USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1018 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 78 MET CE :methyl 179:sc= 0 (180deg=0) USER MOD Set 1.2: B 96 ASN : amide:sc= -2.16! C(o=-2.2!,f=-5.2!) USER MOD Set 2.1: A 96 ASN : amide:sc= -2.09! C(o=-2.1!,f=-4.9!) USER MOD Set 2.2: B 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 MET CE :methyl -133:sc= -0.0837 (180deg=-0.577) USER MOD Single : A 57 THR OG1 : rot -55:sc= 1.3 USER MOD Single : A 60 LYS NZ :NH3+ 167:sc= -0.0304 (180deg=-0.215) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 66:sc= 1.23 USER MOD Single : A 74 LYS NZ :NH3+ 169:sc= -0.0424 (180deg=-0.274) USER MOD Single : A 75 LYS NZ :NH3+ -169:sc= -0.0245 (180deg=-0.154) USER MOD Single : A 82 LYS NZ :NH3+ -165:sc= -0.0702 (180deg=-0.339) USER MOD Single : A 83 LYS NZ :NH3+ 132:sc= -0.712 (180deg=-1.22) USER MOD Single : A 85 LYS NZ :NH3+ -147:sc= -0.0139 (180deg=-1.4!) USER MOD Single : A 86 LYS NZ :NH3+ -170:sc= -0.0266 (180deg=-0.154) USER MOD Single : A 91 MET CE :methyl 164:sc= -0.0525 (180deg=-0.405) USER MOD Single : B 46 MET CE :methyl -130:sc= -0.0939 (180deg=-0.56) USER MOD Single : B 57 THR OG1 : rot -47:sc= 1.26 USER MOD Single : B 60 LYS NZ :NH3+ 166:sc= -0.0226 (180deg=-0.237) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 67 ASN : amide:sc=-0.00617 X(o=-0.0062,f=0) USER MOD Single : B 71 SER OG : rot 61:sc= 1.19 USER MOD Single : B 74 LYS NZ :NH3+ 169:sc= -0.0623 (180deg=-0.315) USER MOD Single : B 75 LYS NZ :NH3+ -169:sc= -0.0204 (180deg=-0.184) USER MOD Single : B 82 LYS NZ :NH3+ -165:sc= -0.0363 (180deg=-0.317) USER MOD Single : B 83 LYS NZ :NH3+ 131:sc= -0.736 (180deg=-1.2) USER MOD Single : B 85 LYS NZ :NH3+ -146:sc=-0.00964 (180deg=-1.39!) USER MOD Single : B 86 LYS NZ :NH3+ -170:sc= -0.0187 (180deg=-0.172) USER MOD Single : B 91 MET CE :methyl 164:sc= -0.0449 (180deg=-0.381) USER MOD ----------------------------------------------------------------- ATOM 100 N GLY A 42 -9.480 -10.630 6.835 1.00 0.00 N ATOM 101 CA GLY A 42 -9.040 -9.794 7.930 1.00 0.00 C ATOM 102 C GLY A 42 -9.919 -8.576 8.112 1.00 0.00 C ATOM 103 O GLY A 42 -10.917 -8.424 7.405 1.00 0.00 O ATOM 0 HA2 GLY A 42 -9.036 -10.377 8.851 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -8.013 -9.475 7.751 1.00 0.00 H new ATOM 107 N PRO A 43 -9.577 -7.700 9.069 1.00 0.00 N ATOM 108 CA PRO A 43 -10.318 -6.457 9.331 1.00 0.00 C ATOM 109 C PRO A 43 -10.313 -5.504 8.136 1.00 0.00 C ATOM 110 O PRO A 43 -9.545 -5.703 7.196 1.00 0.00 O ATOM 111 CB PRO A 43 -9.563 -5.828 10.507 1.00 0.00 C ATOM 112 CG PRO A 43 -8.817 -6.955 11.130 1.00 0.00 C ATOM 113 CD PRO A 43 -8.447 -7.862 9.996 1.00 0.00 C ATOM 0 HA PRO A 43 -11.370 -6.656 9.534 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -8.885 -5.045 10.168 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -10.250 -5.369 11.217 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -7.930 -6.598 11.653 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -9.432 -7.475 11.864 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -7.502 -7.571 9.537 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -8.337 -8.896 10.324 1.00 0.00 H new ATOM 121 N ILE A 44 -11.138 -4.465 8.179 1.00 0.00 N ATOM 122 CA ILE A 44 -11.272 -3.543 7.048 1.00 0.00 C ATOM 123 C ILE A 44 -9.933 -2.910 6.658 1.00 0.00 C ATOM 124 O ILE A 44 -9.662 -2.699 5.474 1.00 0.00 O ATOM 125 CB ILE A 44 -12.321 -2.443 7.322 1.00 0.00 C ATOM 126 CG1 ILE A 44 -12.035 -1.729 8.647 1.00 0.00 C ATOM 127 CG2 ILE A 44 -13.719 -3.045 7.322 1.00 0.00 C ATOM 128 CD1 ILE A 44 -13.070 -0.687 9.009 1.00 0.00 C ATOM 0 H ILE A 44 -11.725 -4.236 8.981 1.00 0.00 H new ATOM 0 HA ILE A 44 -11.619 -4.144 6.207 1.00 0.00 H new ATOM 0 HB ILE A 44 -12.260 -1.700 6.526 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -11.982 -2.469 9.445 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -11.056 -1.252 8.589 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -14.452 -2.262 7.516 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -13.920 -3.498 6.351 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -13.787 -3.807 8.099 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -12.803 -0.223 9.958 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -13.107 0.075 8.230 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -14.047 -1.161 9.099 1.00 0.00 H new ATOM 140 N ARG A 45 -9.086 -2.636 7.649 1.00 0.00 N ATOM 141 CA ARG A 45 -7.742 -2.128 7.381 1.00 0.00 C ATOM 142 C ARG A 45 -6.960 -3.124 6.536 1.00 0.00 C ATOM 143 O ARG A 45 -6.309 -2.760 5.558 1.00 0.00 O ATOM 144 CB ARG A 45 -6.979 -1.877 8.680 1.00 0.00 C ATOM 145 CG ARG A 45 -7.535 -0.750 9.529 1.00 0.00 C ATOM 146 CD ARG A 45 -6.682 -0.542 10.767 1.00 0.00 C ATOM 147 NE ARG A 45 -5.317 -0.143 10.421 1.00 0.00 N ATOM 148 CZ ARG A 45 -4.225 -0.838 10.745 1.00 0.00 C ATOM 149 NH1 ARG A 45 -4.321 -1.950 11.465 1.00 0.00 N ATOM 150 NH2 ARG A 45 -3.033 -0.413 10.353 1.00 0.00 N ATOM 0 H ARG A 45 -9.305 -2.756 8.638 1.00 0.00 H new ATOM 0 HA ARG A 45 -7.847 -1.186 6.843 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -6.980 -2.794 9.270 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -5.940 -1.654 8.439 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -7.568 0.170 8.945 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -8.560 -0.979 9.821 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -7.136 0.222 11.398 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -6.656 -1.463 11.350 1.00 0.00 H new ATOM 0 HE ARG A 45 -5.192 0.724 9.898 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -5.235 -2.279 11.775 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -3.481 -2.475 11.708 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -2.952 0.443 9.805 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -2.197 -0.942 10.599 1.00 0.00 H new ATOM 164 N MET A 46 -7.044 -4.389 6.924 1.00 0.00 N ATOM 165 CA MET A 46 -6.350 -5.456 6.221 1.00 0.00 C ATOM 166 C MET A 46 -6.954 -5.659 4.835 1.00 0.00 C ATOM 167 O MET A 46 -6.254 -6.030 3.898 1.00 0.00 O ATOM 168 CB MET A 46 -6.413 -6.754 7.030 1.00 0.00 C ATOM 169 CG MET A 46 -5.678 -7.916 6.382 1.00 0.00 C ATOM 170 SD MET A 46 -5.660 -9.397 7.411 1.00 0.00 S ATOM 171 CE MET A 46 -4.628 -8.845 8.768 1.00 0.00 C ATOM 0 H MET A 46 -7.590 -4.701 7.727 1.00 0.00 H new ATOM 0 HA MET A 46 -5.304 -5.173 6.103 1.00 0.00 H new ATOM 0 HB2 MET A 46 -5.991 -6.576 8.019 1.00 0.00 H new ATOM 0 HB3 MET A 46 -7.457 -7.031 7.174 1.00 0.00 H new ATOM 0 HG2 MET A 46 -6.148 -8.149 5.427 1.00 0.00 H new ATOM 0 HG3 MET A 46 -4.652 -7.616 6.168 1.00 0.00 H new ATOM 0 HE1 MET A 46 -3.877 -9.604 8.987 1.00 0.00 H new ATOM 0 HE2 MET A 46 -4.133 -7.914 8.493 1.00 0.00 H new ATOM 0 HE3 MET A 46 -5.245 -8.680 9.651 1.00 0.00 H new ATOM 181 N VAL A 47 -8.253 -5.399 4.715 1.00 0.00 N ATOM 182 CA VAL A 47 -8.944 -5.491 3.431 1.00 0.00 C ATOM 183 C VAL A 47 -8.306 -4.555 2.412 1.00 0.00 C ATOM 184 O VAL A 47 -7.992 -4.959 1.295 1.00 0.00 O ATOM 185 CB VAL A 47 -10.443 -5.143 3.561 1.00 0.00 C ATOM 186 CG1 VAL A 47 -11.145 -5.253 2.214 1.00 0.00 C ATOM 187 CG2 VAL A 47 -11.112 -6.042 4.584 1.00 0.00 C ATOM 0 H VAL A 47 -8.851 -5.122 5.494 1.00 0.00 H new ATOM 0 HA VAL A 47 -8.854 -6.524 3.094 1.00 0.00 H new ATOM 0 HB VAL A 47 -10.523 -4.111 3.902 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -12.199 -5.003 2.332 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.685 -4.563 1.507 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -11.053 -6.272 1.838 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -12.168 -5.782 4.662 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -11.017 -7.082 4.272 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -10.633 -5.909 5.554 1.00 0.00 H new ATOM 197 N LEU A 48 -8.102 -3.307 2.811 1.00 0.00 N ATOM 198 CA LEU A 48 -7.491 -2.319 1.933 1.00 0.00 C ATOM 199 C LEU A 48 -6.016 -2.638 1.701 1.00 0.00 C ATOM 200 O LEU A 48 -5.465 -2.340 0.642 1.00 0.00 O ATOM 201 CB LEU A 48 -7.650 -0.910 2.516 1.00 0.00 C ATOM 202 CG LEU A 48 -9.097 -0.425 2.666 1.00 0.00 C ATOM 203 CD1 LEU A 48 -9.131 0.982 3.237 1.00 0.00 C ATOM 204 CD2 LEU A 48 -9.824 -0.471 1.329 1.00 0.00 C ATOM 0 H LEU A 48 -8.350 -2.955 3.736 1.00 0.00 H new ATOM 0 HA LEU A 48 -8.003 -2.356 0.971 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -7.171 -0.883 3.495 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -7.112 -0.208 1.879 1.00 0.00 H new ATOM 0 HG LEU A 48 -9.609 -1.094 3.358 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -10.166 1.309 3.336 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -8.653 0.989 4.216 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -8.599 1.659 2.569 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -10.849 -0.123 1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -9.311 0.171 0.613 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -9.834 -1.495 0.955 1.00 0.00 H new ATOM 216 N ALA A 49 -5.390 -3.264 2.691 1.00 0.00 N ATOM 217 CA ALA A 49 -3.988 -3.649 2.591 1.00 0.00 C ATOM 218 C ALA A 49 -3.796 -4.779 1.582 1.00 0.00 C ATOM 219 O ALA A 49 -2.931 -4.703 0.708 1.00 0.00 O ATOM 220 CB ALA A 49 -3.457 -4.057 3.955 1.00 0.00 C ATOM 0 H ALA A 49 -5.833 -3.516 3.574 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.424 -2.786 2.237 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -2.409 -4.342 3.867 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -3.548 -3.219 4.646 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -4.033 -4.902 4.332 1.00 0.00 H new ATOM 226 N ILE A 50 -4.609 -5.826 1.699 1.00 0.00 N ATOM 227 CA ILE A 50 -4.522 -6.958 0.782 1.00 0.00 C ATOM 228 C ILE A 50 -5.014 -6.556 -0.605 1.00 0.00 C ATOM 229 O ILE A 50 -4.626 -7.146 -1.613 1.00 0.00 O ATOM 230 CB ILE A 50 -5.312 -8.190 1.288 1.00 0.00 C ATOM 231 CG1 ILE A 50 -6.809 -7.880 1.393 1.00 0.00 C ATOM 232 CG2 ILE A 50 -4.772 -8.645 2.637 1.00 0.00 C ATOM 233 CD1 ILE A 50 -7.642 -9.047 1.880 1.00 0.00 C ATOM 0 H ILE A 50 -5.331 -5.914 2.415 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.472 -7.245 0.728 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.183 -8.995 0.565 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -6.949 -7.038 2.070 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -7.175 -7.567 0.415 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.336 -9.512 2.981 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -3.720 -8.913 2.536 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -4.872 -7.836 3.361 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -8.690 -8.751 1.928 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -7.533 -9.885 1.191 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -7.304 -9.347 2.872 1.00 0.00 H new ATOM 245 N LEU A 51 -5.867 -5.539 -0.642 1.00 0.00 N ATOM 246 CA LEU A 51 -6.319 -4.962 -1.899 1.00 0.00 C ATOM 247 C LEU A 51 -5.152 -4.287 -2.605 1.00 0.00 C ATOM 248 O LEU A 51 -4.917 -4.512 -3.791 1.00 0.00 O ATOM 249 CB LEU A 51 -7.422 -3.935 -1.650 1.00 0.00 C ATOM 250 CG LEU A 51 -7.996 -3.283 -2.906 1.00 0.00 C ATOM 251 CD1 LEU A 51 -9.080 -4.156 -3.525 1.00 0.00 C ATOM 252 CD2 LEU A 51 -8.523 -1.898 -2.584 1.00 0.00 C ATOM 0 H LEU A 51 -6.260 -5.097 0.189 1.00 0.00 H new ATOM 0 HA LEU A 51 -6.714 -5.762 -2.525 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -8.234 -4.421 -1.108 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.029 -3.153 -1.001 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.197 -3.182 -3.641 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -9.473 -3.670 -4.418 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.658 -5.124 -3.795 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -9.886 -4.300 -2.806 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.929 -1.444 -3.488 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.308 -1.973 -1.831 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -7.711 -1.280 -2.201 1.00 0.00 H new ATOM 264 N ALA A 52 -4.422 -3.459 -1.856 1.00 0.00 N ATOM 265 CA ALA A 52 -3.251 -2.766 -2.381 1.00 0.00 C ATOM 266 C ALA A 52 -2.232 -3.768 -2.907 1.00 0.00 C ATOM 267 O ALA A 52 -1.585 -3.535 -3.930 1.00 0.00 O ATOM 268 CB ALA A 52 -2.627 -1.884 -1.309 1.00 0.00 C ATOM 0 H ALA A 52 -4.625 -3.253 -0.878 1.00 0.00 H new ATOM 0 HA ALA A 52 -3.568 -2.130 -3.207 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -1.755 -1.375 -1.719 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -3.356 -1.145 -0.977 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -2.323 -2.500 -0.463 1.00 0.00 H new ATOM 274 N PHE A 53 -2.107 -4.887 -2.204 1.00 0.00 N ATOM 275 CA PHE A 53 -1.265 -5.986 -2.649 1.00 0.00 C ATOM 276 C PHE A 53 -1.683 -6.426 -4.048 1.00 0.00 C ATOM 277 O PHE A 53 -0.930 -6.267 -5.003 1.00 0.00 O ATOM 278 CB PHE A 53 -1.364 -7.156 -1.662 1.00 0.00 C ATOM 279 CG PHE A 53 -0.586 -8.384 -2.061 1.00 0.00 C ATOM 280 CD1 PHE A 53 0.761 -8.499 -1.760 1.00 0.00 C ATOM 281 CD2 PHE A 53 -1.211 -9.432 -2.718 1.00 0.00 C ATOM 282 CE1 PHE A 53 1.469 -9.632 -2.111 1.00 0.00 C ATOM 283 CE2 PHE A 53 -0.507 -10.565 -3.074 1.00 0.00 C ATOM 284 CZ PHE A 53 0.835 -10.666 -2.768 1.00 0.00 C ATOM 0 H PHE A 53 -2.582 -5.056 -1.318 1.00 0.00 H new ATOM 0 HA PHE A 53 -0.228 -5.652 -2.685 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -1.013 -6.821 -0.686 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -2.413 -7.429 -1.547 1.00 0.00 H new ATOM 0 HD1 PHE A 53 1.264 -7.694 -1.245 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -2.262 -9.361 -2.955 1.00 0.00 H new ATOM 0 HE1 PHE A 53 2.519 -9.708 -1.871 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -1.006 -11.371 -3.591 1.00 0.00 H new ATOM 0 HZ PHE A 53 1.387 -11.553 -3.042 1.00 0.00 H new ATOM 294 N LEU A 54 -2.908 -6.920 -4.166 1.00 0.00 N ATOM 295 CA LEU A 54 -3.433 -7.419 -5.442 1.00 0.00 C ATOM 296 C LEU A 54 -3.590 -6.305 -6.470 1.00 0.00 C ATOM 297 O LEU A 54 -3.920 -6.552 -7.626 1.00 0.00 O ATOM 298 CB LEU A 54 -4.779 -8.114 -5.223 1.00 0.00 C ATOM 299 CG LEU A 54 -4.736 -9.370 -4.351 1.00 0.00 C ATOM 300 CD1 LEU A 54 -6.143 -9.881 -4.090 1.00 0.00 C ATOM 