USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1026 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 88 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Set 1.2: A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 12 GLN :FLIP amide:sc= -2.27! C(o=-6.5!,f=-4.5!) USER MOD Set 2.2: A 15 SER OG : rot 148:sc= -2.2! USER MOD Single : A 21 ASN : amide:sc= -1.29 K(o=-1.3,f=-11!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.159 X(o=-0.16,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 CYS SG : rot -93:sc= 0.978 USER MOD Single : A 35 HIS : no HE2:sc= -1.69 K(o=-1.7,f=-2.7!) USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 85:sc= 0.301 USER MOD Single : A 44 THR OG1 : rot 107:sc= -0.273 USER MOD Single : A 46 CYS SG : rot 81:sc= -4.56! USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.228 USER MOD Single : A 72 THR OG1 : rot 110:sc= 0.356 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot -179:sc= 0.677 USER MOD Single : A 77 GLN : amide:sc= 0.377 X(o=0.38,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.0585 USER MOD Single : A 84 ASN : amide:sc= -1.09 X(o=-1.1,f=-1) USER MOD Single : A 85 LYS NZ :NH3+ -158:sc= 1.03 (180deg=0.364) USER MOD Single : A 91 HIS : no HE2:sc= -0.846 X(o=-0.85,f=-0.35) USER MOD Single : A 93 ASN :FLIP amide:sc= 0.685 F(o=-0.0092,f=0.69) USER MOD Single : A 104 SER OG : rot 46:sc= -0.145 USER MOD Single : A 105 ASN : amide:sc= -0.269 X(o=-0.27,f=-0.11) USER MOD Single : A 106 GLN : amide:sc= -0.0611 K(o=-0.061,f=-1.4) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.0367 USER MOD Single : A 111 SER OG : rot 180:sc= 0.00769 USER MOD Single : A 114 MET CE :methyl -113:sc= -0.0075 (180deg=-1.14) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl 148:sc= -11.4! (180deg=-12.1!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl -147:sc= -3.83! (180deg=-4.14!) USER MOD Single : A 126 GLN : amide:sc= -0.0635 X(o=-0.063,f=-0.39) USER MOD Single : A 129 THR OG1 : rot 180:sc= -0.68 USER MOD Single : A 134 ASN : amide:sc= -0.055 X(o=-0.055,f=-0.013) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 174:sc= 0.0215 (180deg=0.0169) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 164:sc= -0.104 (180deg=-0.433) USER MOD ----------------------------------------------------------------- ATOM 127 N GLN A 12 12.537 13.818 4.125 1.00 0.00 N ATOM 128 CA GLN A 12 13.175 12.585 4.555 1.00 0.00 C ATOM 129 C GLN A 12 12.230 11.399 4.351 1.00 0.00 C ATOM 130 O GLN A 12 11.066 11.454 4.743 1.00 0.00 O ATOM 131 CB GLN A 12 13.628 12.681 6.013 1.00 0.00 C ATOM 132 CG GLN A 12 13.959 11.297 6.576 1.00 0.00 C ATOM 133 CD GLN A 12 15.347 11.284 7.218 1.00 0.00 C ATOM 134 OE1 GLN A 12 15.492 12.156 8.212 1.00 0.00 O flip ATOM 135 NE2 GLN A 12 16.229 10.532 6.837 1.00 0.00 N flip ATOM 0 HA GLN A 12 14.063 12.426 3.943 1.00 0.00 H new ATOM 0 HB2 GLN A 12 14.504 13.326 6.084 1.00 0.00 H new ATOM 0 HB3 GLN A 12 12.843 13.143 6.612 1.00 0.00 H new ATOM 0 HG2 GLN A 12 13.210 11.012 7.315 1.00 0.00 H new ATOM 0 HG3 GLN A 12 13.917 10.556 5.778 1.00 0.00 H new ATOM 0 HE21 GLN A 12 16.052 9.886 6.068 1.00 0.00 H new ATOM 0 HE22 GLN A 12 17.144 10.549 7.288 1.00 0.00 H new ATOM 144 N PRO A 13 12.781 10.327 3.722 1.00 0.00 N ATOM 145 CA PRO A 13 12.000 9.129 3.461 1.00 0.00 C ATOM 146 C PRO A 13 11.797 8.317 4.742 1.00 0.00 C ATOM 147 O PRO A 13 12.707 7.621 5.190 1.00 0.00 O ATOM 148 CB PRO A 13 12.780 8.375 2.397 1.00 0.00 C ATOM 149 CG PRO A 13 14.191 8.938 2.436 1.00 0.00 C ATOM 150 CD PRO A 13 14.157 10.226 3.244 1.00 0.00 C ATOM 0 HA PRO A 13 10.991 9.352 3.113 1.00 0.00 H new ATOM 0 HB2 PRO A 13 12.781 7.304 2.599 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.332 8.513 1.413 1.00 0.00 H new ATOM 0 HG2 PRO A 13 14.876 8.221 2.889 1.00 0.00 H new ATOM 0 HG3 PRO A 13 14.553 9.130 1.426 1.00 0.00 H new ATOM 0 HD2 PRO A 13 14.863 10.192 4.074 1.00 0.00 H new ATOM 0 HD3 PRO A 13 14.427 11.086 2.631 1.00 0.00 H new ATOM 158 N VAL A 14 10.599 8.434 5.295 1.00 0.00 N ATOM 159 CA VAL A 14 10.265 7.720 6.515 1.00 0.00 C ATOM 160 C VAL A 14 11.553 7.356 7.257 1.00 0.00 C ATOM 161 O VAL A 14 12.114 6.283 7.045 1.00 0.00 O ATOM 162 CB VAL A 14 9.399 6.501 6.188 1.00 0.00 C ATOM 163 CG1 VAL A 14 7.941 6.908 5.965 1.00 0.00 C ATOM 164 CG2 VAL A 14 9.950 5.747 4.976 1.00 0.00 C ATOM 0 H VAL A 14 9.847 9.013 4.920 1.00 0.00 H new ATOM 0 HA VAL A 14 9.675 8.353 7.178 1.00 0.00 H new ATOM 0 HB VAL A 14 9.431 5.827 7.044 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.347 6.023 5.734 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.553 7.380 6.868 1.00 0.00 H new ATOM 0 HG13 VAL A 14 7.882 7.611 5.134 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.317 4.885 4.765 1.00 0.00 H new ATOM 0 HG22 VAL A 14 9.962 6.409 4.110 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.964 5.408 5.188 1.00 0.00 H new ATOM 174 N SER A 15 11.984 8.272 8.112 1.00 0.00 N ATOM 175 CA SER A 15 13.195 8.062 8.886 1.00 0.00 C ATOM 176 C SER A 15 13.039 6.827 9.776 1.00 0.00 C ATOM 177 O SER A 15 14.023 6.162 10.098 1.00 0.00 O ATOM 178 CB SER A 15 13.526 9.291 9.736 1.00 0.00 C ATOM 179 OG SER A 15 14.740 9.913 9.325 1.00 0.00 O ATOM 0 H SER A 15 11.516 9.161 8.286 1.00 0.00 H new ATOM 0 HA SER A 15 14.021 7.901 8.193 1.00 0.00 H new ATOM 0 HB2 SER A 15 12.709 10.010 9.668 1.00 0.00 H new ATOM 0 HB3 SER A 15 13.605 8.997 10.783 1.00 0.00 H new ATOM 0 HG SER A 15 14.683 10.878 9.484 1.00 0.00 H new ATOM 185 N LEU A 16 11.797 6.559 10.149 1.00 0.00 N ATOM 186 CA LEU A 16 11.500 5.416 10.996 1.00 0.00 C ATOM 187 C LEU A 16 10.278 4.680 10.441 1.00 0.00 C ATOM 188 O LEU A 16 9.609 5.175 9.535 1.00 0.00 O ATOM 189 CB LEU A 16 11.344 5.855 12.453 1.00 0.00 C ATOM 190 CG LEU A 16 11.257 7.363 12.694 1.00 0.00 C ATOM 191 CD1 LEU A 16 9.960 7.936 12.118 1.00 0.00 C ATOM 192 CD2 LEU A 16 11.419 7.691 14.179 1.00 0.00 C ATOM 0 H LEU A 16 10.984 7.114 9.880 1.00 0.00 H new ATOM 0 HA LEU A 16 12.330 4.709 10.988 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.445 5.390 12.857 1.00 0.00 H new ATOM 0 HB3 LEU A 16 12.188 5.464 13.022 1.00 0.00 H new ATOM 0 HG LEU A 16 12.082 7.842 12.167 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.923 9.010 12.303 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.926 7.751 11.044 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.106 7.456 12.596 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.353 8.769 14.323 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.630 7.200 14.748 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.390 7.337 14.526 1.00 0.00 H new ATOM 204 N PRO A 17 10.018 3.479 11.023 1.00 0.00 N ATOM 205 CA PRO A 17 8.889 2.670 10.597 1.00 0.00 C ATOM 206 C PRO A 17 7.572 3.247 11.120 1.00 0.00 C ATOM 207 O PRO A 17 6.495 2.808 10.720 1.00 0.00 O ATOM 208 CB PRO A 17 9.179 1.276 11.131 1.00 0.00 C ATOM 209 CG PRO A 17 10.219 1.457 12.225 1.00 0.00 C ATOM 210 CD PRO A 17 10.789 2.861 12.099 1.00 0.00 C ATOM 0 HA PRO A 17 8.771 2.651 9.514 1.00 0.00 H new ATOM 0 HB2 PRO A 17 8.274 0.813 11.525 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.553 0.625 10.341 1.00 0.00 H new ATOM 0 HG2 PRO A 17 9.768 1.315 13.207 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.010 0.714 12.126 1.00 0.00 H new ATOM 0 HD2 PRO A 17 10.684 3.416 13.031 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.852 2.837 11.861 1.00 0.00 H new ATOM 218 N GLU A 18 7.702 4.223 12.007 1.00 0.00 N ATOM 219 CA GLU A 18 6.535 4.866 12.588 1.00 0.00 C ATOM 220 C GLU A 18 5.798 5.688 11.529 1.00 0.00 C ATOM 221 O GLU A 18 4.617 5.460 11.272 1.00 0.00 O ATOM 222 CB GLU A 18 6.928 5.737 13.783 1.00 0.00 C ATOM 223 CG GLU A 18 7.860 4.980 14.731 1.00 0.00 C ATOM 224 CD GLU A 18 7.464 5.213 16.191 1.00 0.00 C ATOM 225 OE1 GLU A 18 7.895 6.252 16.736 1.00 0.00 O ATOM 226 OE2 GLU A 18 6.740 4.347 16.728 1.00 0.00 O ATOM 0 H GLU A 18 8.597 4.584 12.337 1.00 0.00 H new ATOM 0 HA GLU A 18 5.860 4.091 12.951 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.420 6.643 13.430 1.00 0.00 H new ATOM 0 HB3 GLU A 18 6.032 6.049 14.320 1.00 0.00 H new ATOM 0 HG2 GLU A 18 7.825 3.914 14.507 1.00 0.00 H new ATOM 0 HG3 GLU A 18 8.888 5.306 14.573 1.00 0.00 H new ATOM 233 N GLU A 19 6.526 6.627 10.942 1.00 0.00 N ATOM 234 CA GLU A 19 5.956 7.484 9.917 1.00 0.00 C ATOM 235 C GLU A 19 5.172 6.648 8.903 1.00 0.00 C ATOM 236 O GLU A 19 4.069 7.021 8.506 1.00 0.00 O ATOM 237 CB GLU A 19 7.044 8.308 9.224 1.00 0.00 C ATOM 238 CG GLU A 19 7.610 9.371 10.167 1.00 0.00 C ATOM 239 CD GLU A 19 6.647 10.552 10.303 1.00 0.00 C ATOM 240 OE1 GLU A 19 6.478 11.265 9.291 1.00 0.00 O ATOM 241 OE2 GLU A 19 6.103 10.716 11.416 1.00 0.00 O ATOM 0 H GLU A 19 7.506 6.813 11.157 1.00 0.00 H new ATOM 0 HA GLU A 19 5.267 8.181 10.395 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.846 7.650 8.889 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.632 8.787 8.336 1.00 0.00 H new ATOM 0 HG2 GLU A 19 7.793 8.932 11.148 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.571 9.722 9.790 1.00 0.00 H new ATOM 248 N LEU A 20 5.772 5.534 8.512 1.00 0.00 N ATOM 249 CA LEU A 20 5.144 4.642 7.551 1.00 0.00 C ATOM 250 C LEU A 20 3.866 4.062 8.161 1.00 0.00 C ATOM 251 O LEU A 20 2.906 3.780 7.446 1.00 0.00 O ATOM 252 CB LEU A 20 6.137 3.580 7.077 1.00 0.00 C ATOM 253 CG LEU A 20 5.842 2.947 5.715 1.00 0.00 C ATOM 254 CD1 LEU A 20 5.389 4.003 4.706 1.00 0.00 C ATOM 255 CD2 LEU A 20 7.047 2.150 5.209 1.00 0.00 C ATOM 0 H LEU A 20 6.687 5.228 8.843 1.00 0.00 H new ATOM 0 HA LEU A 20 4.850 5.191 6.656 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.129 4.030 7.039 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.175 2.787 7.824 1.00 0.00 H new ATOM 0 HG LEU A 20 5.018 2.244 5.836 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.186 3.526 3.747 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.483 4.488 5.069 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.175 4.748 4.582 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.811 1.710 4.240 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.906 2.814 5.107 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.283 1.357 5.919 1.00 0.00 H new ATOM 267 N ASN A 21 3.897 3.900 9.476 1.00 0.00 N ATOM 268 CA ASN A 21 2.753 3.358 10.190 1.00 0.00 C ATOM 269 C ASN A 21 1.655 4.421 10.266 1.00 0.00 C ATOM 270 O ASN A 21 0.497 4.103 10.535 1.00 0.00 O ATOM 271 CB ASN A 21 3.131 2.966 11.619 1.00 0.00 C ATOM 272 CG ASN A 21 3.233 1.447 11.763 1.00 0.00 C ATOM 273 OD1 ASN A 21 2.435 0.692 11.232 1.00 0.00 O ATOM 274 ND2 ASN A 21 4.258 1.041 12.508 1.00 0.00 N ATOM 0 H ASN A 21 4.696 4.134 10.065 1.00 0.00 H new ATOM 0 HA ASN A 21 2.408 2.474 9.653 1.00 0.00 H new ATOM 0 HB2 ASN A 21 4.083 3.425 11.886 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.386 3.351 12.315 1.00 0.00 H new ATOM 0 HD21 ASN A 21 4.413 0.045 12.663 1.00 0.00 H new ATOM 0 HD22 ASN A 21 4.889 1.726 12.924 1.00 0.00 H new ATOM 281 N ARG A 22 2.056 5.660 10.023 1.00 0.00 N ATOM 282 CA ARG A 22 1.120 6.771 10.061 1.00 0.00 C ATOM 283 C ARG A 22 0.271 6.792 8.789 1.00 0.00 C ATOM 284 O ARG A 22 -0.854 7.289 8.798 1.00 0.00 O ATOM 285 CB ARG A 22 1.855 8.106 10.198 1.00 0.00 C ATOM 286 CG ARG A 22 2.798 8.091 11.403 1.00 0.00 C ATOM 287 CD ARG A 22 3.356 9.489 11.679 1.00 0.00 C ATOM 288 NE ARG A 22 2.569 10.146 12.746 1.00 0.00 N ATOM 