLN A 111 -13.201 -25.120 -6.807 1.00 0.00 H new ATOM 0 HA GLN A 111 -12.961 -24.333 -9.623 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -14.916 -26.118 -8.131 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -15.046 -25.731 -9.835 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -14.006 -27.887 -9.648 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.793 -26.754 -10.212 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -11.031 -27.981 -9.492 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -10.650 -28.162 -7.776 1.00 0.00 H new ATOM 1713 N PHE A 112 -14.762 -22.644 -9.722 1.00 0.00 N ATOM 1714 CA PHE A 112 -15.655 -21.495 -9.767 1.00 0.00 C ATOM 1715 C PHE A 112 -16.699 -21.676 -10.864 1.00 0.00 C ATOM 1716 O PHE A 112 -16.506 -22.450 -11.804 1.00 0.00 O ATOM 1717 CB PHE A 112 -14.858 -20.200 -10.000 1.00 0.00 C ATOM 1718 CG PHE A 112 -14.051 -19.753 -8.805 1.00 0.00 C ATOM 1719 CD1 PHE A 112 -12.830 -20.343 -8.509 1.00 0.00 C ATOM 1720 CD2 PHE A 112 -14.516 -18.741 -7.976 1.00 0.00 C ATOM 1721 CE1 PHE A 112 -12.095 -19.932 -7.414 1.00 0.00 C ATOM 1722 CE2 PHE A 112 -13.783 -18.329 -6.880 1.00 0.00 C ATOM 1723 CZ PHE A 112 -12.571 -18.925 -6.599 1.00 0.00 C ATOM 0 H PHE A 112 -14.259 -22.811 -10.593 1.00 0.00 H new ATOM 0 HA PHE A 112 -16.166 -21.419 -8.807 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -14.186 -20.346 -10.845 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -15.550 -19.404 -10.277 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -12.451 -21.132 -9.142 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -15.464 -18.270 -8.191 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -11.146 -20.399 -7.195 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -14.158 -17.541 -6.244 1.00 0.00 H new ATOM 0 HZ PHE A 112 -11.996 -18.604 -5.743 1.00 0.00 H new ATOM 1733 N ARG A 113 -17.791 -20.946 -10.733 1.00 0.00 N ATOM 1734 CA ARG A 113 -18.914 -21.023 -11.654 1.00 0.00 C ATOM 1735 C ARG A 113 -19.192 -19.650 -12.239 1.00 0.00 C ATOM 1736 O ARG A 113 -19.073 -18.640 -11.546 1.00 0.00 O ATOM 1737 CB ARG A 113 -20.138 -21.542 -10.902 1.00 0.00 C ATOM 1738 CG ARG A 113 -21.439 -21.552 -11.697 1.00 0.00 C ATOM 1739 CD ARG A 113 -22.531 -22.234 -10.887 1.00 0.00 C ATOM 1740 NE ARG A 113 -23.837 -22.226 -11.537 1.00 0.00 N ATOM 1741 CZ ARG A 113 -24.948 -22.651 -10.934 1.00 0.00 C ATOM 1742 NH1 ARG A 113 -24.902 -23.034 -9.659 1.00 0.00 N ATOM 1743 NH2 ARG A 113 -26.101 -22.671 -11.589 1.00 0.00 N ATOM 0 H ARG A 113 -17.926 -20.275 -9.977 1.00 0.00 H new ATOM 0 HA ARG A 113 -18.680 -21.705 -12.471 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -19.931 -22.557 -10.563 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -20.281 -20.931 -10.011 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.736 -20.532 -11.939 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -21.294 -22.075 -12.643 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -22.237 -23.266 -10.695 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -22.614 -21.741 -9.919 1.00 0.00 H new ATOM 0 HE ARG A 113 -23.903 -21.880 -12.494 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -24.020 -23.001 -9.148 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -25.749 -23.360 -9.193 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -26.142 -22.360 -12.560 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -26.947 -22.997 -11.122 