301 CD2 LEU A 54 -3.893 -10.450 -5.014 1.00 0.00 C ATOM 0 H LEU A 54 -3.566 -6.989 -3.390 1.00 0.00 H new ATOM 0 HA LEU A 54 -2.709 -8.134 -5.834 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.467 -7.401 -4.769 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.193 -8.382 -6.195 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.278 -9.113 -3.396 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.096 -10.775 -3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.720 -9.112 -3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.624 -10.123 -5.038 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.873 -11.336 -4.380 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -4.325 -10.706 -5.982 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.877 -10.082 -5.156 1.00 0.00 H new ATOM 313 N ARG A 55 -3.362 -5.080 -6.054 1.00 0.00 N ATOM 314 CA ARG A 55 -3.437 -3.966 -6.939 1.00 0.00 C ATOM 315 C ARG A 55 -2.078 -3.703 -7.581 1.00 0.00 C ATOM 316 O ARG A 55 -1.963 -3.611 -8.803 1.00 0.00 O ATOM 317 CB ARG A 55 -3.910 -2.759 -6.149 1.00 0.00 C ATOM 318 CG ARG A 55 -3.835 -1.491 -6.934 1.00 0.00 C ATOM 319 CD ARG A 55 -4.659 -1.585 -8.204 1.00 0.00 C ATOM 320 NE ARG A 55 -4.767 -0.291 -8.869 1.00 0.00 N ATOM 321 CZ ARG A 55 -5.225 -0.117 -10.104 1.00 0.00 C ATOM 322 NH1 ARG A 55 -5.638 -1.155 -10.822 1.00 0.00 N ATOM 323 NH2 ARG A 55 -5.274 1.102 -10.621 1.00 0.00 N ATOM 0 H ARG A 55 -3.121 -4.840 -5.092 1.00 0.00 H new ATOM 0 HA ARG A 55 -4.142 -4.173 -7.744 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -4.938 -2.921 -5.826 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -3.305 -2.660 -5.248 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -4.193 -0.661 -6.325 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -2.796 -1.276 -7.186 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -4.203 -2.307 -8.882 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -5.655 -1.957 -7.966 1.00 0.00 H new ATOM 0 HE ARG A 55 -4.471 0.536 -8.351 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -5.605 -2.094 -10.426 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -5.988 -1.013 -11.769 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -4.961 1.902 -10.071 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -5.625 1.240 -11.569 1.00 0.00 H new ATOM 337 N PHE A 56 -1.051 -3.604 -6.754 1.00 0.00 N ATOM 338 CA PHE A 56 0.282 -3.269 -7.236 1.00 0.00 C ATOM 339 C PHE A 56 1.076 -4.514 -7.631 1.00 0.00 C ATOM 340 O PHE A 56 1.989 -4.435 -8.451 1.00 0.00 O ATOM 341 CB PHE A 56 1.039 -2.453 -6.189 1.00 0.00 C ATOM 342 CG PHE A 56 0.470 -1.075 -5.991 1.00 0.00 C ATOM 343 CD1 PHE A 56 0.927 -0.009 -6.750 1.00 0.00 C ATOM 344 CD2 PHE A 56 -0.526 -0.847 -5.055 1.00 0.00 C ATOM 345 CE1 PHE A 56 0.400 1.256 -6.579 1.00 0.00 C ATOM 346 CE2 PHE A 56 -1.055 0.416 -4.879 1.00 0.00 C ATOM 347 CZ PHE A 56 -0.592 1.469 -5.642 1.00 0.00 C ATOM 0 H PHE A 56 -1.113 -3.750 -5.746 1.00 0.00 H new ATOM 0 HA PHE A 56 0.164 -2.664 -8.135 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.022 -2.987 -5.239 1.00 0.00 H new ATOM 0 HB3 PHE A 56 2.084 -2.369 -6.488 1.00 0.00 H new ATOM 0 HD1 PHE A 56 1.704 -0.169 -7.483 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -0.893 -1.667 -4.456 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.763 2.078 -7.178 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -1.830 0.580 -4.145 1.00 0.00 H new ATOM 0 HZ PHE A 56 -1.005 2.458 -5.506 1.00 0.00 H new ATOM 357 N THR A 57 0.728 -5.662 -7.067 1.00 0.00 N ATOM 358 CA THR A 57 1.392 -6.908 -7.436 1.00 0.00 C ATOM 359 C THR A 57 0.642 -7.574 -8.587 1.00 0.00 C ATOM 360 O THR A 57 1.004 -8.666 -9.033 1.00 0.00 O ATOM 361 CB THR A 57 1.493 -7.891 -6.248 1.00 0.00 C ATOM 362 OG1 THR A 57 0.199 -8.401 -5.908 1.00 0.00 O ATOM 363 CG2 THR A 57 2.098 -7.212 -5.030 1.00 0.00 C ATOM 0 H THR A 57 -0.001 -5.759 -6.360 1.00 0.00 H new ATOM 0 HA THR A 57 2.407 -6.656 -7.744 1.00 0.00 H new ATOM 0 HB THR A 57 2.140 -8.714 -6.554 1.00 0.00 H new ATOM 0 HG1 THR A 57 -0.413 -7.654 -5.739 1.00 0.00 H new ATOM 0 HG21 THR A 57 2.158 -7.925 -4.208 1.00 0.00 H new ATOM 0 HG22 THR A 57 3.098 -6.853 -5.273 1.00 0.00 H new ATOM 0 HG23 THR A 57 1.472 -6.370 -4.735 1.00 0.00 H new ATOM 371 N ALA A 58 -0.400 -6.878 -9.054 1.00 0.00 N ATOM 372 CA ALA A 58 -1.261 -7.340 -10.139 1.00 0.00 C ATOM 373 C ALA A 58 -2.167 -8.480 -9.681 1.00 0.00 C ATOM 374 O ALA A 58 -2.211 -8.802 -8.494 1.00 0.00 O ATOM 375 CB ALA A 58 -0.446 -7.735 -11.365 1.00 0.00 C ATOM 0 H ALA A 58 -0.669 -5.967 -8.682 1.00 0.00 H new ATOM 0 HA ALA A 58 -1.902 -6.507 -10.427 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -1.117 -8.074 -12.154 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.122 -6.874 -11.717 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.241 -8.540 -11.102 1.00 0.00 H new ATOM 381 N ILE A 59 -2.878 -9.078 -10.637 1.00 0.00 N ATOM 382 CA ILE A 59 -3.911 -10.076 -10.355 1.00 0.00 C ATOM 383 C ILE A 59 -5.136 -9.405 -9.740 1.00 0.00 C ATOM 384 O ILE A 59 -5.130 -9.002 -8.580 1.00 0.00 O ATOM 385 CB ILE A 59 -3.408 -11.216 -9.440 1.00 0.00 C ATOM 386 CG1 ILE A 59 -2.242 -11.958 -10.105 1.00 0.00 C ATOM 387 CG2 ILE A 59 -4.540 -12.182 -9.110 1.00 0.00 C ATOM 388 CD1 ILE A 59 -2.586 -12.566 -11.449 1.00 0.00 C ATOM 0 H ILE A 59 -2.754 -8.884 -11.631 1.00 0.00 H new ATOM 0 HA ILE A 59 -4.182 -10.532 -11.307 1.00 0.00 H new ATOM 0 HB ILE A 59 -3.053 -10.778 -8.507 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -1.410 -11.266 -10.233 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -1.899 -12.748 -9.437 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -4.164 -12.976 -8.465 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.338 -11.645 -8.597 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -4.928 -12.616 -10.031 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.710 -13.073 -11.854 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -3.396 -13.284 -11.327 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -2.899 -11.779 -12.135 1.00 0.00 H new ATOM 400 N LYS A 60 -6.180 -9.273 -10.547 1.00 0.00 N ATOM 401 CA LYS A 60 -7.387 -8.562 -10.148 1.00 0.00 C ATOM 402 C LYS A 60 -8.059 -9.238 -8.953 1.00 0.00 C ATOM 403 O LYS A 60 -8.324 -10.443 -8.978 1.00 0.00 O ATOM 404 CB LYS A 60 -8.361 -8.493 -11.327 1.00 0.00 C ATOM 405 CG LYS A 60 -9.561 -7.592 -11.082 1.00 0.00 C ATOM 406 CD LYS A 60 -10.507 -7.594 -12.271 1.00 0.00 C ATOM 407 CE LYS A 60 -11.659 -6.622 -12.073 1.00 0.00 C ATOM 408 NZ LYS A 60 -11.196 -5.209 -12.022 1.00 0.00 N ATOM 0 H LYS A 60 -6.214 -9.654 -11.493 1.00 0.00 H new ATOM 0 HA LYS A 60 -7.105 -7.552 -9.849 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -7.826 -8.138 -12.208 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -8.714 -9.499 -11.553 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -10.093 -7.926 -10.191 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -9.221 -6.575 -10.887 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -9.957 -7.328 -13.174 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -10.901 -8.599 -12.422 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -12.376 -6.739 -12.886 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -12.183 -6.865 -11.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -12.014 -4.572 -12.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -10.714 -5.034 -11.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.536 -5.032 -12.806 1.00 0.00 H new ATOM 422 N PRO A 61 -8.324 -8.466 -7.884 1.00 0.00 N ATOM 423 CA PRO A 61 -9.030 -8.962 -6.698 1.00 0.00 C ATOM 424 C PRO A 61 -10.394 -9.547 -7.053 1.00 0.00 C ATOM 425 O PRO A 61 -11.124 -8.989 -7.875 1.00 0.00 O ATOM 426 CB PRO A 61 -9.204 -7.713 -5.830 1.00 0.00 C ATOM 427 CG PRO A 61 -8.145 -6.772 -6.285 1.00 0.00 C ATOM 428 CD PRO A 61 -7.939 -7.050 -7.746 1.00 0.00 C ATOM 0 HA PRO A 61 -8.482 -9.765 -6.204 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -10.196 -7.280 -5.957 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -9.092 -7.950 -4.772 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -8.448 -5.737 -6.124 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -7.222 -6.924 -5.726 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -8.557 -6.403 -8.369 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -6.904 -6.885 -8.044 1.00 0.00 H new ATOM 436 N SER A 62 -10.726 -10.672 -6.436 1.00 0.00 N ATOM 437 CA SER A 62 -11.989 -11.346 -6.695 1.00 0.00 C ATOM 438 C SER A 62 -13.165 -10.538 -6.151 1.00 0.00 C ATOM 439 O SER A 62 -12.975 -9.625 -5.343 1.00 0.00 O ATOM 440 CB SER A 62 -11.963 -12.744 -6.080 1.00 0.00 C ATOM 441 OG SER A 62 -10.812 -13.462 -6.501 1.00 0.00 O ATOM 0 H SER A 62 -10.134 -11.139 -5.749 1.00 0.00 H new ATOM 0 HA SER A 62 -12.121 -11.435 -7.773 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.971 -12.667 -4.993 1.00 0.00 H new ATOM 0 HB3 SER A 62 -12.862 -13.289 -6.368 1.00 0.00 H new ATOM 0 HG SER A 62 -10.815 -14.353 -6.094 1.00 0.00 H new ATOM 447 N LEU A 63 -14.374 -10.880 -6.581 1.00 0.00 N ATOM 448 CA LEU A 63 -15.565 -10.128 -6.197 1.00 0.00 C ATOM 449 C LEU A 63 -15.772 -10.152 -4.688 1.00 0.00 C ATOM 450 O LEU A 63 -16.325 -9.211 -4.121 1.00 0.00 O ATOM 451 CB LEU A 63 -16.814 -10.659 -6.909 1.00 0.00 C ATOM 452 CG LEU A 63 -16.999 -10.199 -8.363 1.00 0.00 C ATOM 453 CD1 LEU A 63 -17.092 -8.682 -8.441 1.00 0.00 C ATOM 454 CD2 LEU A 63 -15.868 -10.704 -9.241 1.00 0.00 C ATOM 0 H LEU A 63 -14.556 -11.673 -7.196 1.00 0.00 H new ATOM 0 HA LEU A 63 -15.406 -9.095 -6.507 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -16.783 -11.748 -6.893 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -17.692 -10.357 -6.337 1.00 0.00 H new ATOM 0 HG LEU A 63 -17.933 -10.623 -8.731 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -17.223 -8.378 -9.480 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -17.943 -8.339 -7.853 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -16.177 -8.241 -8.046 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -16.023 -10.364 -10.265 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -14.919 -10.317 -8.870 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -15.849 -11.794 -9.219 1.00 0.00 H new ATOM 466 N GLY A 64 -15.312 -11.219 -4.043 1.00 0.00 N ATOM 467 CA GLY A 64 -15.385 -11.295 -2.594 1.00 0.00 C ATOM 468 C GLY A 64 -14.614 -10.165 -1.940 1.00 0.00 C ATOM 469 O GLY A 64 -15.094 -9.525 -1.000 1.00 0.00 O ATOM 0 H GLY A 64 -14.891 -12.031 -4.495 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -16.428 -11.256 -2.278 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -14.986 -12.252 -2.258 1.00 0.00 H new ATOM 473 N LEU A 65 -13.427 -9.899 -2.471 1.00 0.00 N ATOM 474 CA LEU A 65 -12.595 -8.809 -1.986 1.00 0.00 C ATOM 475 C LEU A 65 -13.292 -7.485 -2.234 1.00 0.00 C ATOM 476 O LEU A 65 -13.399 -6.654 -1.339 1.00 0.00 O ATOM 477 CB LEU A 65 -11.224 -8.799 -2.684 1.00 0.00 C ATOM 478 CG LEU A 65 -10.239 -9.907 -2.282 1.00 0.00 C ATOM 479 CD1 LEU A 65 -9.979 -9.882 -0.786 1.00 0.00 C ATOM 480 CD2 LEU A 65 -10.741 -11.274 -2.712 1.00 0.00 C ATOM 0 H LEU A 65 -13.019 -10.428 -3.242 1.00 0.00 H new ATOM 0 HA LEU A 65 -12.437 -8.955 -0.917 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.389 -8.864 -3.760 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.751 -7.836 -2.491 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.299 -9.716 -2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -9.279 -10.675 -0.525 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -9.555 -8.917 -0.506 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.916 -10.035 -0.251 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.022 -12.036 -2.413 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -11.701 -11.475 -2.237 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.861 -11.293 -3.795 1.00 0.00 H new ATOM 492 N ILE A 66 -13.788 -7.321 -3.453 1.00 0.00 N ATOM 493 CA ILE A 66 -14.443 -6.089 -3.876 1.00 0.00 C ATOM 494 C ILE A 66 -15.705 -5.819 -3.051 1.00 0.00 C ATOM 495 O ILE A 66 -16.019 -4.672 -2.724 1.00 0.00 O ATOM 496 CB ILE A 66 -14.801 -6.157 -5.379 1.00 0.00 C ATOM 497 CG1 ILE A 66 -13.538 -6.417 -6.205 1.00 0.00 C ATOM 498 CG2 ILE A 66 -15.491 -4.880 -5.841 1.00 0.00 C ATOM 499 CD1 ILE A 66 -12.481 -5.338 -6.075 1.00 0.00 C ATOM 0 H ILE A 66 -13.748 -8.038 -4.177 1.00 0.00 H new ATOM 0 HA ILE A 66 -13.745 -5.268 -3.711 1.00 0.00 H new ATOM 0 HB ILE A 66 -15.499 -6.981 -5.528 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -13.108 -7.371 -5.900 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -13.816 -6.513 -7.254 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -15.730 -4.959 -6.902 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -16.409 -4.736 -5.272 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -14.828 -4.030 -5.681 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -11.619 -5.597 -6.690 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -12.891 -4.385 -6.408 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -12.171 -5.256 -5.033 1.00 0.00 H new ATOM 511 N ASN A 67 -16.419 -6.882 -2.707 1.00 0.00 N ATOM 512 CA ASN A 67 -17.626 -6.767 -1.897 1.00 0.00 C ATOM 513 C ASN A 67 -17.297 -6.248 -0.503 1.00 0.00 C ATOM 514 O ASN A 67 -17.980 -5.367 0.022 1.00 0.00 O ATOM 515 CB ASN A 67 -18.339 -8.120 -1.798 1.00 0.00 C ATOM 516 CG ASN A 67 -19.566 -8.066 -0.907 1.00 0.00 C ATOM 517 OD1 ASN A 67 -20.652 -7.692 -1.353 1.00 0.00 O ATOM 518 ND2 ASN A 67 -19.414 -8.462 0.348 1.00 0.00 N ATOM 0 H ASN A 67 -16.183 -7.837 -2.977 1.00 0.00 H new ATOM 0 HA ASN A 67 -18.291 -6.054 -2.384 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -18.632 -8.446 -2.796 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -17.645 -8.865 -1.410 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -20.213 -8.464 0.982 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -18.498 -8.765 0.680 1.00 0.00 H new ATOM 525 N ARG A 68 -16.234 -6.780 0.083 1.00 0.00 N ATOM 526 CA ARG A 68 -15.833 -6.393 1.428 1.00 0.00 C ATOM 527 C ARG A 68 -15.149 -5.032 1.388 1.00 0.00 