289 CZ ARG A 22 2.592 11.463 12.995 1.00 0.00 C ATOM 290 NH1 ARG A 22 3.362 12.271 12.253 1.00 0.00 N ATOM 291 NH2 ARG A 22 1.845 11.971 13.984 1.00 0.00 N ATOM 0 H ARG A 22 3.017 5.919 9.799 1.00 0.00 H new ATOM 0 HA ARG A 22 0.476 6.633 10.930 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.423 8.308 9.290 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.132 8.914 10.308 1.00 0.00 H new ATOM 0 HG2 ARG A 22 2.265 7.728 12.282 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.619 7.398 11.219 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.402 9.420 11.977 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.323 10.089 10.770 1.00 0.00 H new ATOM 0 HE ARG A 22 1.971 9.560 13.329 1.00 0.00 H new ATOM 0 HH11 ARG A 22 3.930 11.884 11.499 1.00 0.00 H new ATOM 0 HH12 ARG A 22 3.380 13.273 12.442 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.259 11.356 14.548 1.00 0.00 H new ATOM 0 HH22 ARG A 22 1.863 12.973 14.173 1.00 0.00 H new ATOM 305 N VAL A 23 0.841 6.247 7.725 1.00 0.00 N ATOM 306 CA VAL A 23 0.150 6.197 6.448 1.00 0.00 C ATOM 307 C VAL A 23 -0.116 4.737 6.073 1.00 0.00 C ATOM 308 O VAL A 23 -0.423 4.435 4.921 1.00 0.00 O ATOM 309 CB VAL A 23 0.957 6.949 5.387 1.00 0.00 C ATOM 310 CG1 VAL A 23 0.937 8.456 5.649 1.00 0.00 C ATOM 311 CG2 VAL A 23 2.392 6.424 5.315 1.00 0.00 C ATOM 0 H VAL A 23 1.774 5.836 7.721 1.00 0.00 H new ATOM 0 HA VAL A 23 -0.817 6.696 6.517 1.00 0.00 H new ATOM 0 HB VAL A 23 0.487 6.771 4.420 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.518 8.967 4.881 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -0.092 8.816 5.625 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.371 8.661 6.628 1.00 0.00 H new ATOM 0 HG21 VAL A 23 2.943 6.975 4.553 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.877 6.557 6.282 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.379 5.365 5.058 1.00 0.00 H new ATOM 321 N ARG A 24 0.011 3.872 7.068 1.00 0.00 N ATOM 322 CA ARG A 24 -0.212 2.452 6.858 1.00 0.00 C ATOM 323 C ARG A 24 -1.709 2.137 6.906 1.00 0.00 C ATOM 324 O ARG A 24 -2.287 2.015 7.984 1.00 0.00 O ATOM 325 CB ARG A 24 0.512 1.618 7.917 1.00 0.00 C ATOM 326 CG ARG A 24 0.377 0.122 7.623 1.00 0.00 C ATOM 327 CD ARG A 24 0.462 -0.699 8.911 1.00 0.00 C ATOM 328 NE ARG A 24 -0.755 -0.488 9.728 1.00 0.00 N ATOM 329 CZ ARG A 24 -1.905 -1.150 9.547 1.00 0.00 C ATOM 330 NH1 ARG A 24 -2.004 -2.070 8.577 1.00 0.00 N ATOM 331 NH2 ARG A 24 -2.958 -0.893 10.335 1.00 0.00 N ATOM 0 H ARG A 24 0.266 4.127 8.022 1.00 0.00 H new ATOM 0 HA ARG A 24 0.186 2.196 5.876 1.00 0.00 H new ATOM 0 HB2 ARG A 24 1.566 1.893 7.944 1.00 0.00 H new ATOM 0 HB3 ARG A 24 0.100 1.837 8.902 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -0.574 -0.070 7.127 1.00 0.00 H new ATOM 0 HG3 ARG A 24 1.164 -0.190 6.936 1.00 0.00 H new ATOM 0 HD2 ARG A 24 0.570 -1.757 8.671 1.00 0.00 H new ATOM 0 HD3 ARG A 24 1.346 -0.409 9.479 1.00 0.00 H new ATOM 0 HE ARG A 24 -0.715 0.205 10.475 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -1.203 -2.266 7.976 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -2.880 -2.574 8.440 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -2.884 -0.193 11.073 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -3.834 -1.397 10.197 1.00 0.00 H new ATOM 345 N LEU A 25 -2.293 2.013 5.723 1.00 0.00 N ATOM 346 CA LEU A 25 -3.711 1.715 5.616 1.00 0.00 C ATOM 347 C LEU A 25 -4.022 0.448 6.415 1.00 0.00 C ATOM 348 O LEU A 25 -3.124 -0.334 6.721 1.00 0.00 O ATOM 349 CB LEU A 25 -4.132 1.635 4.147 1.00 0.00 C ATOM 350 CG LEU A 25 -4.763 2.899 3.560 1.00 0.00 C ATOM 351 CD1 LEU A 25 -5.207 2.670 2.114 1.00 0.00 C ATOM 352 CD2 LEU A 25 -5.911 3.398 4.440 1.00 0.00 C ATOM 0 H LEU A 25 -1.810 2.114 4.830 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.304 2.520 6.050 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.255 1.381 3.552 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.841 0.814 4.037 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.006 3.683 3.544 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.652 3.584 1.721 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.344 2.397 1.507 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.942 1.866 2.082 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.342 4.297 4.000 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.677 2.626 4.511 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.533 3.627 5.436 1.00 0.00 H new ATOM 364 N SER A 26 -5.299 0.285 6.731 1.00 0.00 N ATOM 365 CA SER A 26 -5.740 -0.873 7.489 1.00 0.00 C ATOM 366 C SER A 26 -6.995 -1.470 6.849 1.00 0.00 C ATOM 367 O SER A 26 -7.934 -0.747 6.523 1.00 0.00 O ATOM 368 CB SER A 26 -6.014 -0.505 8.949 1.00 0.00 C ATOM 369 OG SER A 26 -6.399 -1.638 9.722 1.00 0.00 O ATOM 0 H SER A 26 -6.042 0.936 6.476 1.00 0.00 H new ATOM 0 HA SER A 26 -4.942 -1.616 7.473 1.00 0.00 H new ATOM 0 HB2 SER A 26 -5.121 -0.056 9.384 1.00 0.00 H new ATOM 0 HB3 SER A 26 -6.802 0.247 8.992 1.00 0.00 H new ATOM 0 HG SER A 26 -6.563 -1.362 10.648 1.00 0.00 H new ATOM 375 N ARG A 27 -6.969 -2.785 6.687 1.00 0.00 N ATOM 376 CA ARG A 27 -8.093 -3.488 6.092 1.00 0.00 C ATOM 377 C ARG A 27 -9.412 -2.845 6.525 1.00 0.00 C ATOM 378 O ARG A 27 -10.315 -2.664 5.711 1.00 0.00 O ATOM 379 CB ARG A 27 -8.096 -4.964 6.496 1.00 0.00 C ATOM 380 CG ARG A 27 -8.339 -5.864 5.283 1.00 0.00 C ATOM 381 CD ARG A 27 -8.837 -7.244 5.715 1.00 0.00 C ATOM 382 NE ARG A 27 -9.936 -7.101 6.696 1.00 0.00 N ATOM 383 CZ ARG A 27 -10.283 -8.048 7.579 1.00 0.00 C ATOM 384 NH1 ARG A 27 -9.619 -9.211 7.609 1.00 0.00 N ATOM 385 NH2 ARG A 27 -11.294 -7.831 8.432 1.00 0.00 N ATOM 0 H ARG A 27 -6.187 -3.382 6.957 1.00 0.00 H new ATOM 0 HA ARG A 27 -7.990 -3.420 5.009 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -7.143 -5.220 6.958 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -8.870 -5.139 7.244 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -9.071 -5.400 4.622 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -7.416 -5.969 4.713 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -9.185 -7.803 4.846 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -8.018 -7.814 6.154 1.00 0.00 H new ATOM 0 HE ARG A 27 -10.462 -6.227 6.700 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -8.850 -9.376 6.960 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -9.883 -9.932 8.281 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -11.799 -6.945 8.409 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -11.558 -8.552 9.104 1.00 0.00 H new ATOM 399 N HIS A 28 -9.480 -2.517 7.807 1.00 0.00 N ATOM 400 CA HIS A 28 -10.673 -1.898 8.359 1.00 0.00 C ATOM 401 C HIS A 28 -10.985 -0.611 7.592 1.00 0.00 C ATOM 402 O HIS A 28 -12.034 -0.500 6.960 1.00 0.00 O ATOM 403 CB HIS A 28 -10.520 -1.668 9.864 1.00 0.00 C ATOM 404 CG HIS A 28 -10.491 -2.939 10.679 1.00 0.00 C ATOM 405 ND1 HIS A 28 -10.832 -2.978 12.019 1.00 0.00 N ATOM 406 CD2 HIS A 28 -10.158 -4.215 10.329 1.00 0.00 C ATOM 407 CE1 HIS A 28 -10.707 -4.225 12.447 1.00 0.00 C ATOM 408 NE2 HIS A 28 -10.288 -4.990 11.398 1.00 0.00 N ATOM 0 H HIS A 28 -8.728 -2.668 8.479 1.00 0.00 H new ATOM 0 HA HIS A 28 -11.524 -2.569 8.237 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -9.600 -1.112 10.045 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -11.344 -1.044 10.212 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -9.842 -4.539 9.348 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -10.902 -4.575 13.450 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -10.105 -5.993 11.430 1.00 0.00 H new ATOM 416 N LYS A 29 -10.054 0.328 7.672 1.00 0.00 N ATOM 417 CA LYS A 29 -10.216 1.603 6.993 1.00 0.00 C ATOM 418 C LYS A 29 -10.634 1.353 5.543 1.00 0.00 C ATOM 419 O LYS A 29 -11.578 1.969 5.050 1.00 0.00 O ATOM 420 CB LYS A 29 -8.949 2.449 7.132 1.00 0.00 C ATOM 421 CG LYS A 29 -9.015 3.335 8.377 1.00 0.00 C ATOM 422 CD LYS A 29 -7.687 4.059 8.606 1.00 0.00 C ATOM 423 CE LYS A 29 -7.902 5.374 9.359 1.00 0.00 C ATOM 424 NZ LYS A 29 -7.961 5.131 10.818 1.00 0.00 N ATOM 0 H LYS A 29 -9.185 0.232 8.197 1.00 0.00 H new ATOM 0 HA LYS A 29 -11.011 2.185 7.458 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -8.077 1.797 7.191 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -8.823 3.070 6.245 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -9.817 4.065 8.266 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -9.256 2.726 9.248 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -7.012 3.418 9.173 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -7.208 4.259 7.648 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.092 6.067 9.132 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.827 5.845 9.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.107 6.033 11.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.749 4.487 11.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.068 4.702 11.135 1.00 0.00 H new ATOM 438 N LEU A 30 -9.909 0.450 4.899 1.00 0.00 N ATOM 439 CA LEU A 30 -10.192 0.112 3.514 1.00 0.00 C ATOM 440 C LEU A 30 -11.635 -0.384 3.400 1.00 0.00 C ATOM 441 O LEU A 30 -12.421 0.155 2.622 1.00 0.00 O ATOM 442 CB LEU A 30 -9.157 -0.882 2.983 1.00 0.00 C ATOM 443 CG LEU A 30 -7.712 -0.382 2.934 1.00 0.00 C ATOM 444 CD1 LEU A 30 -6.725 -1.542 3.085 1.00 0.00 C ATOM 445 CD2 LEU A 30 -7.454 0.427 1.661 1.00 0.00 C ATOM 0 H LEU A 30 -9.126 -0.058 5.311 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.106 0.995 2.881 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.190 -1.777 3.604 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -9.452 -1.181 1.977 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.554 0.288 3.779 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.705 -1.159 3.047 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -6.891 -2.039 4.041 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -6.875 -2.255 2.275 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.420 0.770 1.652 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -7.636 -0.200 0.788 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.122 1.288 1.635 1.00 0.00 H new ATOM 457 N GLU A 31 -11.941 -1.406 4.186 1.00 0.00 N ATOM 458 CA GLU A 31 -13.275 -1.980 4.183 1.00 0.00 C ATOM 459 C GLU A 31 -14.330 -0.873 4.253 1.00 0.00 C ATOM 460 O GLU A 31 -15.471 -1.071 3.839 1.00 0.00 O ATOM 461 CB GLU A 31 -13.447 -2.974 5.333 1.00 0.00 C ATOM 462 CG GLU A 31 -14.570 -3.970 5.034 1.00 0.00 C ATOM 463 CD GLU A 31 -15.651 -3.918 6.116 1.00 0.00 C ATOM 464 OE1 GLU A 31 -15.459 -4.603 7.144 1.00 0.00 O ATOM 465 OE2 GLU A 31 -16.645 -3.194 5.891 1.00 0.00 O ATOM 0 H GLU A 31 -11.287 -1.851 4.830 1.00 0.00 H new ATOM 0 HA GLU A 31 -13.411 -2.527 3.250 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -12.513 -3.512 5.496 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -13.670 -2.435 6.254 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -15.011 -3.745 4.063 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -14.160 -4.978 4.972 1.00 0.00 H new ATOM 472 N ARG A 32 -13.910 0.267 4.780 1.00 0.00 N ATOM 473 CA ARG A 32 -14.804 1.406 4.909 1.00 0.00 C ATOM 474 C ARG A 32 -14.689 2.313 3.682 1.00 0.00 C ATOM 475 O ARG A 32 -15.696 2.663 3.069 1.00 0.00 O ATOM 476 CB ARG A 32 -14.484 2.217 6.166 1.00 0.00 C ATOM 477 CG ARG A 32 -14.035 1.304 7.309 1.00 0.00 C ATOM 478 CD ARG A 32 -14.777 1.641 