1.00 0.00 H new ATOM 1757 N LYS A 114 -19.554 -19.614 -13.510 1.00 0.00 N ATOM 1758 CA LYS A 114 -19.795 -18.361 -14.203 1.00 0.00 C ATOM 1759 C LYS A 114 -21.292 -18.151 -14.406 1.00 0.00 C ATOM 1760 O LYS A 114 -21.943 -18.910 -15.127 1.00 0.00 O ATOM 1761 CB LYS A 114 -19.067 -18.361 -15.547 1.00 0.00 C ATOM 1762 CG LYS A 114 -18.871 -16.967 -16.127 1.00 0.00 C ATOM 1763 CD LYS A 114 -17.998 -16.991 -17.375 1.00 0.00 C ATOM 1764 CE LYS A 114 -17.480 -15.602 -17.714 1.00 0.00 C ATOM 1765 NZ LYS A 114 -16.689 -15.600 -18.974 1.00 0.00 N ATOM 0 H LYS A 114 -19.688 -20.445 -14.086 1.00 0.00 H new ATOM 0 HA LYS A 114 -19.411 -17.540 -13.597 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -18.094 -18.836 -15.425 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -19.630 -18.966 -16.257 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -19.842 -16.535 -16.371 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -18.414 -16.322 -15.376 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -17.157 -17.667 -17.220 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -18.572 -17.383 -18.215 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -18.320 -14.914 -17.811 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -16.861 -15.235 -16.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -16.382 -14.630 -19.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -15.855 -16.210 -18.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -17.277 -15.958 -19.754 1.00 0.00 H new ATOM 1779 N ALA A 115 -21.831 -17.134 -13.747 1.00 0.00 N ATOM 1780 CA ALA A 115 -23.242 -16.790 -13.858 1.00 0.00 C ATOM 1781 C ALA A 115 -23.394 -15.282 -14.025 1.00 0.00 C ATOM 1782 O ALA A 115 -22.801 -14.507 -13.268 1.00 0.00 O ATOM 1783 CB ALA A 115 -24.008 -17.277 -12.632 1.00 0.00 C ATOM 0 H ALA A 115 -21.303 -16.525 -13.121 1.00 0.00 H new ATOM 0 HA ALA A 115 -23.660 -17.284 -14.735 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -25.061 -17.012 -12.731 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -23.913 -18.360 -12.550 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -23.599 -16.808 -11.737 1.00 0.00 H new ATOM 1789 N ARG A 116 -24.163 -14.876 -15.035 1.00 0.00 N ATOM 1790 CA ARG A 116 -24.382 -13.459 -15.338 1.00 0.00 C ATOM 1791 C ARG A 116 -23.049 -12.804 -15.736 1.00 0.00 C ATOM 1792 O ARG A 116 -22.900 -11.582 -15.707 1.00 0.00 O ATOM 1793 CB ARG A 116 -25.025 -12.748 -14.122 1.00 0.00 C ATOM 1794 CG ARG A 116 -26.093 -11.707 -14.474 1.00 0.00 C ATOM 1795 CD ARG A 116 -25.517 -10.478 -15.165 1.00 0.00 C ATOM 1796 NE ARG A 116 -26.551 -9.490 -15.473 1.00 0.00 N ATOM 1797 CZ ARG A 116 -26.310 -8.293 -16.008 1.00 0.00 C ATOM 1798 NH1 ARG A 116 -25.071 -7.926 -16.305 1.00 0.00 N ATOM 1799 NH2 ARG A 116 -27.313 -7.466 -16.258 1.00 0.00 N ATOM 0 H ARG A 116 -24.650 -15.515 -15.664 1.00 0.00 H new ATOM 0 HA ARG A 116 -25.070 -13.365 -16.178 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -25.473 -13.501 -13.474 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -24.238 -12.260 -13.547 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -26.840 -12.165 -15.122 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -26.607 -11.398 -13.563 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -24.760 -10.024 -14.526 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -25.018 -10.780 -16.086 1.00 0.00 H new ATOM 0 HE ARG A 116 -27.520 -9.733 -15.265 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -24.294 -8.561 -16.124 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -24.895 -7.008 -16.714 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -28.270 -7.745 -16.041 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -27.129 -6.550 -16.667 1.00 0.00 H new ATOM 1813 N GLY A 117 -22.085 -13.639 -16.121 1.00 0.00 N ATOM 1814 CA GLY A 117 -20.766 -13.154 -16.492 1.00 0.00 C ATOM 1815 C GLY A 117 -19.834 -13.034 -15.298 1.00 0.00 C ATOM 1816 O GLY A 117 -18.624 -12.866 -15.461 1.00 0.00 O ATOM 0 H GLY A 117 -22.197 -14.651 -16.183 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -20.327 -13.830 -17.225 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -20.862 -12.181 -16.973 1.00 0.00 H new ATOM 1820 N ARG A 118 -20.394 -13.125 -14.093 1.00 0.00 N ATOM 1821 CA ARG A 118 -19.603 -13.036 -12.868 1.00 0.00 C ATOM 1822 C ARG A 118 -19.212 -14.430 -12.398 1.00 0.00 C ATOM 1823 O ARG A 118 -19.863 -15.416 -12.741 1.00 0.00 O ATOM 1824 CB ARG A 118 -20.366 -12.304 -11.746 1.00 0.00 C ATOM 1825 CG ARG A 118 -20.603 -10.814 -12.001 1.00 0.00 C ATOM 1826 CD ARG A 118 -21.686 -10.569 -13.043 1.00 0.00 C ATOM 1827 NE ARG A 118 -21.856 -9.143 -13.335 1.00 0.00 N ATOM 1828 CZ ARG A 118 -22.976 -8.453 -13.107 1.00 0.00 C ATOM 1829 NH1 ARG A 118 -24.014 -9.031 -12.516 1.00 0.00 N ATOM 1830 NH2 ARG A 118 -23.052 -7.177 -13.451 1.00 0.00 N ATOM 0 H ARG A 118 -21.393 -13.260 -13.939 1.00 0.00 H new ATOM 0 HA ARG A 118 -18.707 -12.459 -13.096 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -21.330 -12.792 -11.603 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -19.811 -12.416 -10.815 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -20.885 -10.329 -11.067 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -19.673 -10.352 -12.332 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -21.432 -11.099 -13.961 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -22.630 -10.981 -12.688 1.00 0.00 H new ATOM 0 HE ARG A 118 -21.064 -8.643 -13.740 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -23.960 -10.009 -12.232 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -24.866 -8.497 -12.345 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -22.254 -6.719 -13.891 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -23.909 -6.652 -13.276 1.00 0.00 H new ATOM 1844 N TRP A 119 -18.143 -14.505 -11.615 1.00 0.00 N ATOM 1845 CA TRP A 119 -17.640 -15.777 -11.117 1.00 0.00 C ATOM 1846 C TRP A 119 -17.983 -15.971 -9.644 1.00 0.00 C ATOM 1847 O TRP A 119 -17.923 -15.029 -8.851 1.00 0.00 O ATOM 1848 CB TRP A 119 -16.130 -15.861 -11.342 1.00 0.00 C ATOM 1849 CG TRP A 119 -15.782 -16.077 -12.782 1.00 0.00 C ATOM 1850 CD1 TRP A 119 -15.600 -15.131 -13.749 1.00 0.00 C ATOM 1851 CD2 TRP A 119 -15.608 -17.339 -13.421 1.00 0.00 C ATOM 1852 NE1 TRP A 119 -15.295 -15.734 -14.945 1.00 0.00 N ATOM 1853 CE2 TRP A 119 -15.299 -17.091 -14.768 1.00 0.00 C ATOM 1854 CE3 TRP A 119 -15.674 -18.657 -12.976 1.00 0.00 C ATOM 1855 CZ2 TRP A 119 -15.061 -18.116 -15.675 1.00 0.00 C ATOM 1856 CZ3 TRP A 119 -15.441 -19.674 -13.875 1.00 0.00 C ATOM 1857 CH2 TRP A 119 -15.136 -19.400 -15.213 1.00 0.00 C ATOM 0 H TRP A 119 -17.605 -13.694 -11.310 1.00 0.00 H new ATOM 0 HA TRP A 119 -18.125 -16.581 -11.671 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -15.661 -14.942 -10.991 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -15.721 -16.676 -10.745 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -15.684 -14.065 -13.596 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -15.098 -15.250 -15.821 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.904 -18.878 -11.944 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -14.825 -17.906 -16.708 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.495 -20.700 -13.542 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.956 -20.219 -15.894 1.00 0.00 H new ATOM 1868 N TYR A 120 -18.350 -17.202 -9.300 1.00 0.00 N ATOM 1869 CA TYR A 120 -18.761 -17.558 -7.946 1.00 0.00 C ATOM 1870 C TYR A 120 -18.035 -18.822 -7.493 1.00 0.00 C ATOM 1871 O TYR A 120 -17.818 -19.734 -8.286 1.00 0.00 O ATOM 1872 CB TYR A 120 -20.278 -17.794 -7.900 1.00 0.00 C ATOM 1873 CG TYR A 120 -21.103 -16.608 -8.365 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -21.428 -16.445 -9.709 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -21.557 -15.653 -7.462 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -22.176 -15.367 -10.136 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -22.309 -14.574 -7.884 1.00 0.00 C ATOM 1878 CZ TYR A 120 -22.615 -14.435 -9.220 1.00 0.00 C ATOM 1879 OH TYR A 120 -23.367 -13.362 -9.643 1.00 0.00 O ATOM 0 H TYR A 120 -18.371 -17.983 -9.955 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.505 -16.737 -7.277 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -20.520 -18.657 -8.520 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -20.565 -18.045 -6.879 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -21.089 -17.175 -10.429 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -21.318 -15.757 -6.414 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -22.416 -15.254 -11.183 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -22.656 -13.842 -7.169 1.00 0.00 H new ATOM 0 HH TYR A 120 -23.597 -12.800 -8.874 1.00 0.00 H new ATOM 1889 N PHE A 121 -17.652 -18.868 -6.224 1.00 0.00 N ATOM 1890 CA PHE A 121 -16.999 -20.044 -5.653 1.00 0.00 C ATOM 1891 C PHE A 121 -17.992 -21.198 -5.512 1.00 0.00 C ATOM 1892 O PHE A 121 -18.968 -21.091 -4.772 1.00 0.00 O ATOM 1893 CB PHE A 121 -16.392 -19.691 -4.287 1.00 0.00 C ATOM 1894 CG PHE A 121 -15.972 -20.889 -3.474 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -14.786 -21.554 -3.744 1.00 0.00 C ATOM 1896 CD2 PHE A 121 -16.775 -21.353 -2.440 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -14.410 -22.656 -3.000 1.00 0.00 C ATOM 1898 CE2 PHE A 121 -16.405 -22.451 -1.695 1.00 0.00 C ATOM 1899 CZ PHE A 121 -15.221 -23.105 -1.974 1.00 0.00 C ATOM 0 H PHE A 121 -17.782 -18.101 -5.565 1.00 0.00 H new ATOM 0 HA PHE A 121 -16.202 -20.362 -6.325 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -15.526 -19.048 -4.441 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -17.119 -19.114 -3.716 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -14.149 -21.207 -4.544 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -17.702 -20.846 -2.217 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -13.484 -23.166 -3.220 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -17.040 -22.800 -0.894 1.00 0.00 H new ATOM 0 HZ PHE A 121 -14.929 -23.966 -1.391 1.00 0.00 H new ATOM 1909 N SER A 122 -17.738 -22.299 -6.215 1.00 0.00 N ATOM 1910 CA SER A 122 -18.620 -23.463 -6.167 1.00 0.00 C ATOM 1911 C SER A 122 -18.093 -24.516 -5.194 1.00 0.00 C ATOM 1912 