C ATOM 528 O ARG A 68 -15.223 -4.247 2.332 1.00 0.00 O ATOM 529 CB ARG A 68 -14.905 -7.455 2.017 1.00 0.00 C ATOM 530 CG ARG A 68 -14.454 -7.165 3.437 1.00 0.00 C ATOM 531 CD ARG A 68 -13.647 -8.322 4.000 1.00 0.00 C ATOM 532 NE ARG A 68 -12.540 -8.695 3.120 1.00 0.00 N ATOM 533 CZ ARG A 68 -11.967 -9.897 3.115 1.00 0.00 C ATOM 534 NH1 ARG A 68 -12.373 -10.837 3.958 1.00 0.00 N ATOM 535 NH2 ARG A 68 -10.978 -10.156 2.274 1.00 0.00 N ATOM 0 H ARG A 68 -15.634 -7.481 -0.352 1.00 0.00 H new ATOM 0 HA ARG A 68 -16.714 -6.317 2.065 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -15.415 -8.418 1.999 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -14.026 -7.548 1.380 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -13.853 -6.256 3.453 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -15.324 -6.983 4.068 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -13.255 -8.048 4.980 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -14.300 -9.182 4.147 1.00 0.00 H new ATOM 0 HE ARG A 68 -12.186 -7.992 2.471 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -13.128 -10.641 4.615 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -11.930 -11.756 3.949 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -10.655 -9.435 1.629 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -10.539 -11.077 2.271 1.00 0.00 H new ATOM 549 N TRP A 69 -14.500 -4.770 0.267 1.00 0.00 N ATOM 550 CA TRP A 69 -13.870 -3.490 -0.011 1.00 0.00 C ATOM 551 C TRP A 69 -14.895 -2.359 0.058 1.00 0.00 C ATOM 552 O TRP A 69 -14.692 -1.366 0.751 1.00 0.00 O ATOM 553 CB TRP A 69 -13.216 -3.587 -1.391 1.00 0.00 C ATOM 554 CG TRP A 69 -12.834 -2.297 -2.046 1.00 0.00 C ATOM 555 CD1 TRP A 69 -11.748 -1.521 -1.784 1.00 0.00 C ATOM 556 CD2 TRP A 69 -13.528 -1.664 -3.121 1.00 0.00 C ATOM 557 NE1 TRP A 69 -11.714 -0.455 -2.648 1.00 0.00 N ATOM 558 CE2 TRP A 69 -12.803 -0.519 -3.472 1.00 0.00 C ATOM 559 CE3 TRP A 69 -14.694 -1.962 -3.817 1.00 0.00 C ATOM 560 CZ2 TRP A 69 -13.206 0.327 -4.498 1.00 0.00 C ATOM 561 CZ3 TRP A 69 -15.097 -1.125 -4.833 1.00 0.00 C ATOM 562 CH2 TRP A 69 -14.354 0.006 -5.167 1.00 0.00 C ATOM 0 H TRP A 69 -14.394 -5.449 -0.486 1.00 0.00 H new ATOM 0 HA TRP A 69 -13.110 -3.261 0.736 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -12.320 -4.201 -1.300 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -13.899 -4.116 -2.055 1.00 0.00 H new ATOM 0 HD1 TRP A 69 -11.020 -1.715 -1.010 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -10.994 0.267 -2.671 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -15.275 -2.837 -3.564 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 -12.634 1.205 -4.757 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -16.002 -1.348 -5.379 1.00 0.00 H new ATOM 0 HH2 TRP A 69 -14.692 0.642 -5.971 1.00 0.00 H new ATOM 573 N GLY A 70 -16.017 -2.541 -0.627 1.00 0.00 N ATOM 574 CA GLY A 70 -17.079 -1.552 -0.594 1.00 0.00 C ATOM 575 C GLY A 70 -17.859 -1.566 0.712 1.00 0.00 C ATOM 576 O GLY A 70 -18.806 -0.797 0.884 1.00 0.00 O ATOM 0 H GLY A 70 -16.211 -3.358 -1.206 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -16.651 -0.561 -0.745 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -17.764 -1.733 -1.423 1.00 0.00 H new ATOM 580 N SER A 71 -17.467 -2.437 1.633 1.00 0.00 N ATOM 581 CA SER A 71 -18.122 -2.524 2.931 1.00 0.00 C ATOM 582 C SER A 71 -17.388 -1.673 3.965 1.00 0.00 C ATOM 583 O SER A 71 -17.907 -1.416 5.054 1.00 0.00 O ATOM 584 CB SER A 71 -18.188 -3.981 3.394 1.00 0.00 C ATOM 585 OG SER A 71 -18.931 -4.776 2.481 1.00 0.00 O ATOM 0 H SER A 71 -16.697 -3.094 1.504 1.00 0.00 H new ATOM 0 HA SER A 71 -19.137 -2.140 2.830 1.00 0.00 H new ATOM 0 HB2 SER A 71 -17.179 -4.381 3.491 1.00 0.00 H new ATOM 0 HB3 SER A 71 -18.647 -4.031 4.381 1.00 0.00 H new ATOM 0 HG SER A 71 -18.454 -4.824 1.626 1.00 0.00 H new ATOM 591 N VAL A 72 -16.178 -1.246 3.621 1.00 0.00 N ATOM 592 CA VAL A 72 -15.397 -0.371 4.483 1.00 0.00 C ATOM 593 C VAL A 72 -16.055 1.003 4.557 1.00 0.00 C ATOM 594 O VAL A 72 -16.515 1.531 3.541 1.00 0.00 O ATOM 595 CB VAL A 72 -13.950 -0.218 3.960 1.00 0.00 C ATOM 596 CG1 VAL A 72 -13.115 0.639 4.901 1.00 0.00 C ATOM 597 CG2 VAL A 72 -13.302 -1.579 3.756 1.00 0.00 C ATOM 0 H VAL A 72 -15.716 -1.494 2.746 1.00 0.00 H new ATOM 0 HA VAL A 72 -15.361 -0.820 5.476 1.00 0.00 H new ATOM 0 HB VAL A 72 -13.995 0.287 2.995 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -12.102 0.730 4.508 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -13.562 1.630 4.984 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -13.082 0.172 5.885 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -12.285 -1.446 3.388 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -13.277 -2.116 4.704 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -13.879 -2.151 3.030 1.00 0.00 H new ATOM 607 N GLY A 73 -16.128 1.564 5.760 1.00 0.00 N ATOM 608 CA GLY A 73 -16.696 2.880 5.928 1.00 0.00 C ATOM 609 C GLY A 73 -15.895 3.924 5.190 1.00 0.00 C ATOM 610 O GLY A 73 -14.669 3.882 5.195 1.00 0.00 O ATOM 0 H GLY A 73 -15.802 1.125 6.621 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -17.724 2.883 5.564 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -16.732 3.130 6.988 1.00 0.00 H new ATOM 614 N LYS A 74 -16.586 4.863 4.567 1.00 0.00 N ATOM 615 CA LYS A 74 -15.935 5.867 3.731 1.00 0.00 C ATOM 616 C LYS A 74 -15.048 6.745 4.596 1.00 0.00 C ATOM 617 O LYS A 74 -13.935 7.098 4.214 1.00 0.00 O ATOM 618 CB LYS A 74 -16.975 6.728 3.005 1.00 0.00 C ATOM 619 CG LYS A 74 -18.188 5.952 2.520 1.00 0.00 C ATOM 620 CD LYS A 74 -17.795 4.839 1.570 1.00 0.00 C ATOM 621 CE LYS A 74 -18.995 4.012 1.154 1.00 0.00 C ATOM 622 NZ LYS A 74 -20.073 4.847 0.572 1.00 0.00 N ATOM 0 H LYS A 74 -17.600 4.954 4.622 1.00 0.00 H new ATOM 0 HA LYS A 74 -15.329 5.360 2.981 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -17.307 7.521 3.675 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -16.500 7.211 2.151 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -18.717 5.531 3.375 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -18.879 6.631 2.020 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -17.321 5.265 0.685 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -17.057 4.195 2.048 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -18.684 3.263 0.426 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -19.381 3.474 2.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -20.789 4.233 0.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -20.516 5.415 1.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -19.671 5.479 -0.149 1.00 0.00 H new ATOM 636 N LYS A 75 -15.554 7.069 5.779 1.00 0.00 N ATOM 637 CA LYS A 75 -14.804 7.833 6.760 1.00 0.00 C ATOM 638 C LYS A 75 -13.567 7.061 7.195 1.00 0.00 C ATOM 639 O LYS A 75 -12.460 7.601 7.235 1.00 0.00 O ATOM 640 CB LYS A 75 -15.687 8.126 7.976 1.00 0.00 C ATOM 641 CG LYS A 75 -14.954 8.810 9.122 1.00 0.00 C ATOM 642 CD LYS A 75 -14.373 10.151 8.704 1.00 0.00 C ATOM 643 CE LYS A 75 -13.593 10.801 9.837 1.00 0.00 C ATOM 644 NZ LYS A 75 -14.445 11.065 11.026 1.00 0.00 N ATOM 0 H LYS A 75 -16.493 6.809 6.082 1.00 0.00 H new ATOM 0 HA LYS A 75 -14.491 8.774 6.308 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -16.520 8.755 7.664 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -16.112 7.190 8.337 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -15.640 8.956 9.956 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -14.153 8.163 9.478 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -13.718 10.012 7.844 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -15.178 10.814 8.388 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -12.764 10.154 10.123 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.160 11.738 9.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -13.928 11.670 11.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -15.318 11.545 10.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -14.686 10.165 11.488 1.00 0.00 H new ATOM 658 N GLU A 76 -13.767 5.788 7.507 1.00 0.00 N ATOM 659 CA GLU A 76 -12.686 4.941 7.971 1.00 0.00 C ATOM 660 C GLU A 76 -11.648 4.762 6.874 1.00 0.00 C ATOM 661 O GLU A 76 -10.450 4.811 7.135 1.00 0.00 O ATOM 662 CB GLU A 76 -13.223 3.583 8.416 1.00 0.00 C ATOM 663 CG GLU A 76 -12.209 2.756 9.187 1.00 0.00 C ATOM 664 CD GLU A 76 -11.788 3.416 10.483 1.00 0.00 C ATOM 665 OE1 GLU A 76 -12.544 3.321 11.474 1.00 0.00 O ATOM 666 OE2 GLU A 76 -10.702 4.028 10.526 1.00 0.00 O ATOM 0 H GLU A 76 -14.672 5.321 7.446 1.00 0.00 H new ATOM 0 HA GLU A 76 -12.213 5.423 8.826 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -14.105 3.736 9.038 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -13.545 3.023 7.538 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -12.634 1.776 9.403 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -11.330 2.592 8.564 1.00 0.00 H new ATOM 673 N ALA A 77 -12.115 4.576 5.640 1.00 0.00 N ATOM 674 CA ALA A 77 -11.223 4.427 4.501 1.00 0.00 C ATOM 675 C ALA A 77 -10.305 5.636 4.380 1.00 0.00 C ATOM 676 O ALA A 77 -9.113 5.495 4.119 1.00 0.00 O ATOM 677 CB ALA A 77 -12.022 4.229 3.221 1.00 0.00 C ATOM 0 H ALA A 77 -13.107 4.526 5.408 1.00 0.00 H new ATOM 0 HA ALA A 77 -10.605 3.543 4.659 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -11.339 4.119 2.379 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -12.635 3.332 3.310 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -12.665 5.093 3.056 1.00 0.00 H new ATOM 683 N MET A 78 -10.867 6.822 4.597 1.00 0.00 N ATOM 684 CA MET A 78 -10.093 8.058 4.554 1.00 0.00 C ATOM 685 C MET A 78 -8.999 8.035 5.610 1.00 0.00 C ATOM 686 O MET A 78 -7.856 8.408 5.341 1.00 0.00 O ATOM 687 CB MET A 78 -10.998 9.274 4.777 1.00 0.00 C ATOM 688 CG MET A 78 -12.050 9.463 3.698 1.00 0.00 C ATOM 689 SD MET A 78 -13.152 10.849 4.036 1.00 0.00 S ATOM 690 CE MET A 78 -14.262 10.731 2.635 1.00 0.00 C ATOM 0 H MET A 78 -11.857 6.953 4.805 1.00 0.00 H new ATOM 0 HA MET A 78 -9.637 8.136 3.567 1.00 0.00 H new ATOM 0 HB2 MET A 78 -11.495 9.173 5.742 1.00 0.00 H new ATOM 0 HB3 MET A 78 -10.380 10.170 4.829 1.00 0.00 H new ATOM 0 HG2 MET A 78 -11.557 9.622 2.739 1.00 0.00 H new ATOM 0 HG3 MET A 78 -12.639 8.550 3.606 1.00 0.00 H new ATOM 0 HE1 MET A 78 -15.019 11.512 2.704 1.00 0.00 H new ATOM 0 HE2 MET A 78 -13.697 10.855 1.711 1.00 0.00 H new ATOM 0 HE3 MET A 78 -14.747 9.755 2.636 1.00 0.00 H new ATOM 700 N GLU A 79 -9.355 7.578 6.805 1.00 0.00 N ATOM 701 CA GLU A 79 -8.416 7.510 7.915 1.00 0.00 C ATOM 702 C GLU A 79 -7.357 6.436 7.679 1.00 0.00 C ATOM 703 O GLU A 79 -6.184 6.628 8.000 1.00 0.00 O ATOM 704 CB GLU A 79 -9.156 7.233 9.223 1.00 0.00 C ATOM 705 CG GLU A 79 -10.128 8.333 9.609 1.00 0.00 C ATOM 706 CD GLU A 79 -10.725 8.131 10.987 1.00 0.00 C ATOM 707 OE1 GLU A 79 -11.937 7.860 11.090 1.00 0.00 O ATOM 708 OE2 GLU A 79 -9.982 8.251 11.987 1.00 0.00 O ATOM 0 H GLU A 79 -10.294 7.247 7.029 1.00 0.00 H new ATOM 0 HA GLU A 79 -7.914 8.475 7.986 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -9.700 6.293 9.132 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -8.428 7.104 10.024 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.614 9.294 9.578 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.931 8.377 8.873 1.00 0.00 H new ATOM 715 N ILE A 80 -7.780 5.306 7.127 1.00 0.00 N ATOM 716 CA ILE A 80 -6.865 4.209 6.822 1.00 0.00 C ATOM 717 C ILE A 80 -5.870 4.622 5.744 1.00 0.00 C ATOM 718 O ILE A 80 -4.663 4.464 5.913 1.00 0.00 O ATOM 719 CB ILE A 80 -7.619 2.940 6.361 1.00 0.00 C ATOM 720 CG1 ILE A 80 -8.573 2.459 7.456 1.00 0.00 C ATOM 721 CG2 ILE A 80 -6.631 1.836 5.999 1.00 0.00 C ATOM 722 CD1 ILE A 80 -9.482 1.332 7.015 1.00 0.00 C ATOM 0 H ILE A 80 -8.753 5.123 6.880 1.00 0.00 H new ATOM 0 HA ILE A 80 -6.332 3.976 7.744 1.00 0.00 H new ATOM 0 HB ILE A 80 -8.203 3.188 5.475 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -7.989 2.129 8.315 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -9.184 3.298 7.789 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -7.178 0.950 5.677 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -5.984 2.177 5.191 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -6.024 1.591 6.871 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -10.130 1.043 7.842 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -10.092 1.664 6.175 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -8.879 0.477 6.710 1.00 0.00 H new ATOM 734 N ILE A 81 -6.382 5.168 4.645 1.00 0.00 N ATOM 735 CA ILE A 81 -5.536 5.619 3.544 1.00 0.00 C ATOM 736 C ILE A 81 -4.594 6.729 4.012 1.00 0.00 C ATOM 737 O ILE A 81 -3.450 6.818 3.560 1.00 0.00 O ATOM 738 CB ILE A 81 -6.384 6.113 2.345 1.00 0.00 C ATOM 739 CG1 ILE A 81 -7.224 4.966 1.769 1.00 0.00 C ATOM 740 CG2 ILE A 81 -5.502 6.719 1.261 1.00 0.00 C ATOM 741 CD1 ILE A 81 -6.408 3.789 1.273 1.00 0.00 C ATOM 0 H ILE A 81 -7.381 5.309 4.493 1.00 0.00 H new ATOM 0 HA ILE A 81 -4.944 4.766 3.212 1.00 0.00 H new ATOM 0 HB ILE A 81 -7.056 6.890 2.709 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.916 4.617 2.535 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -7.826 5.349 0.945 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.124 7.057 0.432 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.952 7.566 1.671 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -4.798 5.968 0.903 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -7.076 3.022 0.882 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.734 4.121 0.483 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -5.826 3.377 2.097 1.00 0.00 H new ATOM 753 N LYS A 82 -5.077 7.556 4.931 1.00 0.00 N ATOM 754 CA LYS A 82 -4.266 8.618 5.511 1.00 0.00 C ATOM 755 C LYS A 82 -3.045 8.033 6.217 1.00 0.00 C ATOM 756 O LYS A 82 -1.914 8.462 5.984 1.00 0.00 O ATOM 757 CB LYS A 82 -5.100 9.440 6.499 1.00 0.00 C ATOM 758 CG LYS A 82 -4.354 10.617 7.107 1.00 0.00 C ATOM 759 CD LYS A 82 -3.969 11.643 6.054 1.00 0.00 C ATOM 760 CE LYS A 82 -3.245 12.827 6.672 1.00 0.00 C ATOM 761 NZ LYS A 82 -4.080 13.521 7.687 1.00 0.00 N ATOM 0 H LYS A 82 -6.030 7.511 5.291 1.00 0.00 H new ATOM 0 HA LYS A 82 -3.924 9.270 4.707 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.989 9.811 5.988 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -5.443 8.787 7.301 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -4.977 11.090 7.866 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.456 10.258 7.611 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.331 11.175 5.304 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.864 11.991 5.538 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.320 12.485 7.136 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.967 13.531 5.