8.604 1.00 0.00 C ATOM 479 NE ARG A 32 -14.361 0.716 9.681 1.00 0.00 N ATOM 480 CZ ARG A 32 -14.895 -0.497 9.878 1.00 0.00 C ATOM 481 NH1 ARG A 32 -15.870 -0.939 9.071 1.00 0.00 N ATOM 482 NH2 ARG A 32 -14.456 -1.269 10.881 1.00 0.00 N ATOM 0 H ARG A 32 -12.963 0.427 5.123 1.00 0.00 H new ATOM 0 HA ARG A 32 -15.821 1.022 4.987 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -13.700 2.942 5.946 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -15.364 2.782 6.472 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.218 0.263 7.041 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.961 1.409 7.463 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.567 2.670 8.896 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.853 1.568 8.446 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.621 1.021 10.313 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -16.205 -0.352 8.307 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.277 -1.862 9.221 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -13.714 -0.934 11.496 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -14.863 -2.192 11.030 1.00 0.00 H new ATOM 496 N TRP A 33 -13.454 2.666 3.361 1.00 0.00 N ATOM 497 CA TRP A 33 -13.195 3.526 2.218 1.00 0.00 C ATOM 498 C TRP A 33 -13.526 2.737 0.949 1.00 0.00 C ATOM 499 O TRP A 33 -13.546 3.297 -0.146 1.00 0.00 O ATOM 500 CB TRP A 33 -11.757 4.048 2.239 1.00 0.00 C ATOM 501 CG TRP A 33 -11.307 4.576 3.603 1.00 0.00 C ATOM 502 CD1 TRP A 33 -12.033 4.695 4.722 1.00 0.00 C ATOM 503 CD2 TRP A 33 -9.989 5.054 3.948 1.00 0.00 C ATOM 504 NE1 TRP A 33 -11.284 5.214 5.759 1.00 0.00 N ATOM 505 CE2 TRP A 33 -10.001 5.438 5.273 1.00 0.00 C ATOM 506 CE3 TRP A 33 -8.825 5.158 3.165 1.00 0.00 C ATOM 507 CZ2 TRP A 33 -8.879 5.953 5.932 1.00 0.00 C ATOM 508 CZ3 TRP A 33 -7.712 5.674 3.839 1.00 0.00 C ATOM 509 CH2 TRP A 33 -7.708 6.065 5.173 1.00 0.00 C ATOM 0 H TRP A 33 -12.621 2.373 3.872 1.00 0.00 H new ATOM 0 HA TRP A 33 -13.827 4.413 2.252 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -11.086 3.246 1.932 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -11.660 4.845 1.502 1.00 0.00 H new ATOM 0 HD1 TRP A 33 -13.074 4.419 4.803 1.00 0.00 H new ATOM 0 HE1 TRP A 33 -11.612 5.399 6.707 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -8.793 4.863 2.127 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -8.915 6.248 6.970 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -6.791 5.776 3.283 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -6.806 6.453 5.622 1.00 0.00 H new ATOM 520 N CYS A 34 -13.777 1.450 1.139 1.00 0.00 N ATOM 521 CA CYS A 34 -14.106 0.580 0.023 1.00 0.00 C ATOM 522 C CYS A 34 -15.389 1.099 -0.629 1.00 0.00 C ATOM 523 O CYS A 34 -15.715 0.719 -1.753 1.00 0.00 O ATOM 524 CB CYS A 34 -14.240 -0.879 0.465 1.00 0.00 C ATOM 525 SG CYS A 34 -15.929 -1.189 1.096 1.00 0.00 S ATOM 0 H CYS A 34 -13.759 0.989 2.049 1.00 0.00 H new ATOM 0 HA CYS A 34 -13.297 0.598 -0.707 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -14.029 -1.542 -0.374 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -13.507 -1.102 1.240 1.00 0.00 H new ATOM 0 HG CYS A 34 -15.947 -1.027 2.386 1.00 0.00 H new ATOM 531 N HIS A 35 -16.081 1.958 0.104 1.00 0.00 N ATOM 532 CA HIS A 35 -17.321 2.533 -0.389 1.00 0.00 C ATOM 533 C HIS A 35 -17.138 4.036 -0.610 1.00 0.00 C ATOM 534 O HIS A 35 -17.969 4.679 -1.250 1.00 0.00 O ATOM 535 CB HIS A 35 -18.483 2.209 0.552 1.00 0.00 C ATOM 536 CG HIS A 35 -18.686 3.227 1.649 1.00 0.00 C ATOM 537 ND1 HIS A 35 -19.143 4.510 1.406 1.00 0.00 N ATOM 538 CD2 HIS A 35 -18.490 3.137 2.996 1.00 0.00 C ATOM 539 CE1 HIS A 35 -19.215 5.155 2.561 1.00 0.00 C ATOM 540 NE2 HIS A 35 -18.809 4.302 3.546 1.00 0.00 N ATOM 0 H HIS A 35 -15.807 2.270 1.036 1.00 0.00 H new ATOM 0 HA HIS A 35 -17.575 2.088 -1.351 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -19.400 2.132 -0.032 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -18.310 1.232 1.004 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -19.384 4.894 0.492 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -18.135 2.265 3.525 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -19.538 6.176 2.699 1.00 0.00 H new ATOM 548 N MET A 36 -16.045 4.552 -0.069 1.00 0.00 N ATOM 549 CA MET A 36 -15.742 5.967 -0.198 1.00 0.00 C ATOM 550 C MET A 36 -15.585 6.362 -1.668 1.00 0.00 C ATOM 551 O MET A 36 -15.311 5.514 -2.517 1.00 0.00 O ATOM 552 CB MET A 36 -14.449 6.284 0.556 1.00 0.00 C ATOM 553 CG MET A 36 -14.739 6.625 2.020 1.00 0.00 C ATOM 554 SD MET A 36 -15.760 8.086 2.115 1.00 0.00 S ATOM 555 CE MET A 36 -15.920 8.237 3.887 1.00 0.00 C ATOM 0 H MET A 36 -15.358 4.015 0.460 1.00 0.00 H new ATOM 0 HA MET A 36 -16.569 6.536 0.226 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.775 5.429 0.504 1.00 0.00 H new ATOM 0 HB3 MET A 36 -13.940 7.121 0.078 1.00 0.00 H new ATOM 0 HG2 MET A 36 -15.242 5.788 2.504 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.804 6.789 2.556 1.00 0.00 H new ATOM 0 HE1 MET A 36 -16.533 9.106 4.124 1.00 0.00 H new ATOM 0 HE2 MET A 36 -16.392 7.340 4.287 1.00 0.00 H new ATOM 0 HE3 MET A 36 -14.933 8.357 4.333 1.00 0.00 H new ATOM 565 N PRO A 37 -15.769 7.683 -1.932 1.00 0.00 N ATOM 566 CA PRO A 37 -15.651 8.200 -3.284 1.00 0.00 C ATOM 567 C PRO A 37 -14.184 8.284 -3.713 1.00 0.00 C ATOM 568 O PRO A 37 -13.803 7.735 -4.745 1.00 0.00 O ATOM 569 CB PRO A 37 -16.338 9.556 -3.249 1.00 0.00 C ATOM 570 CG PRO A 37 -16.405 9.951 -1.783 1.00 0.00 C ATOM 571 CD PRO A 37 -16.095 8.716 -0.952 1.00 0.00 C ATOM 0 HA PRO A 37 -16.118 7.551 -4.024 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -15.779 10.292 -3.827 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -17.336 9.500 -3.684 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -15.689 10.745 -1.569 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -17.394 10.338 -1.537 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -15.262 8.895 -0.273 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -16.949 8.426 -0.340 1.00 0.00 H new ATOM 579 N PHE A 38 -13.402 8.977 -2.898 1.00 0.00 N ATOM 580 CA PHE A 38 -11.986 9.140 -3.180 1.00 0.00 C ATOM 581 C PHE A 38 -11.173 7.987 -2.588 1.00 0.00 C ATOM 582 O PHE A 38 -10.014 8.166 -2.217 1.00 0.00 O ATOM 583 CB PHE A 38 -11.547 10.449 -2.520 1.00 0.00 C ATOM 584 CG PHE A 38 -12.022 10.608 -1.075 1.00 0.00 C ATOM 585 CD1 PHE A 38 -11.625 9.717 -0.127 1.00 0.00 C ATOM 586 CD2 PHE A 38 -12.842 11.639 -0.738 1.00 0.00 C ATOM 587 CE1 PHE A 38 -12.066 9.865 1.215 1.00 0.00 C ATOM 588 CE2 PHE A 38 -13.284 11.786 0.604 1.00 0.00 C ATOM 589 CZ PHE A 38 -12.886 10.896 1.552 1.00 0.00 C ATOM 0 H PHE A 38 -13.722 9.432 -2.043 1.00 0.00 H new ATOM 0 HA PHE A 38 -11.820 9.151 -4.257 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -10.459 10.508 -2.542 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -11.924 11.285 -3.109 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -10.975 8.897 -0.395 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -13.157 12.346 -1.491 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -11.750 9.158 1.968 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -13.936 12.604 0.871 1.00 0.00 H new ATOM 0 HZ PHE A 38 -13.221 11.008 2.573 1.00 0.00 H new ATOM 599 N PHE A 39 -11.812 6.829 -2.519 1.00 0.00 N ATOM 600 CA PHE A 39 -11.163 5.646 -1.979 1.00 0.00 C ATOM 601 C PHE A 39 -9.807 5.412 -2.647 1.00 0.00 C ATOM 602 O PHE A 39 -8.763 5.613 -2.027 1.00 0.00 O ATOM 603 CB PHE A 39 -12.078 4.457 -2.279 1.00 0.00 C ATOM 604 CG PHE A 39 -11.494 3.104 -1.868 1.00 0.00 C ATOM 605 CD1 PHE A 39 -10.887 2.964 -0.659 1.00 0.00 C ATOM 606 CD2 PHE A 39 -11.583 2.040 -2.711 1.00 0.00 C ATOM 607 CE1 PHE A 39 -10.346 1.708 -0.277 1.00 0.00 C ATOM 608 CE2 PHE A 39 -11.042 0.784 -2.329 1.00 0.00 C ATOM 609 CZ PHE A 39 -10.435 0.645 -1.120 1.00 0.00 C ATOM 0 H PHE A 39 -12.773 6.684 -2.828 1.00 0.00 H new ATOM 0 HA PHE A 39 -10.995 5.770 -0.909 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -13.027 4.603 -1.764 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -12.294 4.439 -3.347 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -10.816 3.808 0.011 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -12.065 2.151 -3.671 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -9.864 1.597 0.683 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -11.113 -0.061 -2.998 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.023 -0.310 -0.829 1.00 0.00 H new ATOM 619 N ALA A 40 -9.865 4.991 -3.901 1.00 0.00 N ATOM 620 CA ALA A 40 -8.654 4.728 -4.660 1.00 0.00 C ATOM 621 C ALA A 40 -7.736 5.949 -4.586 1.00 0.00 C ATOM 622 O ALA A 40 -6.524 5.810 -4.423 1.00 0.00 O ATOM 623 CB ALA A 40 -9.023 4.362 -6.099 1.00 0.00 C ATOM 0 H ALA A 40 -10.732 4.825 -4.411 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.112 3.882 -4.237 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -8.115 4.165 -6.669 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.651 3.471 -6.098 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.566 5.189 -6.557 1.00 0.00 H new ATOM 629 N LYS A 41 -8.347 7.118 -4.708 1.00 0.00 N ATOM 630 CA LYS A 41 -7.599 8.363 -4.656 1.00 0.00 C ATOM 631 C LYS A 41 -6.824 8.433 -3.339 1.00 0.00 C ATOM 632 O LYS A 41 -5.645 8.784 -3.326 1.00 0.00 O ATOM 633 CB LYS A 41 -8.528 9.556 -4.888 1.00 0.00 C ATOM 634 CG LYS A 41 -7.900 10.560 -5.856 1.00 0.00 C ATOM 635 CD LYS A 41 -8.645 10.573 -7.192 1.00 0.00 C ATOM 636 CE LYS A 41 -7.755 11.116 -8.312 1.00 0.00 C ATOM 637 NZ LYS A 41 -8.539 11.301 -9.554 1.00 0.00 N ATOM 0 H LYS A 41 -9.352 7.230 -4.843 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.864 8.400 -5.460 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.480 9.207 -5.287 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.741 10.046 -3.938 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.919 11.557 -5.415 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -6.853 10.305 -6.022 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -8.972 9.563 -7.440 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -9.542 11.186 -7.106 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -7.316 12.066 -8.007 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -6.930 10.428 -8.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -7.920 11.670 -10.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -8.937 10.388 -9.