O SER A 122 -18.813 -24.969 -4.305 1.00 0.00 O ATOM 1913 CB SER A 122 -18.770 -24.076 -7.563 1.00 0.00 C ATOM 1914 OG SER A 122 -19.342 -23.150 -8.471 1.00 0.00 O ATOM 0 H SER A 122 -16.928 -22.410 -6.825 1.00 0.00 H new ATOM 0 HA SER A 122 -19.595 -23.127 -5.815 1.00 0.00 H new ATOM 0 HB2 SER A 122 -17.794 -24.394 -7.930 1.00 0.00 H new ATOM 0 HB3 SER A 122 -19.395 -24.967 -7.506 1.00 0.00 H new ATOM 0 HG SER A 122 -20.290 -23.025 -8.257 1.00 0.00 H new ATOM 1920 N GLU A 123 -16.832 -24.898 -5.363 1.00 0.00 N ATOM 1921 CA GLU A 123 -16.247 -25.975 -4.573 1.00 0.00 C ATOM 1922 C GLU A 123 -14.725 -25.883 -4.575 1.00 0.00 C ATOM 1923 O GLU A 123 -14.148 -24.995 -5.208 1.00 0.00 O ATOM 1924 CB GLU A 123 -16.706 -27.336 -5.124 1.00 0.00 C ATOM 1925 CG GLU A 123 -16.374 -27.546 -6.599 1.00 0.00 C ATOM 1926 CD GLU A 123 -16.936 -28.845 -7.155 1.00 0.00 C ATOM 1927 OE1 GLU A 123 -18.114 -28.859 -7.571 1.00 0.00 O ATOM 1928 OE2 GLU A 123 -16.206 -29.860 -7.181 1.00 0.00 O ATOM 0 H GLU A 123 -16.195 -24.478 -6.040 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.588 -25.877 -3.543 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.241 -28.130 -4.540 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -17.783 -27.429 -4.987 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -16.767 -26.710 -7.177 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.291 -27.541 -6.726 1.00 0.00 H new ATOM 1935 N GLY A 124 -14.087 -26.796 -3.855 1.00 0.00 N ATOM 1936 CA GLY A 124 -12.639 -26.831 -3.785 1.00 0.00 C ATOM 1937 C GLY A 124 -12.132 -28.212 -3.421 1.00 0.00 C ATOM 1938 O GLY A 124 -12.666 -28.856 -2.510 1.00 0.00 O ATOM 0 H GLY A 124 -14.554 -27.522 -3.311 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.220 -26.530 -4.745 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -12.292 -26.109 -3.046 1.00 0.00 H new ATOM 1942 N GLU A 125 -11.113 -28.676 -4.132 1.00 0.00 N ATOM 1943 CA GLU A 125 -10.527 -29.990 -3.884 1.00 0.00 C ATOM 1944 C GLU A 125 -9.025 -29.863 -3.654 1.00 0.00 C ATOM 1945 O GLU A 125 -8.393 -28.917 -4.127 1.00 0.00 O ATOM 1946 CB GLU A 125 -10.814 -30.933 -5.062 1.00 0.00 C ATOM 1947 CG GLU A 125 -10.263 -30.441 -6.397 1.00 0.00 C ATOM 1948 CD GLU A 125 -10.674 -31.323 -7.565 1.00 0.00 C ATOM 1949 OE1 GLU A 125 -10.003 -32.349 -7.812 1.00 0.00 O ATOM 1950 OE2 GLU A 125 -11.671 -30.995 -8.244 1.00 0.00 O ATOM 0 H GLU A 125 -10.671 -28.158 -4.892 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.980 -30.412 -2.987 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -10.388 -31.912 -4.843 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -11.892 -31.068 -5.153 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.611 -29.424 -6.576 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -9.175 -30.401 -6.343 1.00 0.00 H new ATOM 1957 N ALA A 126 -8.461 -30.809 -2.915 1.00 0.00 N ATOM 1958 CA ALA A 126 -7.032 -30.808 -2.626 1.00 0.00 C ATOM 1959 C ALA A 126 -6.250 -31.325 -3.830 1.00 0.00 C ATOM 1960 O ALA A 126 -6.544 -32.406 -4.348 1.00 0.00 O ATOM 1961 CB ALA A 126 -6.742 -31.660 -1.394 1.00 0.00 C ATOM 0 H ALA A 126 -8.973 -31.589 -2.503 1.00 0.00 H new ATOM 0 HA ALA A 126 -6.716 -29.785 -2.421 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -5.671 -31.651 -1.189 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.279 -31.254 -0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.068 -32.684 -1.575 1.00 0.00 H new