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.668 14.452 7.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.044 13.645 7.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -4.113 12.952 8.557 1.00 0.00 H new ATOM 775 N LYS A 83 -3.280 7.036 7.063 1.00 0.00 N ATOM 776 CA LYS A 83 -2.202 6.387 7.800 1.00 0.00 C ATOM 777 C LYS A 83 -1.356 5.534 6.867 1.00 0.00 C ATOM 778 O LYS A 83 -0.166 5.328 7.106 1.00 0.00 O ATOM 779 CB LYS A 83 -2.768 5.522 8.925 1.00 0.00 C ATOM 780 CG LYS A 83 -3.620 6.293 9.915 1.00 0.00 C ATOM 781 CD LYS A 83 -4.175 5.385 10.996 1.00 0.00 C ATOM 782 CE LYS A 83 -5.145 6.126 11.897 1.00 0.00 C ATOM 783 NZ LYS A 83 -6.299 6.672 11.135 1.00 0.00 N ATOM 0 H LYS A 83 -4.208 6.659 7.255 1.00 0.00 H new ATOM 0 HA LYS A 83 -1.572 7.163 8.235 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.366 4.721 8.490 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -1.943 5.050 9.459 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.024 7.083 10.372 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -4.442 6.778 9.389 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -4.680 4.535 10.536 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -3.356 4.984 11.593 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -5.508 5.452 12.673 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -4.624 6.940 12.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -7.184 6.429 11.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -6.213 7.706 11.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -6.309 6.263 10.179 1.00 0.00 H new ATOM 797 N PHE A 84 -1.982 5.037 5.809 1.00 0.00 N ATOM 798 CA PHE A 84 -1.289 4.249 4.803 1.00 0.00 C ATOM 799 C PHE A 84 -0.216 5.106 4.137 1.00 0.00 C ATOM 800 O PHE A 84 0.958 4.741 4.111 1.00 0.00 O ATOM 801 CB PHE A 84 -2.287 3.738 3.758 1.00 0.00 C ATOM 802 CG PHE A 84 -1.892 2.440 3.109 1.00 0.00 C ATOM 803 CD1 PHE A 84 -0.788 2.366 2.276 1.00 0.00 C ATOM 804 CD2 PHE A 84 -2.633 1.290 3.332 1.00 0.00 C ATOM 805 CE1 PHE A 84 -0.431 1.173 1.677 1.00 0.00 C ATOM 806 CE2 PHE A 84 -2.282 0.093 2.736 1.00 0.00 C ATOM 807 CZ PHE A 84 -1.179 0.035 1.908 1.00 0.00 C ATOM 0 H PHE A 84 -2.977 5.168 5.626 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.815 3.390 5.278 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.260 3.612 4.233 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -2.406 4.497 2.984 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.199 3.252 2.092 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -3.496 1.330 3.980 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.432 1.130 1.029 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.869 -0.795 2.918 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.901 -0.899 1.442 1.00 0.00 H new ATOM 817 N LYS A 85 -0.631 6.264 3.629 1.00 0.00 N ATOM 818 CA LYS A 85 0.290 7.203 2.999 1.00 0.00 C ATOM 819 C LYS A 85 1.330 7.696 4.001 1.00 0.00 C ATOM 820 O LYS A 85 2.487 7.929 3.647 1.00 0.00 O ATOM 821 CB LYS A 85 -0.470 8.403 2.430 1.00 0.00 C ATOM 822 CG LYS A 85 -1.467 8.051 1.338 1.00 0.00 C ATOM 823 CD LYS A 85 -2.157 9.299 0.816 1.00 0.00 C ATOM 824 CE LYS A 85 -3.115 8.989 -0.319 1.00 0.00 C ATOM 825 NZ LYS A 85 -3.818 10.212 -0.788 1.00 0.00 N ATOM 0 H LYS A 85 -1.603 6.574 3.642 1.00 0.00 H new ATOM 0 HA LYS A 85 0.795 6.679 2.188 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -0.999 8.901 3.242 1.00 0.00 H new ATOM 0 HB3 LYS A 85 0.250 9.119 2.032 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -0.954 7.544 0.520 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -2.210 7.355 1.728 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -2.702 9.778 1.629 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -1.406 10.011 0.472 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -2.566 8.543 -1.148 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -3.847 8.252 0.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -4.777 9.962 -1.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -3.877 10.899 -0.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -3.292 10.632 -1.581 1.00 0.00 H new ATOM 839 N LYS A 86 0.901 7.850 5.248 1.00 0.00 N ATOM 840 CA LYS A 86 1.768 8.321 6.319 1.00 0.00 C ATOM 841 C LYS A 86 2.912 7.334 6.545 1.00 0.00 C ATOM 842 O LYS A 86 4.082 7.719 6.582 1.00 0.00 O ATOM 843 CB LYS A 86 0.941 8.502 7.603 1.00 0.00 C ATOM 844 CG LYS A 86 1.582 9.385 8.669 1.00 0.00 C ATOM 845 CD LYS A 86 2.730 8.691 9.387 1.00 0.00 C ATOM 846 CE LYS A 86 3.268 9.539 10.529 1.00 0.00 C ATOM 847 NZ LYS A 86 3.726 10.876 10.066 1.00 0.00 N ATOM 0 H LYS A 86 -0.055 7.652 5.544 1.00 0.00 H new ATOM 0 HA LYS A 86 2.201 9.281 6.040 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.027 8.927 7.336 1.00 0.00 H new ATOM 0 HB3 LYS A 86 0.750 7.519 8.035 1.00 0.00 H new ATOM 0 HG2 LYS A 86 1.948 10.301 8.205 1.00 0.00 H new ATOM 0 HG3 LYS A 86 0.826 9.677 9.397 1.00 0.00 H new ATOM 0 HD2 LYS A 86 2.390 7.730 9.775 1.00 0.00 H new ATOM 0 HD3 LYS A 86 3.531 8.483 8.678 1.00 0.00 H new ATOM 0 HE2 LYS A 86 2.492 9.664 11.284 1.00 0.00 H new ATOM 0 HE3 LYS A 86 4.097 9.018 11.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 4.237 11.354 10.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 4.359 10.762 9.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 2.903 11.448 9.789 1.00 0.00 H new ATOM 861 N ASP A 87 2.570 6.058 6.672 1.00 0.00 N ATOM 862 CA ASP A 87 3.567 5.026 6.934 1.00 0.00 C ATOM 863 C ASP A 87 4.453 4.822 5.706 1.00 0.00 C ATOM 864 O ASP A 87 5.643 4.519 5.828 1.00 0.00 O ATOM 865 CB ASP A 87 2.890 3.711 7.335 1.00 0.00 C ATOM 866 CG ASP A 87 3.831 2.767 8.062 1.00 0.00 C ATOM 867 OD1 ASP A 87 4.353 1.827 7.432 1.00 0.00 O ATOM 868 OD2 ASP A 87 4.056 2.959 9.278 1.00 0.00 O ATOM 0 H ASP A 87 1.613 5.713 6.598 1.00 0.00 H new ATOM 0 HA ASP A 87 4.194 5.353 7.764 1.00 0.00 H new ATOM 0 HB2 ASP A 87 2.034 3.928 7.974 1.00 0.00 H new ATOM 0 HB3 ASP A 87 2.505 3.218 6.442 1.00 0.00 H new ATOM 873 N LEU A 88 3.869 5.012 4.521 1.00 0.00 N ATOM 874 CA LEU A 88 4.627 4.961 3.271 1.00 0.00 C ATOM 875 C LEU A 88 5.674 6.066 3.233 1.00 0.00 C ATOM 876 O LEU A 88 6.807 5.845 2.811 1.00 0.00 O ATOM 877 CB LEU A 88 3.706 5.110 2.057 1.00 0.00 C ATOM 878 CG LEU A 88 2.729 3.962 1.809 1.00 0.00 C ATOM 879 CD1 LEU A 88 1.862 4.272 0.600 1.00 0.00 C ATOM 880 CD2 LEU A 88 3.475 2.650 1.609 1.00 0.00 C ATOM 0 H LEU A 88 2.874 5.202 4.402 1.00 0.00 H new ATOM 0 HA LEU A 88 5.117 3.988 3.229 1.00 0.00 H new ATOM 0 HB2 LEU A 88 3.132 6.030 2.173 1.00 0.00 H new ATOM 0 HB3 LEU A 88 4.326 5.231 1.169 1.00 0.00 H new ATOM 0 HG LEU A 88 2.089 3.855 2.685 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.168 3.449 0.429 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.301 5.189 0.780 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.495 4.401 -0.278 1.00 0.00 H new ATOM 0 HD21 LEU A 88 2.759 1.847 1.434 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.140 2.737 0.750 1.00 0.00 H new ATOM 0 HD23 LEU A 88 4.061 2.425 2.500 1.00 0.00 H new ATOM 892 N ALA A 89 5.281 7.256 3.676 1.00 0.00 N ATOM 893 CA ALA A 89 6.183 8.399 3.716 1.00 0.00 C ATOM 894 C ALA A 89 7.370 8.108 4.621 1.00 0.00 C ATOM 895 O ALA A 89 8.518 8.388 4.272 1.00 0.00 O ATOM 896 CB ALA A 89 5.445 9.637 4.193 1.00 0.00 C ATOM 0 H ALA A 89 4.339 7.453 4.014 1.00 0.00 H new ATOM 0 HA ALA A 89 6.554 8.583 2.708 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.132 10.483 4.218 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.624 9.856 3.511 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.049 9.462 5.193 1.00 0.00 H new ATOM 902 N ALA A 90 7.081 7.534 5.782 1.00 0.00 N ATOM 903 CA ALA A 90 8.121 7.131 6.712 1.00 0.00 C ATOM 904 C ALA A 90 9.021 6.077 6.078 1.00 0.00 C ATOM 905 O ALA A 90 10.244 6.183 6.130 1.00 0.00 O ATOM 906 CB ALA A 90 7.505 6.606 7.999 1.00 0.00 C ATOM 0 H ALA A 90 6.132 7.338 6.100 1.00 0.00 H new ATOM 0 HA ALA A 90 8.730 8.002 6.953 1.00 0.00 H new ATOM 0 HB1 ALA A 90 8.297 6.308 8.686 1.00 0.00 H new ATOM 0 HB2 ALA A 90 6.901 7.388 8.459 1.00 0.00 H new ATOM 0 HB3 ALA A 90 6.875 5.745 7.776 1.00 0.00 H new ATOM 912 N MET A 91 8.400 5.081 5.451 1.00 0.00 N ATOM 913 CA MET A 91 9.131 3.996 4.799 1.00 0.00 C ATOM 914 C MET A 91 10.051 4.543 3.711 1.00 0.00 C ATOM 915 O MET A 91 11.189 4.097 3.561 1.00 0.00 O ATOM 916 CB MET A 91 8.152 2.986 4.194 1.00 0.00 C ATOM 917 CG MET A 91 8.832 1.768 3.591 1.00 0.00 C ATOM 918 SD MET A 91 9.697 0.772 4.822 1.00 0.00 S ATOM 919 CE MET A 91 8.325 0.110 5.766 1.00 0.00 C ATOM 0 H MET A 91 7.385 5.002 5.380 1.00 0.00 H new ATOM 0 HA MET A 91 9.741 3.495 5.551 1.00 0.00 H new ATOM 0 HB2 MET A 91 7.457 2.658 4.967 1.00 0.00 H new ATOM 0 HB3 MET A 91 7.562 3.481 3.423 1.00 0.00 H new ATOM 0 HG2 MET A 91 8.086 1.151 3.090 1.00 0.00 H new ATOM 0 HG3 MET A 91 9.541 2.093 2.829 1.00 0.00 H new ATOM 0 HE1 MET A 91 8.669 -0.731 6.368 1.00 0.00 H new ATOM 0 HE2 MET A 91 7.926 0.885 6.421 1.00 0.00 H new ATOM 0 HE3 MET A 91 7.544 -0.227 5.085 1.00 0.00 H new ATOM 929 N LEU A 92 9.547 5.519 2.963 1.00 0.00 N ATOM 930 CA LEU A 92 10.318 6.175 1.914 1.00 0.00 C ATOM 931 C LEU A 92 11.581 6.810 2.487 1.00 0.00 C ATOM 932 O LEU A 92 12.669 6.689 1.918 1.00 0.00 O ATOM 933 CB LEU A 92 9.460 7.241 1.225 1.00 0.00 C ATOM 934 CG LEU A 92 10.175 8.079 0.164 1.00 0.00 C ATOM 935 CD1 LEU A 92 10.712 7.192 -0.947 1.00 0.00 C ATOM 936 CD2 LEU A 92 9.233 9.133 -0.399 1.00 0.00 C ATOM 0 H LEU A 92 8.597 5.876 3.066 1.00 0.00 H new ATOM 0 HA LEU A 92 10.614 5.424 1.182 1.00 0.00 H new ATOM 0 HB2 LEU A 92 8.606 6.749 0.759 1.00 0.00 H new ATOM 0 HB3 LEU A 92 9.065 7.912 1.987 1.00 0.00 H new ATOM 0 HG LEU A 92 11.019 8.584 0.633 1.00 0.00 H new ATOM 0 HD11 LEU A 92 11.217 7.807 -1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 92 11.418 6.474 -0.530 1.00 0.00 H new ATOM 0 HD13 LEU A 92 9.886 6.658 -1.417 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.755 9.722 -1.153 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.371 8.645 -0.853 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.898 9.788 0.405 1.00 0.00 H new ATOM 948 N ARG A 93 11.433 7.472 3.627 1.00 0.00 N ATOM 949 CA ARG A 93 12.560 8.119 4.276 1.00 0.00 C ATOM 950 C ARG A 93 13.576 7.092 4.764 1.00 0.00 C ATOM 951 O ARG A 93 14.768 7.381 4.834 1.00 0.00 O ATOM 952 CB ARG A 93 12.098 8.989 5.441 1.00 0.00 C ATOM 953 CG ARG A 93 11.229 10.159 5.017 1.00 0.00 C ATOM 954 CD ARG A 93 10.991 11.112 6.172 1.00 0.00 C ATOM 955 NE ARG A 93 12.226 11.772 6.602 1.00 0.00 N ATOM 956 CZ ARG A 93 12.346 12.481 7.725 1.00 0.00 C ATOM 957 NH1 ARG A 93 11.311 12.622 8.540 1.00 0.00 N ATOM 958 NH2 ARG A 93 13.505 13.053 8.027 1.00 0.00 N ATOM 0 H ARG A 93 10.545 7.574 4.118 1.00 0.00 H new ATOM 0 HA ARG A 93 13.040 8.758 3.535 1.00 0.00 H new ATOM 0 HB2 ARG A 93 11.543 8.372 6.147 1.00 0.00 H new ATOM 0 HB3 ARG A 93 12.972 9.369 5.969 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.707 10.692 4.195 1.00 0.00 H new ATOM 0 HG3 ARG A 93 10.274 9.790 4.644 1.00 0.00 H new ATOM 0 HD2 ARG A 93 10.261 11.866 5.876 1.00 0.00 H new ATOM 0 HD3 ARG A 93 10.561 10.565 7.011 1.00 0.00 H new ATOM 0 HE ARG A 93 13.047 11.684 6.004 1.00 0.00 H new ATOM 0 HH11 ARG A 93 10.418 12.187 8.310 1.00 0.00 H new ATOM 0 HH12 ARG A 93 11.408 13.165 9.398 1.00 0.00 H new ATOM 0 HH21 ARG A 93 14.303 12.950 7.400 1.00 0.00 H new ATOM 0 HH22 ARG A 93 13.598 13.595 8.886 1.00 0.00 H new ATOM 972 N ILE A 94 13.110 5.894 5.102 1.00 0.00 N ATOM 973 CA ILE A 94 14.011 4.843 5.551 1.00 0.00 C ATOM 974 C ILE A 94 14.801 4.273 4.372 1.00 0.00 C ATOM 975 O ILE A 94 15.969 3.904 4.520 1.00 0.00 O ATOM 976 CB ILE A 94 13.272 3.698 6.265 1.00 0.00 C ATOM 977 CG1 ILE A 94 12.218 4.247 7.227 1.00 0.00 C ATOM 978 CG2 ILE A 94 14.273 2.850 7.032 1.00 0.00 C ATOM 979 CD1 ILE A 94 11.382 3.173 7.887 1.00 0.00 C ATOM 0 H ILE A 94 12.125 5.630 5.074 1.00 0.00 H new ATOM 0 HA ILE A 94 14.691 5.303 6.268 1.00 0.00 H new ATOM 0 HB ILE A 94 12.769 3.088 5.515 1.00 0.00 H new ATOM 0 HG12 ILE A 94 12.714 4.835 7.999 1.00 0.00 H new ATOM 0 HG13 ILE A 94 11.560 4.925 6.683 1.00 0.00 H new ATOM 0 HG21 ILE A 94 13.750 2.039 7.538 1.00 0.00 H new ATOM 0 HG22 ILE A 94 15.004 2.434 6.339 1.00 0.00 H new ATOM 0 HG23 ILE A 94 14.784 3.468 7.770 1.00 0.00 H new ATOM 0 HD11 ILE A 94 10.656 3.636 8.555 1.00 0.00 H new ATOM 0 HD12 ILE A 94 10.857 2.599 7.123 1.00 0.00 H new ATOM 0 HD13 ILE A 94 12.029 2.508 8.459 1.00 0.00 H new ATOM 991 N ILE A 95 14.163 4.202 3.200 1.00 0.00 N ATOM 992 CA ILE A 95 14.863 3.816 1.977 1.00 0.00 C ATOM 993 C ILE A 95 16.057 4.744 1.769 1.00 0.00 C ATOM 994 O ILE A 95 17.184 4.295 1.552 1.00 0.00 O ATOM 995 CB ILE A 95 13.947 3.877 0.731 1.00 0.00 C ATOM 996 CG1 ILE A 95 12.817 2.856 0.853 1.00 0.00 C ATOM 997 CG2 ILE A 95 14.756 3.607 -0.530 1.00 0.00 C ATOM 998 CD1 ILE A 95 13.282 1.435 0.658 1.00 0.00 C ATOM 0 H ILE A 95 13.171 4.405 3.075 1.00 0.00 H new ATOM 0 HA ILE A 95 15.190 2.783 2.095 1.00 0.00 H new ATOM 0 HB ILE A 95 13.514 4.875 0.667 1.00 0.00 H new ATOM 0 HG12 ILE A 95 12.355 2.949 1.836 1.00 0.00 H new ATOM 0 HG13 ILE A 95 12.047 3.085 0.116 1.00 0.00 H new ATOM 0 HG21 ILE A 95 14.100 3.653 -1.400 1.00 0.00 H new ATOM 0 HG22 ILE A 95 15.540 4.358 -0.627 1.00 0.00 H new ATOM 0 HG23 ILE A 95 15.207 2.617 -0.468 1.00 0.00 H new ATOM 0 HD11 ILE A 95 12.434 0.758 0.757 1.00 0.00 H new ATOM 0 HD12 ILE A 95 13.718 1.328 -0.335 1.00 0.00 H new ATOM 0 HD13 ILE A 95 14.031 1.191 1.411 1.00 0.00 H new ATOM 1010 