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -9.311 11.975 -9.380 1.00 0.00 H new ATOM 651 N THR A 42 -7.518 8.093 -2.262 1.00 0.00 N ATOM 652 CA THR A 42 -6.910 8.113 -0.943 1.00 0.00 C ATOM 653 C THR A 42 -5.932 6.946 -0.788 1.00 0.00 C ATOM 654 O THR A 42 -4.719 7.147 -0.763 1.00 0.00 O ATOM 655 CB THR A 42 -8.033 8.106 0.096 1.00 0.00 C ATOM 656 OG1 THR A 42 -8.795 9.272 -0.209 1.00 0.00 O ATOM 657 CG2 THR A 42 -7.520 8.357 1.515 1.00 0.00 C ATOM 0 H THR A 42 -8.496 7.802 -2.277 1.00 0.00 H new ATOM 0 HA THR A 42 -6.317 9.015 -0.795 1.00 0.00 H new ATOM 0 HB THR A 42 -8.552 7.148 0.062 1.00 0.00 H new ATOM 0 HG1 THR A 42 -9.448 9.062 -0.909 1.00 0.00 H new ATOM 0 HG21 THR A 42 -8.357 8.342 2.213 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.807 7.579 1.787 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.030 9.330 1.558 1.00 0.00 H new ATOM 665 N VAL A 43 -6.498 5.752 -0.688 1.00 0.00 N ATOM 666 CA VAL A 43 -5.691 4.553 -0.537 1.00 0.00 C ATOM 667 C VAL A 43 -4.405 4.702 -1.352 1.00 0.00 C ATOM 668 O VAL A 43 -3.344 4.243 -0.933 1.00 0.00 O ATOM 669 CB VAL A 43 -6.508 3.320 -0.929 1.00 0.00 C ATOM 670 CG1 VAL A 43 -7.875 3.326 -0.241 1.00 0.00 C ATOM 671 CG2 VAL A 43 -6.660 3.223 -2.448 1.00 0.00 C ATOM 0 H VAL A 43 -7.505 5.589 -0.709 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.401 4.417 0.505 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.966 2.438 -0.589 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -8.435 2.439 -0.537 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -7.738 3.325 0.840 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -8.427 4.219 -0.536 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.245 2.338 -2.699 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.169 4.112 -2.820 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.675 3.150 -2.908 1.00 0.00 H new ATOM 681 N THR A 44 -4.542 5.345 -2.502 1.00 0.00 N ATOM 682 CA THR A 44 -3.405 5.560 -3.380 1.00 0.00 C ATOM 683 C THR A 44 -2.395 6.503 -2.722 1.00 0.00 C ATOM 684 O THR A 44 -2.639 7.704 -2.615 1.00 0.00 O ATOM 685 CB THR A 44 -3.933 6.075 -4.720 1.00 0.00 C ATOM 686 OG1 THR A 44 -4.511 4.925 -5.331 1.00 0.00 O ATOM 687 CG2 THR A 44 -2.808 6.478 -5.677 1.00 0.00 C ATOM 0 H THR A 44 -5.424 5.724 -2.846 1.00 0.00 H new ATOM 0 HA THR A 44 -2.865 4.631 -3.563 1.00 0.00 H new ATOM 0 HB THR A 44 -4.587 6.929 -4.547 1.00 0.00 H new ATOM 0 HG1 THR A 44 -5.488 4.995 -5.302 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.237 6.836 -6.613 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.212 7.270 -5.224 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.173 5.615 -5.876 1.00 0.00 H new ATOM 695 N GLY A 45 -1.281 5.923 -2.299 1.00 0.00 N ATOM 696 CA GLY A 45 -0.233 6.696 -1.654 1.00 0.00 C ATOM 697 C GLY A 45 0.069 6.152 -0.256 1.00 0.00 C ATOM 698 O GLY A 45 1.145 6.393 0.289 1.00 0.00 O ATOM 0 H GLY A 45 -1.081 4.927 -2.390 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.671 6.668 -2.262 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.537 7.740 -1.584 1.00 0.00 H new ATOM 702 N CYS A 46 -0.901 5.428 0.284 1.00 0.00 N ATOM 703 CA CYS A 46 -0.752 4.848 1.608 1.00 0.00 C ATOM 704 C CYS A 46 -0.038 3.503 1.466 1.00 0.00 C ATOM 705 O CYS A 46 0.219 3.047 0.353 1.00 0.00 O ATOM 706 CB CYS A 46 -2.100 4.707 2.318 1.00 0.00 C ATOM 707 SG CYS A 46 -2.976 6.314 2.325 1.00 0.00 S ATOM 0 H CYS A 46 -1.792 5.230 -0.171 1.00 0.00 H new ATOM 0 HA CYS A 46 -0.154 5.511 2.233 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -2.708 3.955 1.816 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -1.947 4.362 3.341 1.00 0.00 H new ATOM 0 HG CYS A 46 -3.554 6.498 1.175 1.00 0.00 H new ATOM 713 N PHE A 47 0.262 2.905 2.609 1.00 0.00 N ATOM 714 CA PHE A 47 0.942 1.621 2.627 1.00 0.00 C ATOM 715 C PHE A 47 0.103 0.566 3.351 1.00 0.00 C ATOM 716 O PHE A 47 -0.535 0.861 4.361 1.00 0.00 O ATOM 717 CB PHE A 47 2.256 1.820 3.385 1.00 0.00 C ATOM 718 CG PHE A 47 3.334 2.549 2.581 1.00 0.00 C ATOM 719 CD1 PHE A 47 3.144 3.842 2.204 1.00 0.00 C ATOM 720 CD2 PHE A 47 4.482 1.904 2.242 1.00 0.00 C ATOM 721 CE1 PHE A 47 4.145 4.519 1.458 1.00 0.00 C ATOM 722 CE2 PHE A 47 5.483 2.580 1.496 1.00 0.00 C ATOM 723 CZ PHE A 47 5.293 3.874 1.119 1.00 0.00 C ATOM 0 H PHE A 47 0.047 3.286 3.530 1.00 0.00 H new ATOM 0 HA PHE A 47 1.110 1.275 1.607 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.056 2.382 4.297 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.640 0.846 3.688 1.00 0.00 H new ATOM 0 HD1 PHE A 47 2.232 4.354 2.472 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.632 0.877 2.540 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.994 5.546 1.160 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.395 2.068 1.228 1.00 0.00 H new ATOM 0 HZ PHE A 47 6.054 4.388 0.551 1.00 0.00 H new ATOM 733 N VAL A 48 0.131 -0.642 2.808 1.00 0.00 N ATOM 734 CA VAL A 48 -0.619 -1.742 3.390 1.00 0.00 C ATOM 735 C VAL A 48 0.288 -2.970 3.501 1.00 0.00 C ATOM 736 O VAL A 48 1.083 -3.241 2.602 1.00 0.00 O ATOM 737 CB VAL A 48 -1.884 -2.005 2.571 1.00 0.00 C ATOM 738 CG1 VAL A 48 -2.783 -0.768 2.539 1.00 0.00 C ATOM 739 CG2 VAL A 48 -1.534 -2.465 1.155 1.00 0.00 C ATOM 0 H VAL A 48 0.661 -0.883 1.971 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.948 -1.489 4.398 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.437 -2.809 3.057 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.675 -0.982 1.950 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.074 -0.503 3.556 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.242 0.064 2.088 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.451 -2.645 0.594 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.949 -1.693 0.656 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.952 -3.386 1.205 1.00 0.00 H new ATOM 749 N ARG A 49 0.139 -3.678 4.610 1.00 0.00 N ATOM 750 CA ARG A 49 0.934 -4.871 4.849 1.00 0.00 C ATOM 751 C ARG A 49 0.286 -6.084 4.180 1.00 0.00 C ATOM 752 O ARG A 49 -0.871 -6.403 4.451 1.00 0.00 O ATOM 753 CB ARG A 49 1.083 -5.142 6.348 1.00 0.00 C ATOM 754 CG ARG A 49 2.526 -5.510 6.698 1.00 0.00 C ATOM 755 CD ARG A 49 2.858 -5.118 8.139 1.00 0.00 C ATOM 756 NE ARG A 49 3.354 -6.298 8.883 1.00 0.00 N ATOM 757 CZ ARG A 49 4.423 -7.019 8.521 1.00 0.00 C ATOM 758 NH1 ARG A 49 5.115 -6.686 7.423 1.00 0.00 N ATOM 759 NH2 ARG A 49 4.800 -8.074 9.256 1.00 0.00 N ATOM 0 H ARG A 49 -0.520 -3.449 5.354 1.00 0.00 H new ATOM 0 HA ARG A 49 1.922 -4.702 4.422 1.00 0.00 H new ATOM 0 HB2 ARG A 49 0.782 -4.259 6.912 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.416 -5.952 6.643 1.00 0.00 H new ATOM 0 HG2 ARG A 49 2.674 -6.582 6.566 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.209 -5.007 6.014 1.00 0.00 H new ATOM 0 HD2 ARG A 49 3.611 -4.330 8.146 1.00 0.00 H new ATOM 0 HD3 ARG A 49 1.971 -4.715 8.629 1.00 0.00 H new ATOM 0 HE ARG A 49 2.850 -6.579 9.724 1.00 0.00 H new ATOM 0 HH11 ARG A 49 4.828 -5.883 6.863 1.00 0.00 H new ATOM 0 HH12 ARG A 49 5.929 -7.235 7.147 1.00 0.00 H new ATOM 0 HH21 ARG A 49 4.273 -8.328 10.091 1.00 0.00 H new ATOM 0 HH22 ARG A 49 5.614 -8.623 8.980 1.00 0.00 H new ATOM 773 N ILE A 50 1.060 -6.728 3.318 1.00 0.00 N ATOM 774 CA ILE A 50 0.575 -7.900 2.608 1.00 0.00 C ATOM 775 C ILE A 50 1.112 -9.161 3.288 1.00 0.00 C ATOM 776 O ILE A 50 2.219 -9.158 3.825 1.00 0.00 O ATOM 777 CB ILE A 50 0.924 -7.807 1.121 1.00 0.00 C ATOM 778 CG1 ILE A 50 -0.033 -8.655 0.280 1.00 0.00 C ATOM 779 CG2 ILE A 50 2.387 -8.181 0.877 1.00 0.00 C ATOM 780 CD1 ILE A 50 -1.488 -8.260 0.540 1.00 0.00 C ATOM 0 H ILE A 50 2.019 -6.461 3.095 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.513 -7.951 2.654 1.00 0.00 H new ATOM 0 HB ILE A 50 0.800 -6.771 0.804 1.00 0.00 H new ATOM 0 HG12 ILE A 50 0.198 -8.530 -0.778 1.00 0.00 H new ATOM 0 HG13 ILE A 50 0.109 -9.710 0.514 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.609 -8.107 -0.188 1.00 0.00 H new ATOM 0 HG22 ILE A 50 3.034 -7.500 1.431 1.00 0.00 H new ATOM 0 HG23 ILE A 50 2.562 -9.203 1.214 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.147 -8.878 -0.070 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.723 -8.410 1.594 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.632 -7.211 0.282 1.00 0.00 H new ATOM 792 N GLY A 51 0.302 -10.209 3.244 1.00 0.00 N ATOM 793 CA GLY A 51 0.682 -11.474 3.849 1.00 0.00 C ATOM 794 C GLY A 51 0.873 -12.556 2.783 1.00 0.00 C ATOM 795 O GLY A 51 0.074 -13.486 2.687 1.00 0.00 O ATOM 0 H GLY A 51 -0.616 -10.208 2.799 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.606 -11.348 4.414 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -0.085 -11.787 4.557 1.00 0.00 H new ATOM 799 N ILE A 52 1.937 -12.398 2.010 1.00 0.00 N ATOM 800 CA ILE A 52 2.244 -13.349 0.955 1.00 0.00 C ATOM 801 C ILE A 52 1.821 -14.751 1.400 1.00 0.00 C ATOM 802 O ILE A 52 1.329 -15.539 0.595 1.00 0.00 O ATOM 803 CB ILE A 52 3.717 -13.249 0.555 1.00 0.00 C ATOM 804 CG1 ILE A 52 4.612 -13.957 1.575 1.00 0.00 C ATOM 805 CG2 ILE A 52 4.131 -11.791 0.344 1.00 0.00 C ATOM 806 CD1 ILE A 52 4.810 -13.093 2.823 1.00 0.00 C ATOM 0 H ILE A 52 2.598 -11.625 2.093 1.00 0.00 H new ATOM 0 HA ILE A 52 1.677 -13.115 0.054 1.00 0.00 H new ATOM 0 HB ILE A 52 3.847 -13.762 -0.398 1.00 0.00 H new ATOM 0 HG12 ILE A 52 4.166 -14.911 1.856 1.00 0.00 H new ATOM 0 HG13 ILE A 52 5.579 -14.178 1.124 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.183 -11.749 0.060 1.00 0.00 H new ATOM 0 HG22 ILE A 52 3.524 -11.351 -0.447 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.982 -11.233 1.268 1.00 0.00 H new ATOM 0 HD11 ILE A 52 5.450 -13.619 3.532 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.279 -12.150 2.542 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.843 -12.894 3.285 1.00 0.00 H new ATOM 917 N VAL A 60 5.231 -14.882 7.454 1.00 0.00 N ATOM 918 CA VAL A 60 5.840 -14.205 6.322 1.00 0.00 C ATOM 919 C VAL A 60 4.972 -13.011 5.921 1.00 0.00 C ATOM 920 O VAL A 60 3.800 -13.175 5.586 1.00 0.00 O ATOM 921 CB VAL A 60 6.060 -15.196 5.177 1.00 0.00 C ATOM 922 CG1 VAL A 60 6.964 -14.595 4.098 1.00 0.00 C ATOM 923 CG2 VAL A 60 6.629 -16.517 5.696 1.00 0.00 C ATOM 0 HA VAL A 60 6.822 -13.817 6.591 1.00 0.00 H new ATOM 0 HB VAL A 60 5.091 -15.405 4.724 1.00 0.00 H new ATOM 0 HG11 VAL A 60 7.104 -15.320 3.296 1.00 0.00 H new ATOM 0 HG12 VAL A 60 6.501 -13.694 3.696 1.00 0.00 H new ATOM 0 HG13 VAL A 60 7.931 -14.343 4.533 1.00 0.00 H new ATOM 0 HG21 VAL A 60 6.776 -17.203 4.862 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.585 -16.334 6.187 1.00 0.00 H new ATOM 0 HG23 VAL A 60 5.933 -16.958 6.410 1.00 0.00 H new ATOM 933 N TYR A 61 5.581 -11.835 5.968 1.00 0.00 N ATOM 934 CA TYR A 61 4.879 -10.613 5.613 1.00 0.00 C ATOM 935 C TYR A 61 5.803 -9.645 4.872 1.00 0.00 C ATOM 936 O TYR A 61 7.019 -9.676 5.058 1.00 0.00 O ATOM 937 CB TYR A 61 4.448 -9.976 6.936 1.00 0.00 C ATOM 938 CG TYR A 61 3.195 -10.604 7.549 1.00 0.00 C ATOM 939 CD1 TYR A 61 1.951 -10.315 7.026 1.00 0.00 C ATOM 940 CD2 TYR A 61 3.308 -11.459 8.626 1.00 0.00 C ATOM 941 CE1 TYR A 61 0.771 -10.906 7.603 1.00 0.00 C ATOM 942 CE2 TYR A 61 2.128 -12.050 9.204 1.00 0.00 C ATOM 943 CZ TYR A 61 0.918 -11.745 8.664 1.00 0.00 C ATOM 944 OH TYR A 61 -0.196 -12.303 9.209 1.00 0.00 O ATOM 0 H TYR A 61 6.553 -11.702 6.247 1.00 0.00 H new ATOM 0 HA TYR A 61 4.035 -10.831 4.959 1.00 0.00 H new ATOM 0 HB2 TYR A 61 5.268 -10.055 7.650 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.267 -8.913 6.774 1.00 0.00 H new ATOM 0 HD1 TYR A 61 1.862 -9.645 6.183 1.00 0.00 H new ATOM 0 HD2 TYR A 61 4.281 -11.685 9.036 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -0.208 -10.688 7.203 1.00 0.00 H new ATOM 0 HE2 TYR A 61 2.203 -12.720 10.047 1.00 0.00 H new ATOM 0 HH TYR A 61 0.060 -12.880 9.958 1.00 0.00 H new ATOM 954 N ARG A 62 5.191 -8.808 4.048 1.00 0.00 N ATOM 955 CA ARG A 62 5.944 -7.832 3.278 1.00 0.00 C ATOM 956 C ARG A 62 5.169 -6.516 3.187 1.00 0.00 C ATOM 957 O ARG A 62 3.939 -6.512 3.210 1.00 0.00 O ATOM 958 CB ARG A 62 6.229 -8.346 1.865 1.00 0.00 C ATOM 959 CG ARG A 62 6.844 -9.746 1.905 1.00 0.00 C ATOM 960 CD ARG A 62 7.946 -9.891 0.854 1.00 0.00 C ATOM 961 NE ARG A 62 8.925 -8.790 0.991 1.00 0.00 N ATOM 962 CZ ARG A 62 10.028 -8.668 0.240 1.00 0.00 C ATOM 963 NH1 ARG A 62 10.300 -9.578 -0.705 1.00 0.00 N ATOM 