N ASN A 96 15.799 6.045 1.868 1.00 0.00 N ATOM 1011 CA ASN A 96 16.856 7.051 1.793 1.00 0.00 C ATOM 1012 C ASN A 96 17.874 6.820 2.899 1.00 0.00 C ATOM 1013 O ASN A 96 19.079 6.805 2.653 1.00 0.00 O ATOM 1014 CB ASN A 96 16.272 8.462 1.932 1.00 0.00 C ATOM 1015 CG ASN A 96 15.321 8.832 0.811 1.00 0.00 C ATOM 1016 OD1 ASN A 96 15.468 8.382 -0.322 1.00 0.00 O ATOM 1017 ND2 ASN A 96 14.340 9.668 1.120 1.00 0.00 N ATOM 0 H ASN A 96 14.864 6.429 2.001 1.00 0.00 H new ATOM 0 HA ASN A 96 17.342 6.962 0.821 1.00 0.00 H new ATOM 0 HB2 ASN A 96 15.747 8.538 2.884 1.00 0.00 H new ATOM 0 HB3 ASN A 96 17.088 9.184 1.960 1.00 0.00 H new ATOM 0 HD21 ASN A 96 13.674 9.959 0.405 1.00 0.00 H new ATOM 0 HD22 ASN A 96 14.251 10.020 2.073 1.00 0.00 H new ATOM 1024 N ALA A 97 17.368 6.586 4.108 1.00 0.00 N ATOM 1025 CA ALA A 97 18.198 6.443 5.302 1.00 0.00 C ATOM 1026 C ALA A 97 19.099 5.207 5.254 1.00 0.00 C ATOM 1027 O ALA A 97 19.935 5.010 6.136 1.00 0.00 O ATOM 1028 CB ALA A 97 17.322 6.405 6.542 1.00 0.00 C ATOM 0 H ALA A 97 16.369 6.490 4.288 1.00 0.00 H new ATOM 0 HA ALA A 97 18.855 7.312 5.340 1.00 0.00 H new ATOM 0 HB1 ALA A 97 17.949 6.298 7.427 1.00 0.00 H new ATOM 0 HB2 ALA A 97 16.750 7.330 6.612 1.00 0.00 H new ATOM 0 HB3 ALA A 97 16.637 5.559 6.478 1.00 0.00 H new ATOM 1034 N ARG A 98 18.926 4.369 4.234 1.00 0.00 N ATOM 1035 CA ARG A 98 19.840 3.251 4.006 1.00 0.00 C ATOM 1036 C ARG A 98 21.232 3.783 3.677 1.00 0.00 C ATOM 1037 O ARG A 98 22.231 3.080 3.806 1.00 0.00 O ATOM 1038 CB ARG A 98 19.347 2.368 2.856 1.00 0.00 C ATOM 1039 CG ARG A 98 18.009 1.682 3.106 1.00 0.00 C ATOM 1040 CD ARG A 98 18.111 0.580 4.149 1.00 0.00 C ATOM 1041 NE ARG A 98 18.194 1.096 5.516 1.00 0.00 N ATOM 1042 CZ ARG A 98 18.424 0.328 6.582 1.00 0.00 C ATOM 1043 NH1 ARG A 98 18.596 -0.980 6.437 1.00 0.00 N ATOM 1044 NH2 ARG A 98 18.473 0.867 7.794 1.00 0.00 N ATOM 0 H ARG A 98 18.167 4.441 3.556 1.00 0.00 H new ATOM 0 HA ARG A 98 19.879 2.650 4.914 1.00 0.00 H new ATOM 0 HB2 ARG A 98 19.264 2.979 1.957 1.00 0.00 H new ATOM 0 HB3 ARG A 98 20.099 1.605 2.654 1.00 0.00 H new ATOM 0 HG2 ARG A 98 17.279 2.423 3.433 1.00 0.00 H new ATOM 0 HG3 ARG A 98 17.639 1.261 2.171 1.00 0.00 H new ATOM 0 HD2 ARG A 98 17.243 -0.074 4.065 1.00 0.00 H new ATOM 0 HD3 ARG A 98 18.991 -0.029 3.942 1.00 0.00 H new ATOM 0 HE ARG A 98 18.069 2.098 5.662 1.00 0.00 H new ATOM 0 HH11 ARG A 98 18.552 -1.400 5.509 1.00 0.00 H new ATOM 0 HH12 ARG A 98 18.772 -1.565 7.254 1.00 0.00 H new ATOM 0 HH21 ARG A 98 18.335 1.871 7.912 1.00 0.00 H new ATOM 0 HH22 ARG A 98 18.649 0.278 8.608 1.00 0.00 H new ATOM 1288 N GLY B 42 9.643 -10.308 -7.070 1.00 0.00 N ATOM 1289 CA GLY B 42 9.190 -9.453 -8.145 1.00 0.00 C ATOM 1290 C GLY B 42 10.054 -8.222 -8.303 1.00 0.00 C ATOM 1291 O GLY B 42 11.054 -8.073 -7.595 1.00 0.00 O ATOM 0 HA2 GLY B 42 9.190 -10.016 -9.078 1.00 0.00 H new ATOM 0 HA3 GLY B 42 8.160 -9.150 -7.955 1.00 0.00 H new ATOM 1295 N PRO B 43 9.697 -7.329 -9.238 1.00 0.00 N ATOM 1296 CA PRO B 43 10.419 -6.071 -9.472 1.00 0.00 C ATOM 1297 C PRO B 43 10.398 -5.144 -8.259 1.00 0.00 C ATOM 1298 O PRO B 43 9.635 -5.376 -7.323 1.00 0.00 O ATOM 1299 CB PRO B 43 9.654 -5.431 -10.634 1.00 0.00 C ATOM 1300 CG PRO B 43 8.925 -6.554 -11.279 1.00 0.00 C ATOM 1301 CD PRO B 43 8.566 -7.487 -10.165 1.00 0.00 C ATOM 0 HA PRO B 43 11.475 -6.248 -9.677 1.00 0.00 H new ATOM 0 HB2 PRO B 43 8.965 -4.665 -10.279 1.00 0.00 H new ATOM 0 HB3 PRO B 43 10.334 -4.947 -11.335 1.00 0.00 H new ATOM 0 HG2 PRO B 43 8.034 -6.198 -11.796 1.00 0.00 H new ATOM 0 HG3 PRO B 43 9.548 -7.051 -12.023 1.00 0.00 H new ATOM 0 HD2 PRO B 43 7.619 -7.216 -9.699 1.00 0.00 H new ATOM 0 HD3 PRO B 43 8.468 -8.515 -10.513 1.00 0.00 H new ATOM 1309 N ILE B 44 11.206 -4.087 -8.281 1.00 0.00 N ATOM 1310 CA ILE B 44 11.325 -3.190 -7.126 1.00 0.00 C ATOM 1311 C ILE B 44 9.975 -2.590 -6.720 1.00 0.00 C ATOM 1312 O ILE B 44 9.703 -2.413 -5.530 1.00 0.00 O ATOM 1313 CB ILE B 44 12.354 -2.067 -7.372 1.00 0.00 C ATOM 1314 CG1 ILE B 44 12.057 -1.330 -8.680 1.00 0.00 C ATOM 1315 CG2 ILE B 44 13.762 -2.645 -7.384 1.00 0.00 C ATOM 1316 CD1 ILE B 44 13.071 -0.261 -9.019 1.00 0.00 C ATOM 0 H ILE B 44 11.786 -3.828 -9.079 1.00 0.00 H new ATOM 0 HA ILE B 44 11.683 -3.805 -6.300 1.00 0.00 H new ATOM 0 HB ILE B 44 12.280 -1.344 -6.560 1.00 0.00 H new ATOM 0 HG12 ILE B 44 12.019 -2.054 -9.494 1.00 0.00 H new ATOM 0 HG13 ILE B 44 11.069 -0.874 -8.613 1.00 0.00 H new ATOM 0 HG21 ILE B 44 14.482 -1.845 -7.558 1.00 0.00 H new ATOM 0 HG22 ILE B 44 13.970 -3.117 -6.424 1.00 0.00 H new ATOM 0 HG23 ILE B 44 13.844 -3.387 -8.179 1.00 0.00 H new ATOM 0 HD11 ILE B 44 12.795 0.218 -9.958 1.00 0.00 H new ATOM 0 HD12 ILE B 44 13.093 0.485 -8.224 1.00 0.00 H new ATOM 0 HD13 ILE B 44 14.057 -0.714 -9.119 1.00 0.00 H new ATOM 1328 N ARG B 45 9.121 -2.306 -7.703 1.00 0.00 N ATOM 1329 CA ARG B 45 7.769 -1.826 -7.421 1.00 0.00 C ATOM 1330 C ARG B 45 7.004 -2.855 -6.601 1.00 0.00 C ATOM 1331 O ARG B 45 6.347 -2.524 -5.613 1.00 0.00 O ATOM 1332 CB ARG B 45 7.001 -1.555 -8.713 1.00 0.00 C ATOM 1333 CG ARG B 45 7.536 -0.398 -9.533 1.00 0.00 C ATOM 1334 CD ARG B 45 6.683 -0.179 -10.770 1.00 0.00 C ATOM 1335 NE ARG B 45 5.312 0.190 -10.416 1.00 0.00 N ATOM 1336 CZ ARG B 45 4.228 -0.505 -10.762 1.00 0.00 C ATOM 1337 NH1 ARG B 45 4.336 -1.607 -11.499 1.00 0.00 N ATOM 1338 NH2 ARG B 45 3.032 -0.095 -10.362 1.00 0.00 N ATOM 0 H ARG B 45 9.339 -2.399 -8.695 1.00 0.00 H new ATOM 0 HA ARG B 45 7.860 -0.897 -6.859 1.00 0.00 H new ATOM 0 HB2 ARG B 45 7.017 -2.456 -9.326 1.00 0.00 H new ATOM 0 HB3 ARG B 45 5.958 -1.357 -8.466 1.00 0.00 H new ATOM 0 HG2 ARG B 45 7.548 0.509 -8.928 1.00 0.00 H new ATOM 0 HG3 ARG B 45 8.566 -0.599 -9.826 1.00 0.00 H new ATOM 0 HD2 ARG B 45 7.125 0.605 -11.384 1.00 0.00 H new ATOM 0 HD3 ARG B 45 6.673 -1.088 -11.372 1.00 0.00 H new ATOM 0 HE ARG B 45 5.176 1.038 -9.866 1.00 0.00 H new ATOM 0 HH11 ARG B 45 5.255 -1.928 -11.805 1.00 0.00 H new ATOM 0 HH12 ARG B 45 3.500 -2.131 -11.758 1.00 0.00 H new ATOM 0 HH21 ARG B 45 2.945 0.747 -9.793 1.00 0.00 H new ATOM 0 HH22 ARG B 45 2.199 -0.622 -10.623 1.00 0.00 H new ATOM 1352 N MET B 46 7.108 -4.108 -7.018 1.00 0.00 N ATOM 1353 CA MET B 46 6.434 -5.201 -6.340 1.00 0.00 C ATOM 1354 C MET B 46 7.043 -5.427 -4.959 1.00 0.00 C ATOM 1355 O MET B 46 6.350 -5.831 -4.030 1.00 0.00 O ATOM 1356 CB MET B 46 6.516 -6.478 -7.181 1.00 0.00 C ATOM 1357 CG MET B 46 5.802 -7.665 -6.557 1.00 0.00 C ATOM 1358 SD MET B 46 5.801 -9.125 -7.617 1.00 0.00 S ATOM 1359 CE MET B 46 4.766 -8.565 -8.966 1.00 0.00 C ATOM 0 H MET B 46 7.657 -4.393 -7.829 1.00 0.00 H new ATOM 0 HA MET B 46 5.384 -4.938 -6.213 1.00 0.00 H new ATOM 0 HB2 MET B 46 6.088 -6.283 -8.164 1.00 0.00 H new ATOM 0 HB3 MET B 46 7.564 -6.735 -7.335 1.00 0.00 H new ATOM 0 HG2 MET B 46 6.280 -7.912 -5.609 1.00 0.00 H new ATOM 0 HG3 MET B 46 4.773 -7.386 -6.332 1.00 0.00 H new ATOM 0 HE1 MET B 46 3.993 -9.307 -9.164 1.00 0.00 H new ATOM 0 HE2 MET B 46 4.299 -7.618 -8.697 1.00 0.00 H new ATOM 0 HE3 MET B 46 5.375 -8.429 -9.860 1.00 0.00 H new ATOM 1369 N VAL B 47 8.337 -5.150 -4.834 1.00 0.00 N ATOM 1370 CA VAL B 47 9.030 -5.259 -3.553 1.00 0.00 C ATOM 1371 C VAL B 47 8.376 -4.358 -2.512 1.00 0.00 C ATOM 1372 O VAL B 47 8.067 -4.796 -1.405 1.00 0.00 O ATOM 1373 CB VAL B 47 10.522 -4.883 -3.674 1.00 0.00 C ATOM 1374 CG1 VAL B 47 11.226 -5.014 -2.330 1.00 0.00 C ATOM 1375 CG2 VAL B 47 11.205 -5.746 -4.718 1.00 0.00 C ATOM 0 H VAL B 47 8.930 -4.847 -5.607 1.00 0.00 H new ATOM 0 HA VAL B 47 8.958 -6.301 -3.241 1.00 0.00 H new ATOM 0 HB VAL B 47 10.585 -3.842 -3.990 1.00 0.00 H new ATOM 0 HG11 VAL B 47 12.276 -4.744 -2.441 1.00 0.00 H new ATOM 0 HG12 VAL B 47 10.755 -4.349 -1.606 1.00 0.00 H new ATOM 0 HG13 VAL B 47 11.152 -6.043 -1.979 1.00 0.00 H new ATOM 0 HG21 VAL B 47 12.256 -5.467 -4.790 1.00 0.00 H new ATOM 0 HG22 VAL B 47 11.127 -6.795 -4.431 1.00 0.00 H new ATOM 0 HG23 VAL B 47 10.723 -5.597 -5.685 1.00 0.00 H new ATOM 1385 N LEU B 48 8.153 -3.105 -2.881 1.00 0.00 N ATOM 1386 CA LEU B 48 7.527 -2.147 -1.979 1.00 0.00 C ATOM 1387 C LEU B 48 6.058 -2.497 -1.754 1.00 0.00 C ATOM 1388 O LEU B 48 5.504 -2.235 -0.687 1.00 0.00 O ATOM 1389 CB LEU B 48 7.662 -0.722 -2.530 1.00 0.00 C ATOM 1390 CG LEU B 48 9.100 -0.210 -2.668 1.00 0.00 C ATOM 1391 CD1 LEU B 48 9.111 1.211 -3.206 1.00 0.00 C ATOM 1392 CD2 LEU B 48 9.827 -0.274 -1.332 1.00 0.00 C ATOM 0 H LEU B 48 8.395 -2.728 -3.797 1.00 0.00 H new ATOM 0 HA LEU B 48 8.041 -2.196 -1.019 1.00 0.00 H new ATOM 0 HB2 LEU B 48 7.183 -0.681 -3.508 1.00 0.00 H new ATOM 0 HB3 LEU B 48 7.113 -0.044 -1.877 1.00 0.00 H new ATOM 0 HG LEU B 48 9.623 -0.854 -3.375 1.00 0.00 H new ATOM 0 HD11 LEU B 48 10.140 1.558 -3.297 1.00 0.00 H new ATOM 0 HD12 LEU B 48 8.633 1.233 -4.185 1.00 0.00 H new ATOM 0 HD13 LEU B 48 8.568 1.863 -2.522 1.00 0.00 H new ATOM 0 HD21 LEU B 48 10.846 0.094 -1.454 1.00 0.00 H new ATOM 0 HD22 LEU B 48 9.303 0.344 -0.603 1.00 0.00 H new ATOM 0 HD23 LEU B 48 9.854 -1.306 -0.981 1.00 0.00 H new ATOM 1404 N ALA B 49 5.441 -3.107 -2.759 1.00 0.00 N ATOM 1405 CA ALA B 49 4.046 -3.518 -2.667 1.00 0.00 C ATOM 1406 C ALA B 49 3.874 -4.675 -1.686 1.00 0.00 C ATOM 1407 O ALA B 49 3.009 -4.632 -0.810 1.00 0.00 O ATOM 1408 CB ALA B 49 3.520 -3.903 -4.040 1.00 0.00 C ATOM 0 H ALA B 49 5.887 -3.328 -3.649 1.00 0.00 H new ATOM 0 HA ALA B 49 3.468 -2.673 -2.292 1.00 0.00 H new ATOM 0 HB1 ALA B 49 2.477 -4.208 -3.958 1.00 0.00 H new ATOM 0 HB2 ALA B 49 3.596 -3.048 -4.712 1.00 0.00 H new ATOM 0 HB3 ALA B 49 4.109 -4.730 -4.437 1.00 0.00 H new ATOM 1414 N ILE B 50 4.702 -5.706 -1.827 1.00 0.00 N ATOM 1415 CA ILE B 50 4.633 -6.860 -0.936 1.00 0.00 C ATOM 1416 C ILE B 50 5.121 -6.481 0.460 1.00 0.00 C ATOM 1417 O ILE B 50 4.742 -7.103 1.453 1.00 0.00 O ATOM 1418 CB ILE B 50 5.443 -8.067 -1.471 1.00 0.00 C ATOM 1419 CG1 ILE B 50 6.933 -7.729 -1.569 1.00 0.00 C ATOM 1420 CG2 ILE B 50 4.909 -8.498 -2.829 1.00 0.00 C ATOM 1421 CD1 ILE B 50 7.785 -8.870 -2.083 1.00 0.00 C ATOM 0 H ILE B 50 5.424 -5.766 -2.545 1.00 0.00 H new ATOM 0 HA ILE B 50 3.588 -7.165 -0.887 1.00 0.00 H new ATOM 0 HB ILE B 50 5.329 -8.892 -0.768 1.00 0.00 H new ATOM 0 HG12 ILE B 50 7.059 -6.869 -2.227 1.00 0.00 H new ATOM 0 HG13 ILE B 50 7.294 -7.433 -0.584 1.00 0.00 H new ATOM 0 HG21 ILE B 50 5.487 -9.347 -3.194 1.00 0.00 H new ATOM 0 HG22 ILE B 50 3.862 -8.786 -2.734 1.00 0.00 H new ATOM 0 HG23 ILE B 50 4.995 -7.671 -3.533 1.00 0.00 H new ATOM 0 HD11 ILE B 50 8.828 -8.555 -2.125 1.00 0.00 H new ATOM 0 HD12 ILE B 50 7.691 -9.725 -1.413 1.00 0.00 H new ATOM 0 HD13 ILE B 50 7.451 -9.152 -3.081 1.00 0.00 H new ATOM 1433 N LEU B 51 5.957 -5.450 0.522 1.00 0.00 N ATOM 1434 CA LEU B 51 6.400 -4.897 1.791 1.00 0.00 C ATOM 1435 C LEU B 51 5.221 -4.257 2.512 1.00 0.00 C ATOM 1436 O LEU B 51 4.988 -4.515 3.690 1.00 0.00 O ATOM 1437 CB LEU B 51 7.486 -3.847 1.565 1.00 0.00 C ATOM 1438 CG LEU B 51 8.050 -3.214 2.836 1.00 0.00 C ATOM 1439 CD1 LEU B 51 9.150 -4.081 3.435 1.00 0.00 C ATOM 1440 CD2 LEU B 51 8.555 -1.814 2.545 1.00 0.00 C ATOM 0 H LEU B 51 6.341 -4.980 -0.298 1.00 0.00 H new ATOM 0 HA LEU B 51 6.808 -5.704 2.399 1.00 0.00 H new ATOM 0 HB2 LEU B 51 8.305 -4.307 1.013 1.00 0.00 H new ATOM 0 HB3 LEU B 51 7.080 -3.057 0.934 1.00 0.00 H new ATOM 0 HG LEU B 51 7.249 -3.144 3.572 1.00 0.00 H new ATOM 0 HD11 LEU B 51 9.535 -3.608 4.339 1.00 0.00 H new ATOM 0 HD12 LEU B 51 8.745 -5.062 3.683 1.00 0.00 H new ATOM 0 HD13 LEU B 51 9.958 -4.194 2.712 1.00 0.00 H new ATOM 0 HD21 LEU B 51 8.954 -1.374 3.459 1.00 0.00 H new ATOM 0 HD22 LEU B 51 9.341 -1.860 1.791 1.00 0.00 H new ATOM 0 HD23 LEU B 51 7.733 -1.200 2.176 1.00 0.00 H new ATOM 1452 N ALA B 52 4.479 -3.423 1.783 1.00 0.00 N ATOM 1453 CA ALA B 52 3.297 -2.762 2.324 1.00 0.00 C ATOM 1454 C ALA B 52 2.295 -3.792 2.825 1.00 0.00 C ATOM 1455 O ALA B 52 1.641 -3.592 3.851 1.00 0.00 O ATOM 1456 CB ALA B 52 2.659 -1.865 1.274 1.00 0.00 C ATOM 0 H ALA B 52 4.680 -3.190 0.810 1.00 0.00 H new ATOM 0 HA ALA B 52 3.604 -2.141 3.165 1.00 0.00 H new ATOM 0 HB1 ALA B 52 1.779 -1.380 1.696 1.00 0.00 H new ATOM 0 HB2 ALA B 52 3.376 -1.106 0.960 1.00 0.00 H new ATOM 0 HB3 ALA B 52 2.365 -2.465 0.413 1.00 0.00 H new ATOM 1462 N PHE B 53 2.189 -4.896 2.097 1.00 0.00 N ATOM 1463 CA PHE B 53 1.364 -6.018 2.517 1.00 0.00 C ATOM 1464 C PHE B 53 1.790 -6.485 3.905 1.00 0.00 C ATOM 1465 O PHE B 53 1.034 -6.363 4.863 1.00 0.00 O ATOM 1466 CB PHE B 53 1.481 -7.162 1.503 1.00 0.00 C ATOM 1467 CG PHE B 53 0.723 -8.409 1.873 1.00 0.00 C ATOM 1468 CD1 PHE B 53 -0.623 -8.538 1.570 1.00 0.00 C ATOM 1469 CD2 PHE B 53 1.364 -9.461 2.507 1.00 0.00 C ATOM 1470 CE1 PHE B 53 -1.313 -9.690 1.896 1.00 0.00 C ATOM 1471 CE2 PHE B 53 0.677 -10.613 2.838 1.00 0.00 C ATOM 1472 CZ PHE B 53 -0.663 -10.727 2.531 1.00 0.00 C ATOM 0 H PHE B 53 2.668 -5.037 1.208 1.00 0.00 H new ATOM 0 HA PHE B 53 0.322 -5.701 2.562 1.00 0.00 H new ATOM 0 HB2 PHE B 53 1.124 -6.810 0.535 1.00 0.00 H new ATOM 0 HB3 PHE B 53 2.534 -7.416 1.381 1.00 0.00 H new ATOM 0 HD1 PHE B 53 -1.139 -7.729 1.074 1.00 0.00 H new ATOM 0 HD2 PHE B 53 2.414 -9.379 2.746 1.00 0.00 H new ATOM 0 HE1 PHE B 53 -2.362 -9.778 1.653 1.00 0.00 H new ATOM 0 HE2 PHE B 53 1.188 -11.423 3.336 1.00 0.00 H new ATOM 0 HZ PHE B 53 -1.202 -11.627 2.788 1.00 0.00 H new ATOM 1482 N LEU B 54 3.025 -6.961 4.013 1.00 0.00 N ATOM 1483 CA LEU B 54 3.558 -7.480 5.277 1.00 0.00 C ATOM 1484 C LEU B 54 3.698 -6.388 6.332 1.00 0.00 C ATOM 1485 O LEU B 54 4.032 -6.658 7.482 1.00 0.00 O ATOM 1486 CB LEU B 54 4.915 -8.148 5.043 1.00 0.00 C ATOM 1487 CG LEU B 54 4.890 -9.385 4.143 1.00 0.00 C ATOM 1488 CD1 LEU B 54 6.305 -9.869 3.867 1.00 0.00 C ATOM 1489 CD2 LEU B 54 4.066 -10.494 4.782 1.00 0.00 C ATOM 0 H LEU B 54 3.685 -7.000 3.236 1.00 0.00 H new ATOM 0 HA LEU B 54 2.845 -8.215 5.651 1.00 0.00 H new ATOM 0 HB2 LEU B 54 5.592 -7.414 4.605 1.00 0.00 H new ATOM 0 HB3 LEU B 54 5.333 -8.431 6.009 1.00 0.00 H new ATOM 0 HG LEU B 54 4.425 -9.112 3.196 1.00 0.00 H new ATOM 0 HD11 LEU B 54 6.270 -10.750 3.225 1.00 0.00 H new ATOM 0 HD12 LEU B 54 6.869 -9.080 3.370 1.00 0.00 H new ATOM 0 HD13 LEU B 54 6.792 -10.125 4.808 1.00 0.00 H