964 NH2 ARG A 62 10.860 -7.635 0.435 1.00 0.00 N ATOM 0 H ARG A 62 4.183 -8.785 3.896 1.00 0.00 H new ATOM 0 HA ARG A 62 6.892 -7.666 3.790 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.304 -8.367 1.288 1.00 0.00 H new ATOM 0 HB3 ARG A 62 6.907 -7.662 1.355 1.00 0.00 H new ATOM 0 HG2 ARG A 62 7.254 -9.939 2.896 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.069 -10.493 1.730 1.00 0.00 H new ATOM 0 HD2 ARG A 62 8.448 -10.851 0.972 1.00 0.00 H new ATOM 0 HD3 ARG A 62 7.511 -9.879 -0.145 1.00 0.00 H new ATOM 0 HE ARG A 62 8.749 -8.080 1.701 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.667 -10.364 -0.853 1.00 0.00 H new ATOM 0 HH12 ARG A 62 11.140 -9.485 -1.276 1.00 0.00 H new ATOM 0 HH21 ARG A 62 10.653 -6.942 1.155 1.00 0.00 H new ATOM 0 HH22 ARG A 62 11.700 -7.542 -0.136 1.00 0.00 H new ATOM 978 N VAL A 63 5.921 -5.429 3.086 1.00 0.00 N ATOM 979 CA VAL A 63 5.320 -4.110 2.991 1.00 0.00 C ATOM 980 C VAL A 63 5.090 -3.763 1.519 1.00 0.00 C ATOM 981 O VAL A 63 5.883 -4.140 0.658 1.00 0.00 O ATOM 982 CB VAL A 63 6.193 -3.084 3.718 1.00 0.00 C ATOM 983 CG1 VAL A 63 5.577 -1.686 3.640 1.00 0.00 C ATOM 984 CG2 VAL A 63 6.431 -3.498 5.171 1.00 0.00 C ATOM 0 H VAL A 63 6.941 -5.435 3.068 1.00 0.00 H new ATOM 0 HA VAL A 63 4.348 -4.097 3.483 1.00 0.00 H new ATOM 0 HB VAL A 63 7.160 -3.052 3.216 1.00 0.00 H new ATOM 0 HG11 VAL A 63 6.217 -0.977 4.164 1.00 0.00 H new ATOM 0 HG12 VAL A 63 5.483 -1.387 2.596 1.00 0.00 H new ATOM 0 HG13 VAL A 63 4.591 -1.697 4.104 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.054 -2.752 5.665 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.475 -3.573 5.689 1.00 0.00 H new ATOM 0 HG23 VAL A 63 6.934 -4.465 5.196 1.00 0.00 H new ATOM 994 N ALA A 64 4.002 -3.048 1.276 1.00 0.00 N ATOM 995 CA ALA A 64 3.657 -2.646 -0.078 1.00 0.00 C ATOM 996 C ALA A 64 2.861 -1.341 -0.030 1.00 0.00 C ATOM 997 O ALA A 64 2.085 -1.116 0.898 1.00 0.00 O ATOM 998 CB ALA A 64 2.887 -3.775 -0.765 1.00 0.00 C ATOM 0 H ALA A 64 3.347 -2.736 1.993 1.00 0.00 H new ATOM 0 HA ALA A 64 4.557 -2.462 -0.665 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.628 -3.474 -1.780 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.508 -4.670 -0.799 1.00 0.00 H new ATOM 0 HB3 ALA A 64 1.976 -3.987 -0.206 1.00 0.00 H new ATOM 1004 N GLU A 65 3.079 -0.514 -1.042 1.00 0.00 N ATOM 1005 CA GLU A 65 2.391 0.763 -1.128 1.00 0.00 C ATOM 1006 C GLU A 65 1.363 0.737 -2.260 1.00 0.00 C ATOM 1007 O GLU A 65 1.670 0.314 -3.373 1.00 0.00 O ATOM 1008 CB GLU A 65 3.386 1.910 -1.317 1.00 0.00 C ATOM 1009 CG GLU A 65 2.658 3.244 -1.495 1.00 0.00 C ATOM 1010 CD GLU A 65 3.611 4.324 -2.010 1.00 0.00 C ATOM 1011 OE1 GLU A 65 4.215 4.086 -3.078 1.00 0.00 O ATOM 1012 OE2 GLU A 65 3.713 5.364 -1.325 1.00 0.00 O ATOM 0 H GLU A 65 3.723 -0.704 -1.810 1.00 0.00 H new ATOM 0 HA GLU A 65 1.864 0.934 -0.189 1.00 0.00 H new ATOM 0 HB2 GLU A 65 4.050 1.966 -0.454 1.00 0.00 H new ATOM 0 HB3 GLU A 65 4.011 1.714 -2.188 1.00 0.00 H new ATOM 0 HG2 GLU A 65 1.831 3.121 -2.194 1.00 0.00 H new ATOM 0 HG3 GLU A 65 2.228 3.557 -0.544 1.00 0.00 H new ATOM 1019 N ILE A 66 0.162 1.195 -1.937 1.00 0.00 N ATOM 1020 CA ILE A 66 -0.913 1.230 -2.913 1.00 0.00 C ATOM 1021 C ILE A 66 -0.553 2.213 -4.028 1.00 0.00 C ATOM 1022 O ILE A 66 -0.139 3.340 -3.757 1.00 0.00 O ATOM 1023 CB ILE A 66 -2.247 1.538 -2.229 1.00 0.00 C ATOM 1024 CG1 ILE A 66 -2.530 0.539 -1.104 1.00 0.00 C ATOM 1025 CG2 ILE A 66 -3.387 1.590 -3.249 1.00 0.00 C ATOM 1026 CD1 ILE A 66 -3.577 1.089 -0.134 1.00 0.00 C ATOM 0 H ILE A 66 -0.090 1.545 -1.013 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.037 0.252 -3.378 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.177 2.526 -1.773 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.880 -0.402 -1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.608 0.322 -0.565 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -4.324 1.810 -2.737 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.183 2.369 -3.983 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.467 0.627 -3.754 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.760 0.360 0.656 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.213 2.017 0.306 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.505 1.282 -0.672 1.00 0.00 H new ATOM 1038 N THR A 67 -0.723 1.752 -5.258 1.00 0.00 N ATOM 1039 CA THR A 67 -0.421 2.577 -6.415 1.00 0.00 C ATOM 1040 C THR A 67 -1.706 2.941 -7.161 1.00 0.00 C ATOM 1041 O THR A 67 -1.683 3.750 -8.087 1.00 0.00 O ATOM 1042 CB THR A 67 0.591 1.824 -7.281 1.00 0.00 C ATOM 1043 OG1 THR A 67 -0.203 0.898 -8.018 1.00 0.00 O ATOM 1044 CG2 THR A 67 1.525 0.939 -6.454 1.00 0.00 C ATOM 0 H THR A 67 -1.066 0.817 -5.479 1.00 0.00 H new ATOM 0 HA THR A 67 0.025 3.526 -6.118 1.00 0.00 H new ATOM 0 HB THR A 67 1.182 2.539 -7.854 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.374 0.369 -8.607 1.00 0.00 H new ATOM 0 HG21 THR A 67 2.223 0.427 -7.117 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.081 1.556 -5.748 1.00 0.00 H new ATOM 0 HG23 THR A 67 0.938 0.202 -5.907 1.00 0.00 H new ATOM 1052 N GLY A 68 -2.798 2.327 -6.729 1.00 0.00 N ATOM 1053 CA GLY A 68 -4.090 2.576 -7.344 1.00 0.00 C ATOM 1054 C GLY A 68 -5.097 1.489 -6.964 1.00 0.00 C ATOM 1055 O GLY A 68 -4.825 0.661 -6.096 1.00 0.00 O ATOM 0 H GLY A 68 -2.814 1.657 -5.960 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -4.465 3.550 -7.029 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.980 2.612 -8.428 1.00 0.00 H new ATOM 1059 N VAL A 69 -6.241 1.526 -7.632 1.00 0.00 N ATOM 1060 CA VAL A 69 -7.290 0.555 -7.375 1.00 0.00 C ATOM 1061 C VAL A 69 -7.807 0.005 -8.706 1.00 0.00 C ATOM 1062 O VAL A 69 -8.266 0.764 -9.559 1.00 0.00 O ATOM 1063 CB VAL A 69 -8.391 1.187 -6.521 1.00 0.00 C ATOM 1064 CG1 VAL A 69 -9.601 0.257 -6.411 1.00 0.00 C ATOM 1065 CG2 VAL A 69 -7.862 1.565 -5.136 1.00 0.00 C ATOM 0 H VAL A 69 -6.464 2.214 -8.351 1.00 0.00 H new ATOM 0 HA VAL A 69 -6.899 -0.288 -6.805 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.716 2.102 -7.016 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -10.369 0.730 -5.799 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.000 0.060 -7.406 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -9.297 -0.683 -5.950 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -8.665 2.012 -4.550 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.497 0.671 -4.630 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -7.047 2.281 -5.241 1.00 0.00 H new ATOM 1075 N VAL A 70 -7.716 -1.310 -8.842 1.00 0.00 N ATOM 1076 CA VAL A 70 -8.169 -1.970 -10.055 1.00 0.00 C ATOM 1077 C VAL A 70 -9.572 -2.538 -9.828 1.00 0.00 C ATOM 1078 O VAL A 70 -10.130 -2.405 -8.740 1.00 0.00 O ATOM 1079 CB VAL A 70 -7.155 -3.033 -10.482 1.00 0.00 C ATOM 1080 CG1 VAL A 70 -5.848 -2.388 -10.947 1.00 0.00 C ATOM 1081 CG2 VAL A 70 -6.902 -4.034 -9.353 1.00 0.00 C ATOM 0 H VAL A 70 -7.335 -1.936 -8.132 1.00 0.00 H new ATOM 0 HA VAL A 70 -8.236 -1.256 -10.876 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.577 -3.580 -11.325 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.144 -3.165 -11.245 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -6.047 -1.734 -11.796 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -5.420 -1.804 -10.132 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -6.178 -4.779 -9.683 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -6.511 -3.509 -8.482 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -7.837 -4.529 -9.089 1.00 0.00 H new ATOM 1091 N GLU A 71 -10.100 -3.159 -10.872 1.00 0.00 N ATOM 1092 CA GLU A 71 -11.427 -3.748 -10.800 1.00 0.00 C ATOM 1093 C GLU A 71 -11.396 -5.189 -11.313 1.00 0.00 C ATOM 1094 O GLU A 71 -11.087 -5.430 -12.479 1.00 0.00 O ATOM 1095 CB GLU A 71 -12.442 -2.910 -11.580 1.00 0.00 C ATOM 1096 CG GLU A 71 -12.495 -3.338 -13.047 1.00 0.00 C ATOM 1097 CD GLU A 71 -13.388 -2.399 -13.861 1.00 0.00 C ATOM 1098 OE1 GLU A 71 -14.517 -2.141 -13.391 1.00 0.00 O ATOM 1099 OE2 GLU A 71 -12.921 -1.961 -14.934 1.00 0.00 O ATOM 0 H GLU A 71 -9.633 -3.267 -11.773 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.742 -3.761 -9.756 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.429 -3.017 -11.130 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.175 -1.855 -11.515 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.488 -3.341 -13.465 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.873 -4.358 -13.118 1.00 0.00 H new ATOM 1106 N THR A 72 -11.721 -6.109 -10.417 1.00 0.00 N ATOM 1107 CA THR A 72 -11.735 -7.520 -10.764 1.00 0.00 C ATOM 1108 C THR A 72 -13.085 -7.906 -11.372 1.00 0.00 C ATOM 1109 O THR A 72 -14.008 -7.094 -11.410 1.00 0.00 O ATOM 1110 CB THR A 72 -11.383 -8.320 -9.508 1.00 0.00 C ATOM 1111 OG1 THR A 72 -12.323 -7.871 -8.536 1.00 0.00 O ATOM 1112 CG2 THR A 72 -10.025 -7.924 -8.924 1.00 0.00 C ATOM 0 H THR A 72 -11.977 -5.905 -9.451 1.00 0.00 H new ATOM 0 HA THR A 72 -10.992 -7.746 -11.529 1.00 0.00 H new ATOM 0 HB THR A 72 -11.381 -9.384 -9.744 1.00 0.00 H new ATOM 0 HG1 THR A 72 -12.966 -8.586 -8.348 1.00 0.00 H new ATOM 0 HG21 THR A 72 -9.823 -8.521 -8.035 1.00 0.00 H new ATOM 0 HG22 THR A 72 -9.245 -8.101 -9.664 1.00 0.00 H new ATOM 0 HG23 THR A 72 -10.038 -6.867 -8.656 1.00 0.00 H new ATOM 1120 N ALA A 73 -13.157 -9.147 -11.832 1.00 0.00 N ATOM 1121 CA ALA A 73 -14.379 -9.651 -12.435 1.00 0.00 C ATOM 1122 C ALA A 73 -15.173 -10.436 -11.390 1.00 0.00 C ATOM 1123 O ALA A 73 -16.403 -10.430 -11.406 1.00 0.00 O ATOM 1124 CB ALA A 73 -14.031 -10.499 -13.661 1.00 0.00 C ATOM 0 H ALA A 73 -12.389 -9.818 -11.799 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.007 -8.827 -12.775 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.947 -10.877 -14.114 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.494 -9.887 -14.386 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.403 -11.337 -13.358 1.00 0.00 H new ATOM 1130 N LYS A 74 -14.438 -11.094 -10.506 1.00 0.00 N ATOM 1131 CA LYS A 74 -15.058 -11.883 -9.455 1.00 0.00 C ATOM 1132 C LYS A 74 -15.116 -11.056 -8.169 1.00 0.00 C ATOM 1133 O LYS A 74 -14.313 -10.144 -7.976 1.00 0.00 O ATOM 1134 CB LYS A 74 -14.336 -13.222 -9.293 1.00 0.00 C ATOM 1135 CG LYS A 74 -14.654 -14.161 -10.458 1.00 0.00 C ATOM 1136 CD LYS A 74 -15.082 -15.539 -9.950 1.00 0.00 C ATOM 1137 CE LYS A 74 -15.806 -16.326 -11.044 1.00 0.00 C ATOM 1138 NZ LYS A 74 -14.926 -17.383 -11.591 1.00 0.00 N ATOM 0 H LYS A 74 -13.418 -11.097 -10.496 1.00 0.00 H new ATOM 0 HA LYS A 74 -16.085 -12.132 -9.721 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -13.260 -13.055 -9.239 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -14.634 -13.688 -8.354 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -15.448 -13.732 -11.069 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -13.778 -14.262 -11.098 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -14.206 -16.095 -9.616 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -15.736 -15.425 -9.086 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -16.713 -16.774 -10.638 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -16.113 -15.651 -11.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -15.433 -17.908 -12.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -14.072 -16.949 -11.