new ATOM 0 HD21 LEU B 54 4.060 -11.366 4.128 1.00 0.00 H new ATOM 0 HD22 LEU B 54 4.504 -10.765 5.743 1.00 0.00 H new ATOM 0 HD23 LEU B 54 3.044 -10.147 4.934 1.00 0.00 H new ATOM 1501 N ARG B 55 3.449 -5.158 5.945 1.00 0.00 N ATOM 1502 CA ARG B 55 3.506 -4.064 6.856 1.00 0.00 C ATOM 1503 C ARG B 55 2.144 -3.839 7.506 1.00 0.00 C ATOM 1504 O ARG B 55 2.029 -3.777 8.732 1.00 0.00 O ATOM 1505 CB ARG B 55 3.958 -2.832 6.092 1.00 0.00 C ATOM 1506 CG ARG B 55 3.862 -1.584 6.904 1.00 0.00 C ATOM 1507 CD ARG B 55 4.687 -1.693 8.172 1.00 0.00 C ATOM 1508 NE ARG B 55 4.773 -0.415 8.868 1.00 0.00 N ATOM 1509 CZ ARG B 55 5.232 -0.262 10.106 1.00 0.00 C ATOM 1510 NH1 ARG B 55 5.673 -1.309 10.794 1.00 0.00 N ATOM 1511 NH2 ARG B 55 5.260 0.945 10.650 1.00 0.00 N ATOM 0 H ARG B 55 3.203 -4.899 4.990 1.00 0.00 H new ATOM 0 HA ARG B 55 4.215 -4.277 7.656 1.00 0.00 H new ATOM 0 HB2 ARG B 55 4.989 -2.970 5.765 1.00 0.00 H new ATOM 0 HB3 ARG B 55 3.351 -2.724 5.193 1.00 0.00 H new ATOM 0 HG2 ARG B 55 4.207 -0.735 6.314 1.00 0.00 H new ATOM 0 HG3 ARG B 55 2.820 -1.392 7.160 1.00 0.00 H new ATOM 0 HD2 ARG B 55 4.244 -2.438 8.832 1.00 0.00 H new ATOM 0 HD3 ARG B 55 5.690 -2.042 7.925 1.00 0.00 H new ATOM 0 HE ARG B 55 4.460 0.419 8.371 1.00 0.00 H new ATOM 0 HH11 ARG B 55 5.661 -2.238 10.373 1.00 0.00 H new ATOM 0 HH12 ARG B 55 6.024 -1.184 11.744 1.00 0.00 H new ATOM 0 HH21 ARG B 55 4.930 1.751 10.119 1.00 0.00 H new ATOM 0 HH22 ARG B 55 5.611 1.068 11.600 1.00 0.00 H new ATOM 1525 N PHE B 56 1.115 -3.736 6.681 1.00 0.00 N ATOM 1526 CA PHE B 56 -0.225 -3.434 7.169 1.00 0.00 C ATOM 1527 C PHE B 56 -1.001 -4.698 7.534 1.00 0.00 C ATOM 1528 O PHE B 56 -1.919 -4.647 8.352 1.00 0.00 O ATOM 1529 CB PHE B 56 -0.993 -2.607 6.139 1.00 0.00 C ATOM 1530 CG PHE B 56 -0.448 -1.216 5.973 1.00 0.00 C ATOM 1531 CD1 PHE B 56 -0.921 -0.177 6.758 1.00 0.00 C ATOM 1532 CD2 PHE B 56 0.543 -0.950 5.042 1.00 0.00 C ATOM 1533 CE1 PHE B 56 -0.417 1.102 6.616 1.00 0.00 C ATOM 1534 CE2 PHE B 56 1.050 0.326 4.895 1.00 0.00 C ATOM 1535 CZ PHE B 56 0.570 1.353 5.683 1.00 0.00 C ATOM 0 H PHE B 56 1.180 -3.857 5.670 1.00 0.00 H new ATOM 0 HA PHE B 56 -0.117 -2.849 8.082 1.00 0.00 H new ATOM 0 HB2 PHE B 56 -0.965 -3.119 5.177 1.00 0.00 H new ATOM 0 HB3 PHE B 56 -2.040 -2.547 6.438 1.00 0.00 H new ATOM 0 HD1 PHE B 56 -1.692 -0.369 7.489 1.00 0.00 H new ATOM 0 HD2 PHE B 56 0.923 -1.750 4.424 1.00 0.00 H new ATOM 0 HE1 PHE B 56 -0.794 1.904 7.233 1.00 0.00 H new ATOM 0 HE2 PHE B 56 1.821 0.520 4.164 1.00 0.00 H new ATOM 0 HZ PHE B 56 0.966 2.351 5.570 1.00 0.00 H new ATOM 1545 N THR B 57 -0.634 -5.830 6.945 1.00 0.00 N ATOM 1546 CA THR B 57 -1.277 -7.096 7.285 1.00 0.00 C ATOM 1547 C THR B 57 -0.519 -7.775 8.421 1.00 0.00 C ATOM 1548 O THR B 57 -0.869 -8.880 8.850 1.00 0.00 O ATOM 1549 CB THR B 57 -1.362 -8.052 6.074 1.00 0.00 C ATOM 1550 OG1 THR B 57 -0.061 -8.531 5.716 1.00 0.00 O ATOM 1551 CG2 THR B 57 -1.980 -7.352 4.873 1.00 0.00 C ATOM 0 H THR B 57 0.097 -5.899 6.237 1.00 0.00 H new ATOM 0 HA THR B 57 -2.296 -6.869 7.599 1.00 0.00 H new ATOM 0 HB THR B 57 -1.992 -8.893 6.363 1.00 0.00 H new ATOM 0 HG1 THR B 57 0.568 -7.780 5.689 1.00 0.00 H new ATOM 0 HG21 THR B 57 -2.029 -8.045 4.033 1.00 0.00 H new ATOM 0 HG22 THR B 57 -2.986 -7.016 5.125 1.00 0.00 H new ATOM 0 HG23 THR B 57 -1.369 -6.492 4.599 1.00 0.00 H new ATOM 1559 N ALA B 58 0.515 -7.075 8.901 1.00 0.00 N ATOM 1560 CA ALA B 58 1.386 -7.546 9.976 1.00 0.00 C ATOM 1561 C ALA B 58 2.308 -8.660 9.490 1.00 0.00 C ATOM 1562 O ALA B 58 2.354 -8.955 8.297 1.00 0.00 O ATOM 1563 CB ALA B 58 0.580 -7.981 11.193 1.00 0.00 C ATOM 0 H ALA B 58 0.771 -6.153 8.547 1.00 0.00 H new ATOM 0 HA ALA B 58 2.014 -6.710 10.284 1.00 0.00 H new ATOM 0 HB1 ALA B 58 1.258 -8.326 11.974 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -0.002 -7.138 11.564 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -0.093 -8.791 10.913 1.00 0.00 H new ATOM 1569 N ILE B 59 3.033 -9.266 10.431 1.00 0.00 N ATOM 1570 CA ILE B 59 4.081 -10.240 10.128 1.00 0.00 C ATOM 1571 C ILE B 59 5.295 -9.537 9.528 1.00 0.00 C ATOM 1572 O ILE B 59 5.284 -9.113 8.374 1.00 0.00 O ATOM 1573 CB ILE B 59 3.594 -11.368 9.187 1.00 0.00 C ATOM 1574 CG1 ILE B 59 2.443 -12.145 9.836 1.00 0.00 C ATOM 1575 CG2 ILE B 59 4.739 -12.309 8.834 1.00 0.00 C ATOM 1576 CD1 ILE B 59 2.799 -12.780 11.165 1.00 0.00 C ATOM 0 H ILE B 59 2.909 -9.094 11.429 1.00 0.00 H new ATOM 0 HA ILE B 59 4.360 -10.712 11.070 1.00 0.00 H new ATOM 0 HB ILE B 59 3.231 -10.912 8.266 1.00 0.00 H new ATOM 0 HG12 ILE B 59 1.600 -11.470 9.982 1.00 0.00 H new ATOM 0 HG13 ILE B 59 2.112 -12.925 9.150 1.00 0.00 H new ATOM 0 HG21 ILE B 59 4.374 -13.094 8.172 1.00 0.00 H new ATOM 0 HG22 ILE B 59 5.528 -11.749 8.332 1.00 0.00 H new ATOM 0 HG23 ILE B 59 5.135 -12.758 9.745 1.00 0.00 H new ATOM 0 HD11 ILE B 59 1.932 -13.311 11.559 1.00 0.00 H new ATOM 0 HD12 ILE B 59 3.621 -13.482 11.024 1.00 0.00 H new ATOM 0 HD13 ILE B 59 3.100 -12.005 11.870 1.00 0.00 H new ATOM 1588 N LYS B 60 6.338 -9.410 10.338 1.00 0.00 N ATOM 1589 CA LYS B 60 7.533 -8.669 9.956 1.00 0.00 C ATOM 1590 C LYS B 60 8.213 -9.308 8.745 1.00 0.00 C ATOM 1591 O LYS B 60 8.490 -10.510 8.741 1.00 0.00 O ATOM 1592 CB LYS B 60 8.507 -8.612 11.136 1.00 0.00 C ATOM 1593 CG LYS B 60 9.692 -7.688 10.911 1.00 0.00 C ATOM 1594 CD LYS B 60 10.641 -7.702 12.099 1.00 0.00 C ATOM 1595 CE LYS B 60 11.776 -6.707 11.918 1.00 0.00 C ATOM 1596 NZ LYS B 60 11.287 -5.302 11.893 1.00 0.00 N ATOM 0 H LYS B 60 6.380 -9.815 11.273 1.00 0.00 H new ATOM 0 HA LYS B 60 7.236 -7.657 9.682 1.00 0.00 H new ATOM 0 HB2 LYS B 60 7.967 -8.285 12.025 1.00 0.00 H new ATOM 0 HB3 LYS B 60 8.876 -9.617 11.339 1.00 0.00 H new ATOM 0 HG2 LYS B 60 10.228 -7.993 10.012 1.00 0.00 H new ATOM 0 HG3 LYS B 60 9.336 -6.672 10.740 1.00 0.00 H new ATOM 0 HD2 LYS B 60 10.090 -7.465 13.009 1.00 0.00 H new ATOM 0 HD3 LYS B 60 11.051 -8.704 12.227 1.00 0.00 H new ATOM 0 HE2 LYS B 60 12.495 -6.826 12.728 1.00 0.00 H new ATOM 0 HE3 LYS B 60 12.304 -6.924 10.989 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 12.091 -4.652 12.007 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 10.816 -5.114 10.985 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 10.611 -5.156 12.670 1.00 0.00 H new ATOM 1610 N PRO B 61 8.467 -8.506 7.695 1.00 0.00 N ATOM 1611 CA PRO B 61 9.182 -8.962 6.500 1.00 0.00 C ATOM 1612 C PRO B 61 10.554 -9.533 6.842 1.00 0.00 C ATOM 1613 O PRO B 61 11.276 -8.990 7.683 1.00 0.00 O ATOM 1614 CB PRO B 61 9.335 -7.690 5.660 1.00 0.00 C ATOM 1615 CG PRO B 61 8.259 -6.779 6.135 1.00 0.00 C ATOM 1616 CD PRO B 61 8.059 -7.093 7.589 1.00 0.00 C ATOM 0 HA PRO B 61 8.648 -9.762 5.987 1.00 0.00 H new ATOM 0 HB2 PRO B 61 10.319 -7.243 5.798 1.00 0.00 H new ATOM 0 HB3 PRO B 61 9.229 -7.905 4.597 1.00 0.00 H new ATOM 0 HG2 PRO B 61 8.543 -5.736 5.997 1.00 0.00 H new ATOM 0 HG3 PRO B 61 7.339 -6.936 5.572 1.00 0.00 H new ATOM 0 HD2 PRO B 61 8.667 -6.451 8.226 1.00 0.00 H new ATOM 0 HD3 PRO B 61 7.021 -6.951 7.891 1.00 0.00 H new ATOM 1624 N SER B 62 10.905 -10.632 6.192 1.00 0.00 N ATOM 1625 CA SER B 62 12.177 -11.294 6.433 1.00 0.00 C ATOM 1626 C SER B 62 13.340 -10.455 5.909 1.00 0.00 C ATOM 1627 O SER B 62 13.136 -9.524 5.124 1.00 0.00 O ATOM 1628 CB SER B 62 12.166 -12.676 5.784 1.00 0.00 C ATOM 1629 OG SER B 62 11.019 -13.409 6.189 1.00 0.00 O ATOM 0 H SER B 62 10.322 -11.086 5.489 1.00 0.00 H new ATOM 0 HA SER B 62 12.315 -11.409 7.508 1.00 0.00 H new ATOM 0 HB2 SER B 62 12.175 -12.574 4.699 1.00 0.00 H new ATOM 0 HB3 SER B 62 13.069 -13.221 6.060 1.00 0.00 H new ATOM 0 HG SER B 62 11.027 -14.291 5.762 1.00 0.00 H new ATOM 1635 N LEU B 63 14.554 -10.787 6.333 1.00 0.00 N ATOM 1636 CA LEU B 63 15.733 -10.010 5.963 1.00 0.00 C ATOM 1637 C LEU B 63 15.933 -9.996 4.454 1.00 0.00 C ATOM 1638 O LEU B 63 16.462 -9.033 3.905 1.00 0.00 O ATOM 1639 CB LEU B 63 16.991 -10.539 6.663 1.00 0.00 C ATOM 1640 CG LEU B 63 17.168 -10.108 8.126 1.00 0.00 C ATOM 1641 CD1 LEU B 63 17.239 -8.591 8.237 1.00 0.00 C ATOM 1642 CD2 LEU B 63 16.044 -10.649 8.992 1.00 0.00 C ATOM 0 H LEU B 63 14.749 -11.589 6.933 1.00 0.00 H new ATOM 0 HA LEU B 63 15.563 -8.986 6.295 1.00 0.00 H new ATOM 0 HB2 LEU B 63 16.976 -11.628 6.623 1.00 0.00 H new ATOM 0 HB3 LEU B 63 17.864 -10.211 6.098 1.00 0.00 H new ATOM 0 HG LEU B 63 18.108 -10.526 8.486 1.00 0.00 H new ATOM 0 HD11 LEU B 63 17.364 -8.308 9.282 1.00 0.00 H new ATOM 0 HD12 LEU B 63 18.086 -8.223 7.657 1.00 0.00 H new ATOM 0 HD13 LEU B 63 16.318 -8.154 7.851 1.00 0.00 H new ATOM 0 HD21 LEU B 63 16.193 -10.329 10.023 1.00 0.00 H new ATOM 0 HD22 LEU B 63 15.089 -10.269 8.629 1.00 0.00 H new ATOM 0 HD23 LEU B 63 16.042 -11.738 8.946 1.00 0.00 H new ATOM 1654 N GLY B 64 15.490 -11.056 3.786 1.00 0.00 N ATOM 1655 CA GLY B 64 15.565 -11.099 2.336 1.00 0.00 C ATOM 1656 C GLY B 64 14.774 -9.972 1.704 1.00 0.00 C ATOM 1657 O GLY B 64 15.238 -9.316 0.764 1.00 0.00 O ATOM 0 H GLY B 64 15.082 -11.884 4.220 1.00 0.00 H new ATOM 0 HA2 GLY B 64 16.607 -11.034 2.023 1.00 0.00 H new ATOM 0 HA3 GLY B 64 15.184 -12.056 1.979 1.00 0.00 H new ATOM 1661 N LEU B 65 13.586 -9.731 2.244 1.00 0.00 N ATOM 1662 CA LEU B 65 12.737 -8.642 1.785 1.00 0.00 C ATOM 1663 C LEU B 65 13.414 -7.312 2.063 1.00 0.00 C ATOM 1664 O LEU B 65 13.507 -6.461 1.186 1.00 0.00 O ATOM 1665 CB LEU B 65 11.366 -8.669 2.484 1.00 0.00 C ATOM 1666 CG LEU B 65 10.397 -9.781 2.057 1.00 0.00 C ATOM 1667 CD1 LEU B 65 10.136 -9.728 0.562 1.00 0.00 C ATOM 1668 CD2 LEU B 65 10.918 -11.150 2.459 1.00 0.00 C ATOM 0 H LEU B 65 13.188 -10.280 3.006 1.00 0.00 H new ATOM 0 HA LEU B 65 12.581 -8.766 0.713 1.00 0.00 H new ATOM 0 HB2 LEU B 65 11.533 -8.757 3.558 1.00 0.00 H new ATOM 0 HB3 LEU B 65 10.878 -7.709 2.314 1.00 0.00 H new ATOM 0 HG LEU B 65 9.454 -9.614 2.577 1.00 0.00 H new ATOM 0 HD11 LEU B 65 9.447 -10.526 0.284 1.00 0.00 H new ATOM 0 HD12 LEU B 65 9.698 -8.764 0.303 1.00 0.00 H new ATOM 0 HD13 LEU B 65 11.075 -9.856 0.024 1.00 0.00 H new ATOM 0 HD21 LEU B 65 10.210 -11.916 2.143 1.00 0.00 H new ATOM 0 HD22 LEU B 65 11.882 -11.327 1.981 1.00 0.00 H new ATOM 0 HD23 LEU B 65 11.037 -11.190 3.542 1.00 0.00 H new ATOM 1680 N ILE B 66 13.908 -7.168 3.286 1.00 0.00 N ATOM 1681 CA ILE B 66 14.544 -5.935 3.737 1.00 0.00 C ATOM 1682 C ILE B 66 15.803 -5.626 2.920 1.00 0.00 C ATOM 1683 O ILE B 66 16.098 -4.466 2.621 1.00 0.00 O ATOM 1684 CB ILE B 66 14.901 -6.032 5.239 1.00 0.00 C ATOM 1685 CG1 ILE B 66 13.643 -6.332 6.060 1.00 0.00 C ATOM 1686 CG2 ILE B 66 15.571 -4.755 5.731 1.00 0.00 C ATOM 1687 CD1 ILE B 66 12.568 -5.268 5.955 1.00 0.00 C ATOM 0 H ILE B 66 13.880 -7.902 3.994 1.00 0.00 H new ATOM 0 HA ILE B 66 13.834 -5.121 3.589 1.00 0.00 H new ATOM 0 HB ILE B 66 15.611 -6.849 5.369 1.00 0.00 H new ATOM 0 HG12 ILE B 66 13.228 -7.286 5.734 1.00 0.00 H new ATOM 0 HG13 ILE B 66 13.924 -6.447 7.107 1.00 0.00 H new ATOM 0 HG21 ILE B 66 15.810 -4.854 6.790 1.00 0.00 H new ATOM 0 HG22 ILE B 66 16.488 -4.585 5.167 1.00 0.00 H new ATOM 0 HG23 ILE B 66 14.895 -3.912 5.589 1.00 0.00 H new ATOM 0 HD11 ILE B 66 11.711 -5.555 6.565 1.00 0.00 H new ATOM 0 HD12 ILE B 66 12.963 -4.316 6.309 1.00 0.00 H new ATOM 0 HD13 ILE B 66 12.256 -5.167 4.915 1.00 0.00 H new ATOM 1699 N ASN B 67 16.534 -6.670 2.553 1.00 0.00 N ATOM 1700 CA ASN B 67 17.738 -6.516 1.744 1.00 0.00 C ATOM 1701 C ASN B 67 17.396 -5.972 0.364 1.00 0.00 C ATOM 1702 O ASN B 67 18.061 -5.066 -0.141 1.00 0.00 O ATOM 1703 CB ASN B 67 18.476 -7.853 1.612 1.00 0.00 C ATOM 1704 CG ASN B 67 19.706 -7.757 0.724 1.00 0.00 C ATOM 1705 OD1 ASN B 67 20.785 -7.376 1.180 1.00 0.00 O ATOM 1706 ND2 ASN B 67 19.561 -8.124 -0.541 1.00 0.00 N ATOM 0 H ASN B 67 16.315 -7.634 2.803 1.00 0.00 H new ATOM 0 HA ASN B 67 18.391 -5.803 2.247 1.00 0.00 H new ATOM 0 HB2 ASN B 67 18.773 -8.199 2.602 1.00 0.00 H new ATOM 0 HB3 ASN B 67 17.796 -8.601 1.204 1.00 0.00 H new ATOM 0 HD21 ASN B 67 20.360 -8.097 -1.175 1.00 0.00 H new ATOM 0 HD22 ASN B 67 18.651 -8.434 -0.881 1.00 0.00 H new ATOM 1713 N ARG B 68 16.340 -6.507 -0.232 1.00 0.00 N ATOM 1714 CA ARG B 68 15.931 -6.093 -1.567 1.00 0.00 C ATOM 1715 C ARG B 68 15.227 -4.744 -1.495 1.00 0.00 C ATOM 1716 O ARG B 68 15.285 -3.938 -2.423 1.00 0.00 O ATOM 1717 CB ARG B 68 15.019 -7.154 -2.180 1.00 0.00 C ATOM 1718 CG ARG B 68 14.562 -6.841 -3.594 1.00 0.00 C ATOM 1719 CD ARG B 68 13.773 -7.996 -4.183 1.00 0.00 C ATOM 1720 NE ARG B 68 12.672 -8.407 -3.313 1.00 0.00 N ATOM 1721 CZ ARG B 68 12.119 -9.617 -3.340 1.00 0.00 C ATOM 1722 NH1 ARG B 68 12.539 -10.526 -4.211 1.00 0.00 N ATOM 1723 NH2 ARG B 68 11.136 -9.916 -2.505 1.00 0.00 N ATOM 0 H ARG B 68 15.752 -7.227 0.187 1.00 0.00 H new ATOM 0 HA ARG B 68 16.810 -5.988 -2.203 1.00 0.00 H new ATOM 0 HB2 ARG B 68 15.543 -8.110 -2.183 1.00 0.00 H new ATOM 0 HB3 ARG B 68 14.141 -7.274 -1.545 1.00 0.00 H new ATOM 0 HG2 ARG B 68 13.947 -5.941 -3.590 1.00 0.00 H new ATOM 0 HG3 ARG B 68 15.428 -6.631 -4.221 1.00 0.00 H new ATOM 0 HD2 ARG B 68 13.377 -7.706 -5.156 1.00 0.00 H new ATOM 0 HD3 ARG B 68 14.439 -8.843 -4.349 1.00 0.00 H new ATOM 0 HE ARG B 68 12.307 -7.727 -2.647 1.00 0.00 H new ATOM 0 HH11 ARG B 68 13.289 -10.299 -4.864 1.00 0.00 H new ATOM 0 HH12 ARG B 68 12.112 -11.452 -4.228 1.00 0.00 H new ATOM 0 HH21 ARG B 68 10.802 -9.218 -1.840 1.00 0.00 H new ATOM 0 HH22 ARG B 68 10.713 -10.844 -2.527 1.00 0.00 H new ATOM 1737 N TRP B 69 14.575 -4.520 -0.370 1.00 0.00 N ATOM 1738 CA TRP B 69 13.926 -3.257 -0.062 1.00 0.00 C ATOM 1739 C TRP B 69 14.931 -2.108 -0.105 1.00 0.00 C ATOM 1740 O TRP B 69 14.709 -1.099 -0.770 1.00 0.00 O ATOM 1741 CB TRP B 69 13.272 -3.397 1.314 1.00 0.00 C ATOM 1742 CG TRP B 69 12.869 -2.129 1.999 1.00 0.00 C ATOM 1743 CD1 TRP B 69 11.770 -1.365 1.756 1.00 0.00 C ATOM 1744 CD2 TRP B 69 13.553 -1.511 3.089 1.00 0.00 C ATOM 1745 NE1 TRP B 69 11.720 -0.320 2.644 1.00 0.00 N ATOM 1746 CE2 TRP B 69 12.811 -0.385 3.466 1.00 0.00 C ATOM 1747 CE3 TRP B 69 14.725 -1.807 3.778 1.00 0.00 C ATOM 1748 CZ2 TRP B 69 13.201 0.442 4.512 1.00 0.00 C ATOM 1749 CZ3 TRP B 69 15.115 -0.988 4.813 1.00 0.00 C ATOM 1750 CH2 TRP B 69 14.355 0.124 5.173 1.00 0.00 C ATOM 0 H TRP B 69 14.479 -5.219 0.367 1.00 