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -14.654 -18.037 -10.829 1.00 0.00 H new ATOM 1152 N VAL A 75 -16.074 -11.403 -7.323 1.00 0.00 N ATOM 1153 CA VAL A 75 -16.248 -10.704 -6.061 1.00 0.00 C ATOM 1154 C VAL A 75 -15.870 -11.638 -4.909 1.00 0.00 C ATOM 1155 O VAL A 75 -16.121 -12.840 -4.973 1.00 0.00 O ATOM 1156 CB VAL A 75 -17.676 -10.168 -5.952 1.00 0.00 C ATOM 1157 CG1 VAL A 75 -18.033 -9.848 -4.498 1.00 0.00 C ATOM 1158 CG2 VAL A 75 -17.872 -8.942 -6.846 1.00 0.00 C ATOM 0 H VAL A 75 -16.738 -12.159 -7.487 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.586 -9.839 -6.009 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.353 -10.948 -6.300 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -19.054 -9.469 -4.449 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.953 -10.753 -3.896 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -17.347 -9.094 -4.112 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.896 -8.581 -6.749 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -17.180 -8.156 -6.543 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.680 -9.214 -7.884 1.00 0.00 H new ATOM 1168 N TYR A 76 -15.273 -11.049 -3.884 1.00 0.00 N ATOM 1169 CA TYR A 76 -14.858 -11.813 -2.720 1.00 0.00 C ATOM 1170 C TYR A 76 -15.306 -11.129 -1.426 1.00 0.00 C ATOM 1171 O TYR A 76 -15.584 -9.931 -1.417 1.00 0.00 O ATOM 1172 CB TYR A 76 -13.329 -11.847 -2.760 1.00 0.00 C ATOM 1173 CG TYR A 76 -12.676 -10.464 -2.770 1.00 0.00 C ATOM 1174 CD1 TYR A 76 -12.384 -9.830 -1.579 1.00 0.00 C ATOM 1175 CD2 TYR A 76 -12.377 -9.849 -3.969 1.00 0.00 C ATOM 1176 CE1 TYR A 76 -11.770 -8.528 -1.588 1.00 0.00 C ATOM 1177 CE2 TYR A 76 -11.763 -8.547 -3.978 1.00 0.00 C ATOM 1178 CZ TYR A 76 -11.489 -7.951 -2.787 1.00 0.00 C ATOM 1179 OH TYR A 76 -10.908 -6.721 -2.795 1.00 0.00 O ATOM 0 H TYR A 76 -15.067 -10.051 -3.835 1.00 0.00 H new ATOM 0 HA TYR A 76 -15.299 -12.809 -2.739 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -12.965 -12.403 -1.896 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -13.011 -12.394 -3.648 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -12.616 -10.311 -0.640 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -12.604 -10.345 -4.901 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -11.538 -8.021 -0.663 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -11.525 -8.055 -4.910 1.00 0.00 H new ATOM 0 HH TYR A 76 -10.779 -6.426 -3.721 1.00 0.00 H new ATOM 1189 N GLN A 77 -15.364 -11.921 -0.365 1.00 0.00 N ATOM 1190 CA GLN A 77 -15.774 -11.407 0.930 1.00 0.00 C ATOM 1191 C GLN A 77 -14.624 -10.638 1.585 1.00 0.00 C ATOM 1192 O GLN A 77 -13.456 -10.940 1.345 1.00 0.00 O ATOM 1193 CB GLN A 77 -16.266 -12.536 1.838 1.00 0.00 C ATOM 1194 CG GLN A 77 -16.823 -11.982 3.150 1.00 0.00 C ATOM 1195 CD GLN A 77 -17.851 -12.939 3.757 1.00 0.00 C ATOM 1196 OE1 GLN A 77 -17.554 -14.068 4.111 1.00 0.00 O ATOM 1197 NE2 GLN A 77 -19.075 -12.426 3.856 1.00 0.00 N ATOM 0 H GLN A 77 -15.134 -12.915 -0.376 1.00 0.00 H new ATOM 0 HA GLN A 77 -16.606 -10.719 0.779 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -17.038 -13.110 1.325 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -15.445 -13.222 2.048 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -16.008 -11.822 3.856 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -17.285 -11.011 2.972 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -19.256 -11.473 3.540 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -19.832 -12.986 4.247 1.00 0.00 H new ATOM 1206 N LEU A 78 -14.996 -9.661 2.398 1.00 0.00 N ATOM 1207 CA LEU A 78 -14.010 -8.847 3.089 1.00 0.00 C ATOM 1208 C LEU A 78 -14.581 -8.393 4.434 1.00 0.00 C ATOM 1209 O LEU A 78 -15.211 -7.340 4.521 1.00 0.00 O ATOM 1210 CB LEU A 78 -13.547 -7.694 2.197 1.00 0.00 C ATOM 1211 CG LEU A 78 -12.790 -6.564 2.899 1.00 0.00 C ATOM 1212 CD1 LEU A 78 -11.354 -6.982 3.219 1.00 0.00 C ATOM 1213 CD2 LEU A 78 -12.843 -5.275 2.077 1.00 0.00 C ATOM 0 H LEU A 78 -15.966 -9.414 2.594 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.116 -9.433 3.303 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -12.907 -8.101 1.414 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.421 -7.268 1.705 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.285 -6.360 3.849 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.839 -6.161 3.717 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.366 -7.854 3.874 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.833 -7.230 2.294 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.298 -4.488 2.598 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.388 -5.447 1.101 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -13.881 -4.970 1.945 1.00 0.00 H new ATOM 1225 N GLY A 79 -14.342 -9.211 5.449 1.00 0.00 N ATOM 1226 CA GLY A 79 -14.825 -8.906 6.785 1.00 0.00 C ATOM 1227 C GLY A 79 -16.354 -8.930 6.834 1.00 0.00 C ATOM 1228 O GLY A 79 -16.955 -8.440 7.788 1.00 0.00 O ATOM 0 H GLY A 79 -13.820 -10.084 5.373 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -14.423 -9.629 7.495 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.463 -7.924 7.091 1.00 0.00 H new ATOM 1232 N GLY A 80 -16.938 -9.503 5.792 1.00 0.00 N ATOM 1233 CA GLY A 80 -18.386 -9.596 5.704 1.00 0.00 C ATOM 1234 C GLY A 80 -18.897 -8.980 4.400 1.00 0.00 C ATOM 1235 O GLY A 80 -19.801 -9.521 3.766 1.00 0.00 O ATOM 0 H GLY A 80 -16.435 -9.907 5.002 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -18.691 -10.641 5.761 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -18.839 -9.085 6.554 1.00 0.00 H new ATOM 1239 N THR A 81 -18.295 -7.856 4.039 1.00 0.00 N ATOM 1240 CA THR A 81 -18.678 -7.160 2.822 1.00 0.00 C ATOM 1241 C THR A 81 -17.960 -7.764 1.614 1.00 0.00 C ATOM 1242 O THR A 81 -16.786 -8.122 1.700 1.00 0.00 O ATOM 1243 CB THR A 81 -18.390 -5.671 3.019 1.00 0.00 C ATOM 1244 OG1 THR A 81 -19.044 -5.042 1.920 1.00 0.00 O ATOM 1245 CG2 THR A 81 -16.912 -5.329 2.817 1.00 0.00 C ATOM 0 H THR A 81 -17.545 -7.410 4.568 1.00 0.00 H new ATOM 0 HA THR A 81 -19.743 -7.275 2.618 1.00 0.00 H new ATOM 0 HB THR A 81 -18.699 -5.371 4.020 1.00 0.00 H new ATOM 0 HG1 THR A 81 -18.910 -4.073 1.971 1.00 0.00 H new ATOM 0 HG21 THR A 81 -16.762 -4.260 2.968 1.00 0.00 H new ATOM 0 HG22 THR A 81 -16.308 -5.885 3.534 1.00 0.00 H new ATOM 0 HG23 THR A 81 -16.611 -5.598 1.804 1.00 0.00 H new ATOM 1253 N ARG A 82 -18.694 -7.858 0.515 1.00 0.00 N ATOM 1254 CA ARG A 82 -18.142 -8.413 -0.709 1.00 0.00 C ATOM 1255 C ARG A 82 -17.776 -7.290 -1.682 1.00 0.00 C ATOM 1256 O ARG A 82 -18.653 -6.586 -2.181 1.00 0.00 O ATOM 1257 CB ARG A 82 -19.137 -9.359 -1.383 1.00 0.00 C ATOM 1258 CG ARG A 82 -18.834 -10.817 -1.029 1.00 0.00 C ATOM 1259 CD ARG A 82 -19.475 -11.771 -2.038 1.00 0.00 C ATOM 1260 NE ARG A 82 -20.207 -12.843 -1.326 1.00 0.00 N ATOM 1261 CZ ARG A 82 -20.737 -13.917 -1.927 1.00 0.00 C ATOM 1262 NH1 ARG A 82 -20.621 -14.068 -3.253 1.00 0.00 N ATOM 1263 NH2 ARG A 82 -21.384 -14.839 -1.201 1.00 0.00 N ATOM 0 H ARG A 82 -19.667 -7.559 0.447 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.247 -8.976 -0.444 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -20.151 -9.108 -1.071 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -19.094 -9.227 -2.464 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -17.755 -10.974 -1.010 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -19.206 -11.037 -0.028 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -20.158 -11.222 -2.687 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.707 -12.206 -2.678 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.315 -12.759 -0.315 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -20.129 -13.365 -3.805 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -21.024 -14.886 -3.710 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -21.473 -14.723 -0.192 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -21.788 -15.657 -1.658 1.00 0.00 H new ATOM 1277 N THR A 83 -16.480 -7.158 -1.924 1.00 0.00 N ATOM 1278 CA THR A 83 -15.988 -6.133 -2.829 1.00 0.00 C ATOM 1279 C THR A 83 -15.392 -6.772 -4.085 1.00 0.00 C ATOM 1280 O THR A 83 -15.112 -7.970 -4.103 1.00 0.00 O ATOM 1281 CB THR A 83 -14.994 -5.261 -2.060 1.00 0.00 C ATOM 1282 OG1 THR A 83 -14.771 -4.147 -2.920 1.00 0.00 O ATOM 1283 CG2 THR A 83 -13.617 -5.916 -1.934 1.00 0.00 C ATOM 0 H THR A 83 -15.756 -7.744 -1.509 1.00 0.00 H new ATOM 0 HA THR A 83 -16.798 -5.494 -3.181 1.00 0.00 H new ATOM 0 HB THR A 83 -15.389 -5.051 -1.066 1.00 0.00 H new ATOM 0 HG1 THR A 83 -14.138 -3.529 -2.498 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.949 -5.256 -1.380 1.00 0.00 H new ATOM 0 HG22 THR A 83 -13.712 -6.864 -1.404 1.00 0.00 H new ATOM 0 HG23 THR A 83 -13.207 -6.095 -2.928 1.00 0.00 H new ATOM 1291 N ASN A 84 -15.215 -5.944 -5.104 1.00 0.00 N ATOM 1292 CA ASN A 84 -14.657 -6.413 -6.361 1.00 0.00 C ATOM 1293 C ASN A 84 -13.557 -5.452 -6.815 1.00 0.00 C ATOM 1294 O ASN A 84 -13.426 -5.171 -8.006 1.00 0.00 O ATOM 1295 CB ASN A 84 -15.726 -6.460 -7.455 1.00 0.00 C ATOM 1296 CG ASN A 84 -15.998 -5.062 -8.015 1.00 0.00 C ATOM 1297 OD1 ASN A 84 -16.454 -4.166 -7.324 1.00 0.00 O ATOM 1298 ND2 ASN A 84 -15.694 -4.927 -9.302 1.00 0.00 N ATOM 0 H ASN A 84 -15.448 -4.951 -5.085 1.00 0.00 H new ATOM 0 HA ASN A 84 -14.261 -7.416 -6.201 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -15.401 -7.121 -8.259 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -16.647 -6.880 -7.051 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -15.839 -4.032 -9.769 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -15.315 -5.718 -9.822 1.00 0.00 H new ATOM 1305 N LYS A 85 -12.794 -4.975 -5.843 1.00 0.00 N ATOM 1306 CA LYS A 85 -11.709 -4.052 -6.129 1.00 0.00 C ATOM 1307 C LYS A 85 -10.388 -4.660 -5.652 1.00 0.00 C ATOM 1308 O LYS A 85 -10.307 -5.185 -4.542 1.00 0.00 O ATOM 1309 CB LYS A 85 -12.004 -2.676 -5.528 1.00 0.00 C ATOM 1310 CG LYS A 85 -13.296 -2.092 -6.104 1.00 0.00 C ATOM 1311 CD LYS A 85 -13.305 -0.566 -5.995 1.00 0.00 C ATOM 1312 CE LYS A 85 -13.600 -0.121 -4.561 1.00 0.00 C ATOM 1313 NZ LYS A 85 -14.954 -0.555 -4.152 1.00 0.00 N ATOM 0 H LYS A 85 -12.905 -5.210 -4.857 1.00 0.00 H new ATOM 0 HA LYS A 85 -11.618 -3.893 -7.203 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -12.090 -2.759 -4.445 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -11.173 -2.001 -5.731 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -13.398 -2.386 -7.149 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -14.154 -2.503 -5.572 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -12.340 -0.169 -6.312 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -14.056 -0.154 -6.669 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -12.857 -0.541 -3.883 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -13.522 0.964 -4.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -15.287 0.040 -3.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -15.606 -0.463 -4.