0.00 H new ATOM 0 HA TRP B 69 13.163 -3.022 -0.804 1.00 0.00 H new ATOM 0 HB2 TRP B 69 12.386 -4.023 1.207 1.00 0.00 H new ATOM 0 HB3 TRP B 69 13.963 -3.931 1.966 1.00 0.00 H new ATOM 0 HD1 TRP B 69 11.044 -1.553 0.979 1.00 0.00 H new ATOM 0 HE1 TRP B 69 10.988 0.390 2.684 1.00 0.00 H new ATOM 0 HE3 TRP B 69 15.320 -2.666 3.505 1.00 0.00 H new ATOM 0 HZ2 TRP B 69 12.614 1.304 4.793 1.00 0.00 H new ATOM 0 HZ3 TRP B 69 16.023 -1.210 5.354 1.00 0.00 H new ATOM 0 HH2 TRP B 69 14.685 0.747 5.991 1.00 0.00 H new ATOM 1761 N GLY B 70 16.059 -2.289 0.572 1.00 0.00 N ATOM 1762 CA GLY B 70 17.106 -1.284 0.560 1.00 0.00 C ATOM 1763 C GLY B 70 17.887 -1.261 -0.745 1.00 0.00 C ATOM 1764 O GLY B 70 18.830 -0.481 -0.898 1.00 0.00 O ATOM 0 H GLY B 70 16.268 -3.116 1.131 1.00 0.00 H new ATOM 0 HA2 GLY B 70 16.663 -0.303 0.730 1.00 0.00 H new ATOM 0 HA3 GLY B 70 17.793 -1.471 1.386 1.00 0.00 H new ATOM 1768 N SER B 71 17.503 -2.112 -1.687 1.00 0.00 N ATOM 1769 CA SER B 71 18.158 -2.161 -2.986 1.00 0.00 C ATOM 1770 C SER B 71 17.411 -1.296 -3.999 1.00 0.00 C ATOM 1771 O SER B 71 17.928 -0.999 -5.077 1.00 0.00 O ATOM 1772 CB SER B 71 18.248 -3.605 -3.482 1.00 0.00 C ATOM 1773 OG SER B 71 18.999 -4.407 -2.584 1.00 0.00 O ATOM 0 H SER B 71 16.739 -2.779 -1.575 1.00 0.00 H new ATOM 0 HA SER B 71 19.168 -1.766 -2.877 1.00 0.00 H new ATOM 0 HB2 SER B 71 17.245 -4.018 -3.592 1.00 0.00 H new ATOM 0 HB3 SER B 71 18.712 -3.626 -4.468 1.00 0.00 H new ATOM 0 HG SER B 71 18.561 -4.414 -1.707 1.00 0.00 H new ATOM 1779 N VAL B 72 16.194 -0.897 -3.646 1.00 0.00 N ATOM 1780 CA VAL B 72 15.399 -0.013 -4.487 1.00 0.00 C ATOM 1781 C VAL B 72 16.038 1.373 -4.532 1.00 0.00 C ATOM 1782 O VAL B 72 16.496 1.883 -3.505 1.00 0.00 O ATOM 1783 CB VAL B 72 13.950 0.108 -3.959 1.00 0.00 C ATOM 1784 CG1 VAL B 72 13.100 0.971 -4.881 1.00 0.00 C ATOM 1785 CG2 VAL B 72 13.323 -1.269 -3.787 1.00 0.00 C ATOM 0 H VAL B 72 15.736 -1.174 -2.778 1.00 0.00 H new ATOM 0 HA VAL B 72 15.368 -0.440 -5.489 1.00 0.00 H new ATOM 0 HB VAL B 72 13.989 0.594 -2.984 1.00 0.00 H new ATOM 0 HG11 VAL B 72 12.087 1.038 -4.485 1.00 0.00 H new ATOM 0 HG12 VAL B 72 13.532 1.970 -4.945 1.00 0.00 H new ATOM 0 HG13 VAL B 72 13.072 0.524 -5.875 1.00 0.00 H new ATOM 0 HG21 VAL B 72 12.304 -1.161 -3.415 1.00 0.00 H new ATOM 0 HG22 VAL B 72 13.306 -1.784 -4.748 1.00 0.00 H new ATOM 0 HG23 VAL B 72 13.910 -1.850 -3.075 1.00 0.00 H new ATOM 1795 N GLY B 73 16.099 1.964 -5.722 1.00 0.00 N ATOM 1796 CA GLY B 73 16.649 3.294 -5.858 1.00 0.00 C ATOM 1797 C GLY B 73 15.830 4.307 -5.096 1.00 0.00 C ATOM 1798 O GLY B 73 14.605 4.244 -5.103 1.00 0.00 O ATOM 0 H GLY B 73 15.776 1.542 -6.593 1.00 0.00 H new ATOM 0 HA2 GLY B 73 17.676 3.304 -5.492 1.00 0.00 H new ATOM 0 HA3 GLY B 73 16.683 3.570 -6.912 1.00 0.00 H new ATOM 1802 N LYS B 74 16.504 5.243 -4.450 1.00 0.00 N ATOM 1803 CA LYS B 74 15.834 6.215 -3.590 1.00 0.00 C ATOM 1804 C LYS B 74 14.933 7.101 -4.435 1.00 0.00 C ATOM 1805 O LYS B 74 13.817 7.434 -4.042 1.00 0.00 O ATOM 1806 CB LYS B 74 16.859 7.075 -2.841 1.00 0.00 C ATOM 1807 CG LYS B 74 18.082 6.308 -2.374 1.00 0.00 C ATOM 1808 CD LYS B 74 17.708 5.167 -1.452 1.00 0.00 C ATOM 1809 CE LYS B 74 18.923 4.351 -1.060 1.00 0.00 C ATOM 1810 NZ LYS B 74 19.992 5.190 -0.463 1.00 0.00 N ATOM 0 H LYS B 74 17.517 5.354 -4.502 1.00 0.00 H new ATOM 0 HA LYS B 74 15.235 5.679 -2.854 1.00 0.00 H new ATOM 0 HB2 LYS B 74 17.179 7.889 -3.491 1.00 0.00 H new ATOM 0 HB3 LYS B 74 16.375 7.529 -1.976 1.00 0.00 H new ATOM 0 HG2 LYS B 74 18.618 5.917 -3.238 1.00 0.00 H new ATOM 0 HG3 LYS B 74 18.761 6.986 -1.857 1.00 0.00 H new ATOM 0 HD2 LYS B 74 17.230 5.563 -0.556 1.00 0.00 H new ATOM 0 HD3 LYS B 74 16.979 4.523 -1.945 1.00 0.00 H new ATOM 0 HE2 LYS B 74 18.627 3.581 -0.348 1.00 0.00 H new ATOM 0 HE3 LYS B 74 19.314 3.839 -1.939 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 20.720 4.578 -0.042 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 20.422 5.782 -1.202 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 19.584 5.799 0.274 1.00 0.00 H new ATOM 1824 N LYS B 75 15.432 7.458 -5.610 1.00 0.00 N ATOM 1825 CA LYS B 75 14.668 8.232 -6.574 1.00 0.00 C ATOM 1826 C LYS B 75 13.444 7.450 -7.025 1.00 0.00 C ATOM 1827 O LYS B 75 12.328 7.974 -7.050 1.00 0.00 O ATOM 1828 CB LYS B 75 15.545 8.566 -7.784 1.00 0.00 C ATOM 1829 CG LYS B 75 14.802 9.265 -8.914 1.00 0.00 C ATOM 1830 CD LYS B 75 14.198 10.588 -8.465 1.00 0.00 C ATOM 1831 CE LYS B 75 13.408 11.249 -9.584 1.00 0.00 C ATOM 1832 NZ LYS B 75 14.260 11.553 -10.764 1.00 0.00 N ATOM 0 H LYS B 75 16.374 7.220 -5.920 1.00 0.00 H new ATOM 0 HA LYS B 75 14.340 9.158 -6.101 1.00 0.00 H new ATOM 0 HB2 LYS B 75 16.369 9.200 -7.458 1.00 0.00 H new ATOM 0 HB3 LYS B 75 15.984 7.645 -8.167 1.00 0.00 H new ATOM 0 HG2 LYS B 75 15.487 9.442 -9.744 1.00 0.00 H new ATOM 0 HG3 LYS B 75 14.012 8.613 -9.286 1.00 0.00 H new ATOM 0 HD2 LYS B 75 13.546 10.419 -7.608 1.00 0.00 H new ATOM 0 HD3 LYS B 75 14.992 11.258 -8.134 1.00 0.00 H new ATOM 0 HE2 LYS B 75 12.591 10.594 -9.886 1.00 0.00 H new ATOM 0 HE3 LYS B 75 12.958 12.171 -9.215 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 13.736 12.164 -11.423 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 15.124 12.041 -10.452 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 14.517 10.667 -11.244 1.00 0.00 H new ATOM 1846 N GLU B 76 13.663 6.187 -7.360 1.00 0.00 N ATOM 1847 CA GLU B 76 12.595 5.335 -7.844 1.00 0.00 C ATOM 1848 C GLU B 76 11.565 5.113 -6.749 1.00 0.00 C ATOM 1849 O GLU B 76 10.366 5.150 -7.007 1.00 0.00 O ATOM 1850 CB GLU B 76 13.154 3.996 -8.321 1.00 0.00 C ATOM 1851 CG GLU B 76 12.154 3.175 -9.116 1.00 0.00 C ATOM 1852 CD GLU B 76 11.719 3.866 -10.391 1.00 0.00 C ATOM 1853 OE1 GLU B 76 12.494 3.853 -11.371 1.00 0.00 O ATOM 1854 OE2 GLU B 76 10.603 4.420 -10.427 1.00 0.00 O ATOM 0 H GLU B 76 14.574 5.732 -7.304 1.00 0.00 H new ATOM 0 HA GLU B 76 12.112 5.829 -8.687 1.00 0.00 H new ATOM 0 HB2 GLU B 76 14.035 4.177 -8.936 1.00 0.00 H new ATOM 0 HB3 GLU B 76 13.482 3.419 -7.457 1.00 0.00 H new ATOM 0 HG2 GLU B 76 12.596 2.210 -9.363 1.00 0.00 H new ATOM 0 HG3 GLU B 76 11.279 2.976 -8.498 1.00 0.00 H new ATOM 1861 N ALA B 77 12.038 4.904 -5.523 1.00 0.00 N ATOM 1862 CA ALA B 77 11.148 4.714 -4.388 1.00 0.00 C ATOM 1863 C ALA B 77 10.213 5.905 -4.240 1.00 0.00 C ATOM 1864 O ALA B 77 9.022 5.740 -3.984 1.00 0.00 O ATOM 1865 CB ALA B 77 11.948 4.498 -3.113 1.00 0.00 C ATOM 0 H ALA B 77 13.031 4.862 -5.293 1.00 0.00 H new ATOM 0 HA ALA B 77 10.544 3.824 -4.567 1.00 0.00 H new ATOM 0 HB1 ALA B 77 11.266 4.358 -2.275 1.00 0.00 H new ATOM 0 HB2 ALA B 77 12.575 3.613 -3.222 1.00 0.00 H new ATOM 0 HB3 ALA B 77 12.578 5.368 -2.927 1.00 0.00 H new ATOM 1871 N MET B 78 10.756 7.105 -4.429 1.00 0.00 N ATOM 1872 CA MET B 78 9.961 8.327 -4.359 1.00 0.00 C ATOM 1873 C MET B 78 8.865 8.313 -5.416 1.00 0.00 C ATOM 1874 O MET B 78 7.719 8.670 -5.142 1.00 0.00 O ATOM 1875 CB MET B 78 10.845 9.562 -4.554 1.00 0.00 C ATOM 1876 CG MET B 78 11.892 9.742 -3.469 1.00 0.00 C ATOM 1877 SD MET B 78 12.973 11.152 -3.772 1.00 0.00 S ATOM 1878 CE MET B 78 14.086 11.018 -2.374 1.00 0.00 C ATOM 0 H MET B 78 11.744 7.257 -4.632 1.00 0.00 H new ATOM 0 HA MET B 78 9.504 8.372 -3.371 1.00 0.00 H new ATOM 0 HB2 MET B 78 11.345 9.491 -5.520 1.00 0.00 H new ATOM 0 HB3 MET B 78 10.212 10.449 -4.587 1.00 0.00 H new ATOM 0 HG2 MET B 78 11.395 9.871 -2.508 1.00 0.00 H new ATOM 0 HG3 MET B 78 12.494 8.836 -3.397 1.00 0.00 H new ATOM 0 HE1 MET B 78 14.820 11.823 -2.415 1.00 0.00 H new ATOM 0 HE2 MET B 78 13.517 11.093 -1.447 1.00 0.00 H new ATOM 0 HE3 MET B 78 14.599 10.057 -2.408 1.00 0.00 H new ATOM 1888 N GLU B 79 9.226 7.887 -6.619 1.00 0.00 N ATOM 1889 CA GLU B 79 8.285 7.830 -7.728 1.00 0.00 C ATOM 1890 C GLU B 79 7.246 6.733 -7.516 1.00 0.00 C ATOM 1891 O GLU B 79 6.068 6.912 -7.832 1.00 0.00 O ATOM 1892 CB GLU B 79 9.028 7.598 -9.041 1.00 0.00 C ATOM 1893 CG GLU B 79 9.980 8.723 -9.405 1.00 0.00 C ATOM 1894 CD GLU B 79 10.580 8.557 -10.785 1.00 0.00 C ATOM 1895 OE1 GLU B 79 11.788 8.270 -10.885 1.00 0.00 O ATOM 1896 OE2 GLU B 79 9.839 8.712 -11.782 1.00 0.00 O ATOM 0 H GLU B 79 10.169 7.575 -6.852 1.00 0.00 H new ATOM 0 HA GLU B 79 7.765 8.787 -7.775 1.00 0.00 H new ATOM 0 HB2 GLU B 79 9.589 6.666 -8.972 1.00 0.00 H new ATOM 0 HB3 GLU B 79 8.301 7.474 -9.844 1.00 0.00 H new ATOM 0 HG2 GLU B 79 9.448 9.673 -9.356 1.00 0.00 H new ATOM 0 HG3 GLU B 79 10.782 8.768 -8.668 1.00 0.00 H new ATOM 1903 N ILE B 80 7.688 5.599 -6.991 1.00 0.00 N ATOM 1904 CA ILE B 80 6.792 4.481 -6.714 1.00 0.00 C ATOM 1905 C ILE B 80 5.789 4.851 -5.628 1.00 0.00 C ATOM 1906 O ILE B 80 4.584 4.675 -5.805 1.00 0.00 O ATOM 1907 CB ILE B 80 7.566 3.214 -6.283 1.00 0.00 C ATOM 1908 CG1 ILE B 80 8.528 2.775 -7.388 1.00 0.00 C ATOM 1909 CG2 ILE B 80 6.596 2.086 -5.947 1.00 0.00 C ATOM 1910 CD1 ILE B 80 9.456 1.653 -6.975 1.00 0.00 C ATOM 0 H ILE B 80 8.663 5.427 -6.747 1.00 0.00 H new ATOM 0 HA ILE B 80 6.264 4.262 -7.642 1.00 0.00 H new ATOM 0 HB ILE B 80 8.146 3.451 -5.391 1.00 0.00 H new ATOM 0 HG12 ILE B 80 7.950 2.456 -8.255 1.00 0.00 H new ATOM 0 HG13 ILE B 80 9.125 3.632 -7.700 1.00 0.00 H new ATOM 0 HG21 ILE B 80 7.157 1.201 -5.646 1.00 0.00 H new ATOM 0 HG22 ILE B 80 5.944 2.398 -5.131 1.00 0.00 H new ATOM 0 HG23 ILE B 80 5.993 1.852 -6.824 1.00 0.00 H new ATOM 0 HD11 ILE B 80 10.109 1.395 -7.809 1.00 0.00 H new ATOM 0 HD12 ILE B 80 10.061 1.974 -6.127 1.00 0.00 H new ATOM 0 HD13 ILE B 80 8.868 0.780 -6.691 1.00 0.00 H new ATOM 1922 N ILE B 81 6.292 5.381 -4.516 1.00 0.00 N ATOM 1923 CA ILE B 81 5.441 5.795 -3.406 1.00 0.00 C ATOM 1924 C ILE B 81 4.481 6.900 -3.847 1.00 0.00 C ATOM 1925 O ILE B 81 3.336 6.960 -3.396 1.00 0.00 O ATOM 1926 CB ILE B 81 6.281 6.274 -2.195 1.00 0.00 C ATOM 1927 CG1 ILE B 81 7.142 5.128 -1.647 1.00 0.00 C ATOM 1928 CG2 ILE B 81 5.390 6.837 -1.097 1.00 0.00 C ATOM 1929 CD1 ILE B 81 6.346 3.927 -1.176 1.00 0.00 C ATOM 0 H ILE B 81 7.288 5.534 -4.360 1.00 0.00 H new ATOM 0 HA ILE B 81 4.863 4.925 -3.094 1.00 0.00 H new ATOM 0 HB ILE B 81 6.939 7.071 -2.540 1.00 0.00 H new ATOM 0 HG12 ILE B 81 7.838 4.808 -2.422 1.00 0.00 H new ATOM 0 HG13 ILE B 81 7.740 5.502 -0.816 1.00 0.00 H new ATOM 0 HG21 ILE B 81 6.007 7.165 -0.260 1.00 0.00 H new ATOM 0 HG22 ILE B 81 4.825 7.684 -1.486 1.00 0.00 H new ATOM 0 HG23 ILE B 81 4.699 6.065 -0.758 1.00 0.00 H new ATOM 0 HD11 ILE B 81 7.027 3.162 -0.804 1.00 0.00 H new ATOM 0 HD12 ILE B 81 5.669 4.230 -0.377 1.00 0.00 H new ATOM 0 HD13 ILE B 81 5.768 3.524 -2.008 1.00 0.00 H new ATOM 1941 N LYS B 82 4.950 7.756 -4.749 1.00 0.00 N ATOM 1942 CA LYS B 82 4.123 8.820 -5.303 1.00 0.00 C ATOM 1943 C LYS B 82 2.910 8.232 -6.020 1.00 0.00 C ATOM 1944 O LYS B 82 1.773 8.640 -5.777 1.00 0.00 O ATOM 1945 CB LYS B 82 4.942 9.677 -6.274 1.00 0.00 C ATOM 1946 CG LYS B 82 4.176 10.854 -6.856 1.00 0.00 C ATOM 1947 CD LYS B 82 3.776 11.850 -5.778 1.00 0.00 C ATOM 1948 CE LYS B 82 3.032 13.037 -6.365 1.00 0.00 C ATOM 1949 NZ LYS B 82 3.855 13.773 -7.362 1.00 0.00 N ATOM 0 H LYS B 82 5.903 7.732 -5.113 1.00 0.00 H new ATOM 0 HA LYS B 82 3.775 9.450 -4.484 1.00 0.00 H new ATOM 0 HB2 LYS B 82 5.825 10.052 -5.756 1.00 0.00 H new ATOM 0 HB3 LYS B 82 5.295 9.047 -7.090 1.00 0.00 H new ATOM 0 HG2 LYS B 82 4.790 11.354 -7.605 1.00 0.00 H new ATOM 0 HG3 LYS B 82 3.284 10.492 -7.366 1.00 0.00 H new ATOM 0 HD2 LYS B 82 3.147 11.354 -5.039 1.00 0.00 H new ATOM 0 HD3 LYS B 82 4.667 12.200 -5.256 1.00 0.00 H new ATOM 0 HE2 LYS B 82 2.113 12.691 -6.838 1.00 0.00 H new ATOM 0 HE3 LYS B 82 2.742 13.716 -5.563 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 3.426 14.702 -7.548 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 4.817 13.904 -6.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 3.898 13.228 -8.247 1.00 0.00 H new ATOM 1963 N LYS B 83 3.161 7.257 -6.888 1.00 0.00 N ATOM 1964 CA LYS B 83 2.095 6.609 -7.642 1.00 0.00 C ATOM 1965 C LYS B 83 1.262 5.718 -6.730 1.00 0.00 C ATOM 1966 O LYS B 83 0.075 5.495 -6.979 1.00 0.00 O ATOM 1967 CB LYS B 83 2.673 5.778 -8.786 1.00 0.00 C ATOM 1968 CG LYS B 83 3.514 6.586 -9.757 1.00 0.00 C ATOM 1969 CD LYS B 83 4.077 5.711 -10.862 1.00 0.00 C ATOM 1970 CE LYS B 83 5.038 6.483 -11.747 1.00 0.00 C ATOM 1971 NZ LYS B 83 6.193 7.012 -10.976 1.00 0.00 N ATOM 0 H LYS B 83 4.095 6.898 -7.086 1.00 0.00 H new ATOM 0 HA LYS B 83 1.456 7.387 -8.059 1.00 0.00 H new ATOM 0 HB2 LYS B 83 3.283 4.976 -8.370 1.00 0.00 H new ATOM 0 HB3 LYS B 83 1.855 5.307 -9.331 1.00 0.00 H new ATOM 0 HG2 LYS B 83 2.908 7.380 -10.193 1.00 0.00 H new ATOM 0 HG3 LYS B 83 4.331 7.067 -9.220 1.00 0.00 H new ATOM 0 HD2 LYS B 83 4.591 4.856 -10.424 1.00 0.00 H new ATOM 0 HD3 LYS B 83 3.261 5.316 -11.467 1.00 0.00 H new ATOM 0 HE2 LYS B 83 5.400 5.834 -12.544 1.00 0.00 H new ATOM 0 HE3 LYS B 83 4.510 7.309 -12.224 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 7.078 6.774 -11.468 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 6.111 8.045 -10.893 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 6.200 6.588 -10.027 1.00 0.00 H new ATOM 1985 N PHE B 84 1.896 5.209 -5.681 1.00 0.00 N ATOM 1986 CA PHE B 84 1.216 4.386 -4.695 1.00 0.00 C ATOM 1987 C PHE B 84 0.129 5.208 -4.010 1.00 0.00 C ATOM 1988 O PHE B 84 -1.040 4.825 -3.995 1.00 0.00 O ATOM 1989 CB PHE B 84 2.221 3.865 -3.661 1.00 0.00 C ATOM 1990 CG PHE B 84 1.846 2.546 -3.043 1.00 0.00 C ATOM 1991 CD1 PHE B 84 0.745 2.438 -2.210 1.00 0.00 C ATOM 1992 CD2 PHE B 84 2.608 1.414 -3.291 1.00 0.00 C ATOM 1993 CE1 PHE B 84 0.408 1.225 -1.639 1.00 0.00 C ATOM 1994 CE2 PHE B 84 2.275 0.200 -2.724 1.00 0.00 C ATOM 1995 CZ PHE B 84 1.175 0.105 -1.896 1.00 0.00 C ATOM 0 H PHE B 84 2.888 5.355 -5.493 1.00 0.00 H new ATOM 0 HA PHE B 84 0.757 3.531 -5.192 1.00 0.00 H new ATOM 0 HB2 PHE B 84 3.196 3.765 -4.138 1.00 0.00 H new ATOM 0 HB3 PHE B 84 2.327 4.607 -2.869 1.00 0.00 H new ATOM 0 HD1 PHE B 84 0.143 3.311 -2.004 1.00 0.00 H new ATOM 0 HD2 PHE B 84 3.472 1.483 -3.935 1.00 0.00 H new ATOM 0 HE1 PHE B 84 -0.454 1.153 -0.993 1.00 0.00 H new ATOM 0 HE2 PHE B 84 2.875 -0.675 -2.928 1.00 0.00 H new ATOM 0 HZ PHE B 84 0.914 -0.843 -1.450 1.00 0.00 H new ATOM 2005 N LYS B 85 0.525 6.360 -3.472 1.00 0.00 N ATOM 2006 CA LYS B 85 -0.411 7.271 -2.821 1.00 0.00 C ATOM 2007 C LYS B 85 -1.458 7.768 -3.811 1.00 0.00 C ATOM 2008 O LYS B 85 -2.619 7.976 -3.453 1.00 0.00 O ATOM 2009 CB LYS B 85 0.330 8.470 -2.226 1.00 0.00 C ATOM 2010 CG LYS B 85 1.334 8.111 -1.143 1.00 0.00 C ATOM 2011 CD LYS B 85 2.003 9.359 -0.591 1.00 0.00 C ATOM 2012 CE LYS B 85 2.967 9.039 0.540 1.00 0.00 C ATOM 2013 NZ LYS B 85 3.647 10.263 1.040 1.00 0.00 N ATOM 0 H LYS B 85 1.492 6.684 -3.475 1.00 0.00 H new ATOM 0 HA LYS B 85 -0.908 6.722 -2.021 1.00 0.00 H new ATOM 0 HB2 LYS B 85 0.850 8.995 -3.027 1.00 0.00 H new ATOM 0 HB3 LYS B 85 -0.401 9.165 -1.812 1.00 0.00 H new ATOM 0 HG2 LYS B 85 0.831 7.576 -0.337 1.00 0.00 H new ATOM 0 HG3 LYS B 85 2.089 7.438 -1.550 1.00 0.00 H new ATOM 0 HD2 LYS B 85 2.541 9.866 -1.392 1.00 0.00 H new ATOM 0 HD3 LYS B 85 1.240 10.050 -0.232 1.00 0.00 H new ATOM 0 HE2 LYS B 85 2.425 8.563 1.357 1.00 0.00 H new ATOM 0 HE3 LYS B 85 3.712 8.324 0.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 85 4.616 10.026 1.334 1.00 0.00 H new ATOM 0 HZ2 LYS B 85 3.680 10.976 0.283 1.00 0.00 H new ATOM 0 HZ3 LYS B 85 3.122 10.645 1.852 1.00 0.00 H new ATOM 2027 N LYS B 86 -1.031 7.955 -5.055 1.00 0.00 N ATOM 2028 CA LYS B 86 -1.907 8.437 -6.115 1.00 0.00 C ATOM 2029 C LYS B 86 -3.036 7.439 -6.363 1.00 0.00 C ATOM 2030 O LYS B 86 -4.212 7.808 -6.388 1.00 0.00 O ATOM 2031 CB LYS B 86 -1.086 8.661 -7.394 1.00 0.00 C ATOM 2032 CG LYS B 86 -1.744 9.556 -8.439 1.00 0.00 C ATOM 2033 CD LYS B 86 -2.881 8.862 -9.172 1.00 0.00 C ATOM 2034 CE LYS B 86 -3.431 9.729 -10.295 1.00 0.00 C ATOM 2035 NZ LYS B 86 -3.911 11.048 -9.803 1.00 0.00 N ATOM 0 H LYS B 86 -0.073 7.778 -5.355 1.00 0.00 H new ATOM 0 HA LYS B 86 -2.355 9.384 -5.813 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -0.126 9.097 -7.119 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -0.878 7.692 -7.848 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -2.125 10.455 -7.954 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -0.993 9.877 -9.161 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -2.528 7.916 -9.581 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -3.679 8.627 -8.468 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -2.656 9.883 -11.045 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -4.251 9.206 -10.787 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -4.428 11.535 -10.563 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -4.544 10.906 -8.990 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -3.098 11.627 -9.512 1.00 0.00 H new ATOM 2049 N ASP B 87 -2.674 6.172 -6.521 1.00 0.00 N ATOM 2050 CA ASP B 87 -3.654 5.131 -6.804 1.00 0.00 C ATOM 2051 C ASP B 87 -4.535 4.890 -5.580 1.00 0.00 C ATOM 2052 O ASP B 87 -5.719 4.577 -5.708 1.00 0.00 O ATOM 2053 CB ASP B 87 -2.954 3.837 -7.230 1.00 0.00 C ATOM 2054 CG ASP B 87 -3.875 2.892 -7.982 1.00 0.00 C ATOM 2055 OD1 ASP B 87 -4.382 1.931 -7.375 1.00 0.00 O ATOM 2056 OD2 ASP B 87 -4.093 3.106 -9.197 1.00 0.00 O ATOM 0 H ASP B 87 -1.711 5.841 -6.458 1.00 0.00 H new ATOM 0 HA ASP B 87 -4.288 5.462 -7.627 1.00 0.00 H new ATOM 0 HB2 ASP B 87 -2.099 4.082 -7.860 1.00 0.00 H new ATOM 0 HB3 ASP B 87 -2.565 3.332 -6.346 1.00 0.00 H new ATOM 2061 N LEU B 88 -3.952 5.060 -4.393 1.00 0.00 N ATOM 2062 CA LEU B 88 -4.708 4.968 -3.144 1.00 0.00 C ATOM 2063 C LEU B 88 -5.773 6.055 -3.080 1.00 0.00 C ATOM 2064 O LEU B 88 -6.901 5.808 -2.659 1.00 0.00 O ATOM 2065 CB LEU B 88 -3.789 5.104 -1.927 1.00 0.00 C ATOM 2066 CG LEU B 88 -2.794 3.965 -1.706 1.00 0.00 C ATOM 2067 CD1 LEU B 88 -1.929 4.261 -0.491 1.00 0.00 C ATOM 2068 CD2 LEU B 88 -3.517 2.636 -1.537 1.00 0.00 C ATOM 0 H LEU B 88 -2.960 5.262 -4.270 1.00 0.00 H new ATOM 0 HA LEU B 88 -5.182 3.987 -3.125 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.230 6.035 -2.022 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -4.410 5.195 -1.036 1.00 0.00 H new ATOM 0 HG LEU B 88 -2.154 3.888 -2.585 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.222 3.445 -0.340 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -1.382 5.190 -0.652 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -2.562 4.361 0.391 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -2.787 1.842 -1.381 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -4.183 2.691 -0.676 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -4.100 2.422 -2.433 1.00 0.00 H new ATOM 2080 N ALA B 89 -5.400 7.262 -3.496 1.00 0.00 N ATOM 2081 CA ALA B 89 -6.321 8.391 -3.508 1.00 0.00 C ATOM 2082 C ALA B 89 -7.505 8.100 -4.417 1.00 0.00 C ATOM 2083 O ALA B 89 -8.657 8.345 -4.057 1.00 0.00 O ATOM 2084 CB ALA B 89 -5.603 9.655 -3.955 1.00 0.00 C ATOM 0 H ALA B 89 -4.462 7.482 -3.830 1.00 0.00 H new ATOM 0 HA ALA B 89 -6.694 8.546 -2.496 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -6.304 10.490 -3.959 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -4.785 9.871 -3.268 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -5.204 9.511 -4.959 1.00 0.00 H new ATOM 2090 N ALA B 90 -7.209 7.558 -5.592 1.00 0.00 N ATOM 2091 CA ALA B 90 -8.242 7.160 -6.532 1.00 0.00 C ATOM 2092 C ALA B 90 -9.124 6.076 -5.924 1.00 0.00 C ATOM 2093 O ALA B 90 -10.350 6.158 -5.985 1.00 0.00 O ATOM 2094 CB ALA B 90 -7.617 6.674 -7.830 1.00 0.00 C ATOM 0 H ALA B 90 -6.257 7.385 -5.915 1.00 0.00 H new ATOM 0 HA ALA B 90 -8.865 8.027 -6.752 1.00 0.00 H new ATOM 0 HB1 ALA B 90 -8.404 6.379 -8.525 1.00 0.00 H new ATOM 0 HB2 ALA B 90 -7.025 7.476 -8.271 1.00 0.00 H new ATOM 0 HB3 ALA B 90 -6.974 5.818 -7.626 1.00 0.00 H new ATOM 2100 N MET B 91 -8.487 5.078 -5.315 1.00 0.00 N ATOM 2101 CA MET B 91 -9.199 3.965 -4.690 1.00 0.00 C ATOM 2102 C MET B 91 -10.127 4.471 -3.589 1.00 0.00 C ATOM 2103 O MET B 91 -11.258 4.004 -3.449 1.00 0.00 O ATOM 2104 CB MET B 91 -8.204 2.955 -4.108 1.00 0.00 C ATOM 2105 CG MET B 91 -8.862 1.711 -3.536 1.00 0.00 C ATOM 2106 SD MET B 91 -9.714 0.730 -4.788 1.00 0.00 S ATOM 2107 CE MET B 91 -8.331 0.112 -5.745 1.00 0.00 C ATOM 0 H MET B 91 -7.471 5.018 -5.241 1.00 0.00 H new ATOM 0 HA MET B 91 -9.799 3.472 -5.455 1.00 0.00 H new ATOM 0 HB2 MET B 91 -7.503 2.658 -4.888 1.00 0.00 H new ATOM 0 HB3 MET B 91 -7.623 3.441 -3.324 1.00 0.00 H new ATOM 0 HG2 MET B 91 -8.104 1.095 -3.052 1.00 0.00 H new ATOM 0 HG3 MET B 91 -9.574 2.005 -2.765 1.00 0.00 H new ATOM 0 HE1 MET B 91 -8.661 -0.721 -6.366 1.00 0.00 H new ATOM 0 HE2 MET B 91 -7.944 0.908 -6.382 1.00 0.00 H new ATOM 0 HE3 MET B 91 -7.545 -0.227 -5.071 1.00 0.00 H new ATOM 2117 N LEU B 92 -9.637 5.435 -2.819 1.00 0.00 N ATOM 2118 CA LEU B 92 -10.418 6.054 -1.756 1.00 0.00 C ATOM 2119 C LEU B 92 -11.691 6.683 -2.315 1.00 0.00 C ATOM 2120 O LEU B 92 -12.776 6.534 -1.747 1.00 0.00 O ATOM 2121 CB LEU B 92 -9.576 7.117 -1.044 1.00 0.00 C ATOM 2122 CG LEU B 92 -10.304 7.918 0.037 1.00 0.00 C ATOM 2123 CD1 LEU B 92 -10.826 6.998 1.127 1.00 0.00 C ATOM 2124 CD2 LEU B 92 -9.379 8.973 0.625 1.00 0.00 C ATOM 0 H LEU B 92 -8.692 5.808 -2.913 1.00 0.00 H new ATOM 0 HA LEU B 92 -10.703 5.282 -1.041 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -8.713 6.629 -0.591 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -9.193 7.812 -1.791 1.00 0.00 H new ATOM 0 HG LEU B 92 -11.156 8.420 -0.421 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -11.340 7.588 1.886 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -11.521 6.279 0.694 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -9.992 6.466 1.585 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -9.910 9.535 1.393 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -8.509 8.488 1.067 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -9.054 9.652 -0.163 1.00 0.00 H new ATOM 2136 N ARG B 93 -11.555 7.374 -3.439 1.00 0.00 N ATOM 2137 CA ARG B 93 -12.695 8.016 -4.071 1.00 0.00 C ATOM 2138 C ARG B 93 -13.694 6.982 -4.575 1.00 0.00 C ATOM 2139 O ARG B 93 -14.892 7.243 -4.616 1.00 0.00 O ATOM 2140 CB ARG B 93 -12.248 8.918 -5.218 1.00 0.00 C ATOM 2141 CG ARG B 93 -11.399 10.093 -4.767 1.00 0.00 C ATOM 2142 CD ARG B 93 -11.175 11.078 -5.899 1.00 0.00 C ATOM 2143 NE ARG B 93 -12.420 11.731 -6.312 1.00 0.00 N ATOM 2144 CZ ARG B 93 -12.550 12.462 -7.421 1.00 0.00 C ATOM 2145 NH1 ARG B 93 -11.519 12.633 -8.236 1.00 0.00 N ATOM 2146 NH2 ARG B 93 -13.715 13.029 -7.707 1.00 0.00 N ATOM 0 H ARG B 93 -10.670 7.503 -3.929 1.00 0.00 H new ATOM 0 HA ARG B 93 -13.186 8.632 -3.318 1.00 0.00 H new ATOM 0 HB2 ARG B 93 -11.682 8.325 -5.937 1.00 0.00 H new ATOM 0 HB3 ARG B 93 -13.129 9.294 -5.738 1.00 0.00 H new ATOM 0 HG2 ARG B 93 -11.887 10.598 -3.934 1.00 0.00 H new ATOM 0 HG3 ARG B 93 -10.438 9.731 -4.402 1.00 0.00 H new ATOM 0 HD2 ARG B 93 -10.456 11.834 -5.585 1.00 0.00 H new ATOM 0 HD3 ARG B 93 -10.738 10.558 -6.751 1.00 0.00 H new ATOM 0 HE ARG B 93 -13.239 11.620 -5.714 1.00 0.00 H new ATOM 0 HH11 ARG B 93 -10.619 12.205 -8.017 1.00 0.00 H new ATOM 0 HH12 ARG B 93 -11.625 13.193 -9.082 1.00 0.00 H new ATOM 0 HH21 ARG B 93 -14.510 12.906 -7.080 1.00 0.00 H new ATOM 0 HH22 ARG B 93 -13.816 13.588 -8.554 1.00 0.00 H new ATOM 2160 N ILE B 94 -13.206 5.803 -4.947 1.00 0.00 N ATOM 2161 CA ILE B 94 -14.090 4.746 -5.423 1.00 0.00 C ATOM 2162 C ILE B 94 -14.872 4.136 -4.261 1.00 0.00 C ATOM 2163 O ILE B 94 -16.032 3.748 -4.421 1.00 0.00 O ATOM 2164 CB ILE B 94 -13.335 3.627 -6.163 1.00 0.00 C ATOM 2165 CG1 ILE B 94 -12.290 4.213 -7.112 1.00 0.00 C ATOM 2166 CG2 ILE B 94 -14.324 2.782 -6.951 1.00 0.00 C ATOM 2167 CD1 ILE B 94 -11.434 3.170 -7.797 1.00 0.00 C ATOM 0 H ILE B 94 -12.216 5.557 -4.929 1.00 0.00 H new ATOM 0 HA ILE B 94 -14.773 5.215 -6.131 1.00 0.00 H new ATOM 0 HB ILE B 94 -12.824 3.007 -5.427 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -12.796 4.810 -7.871 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -11.644 4.890 -6.553 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -13.789 1.990 -7.475 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -15.050 2.340 -6.268 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -14.843 3.410 -7.675 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -10.717 3.662 -8.454 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -10.899 2.588 -7.046 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -12.069 2.507 -8.385 1.00 0.00 H new ATOM 2179 N ILE B 95 -14.235 4.051 -3.090 1.00 0.00 N ATOM 2180 CA ILE B 95 -14.927 3.624 -1.876 1.00 0.00 C ATOM 2181 C ILE B 95 -16.135 4.528 -1.643 1.00 0.00 C ATOM 2182 O ILE B 95 -17.254 4.058 -1.430 1.00 0.00 O ATOM 2183 CB ILE B 95 -14.010 3.670 -0.630 1.00 0.00 C ATOM 2184 CG1 ILE B 95 -12.863 2.671 -0.775 1.00 0.00 C ATOM 2185 CG2 ILE B 95 -14.810 3.357 0.626 1.00 0.00 C ATOM 2186 CD1 ILE B 95 -13.304 1.238 -0.612 1.00 0.00 C ATOM 0 H ILE B 95 -13.248 4.271 -2.959 1.00 0.00 H new ATOM 0 HA ILE B 95 -15.238 2.589 -2.020 1.00 0.00 H new ATOM 0 HB ILE B 95 -13.595 4.674 -0.546 1.00 0.00 H new ATOM 0 HG12 ILE B 95 -12.403 2.794 -1.756 1.00 0.00 H new ATOM 0 HG13 ILE B 95 -12.097 2.896 -0.033 1.00 0.00 H new ATOM 0 HG21 ILE B 95 -14.152 3.393 1.495 1.00 0.00 H new ATOM 0 HG22 ILE B 95 -15.606 4.092 0.743 1.00 0.00 H new ATOM 0 HG23 ILE B 95 -15.245 2.361 0.541 1.00 0.00 H new ATOM 0 HD11 ILE B 95 -12.444 0.578 -0.726 1.00 0.00 H new ATOM 0 HD12 ILE B 95 -13.738 1.101 0.379 1.00 0.00 H new ATOM 0 HD13 ILE B 95 -14.049 0.998 -1.371 1.00 0.00 H new ATOM 2198 N ASN B 96 -15.897 5.833 -1.714 1.00 0.00 N ATOM 2199 CA ASN B 96 -16.967 6.822 -1.615 1.00 0.00 C ATOM 2200 C ASN B 96 -17.984 6.602 -2.724 1.00 0.00 C ATOM 2201 O ASN B 96 -19.188 6.567 -2.472 1.00 0.00 O ATOM 2202 CB ASN B 96 -16.406 8.244 -1.720 1.00 0.00 C ATOM 2203 CG ASN B 96 -15.459 8.595 -0.589 1.00 0.00 C ATOM 2204 OD1 ASN B 96 -15.604 8.112 0.530 1.00 0.00 O ATOM 2205 ND2 ASN B 96 -14.492 9.453 -0.869 1.00 0.00 N ATOM 0 H ASN B 96 -14.967 6.233 -1.840 1.00 0.00 H new ATOM 0 HA ASN B 96 -17.449 6.703 -0.645 1.00 0.00 H new ATOM 0 HB2 ASN B 96 -15.883 8.353 -2.670 1.00 0.00 H new ATOM 0 HB3 ASN B 96 -17.233 8.955 -1.728 1.00 0.00 H new ATOM 0 HD21 ASN B 96 -13.834 9.735 -0.142 1.00 0.00 H new ATOM 0 HD22 ASN B 96 -14.404 9.833 -1.812 1.00 0.00 H new ATOM 2212 N ALA B 97 -17.476 6.402 -3.938 1.00 0.00 N ATOM 2213 CA ALA B 97 -18.306 6.273 -5.135 1.00 0.00 C ATOM 2214 C ALA B 97 -19.184 5.021 -5.114 1.00 0.00 C ATOM 2215 O ALA B 97 -20.016 4.830 -5.999 1.00 0.00 O ATOM 2216 CB ALA B 97 -17.434 6.278 -6.380 1.00 0.00 C ATOM 0 H ALA B 97 -16.475 6.325 -4.120 1.00 0.00 H new ATOM 0 HA ALA B 97 -18.976 7.132 -5.151 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -18.063 6.181 -7.265 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -16.877 7.214 -6.431 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -16.735 5.442 -6.338 1.00 0.00 H new ATOM 2222 N ARG B 98 -18.999 4.165 -4.112 1.00 0.00 N ATOM 2223 CA ARG B 98 -19.896 3.027 -3.909 1.00 0.00 C ATOM 2224 C ARG B 98 -21.297 3.529 -3.571 1.00 0.00 C ATOM 2225 O ARG B 98 -22.285 2.811 -3.719 1.00 0.00 O ATOM 2226 CB ARG B 98 -19.388 2.125 -2.780 1.00 0.00 C ATOM 2227 CG ARG B 98 -18.040 1.467 -3.046 1.00 0.00 C ATOM 2228 CD ARG B 98 -18.125 0.386 -4.115 1.00 0.00 C ATOM 2229 NE ARG B 98 -18.217 0.933 -5.470 1.00 0.00 N ATOM 2230 CZ ARG B 98 -18.435 0.190 -6.557 1.00 0.00 C ATOM 2231 NH1 ARG B 98 -18.594 -1.125 -6.448 1.00 0.00 N ATOM 2232 NH2 ARG B 98 -18.489 0.761 -7.753 1.00 0.00 N ATOM 0 H ARG B 98 -18.242 4.235 -3.432 1.00 0.00 H new ATOM 0 HA ARG B 98 -19.926 2.445 -4.830 1.00 0.00 H new ATOM 0 HB2 ARG B 98 -19.314 2.716 -1.867 1.00 0.00 H new ATOM 0 HB3 ARG B 98 -20.127 1.345 -2.596 1.00 0.00 H new ATOM 0 HG2 ARG B 98 -17.323 2.226 -3.357 1.00 0.00 H new ATOM 0 HG3 ARG B 98 -17.662 1.031 -2.121 1.00 0.00 H new ATOM 0 HD2 ARG B 98 -17.247 -0.256 -4.046 1.00 0.00 H new ATOM 0 HD3 ARG B 98 -18.995 -0.242 -3.922 1.00 0.00 H new ATOM 0 HE ARG B 98 -18.108 1.940 -5.590 1.00 0.00 H new ATOM 0 HH11 ARG B 98 -18.550 -1.570 -5.531 1.00 0.00 H new ATOM 0 HH12 ARG B 98 -18.760 -1.689 -7.281 1.00 0.00 H new ATOM 0 HH21 ARG B 98 -18.364 1.769 -7.843 1.00 0.00 H new ATOM 0 HH22 ARG B 98 -18.656 0.192 -8.583 1.00 0.00 H new