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -14.922 -1.548 -3.844 1.00 0.00 H new ATOM 1327 N GLY A 86 -9.386 -4.569 -6.514 1.00 0.00 N ATOM 1328 CA GLY A 86 -8.073 -5.104 -6.194 1.00 0.00 C ATOM 1329 C GLY A 86 -7.099 -3.983 -5.827 1.00 0.00 C ATOM 1330 O GLY A 86 -6.903 -3.047 -6.601 1.00 0.00 O ATOM 0 H GLY A 86 -9.457 -4.133 -7.433 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -8.155 -5.806 -5.364 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.686 -5.662 -7.047 1.00 0.00 H new ATOM 1334 N LEU A 87 -6.514 -4.115 -4.646 1.00 0.00 N ATOM 1335 CA LEU A 87 -5.565 -3.124 -4.166 1.00 0.00 C ATOM 1336 C LEU A 87 -4.229 -3.313 -4.888 1.00 0.00 C ATOM 1337 O LEU A 87 -3.545 -4.314 -4.683 1.00 0.00 O ATOM 1338 CB LEU A 87 -5.453 -3.184 -2.641 1.00 0.00 C ATOM 1339 CG LEU A 87 -6.245 -2.126 -1.869 1.00 0.00 C ATOM 1340 CD1 LEU A 87 -5.859 -2.125 -0.389 1.00 0.00 C ATOM 1341 CD2 LEU A 87 -6.081 -0.745 -2.506 1.00 0.00 C ATOM 0 H LEU A 87 -6.678 -4.893 -4.007 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.915 -2.118 -4.398 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.783 -4.169 -2.311 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.401 -3.092 -2.370 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.303 -2.382 -1.925 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.436 -1.364 0.137 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.070 -3.103 0.043 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.796 -1.906 -0.290 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.654 -0.012 -1.938 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.028 -0.465 -2.501 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.445 -0.773 -3.533 1.00 0.00 H new ATOM 1353 N GLN A 88 -3.899 -2.334 -5.718 1.00 0.00 N ATOM 1354 CA GLN A 88 -2.658 -2.380 -6.472 1.00 0.00 C ATOM 1355 C GLN A 88 -1.474 -2.036 -5.566 1.00 0.00 C ATOM 1356 O GLN A 88 -1.318 -0.888 -5.151 1.00 0.00 O ATOM 1357 CB GLN A 88 -2.715 -1.442 -7.680 1.00 0.00 C ATOM 1358 CG GLN A 88 -2.378 -2.190 -8.971 1.00 0.00 C ATOM 1359 CD GLN A 88 -2.311 -1.229 -10.160 1.00 0.00 C ATOM 1360 OE1 GLN A 88 -2.796 -0.110 -10.115 1.00 0.00 O ATOM 1361 NE2 GLN A 88 -1.684 -1.726 -11.222 1.00 0.00 N ATOM 0 H GLN A 88 -4.469 -1.505 -5.885 1.00 0.00 H new ATOM 0 HA GLN A 88 -2.521 -3.394 -6.847 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.710 -1.004 -7.758 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -2.015 -0.619 -7.539 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -1.423 -2.703 -8.859 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -3.131 -2.955 -9.159 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -1.301 -2.671 -11.192 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -1.586 -1.162 -12.066 1.00 0.00 H new ATOM 1370 N LEU A 89 -0.670 -3.051 -5.286 1.00 0.00 N ATOM 1371 CA LEU A 89 0.496 -2.870 -4.436 1.00 0.00 C ATOM 1372 C LEU A 89 1.764 -3.087 -5.265 1.00 0.00 C ATOM 1373 O LEU A 89 1.939 -4.142 -5.872 1.00 0.00 O ATOM 1374 CB LEU A 89 0.405 -3.771 -3.203 1.00 0.00 C ATOM 1375 CG LEU A 89 -0.954 -3.813 -2.502 1.00 0.00 C ATOM 1376 CD1 LEU A 89 -0.876 -4.616 -1.202 1.00 0.00 C ATOM 1377 CD2 LEU A 89 -1.496 -2.401 -2.271 1.00 0.00 C ATOM 0 H LEU A 89 -0.802 -4.001 -5.632 1.00 0.00 H new ATOM 0 HA LEU A 89 0.535 -1.850 -4.054 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.670 -4.786 -3.499 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.154 -3.443 -2.482 1.00 0.00 H new ATOM 0 HG LEU A 89 -1.659 -4.326 -3.156 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.855 -4.630 -0.724 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.565 -5.637 -1.423 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.151 -4.154 -0.532 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.463 -2.460 -1.771 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -0.799 -1.841 -1.648 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -1.613 -1.895 -3.229 1.00 0.00 H new ATOM 1389 N ARG A 90 2.615 -2.071 -5.262 1.00 0.00 N ATOM 1390 CA ARG A 90 3.861 -2.138 -6.006 1.00 0.00 C ATOM 1391 C ARG A 90 5.045 -2.275 -5.046 1.00 0.00 C ATOM 1392 O ARG A 90 5.302 -1.383 -4.240 1.00 0.00 O ATOM 1393 CB ARG A 90 4.055 -0.889 -6.868 1.00 0.00 C ATOM 1394 CG ARG A 90 5.307 -1.014 -7.740 1.00 0.00 C ATOM 1395 CD ARG A 90 5.951 0.354 -7.973 1.00 0.00 C ATOM 1396 NE ARG A 90 5.328 1.014 -9.142 1.00 0.00 N ATOM 1397 CZ ARG A 90 5.775 2.153 -9.689 1.00 0.00 C ATOM 1398 NH1 ARG A 90 6.851 2.765 -9.176 1.00 0.00 N ATOM 1399 NH2 ARG A 90 5.146 2.680 -10.748 1.00 0.00 N ATOM 0 H ARG A 90 2.466 -1.198 -4.756 1.00 0.00 H new ATOM 0 HA ARG A 90 3.813 -3.011 -6.657 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.180 -0.740 -7.501 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.139 -0.011 -6.228 1.00 0.00 H new ATOM 0 HG2 ARG A 90 6.024 -1.680 -7.260 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.044 -1.464 -8.697 1.00 0.00 H new ATOM 0 HD2 ARG A 90 5.831 0.977 -7.087 1.00 0.00 H new ATOM 0 HD3 ARG A 90 7.022 0.238 -8.139 1.00 0.00 H new ATOM 0 HE ARG A 90 4.507 0.574 -9.558 1.00 0.00 H new ATOM 0 HH11 ARG A 90 7.330 2.364 -8.369 1.00 0.00 H new ATOM 0 HH12 ARG A 90 7.191 3.632 -9.592 1.00 0.00 H new ATOM 0 HH21 ARG A 90 4.327 2.214 -11.138 1.00 0.00 H new ATOM 0 HH22 ARG A 90 5.486 3.547 -11.164 1.00 0.00 H new ATOM 1413 N HIS A 91 5.734 -3.401 -5.165 1.00 0.00 N ATOM 1414 CA HIS A 91 6.884 -3.667 -4.318 1.00 0.00 C ATOM 1415 C HIS A 91 8.171 -3.397 -5.100 1.00 0.00 C ATOM 1416 O HIS A 91 8.410 -4.009 -6.140 1.00 0.00 O ATOM 1417 CB HIS A 91 6.823 -5.086 -3.749 1.00 0.00 C ATOM 1418 CG HIS A 91 8.035 -5.474 -2.936 1.00 0.00 C ATOM 1419 ND1 HIS A 91 8.168 -5.164 -1.593 1.00 0.00 N ATOM 1420 CD2 HIS A 91 9.166 -6.150 -3.289 1.00 0.00 C ATOM 1421 CE1 HIS A 91 9.331 -5.637 -1.169 1.00 0.00 C ATOM 1422 NE2 HIS A 91 9.948 -6.247 -2.221 1.00 0.00 N ATOM 0 H HIS A 91 5.518 -4.139 -5.835 1.00 0.00 H new ATOM 0 HA HIS A 91 6.872 -2.993 -3.461 1.00 0.00 H new ATOM 0 HB2 HIS A 91 5.934 -5.178 -3.124 1.00 0.00 H new ATOM 0 HB3 HIS A 91 6.709 -5.792 -4.572 1.00 0.00 H new ATOM 0 HD1 HIS A 91 7.487 -4.658 -1.027 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.388 -6.540 -4.271 1.00 0.00 H new ATOM 0 HE1 HIS A 91 9.722 -5.554 -0.166 1.00 0.00 H new ATOM 1430 N GLY A 92 8.966 -2.479 -4.570 1.00 0.00 N ATOM 1431 CA GLY A 92 10.223 -2.120 -5.206 1.00 0.00 C ATOM 1432 C GLY A 92 10.027 -1.868 -6.702 1.00 0.00 C ATOM 1433 O GLY A 92 9.212 -1.033 -7.094 1.00 0.00 O ATOM 0 H GLY A 92 8.764 -1.973 -3.708 1.00 0.00 H new ATOM 0 HA2 GLY A 92 10.632 -1.227 -4.733 1.00 0.00 H new ATOM 0 HA3 GLY A 92 10.950 -2.919 -5.060 1.00 0.00 H new ATOM 1437 N ASN A 93 10.789 -2.603 -7.499 1.00 0.00 N ATOM 1438 CA ASN A 93 10.710 -2.469 -8.943 1.00 0.00 C ATOM 1439 C ASN A 93 9.711 -3.489 -9.492 1.00 0.00 C ATOM 1440 O ASN A 93 9.700 -3.770 -10.690 1.00 0.00 O ATOM 1441 CB ASN A 93 12.067 -2.738 -9.596 1.00 0.00 C ATOM 1442 CG ASN A 93 12.271 -1.849 -10.825 1.00 0.00 C ATOM 1443 OD1 ASN A 93 13.404 -1.154 -10.808 1.00 0.00 O flip ATOM 1444 ND2 ASN A 93 11.452 -1.798 -11.729 1.00 0.00 N flip ATOM 0 H ASN A 93 11.464 -3.294 -7.171 1.00 0.00 H new ATOM 0 HA ASN A 93 10.396 -1.450 -9.170 1.00 0.00 H new ATOM 0 HB2 ASN A 93 12.864 -2.556 -8.875 1.00 0.00 H new ATOM 0 HB3 ASN A 93 12.133 -3.787 -9.886 1.00 0.00 H new ATOM 0 HD21 ASN A 93 10.601 -2.359 -11.679 1.00 0.00 H new ATOM 0 HD22 ASN A 93 11.618 -1.195 -12.534 1.00 0.00 H new ATOM 1451 N ASP A 94 8.896 -4.016 -8.590 1.00 0.00 N ATOM 1452 CA ASP A 94 7.896 -4.999 -8.969 1.00 0.00 C ATOM 1453 C ASP A 94 6.505 -4.467 -8.617 1.00 0.00 C ATOM 1454 O ASP A 94 6.310 -3.885 -7.552 1.00 0.00 O ATOM 1455 CB ASP A 94 8.103 -6.315 -8.215 1.00 0.00 C ATOM 1456 CG ASP A 94 8.690 -7.454 -9.050 1.00 0.00 C ATOM 1457 OD1 ASP A 94 9.889 -7.351 -9.386 1.00 0.00 O ATOM 1458 OD2 ASP A 94 7.926 -8.402 -9.334 1.00 0.00 O ATOM 0 H ASP A 94 8.908 -3.781 -7.598 1.00 0.00 H new ATOM 0 HA ASP A 94 7.989 -5.178 -10.040 1.00 0.00 H new ATOM 0 HB2 ASP A 94 8.762 -6.130 -7.366 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.144 -6.639 -7.810 1.00 0.00 H new ATOM 1463 N GLN A 95 5.574 -4.685 -9.534 1.00 0.00 N ATOM 1464 CA GLN A 95 4.207 -4.235 -9.335 1.00 0.00 C ATOM 1465 C GLN A 95 3.301 -5.420 -8.998 1.00 0.00 C ATOM 1466 O GLN A 95 3.460 -6.506 -9.554 1.00 0.00 O ATOM 1467 CB GLN A 95 3.693 -3.483 -10.564 1.00 0.00 C ATOM 1468 CG GLN A 95 2.163 -3.450 -10.586 1.00 0.00 C ATOM 1469 CD GLN A 95 1.650 -2.554 -11.716 1.00 0.00 C ATOM 1470 OE1 GLN A 95 1.506 -2.968 -12.854 1.00 0.00 O ATOM 1471 NE2 GLN A 95 1.384 -1.307 -11.338 1.00 0.00 N ATOM 0 H GLN A 95 5.740 -5.168 -10.417 1.00 0.00 H new ATOM 0 HA GLN A 95 4.192 -3.542 -8.494 1.00 0.00 H new ATOM 0 HB2 GLN A 95 4.082 -2.465 -10.561 1.00 0.00 H new ATOM 0 HB3 GLN A 95 4.063 -3.963 -11.470 1.00 0.00 H new ATOM 0 HG2 GLN A 95 1.776 -4.461 -10.714 1.00 0.00 H new ATOM 0 HG3 GLN A 95 1.790 -3.085 -9.629 1.00 0.00 H new ATOM 0 HE21 GLN A 95 1.527 -1.027 -10.368 1.00 0.00 H new ATOM 0 HE22 GLN A 95 1.037 -0.631 -12.018 1.00 0.00 H new ATOM 1480 N ARG A 96 2.369 -5.173 -8.089 1.00 0.00 N ATOM 1481 CA ARG A 96 1.438 -6.207 -7.671 1.00 0.00 C ATOM 1482 C ARG A 96 0.081 -5.590 -7.326 1.00 0.00 C ATOM 1483 O ARG A 96 -0.060 -4.369 -7.294 1.00 0.00 O ATOM 1484 CB ARG A 96 1.969 -6.968 -6.455 1.00 0.00 C ATOM 1485 CG ARG A 96 2.929 -8.080 -6.880 1.00 0.00 C ATOM 1486 CD ARG A 96 4.142 -8.144 -5.950 1.00 0.00 C ATOM 1487 NE ARG A 96 5.330 -8.610 -6.698 1.00 0.00 N ATOM 1488 CZ ARG A 96 5.468 -9.848 -7.192 1.00 0.00 C ATOM 1489 NH1 ARG A 96 4.494 -10.751 -7.019 1.00 0.00 N ATOM 1490 NH2 ARG A 96 6.582 -10.183 -7.858 1.00 0.00 N ATOM 0 H ARG A 96 2.239 -4.271 -7.630 1.00 0.00 H new ATOM 0 HA ARG A 96 1.324 -6.906 -8.500 1.00 0.00 H new ATOM 0 HB2 ARG A 96 2.481 -6.278 -5.785 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.136 -7.396 -5.897 1.00 0.00 H new ATOM 0 HG2 ARG A 96 2.408 -9.038 -6.871 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.260 -7.907 -7.904 1.00 0.00 H new ATOM 0 HD2 ARG A 96 4.335 -7.160 -5.522 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.938 -8.819 -5.119 1.00 0.00 H new ATOM 0 HE ARG A 96 6.091 -7.948 -6.847 1.00 0.00 H new ATOM 0 HH11 ARG A 96 3.647 -10.496 -6.511 1.00 0.00 H new ATOM 0 HH12 ARG A 96 4.599 -11.693 -7.395 1.00 0.00 H new ATOM 0 HH21 ARG A 96 7.324 -9.496 -7.989 1.00 0.00 H new ATOM 0 HH22 ARG A 96 6.687 -11.125 -8.234 1.00 0.00 H new ATOM 1504 N VAL A 97 -0.884 -6.464 -7.076 1.00 0.00 N ATOM 1505 CA VAL A 97 -2.225 -6.020 -6.734 1.00 0.00 C ATOM 1506 C VAL A 97 -2.972 -7.159 -6.038 1.00 0.00 C ATOM 1507 O VAL A 97 -3.466 -8.075 -6.693 1.00 0.00 O ATOM 1508 CB VAL A 97 -2.943 -5.512 -7.986 1.00 0.00 C ATOM 1509 CG1 VAL A 97 -2.865 -6.539 -9.118 1.00 0.00 C ATOM 1510 CG2 VAL A 97 -4.396 -5.148 -7.675 1.00 0.00 C ATOM 0 H VAL A 97 -0.764 -7.477 -7.104 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.184 -5.183 -6.037 1.00 0.00 H new ATOM 0 HB VAL A 97 -2.435 -4.607 -8.319 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.383 -6.153 -9.996 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -1.821 -6.728 -9.367 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -3.336 -7.469 -8.799 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -4.883 -4.790 -8.582 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -4.921 -6.029 -7.305 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.421 -4.366 -6.917 1.00 0.00 H new ATOM 1520 N PHE A 98 -3.030 -7.066 -4.717 1.00 0.00 N ATOM 1521 CA PHE A 98 -3.708 -8.077 -3.924 1.00 0.00 C ATOM 1522 C PHE A 98 -5.114 -7.616 -3.534 1.00 0.00 C ATOM 1523 O PHE A 98 -5.565 -6.555 -3.964 1.00 0.00 O ATOM 1524 CB PHE A 98 -2.880 -8.279 -2.654 1.00 0.00 C ATOM 1525 CG PHE A 98 -1.428 -8.685 -2.916 1.00 0.00 C ATOM 1526 CD1 PHE A 98 -0.537 -7.766 -3.375 1.00 0.00 C ATOM 1527 CD2 PHE A 98 -1.028 -9.965 -2.690 1.00 0.00 C ATOM 1528 CE1 PHE A 98 0.810 -8.142 -3.618 1.00 0.00 C ATOM 1529 CE2 PHE A 98 0.319 -10.342 -2.934 1.00 0.00 C ATOM 1530 CZ PHE A 98 1.210 -9.422 -3.393 1.00 0.00 C ATOM 0 H PHE A 98 -2.618 -6.305 -4.176 1.00 0.00 H new ATOM 0 HA PHE A 98 -3.803 -8.998 -4.499 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -2.890 -7.355 -2.076 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -3.355 -9.044 -2.040 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.854 -6.749 -3.555 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -1.735 -10.695 -2.325 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.517 -7.411 -3.982 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.636 -11.359 -2.755 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.235 -9.708 -3.579 1.00 0.00 H new ATOM 1540 N ARG A 99 -5.767 -8.435 -2.723 1.00 0.00 N ATOM 1541 CA ARG A 99 -7.112 -8.125 -2.270 1.00 0.00 C ATOM 1542 C ARG A 99 -7.078 -7.576 -0.842 1.00 0.00 C ATOM 1543 O ARG A 99 -6.067 -7.696 -0.152 1.00 0.00 O ATOM 1544 CB ARG A 99 -8.007 -9.365 -2.311 1.00 0.00 C ATOM 1545 CG ARG A 99 -8.290 -9.790 -3.754 1.00 0.00 C ATOM 1546 CD ARG A 99 -9.080 -11.099 -3.795 1.00 0.00 C ATOM 1547 NE ARG A 99 -8.600 -11.945 -4.911 1.00 0.00 N ATOM 1548 CZ ARG A 99 -9.114 -13.143 -5.220 1.00 0.00 C ATOM 1549 NH1 ARG A 99 -10.127 -13.644 -4.499 1.00 0.00 N ATOM 1550 NH2 ARG A 99 -8.616 -13.840 -6.250 1.00 0.00 N ATOM 0 H ARG A 99 -5.389 -9.313 -2.368 1.00 0.00 H new ATOM 0 HA ARG A 99 -7.523 -7.372 -2.943 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.526 -10.183 -1.775 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.946 -9.157 -1.799 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -8.851 -9.007 -4.264 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -7.350 -9.911 -4.292 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -8.968 -11.631 -2.850 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -10.142 -10.889 -3.918 1.00 0.00 H new ATOM 0 HE ARG A 99 -7.830 -11.594 -5.480 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -10.507 -13.113 -3.715 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -10.518 -14.556 -4.734 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -7.846 -13.459 -6.799 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -9.007 -14.752 -6.485 1.00 0.00 H new ATOM 1564 N LEU A 100 -8.195 -6.986 -0.442 1.00 0.00 N ATOM 1565 CA LEU A 100 -8.305 -6.418 0.891 1.00 0.00 C ATOM 1566 C LEU A 100 -8.242 -7.543 1.926 1.00 0.00 C ATOM 1567 O LEU A 100 -7.778 -7.335 3.046 1.00 0.00 O ATOM 1568 CB LEU A 100 -9.560 -5.550 1.001 1.00 0.00 C ATOM 1569 CG LEU A 100 -9.441 -4.125 0.457 1.00 0.00 C ATOM 1570 CD1 LEU A 100 -9.497 -4.115 -1.071 1.00 0.00 C ATOM 1571 CD2 LEU A 100 -10.500 -3.212 1.076 1.00 0.00 C ATOM 0 H LEU A 100 -9.032 -6.889 -1.017 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.466 -5.752 1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -10.372 -6.052 0.474 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -9.848 -5.494 2.051 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.467 -3.729 0.745 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.410 -3.090 -1.432 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -8.675 -4.710 -1.469 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.445 -4.537 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.393 -2.205 0.672 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.493 -3.594 0.840 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.370 -3.185 2.158 1.00 0.00 H new ATOM 1583 N GLU A 101 -8.714 -8.710 1.514 1.00 0.00 N ATOM 1584 CA GLU A 101 -8.717 -9.868 2.392 1.00 0.00 C ATOM 1585 C GLU A 101 -7.286 -10.243 2.781 1.00 0.00 C ATOM 1586 O GLU A 101 -7.051 -10.763 3.870 1.00 0.00 O ATOM 1587 CB GLU A 101 -9.436 -11.050 1.738 1.00 0.00 C ATOM 1588 CG GLU A 101 -8.763 -11.439 0.420 1.00 0.00 C ATOM 1589 CD GLU A 101 -9.501 -12.600 -0.250 1.00 0.00 C ATOM 1590 OE1 GLU A 101 -9.166 -13.756 0.087 1.00 0.00 O ATOM 1591 OE2 GLU A 101 -10.384 -12.305 -1.085 1.00 0.00 O ATOM 0 H GLU A 101 -9.097 -8.879 0.584 1.00 0.00 H new ATOM 0 HA GLU A 101 -9.263 -9.610 3.299 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -9.434 -11.903 2.417 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.479 -10.790 1.555 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.744 -10.580 -0.250 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.727 -11.721 0.606 1.00 0.00 H new ATOM 1598 N PHE A 102 -6.367 -9.965 1.868 1.00 0.00 N ATOM 1599 CA PHE A 102 -4.965 -10.267 2.101 1.00 0.00 C ATOM 1600 C PHE A 102 -4.246 -9.075 2.736 1.00 0.00 C ATOM 1601 O PHE A 102 -3.079 -9.177 3.113 1.00 0.00 O ATOM 1602 CB PHE A 102 -4.337 -10.558 0.737 1.00 0.00 C ATOM 1603 CG PHE A 102 -4.993 -11.717 -0.016 1.00 0.00 C ATOM 1604 CD1 PHE A 102 -5.612 -12.713 0.674 1.00 0.00 C ATOM 1605 CD2 PHE A 102 -4.959 -11.751 -1.375 1.00 0.00 C ATOM 1606 CE1 PHE A 102 -6.221 -13.788 -0.024 1.00 0.00 C ATOM 1607 CE2 PHE A 102 -5.569 -12.827 -2.073 1.00 0.00 C ATOM 1608 CZ PHE A 102 -6.187 -13.822 -1.383 1.00 0.00 C ATOM 0 H PHE A 102 -6.566 -9.534 0.965 1.00 0.00 H new ATOM 0 HA PHE A 102 -4.875 -11.115 2.779 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.396 -9.660 0.123 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -3.279 -10.781 0.876 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -5.640 -12.685 1.753 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.468 -10.960 -1.923 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.711 -14.579 0.524 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.542 -12.855 -3.152 1.00 0.00 H new ATOM 0 HZ PHE A 102 -6.651 -14.640 -1.914 1.00 0.00 H new ATOM 1618 N VAL A 103 -4.972 -7.971 2.836 1.00 0.00 N ATOM 1619 CA VAL A 103 -4.418 -6.761 3.419 1.00 0.00 C ATOM 1620 C VAL A 103 -4.479 -6.861 4.945 1.00 0.00 C ATOM 1621 O VAL A 103 -5.508 -6.564 5.549 1.00 0.00 O ATOM 1622 CB VAL A 103 -5.149 -5.534 2.871 1.00 0.00 C ATOM 1623 CG1 VAL A 103 -4.926 -4.316 3.769 1.00 0.00 C ATOM 1624 CG2 VAL A 103 -4.722 -5.239 1.431 1.00 0.00 C ATOM 0 H VAL A 103 -5.939 -7.889 2.523 1.00 0.00 H new ATOM 0 HA VAL A 103 -3.370 -6.649 3.142 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.216 -5.755 2.866 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.456 -3.458 3.356 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.302 -4.528 4.770 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -3.860 -4.093 3.821 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.256 -4.362 1.065 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -3.649 -5.049 1.401 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -4.956 -6.096 0.799 1.00 0.00 H new ATOM 1634 N SER A 104 -3.363 -7.279 5.523 1.00 0.00 N ATOM 1635 CA SER A 104 -3.276 -7.422 6.966 1.00 0.00 C ATOM 1636 C SER A 104 -3.663 -6.107 7.647 1.00 0.00 C ATOM 1637 O SER A 104 -3.958 -5.120 6.975 1.00 0.00 O ATOM 1638 CB SER A 104 -1.870 -7.847 7.395 1.00 0.00 C ATOM 1639 OG SER A 104 -1.800 -8.133 8.789 1.00 0.00 O ATOM 0 H SER A 104 -2.511 -7.523 5.018 1.00 0.00 H new ATOM 0 HA SER A 104 -3.972 -8.202 7.274 1.00 0.00 H new ATOM 0 HB2 SER A 104 -1.569 -8.728 6.829 1.00 0.00 H new ATOM 0 HB3 SER A 104 -1.162 -7.055 7.152 1.00 0.00 H new ATOM 0 HG SER A 104 -2.563 -8.692 9.047 1.00 0.00 H new ATOM 1645 N ASN A 105 -3.650 -6.137 8.971 1.00 0.00 N ATOM 1646 CA ASN A 105 -3.996 -4.960 9.749 1.00 0.00 C ATOM 1647 C ASN A 105 -3.040 -4.840 10.937 1.00 0.00 C ATOM 1648 O ASN A 105 -3.476 -4.717 12.081 1.00 0.00 O ATOM 1649 CB ASN A 105 -5.421 -5.062 10.298 1.00 0.00 C ATOM 1650 CG ASN A 105 -5.665 -6.429 10.940 1.00 0.00 C ATOM 1651 OD1 ASN A 105 -5.544 -6.611 12.140 1.00 0.00 O ATOM 1652 ND2 ASN A 105 -6.015 -7.377 10.075 1.00 0.00 N ATOM 0 H ASN A 105 -3.405 -6.958 9.525 1.00 0.00 H new ATOM 0 HA ASN A 105 -3.922 -4.091 9.096 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -5.588 -4.276 11.034 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -6.137 -4.902 9.492 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -6.200 -8.324 10.404 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -6.098 -7.156 9.083 1.00 0.00 H new ATOM 1659 N GLN A 106 -1.752 -4.879 10.626 1.00 0.00 N ATOM 1660 CA GLN A 106 -0.730 -4.776 11.653 1.00 0.00 C ATOM 1661 C GLN A 106 0.120 -3.524 11.432 1.00 0.00 C ATOM 1662 O GLN A 106 -0.105 -2.776 10.482 1.00 0.00 O ATOM 1663 CB GLN A 106 0.142 -6.033 11.686 1.00 0.00 C ATOM 1664 CG GLN A 106 0.513 -6.405 13.123 1.00 0.00 C ATOM 1665 CD GLN A 106 0.754 -7.910 13.255 1.00 0.00 C ATOM 1666 OE1 GLN A 106 0.811 -8.643 12.281 1.00 0.00 O ATOM 1667 NE2 GLN A 106 0.891 -8.329 14.510 1.00 0.00 N ATOM 0 H GLN A 106 -1.393 -4.981 9.677 1.00 0.00 H new ATOM 0 HA GLN A 106 -1.223 -4.690 12.622 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -0.390 -6.861 11.218 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.048 -5.867 11.104 1.00 0.00 H new ATOM 0 HG2 GLN A 106 1.409 -5.862 13.423 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -0.286 -6.100 13.799 1.00 0.00 H new ATOM 0 HE21 GLN A 106 0.832 -7.662 15.280 1.00 0.00 H new ATOM 0 HE22 GLN A 106 1.055 -9.317 14.703 1.00 0.00 H new ATOM 1676 N GLU A 107 1.079 -3.333 12.327 1.00 0.00 N ATOM 1677 CA GLU A 107 1.964 -2.184 12.241 1.00 0.00 C ATOM 1678 C GLU A 107 3.334 -2.607 11.707 1.00 0.00 C ATOM 1679 O GLU A 107 3.853 -3.657 12.082 1.00 0.00 O ATOM 1680 CB GLU A 107 2.096 -1.492 13.599 1.00 0.00 C ATOM 1681 CG GLU A 107 0.734 -1.366 14.285 1.00 0.00 C ATOM 1682 CD GLU A 107 0.751 -0.258 15.340 1.00 0.00 C ATOM 1683 OE1 GLU A 107 1.571 -0.378 16.276 1.00 0.00 O ATOM 1684 OE2 GLU A 107 -0.055 0.685 15.186 1.00 0.00 O ATOM 0 H GLU A 107 1.262 -3.955 13.115 1.00 0.00 H new ATOM 0 HA GLU A 107 1.530 -1.467 11.544 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.777 -2.058 14.235 1.00 0.00 H new ATOM 0 HB3 GLU A 107 2.533 -0.502 13.466 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.033 -1.153 13.541 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.469 -2.314 14.753 1.00 0.00 H new ATOM 1691 N PHE A 108 3.880 -1.768 10.838 1.00 0.00 N ATOM 1692 CA PHE A 108 5.179 -2.043 10.248 1.00 0.00 C ATOM 1693 C PHE A 108 6.260 -2.146 11.326 1.00 0.00 C ATOM 1694 O PHE A 108 6.493 -1.194 12.069 1.00 0.00 O ATOM 1695 CB PHE A 108 5.507 -0.868 9.324 1.00 0.00 C ATOM 1696 CG PHE A 108 4.710 -0.863 8.018 1.00 0.00 C ATOM 1697 CD1 PHE A 108 4.539 -2.018 7.321 1.00 0.00 C ATOM 1698 CD2 PHE A 108 4.173 0.297 7.554 1.00 0.00 C ATOM 1699 CE1 PHE A 108 3.800 -2.013 6.109 1.00 0.00 C ATOM 1700 CE2 PHE A 108 3.434 0.302 6.341 1.00 0.00 C ATOM 1701 CZ PHE A 108 3.263 -0.853 5.644 1.00 0.00 C ATOM 0 H PHE A 108 3.446 -0.898 10.529 1.00 0.00 H new ATOM 0 HA PHE A 108 5.151 -2.990 9.709 1.00 0.00 H new ATOM 0 HB2 PHE A 108 5.318 0.064 9.857 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.571 -0.890 9.088 1.00 0.00 H new ATOM 0 HD1 PHE A 108 4.965 -2.939 7.690 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.308 1.214 8.108 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.664 -2.931 5.556 1.00 0.00 H new ATOM 0 HE2 PHE A 108 3.008 1.223 5.972 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.701 -0.849 4.722 1.00 0.00 H new ATOM 1711 N THR A 109 6.891 -3.310 11.377 1.00 0.00 N ATOM 1712 CA THR A 109 7.942 -3.549 12.351 1.00 0.00 C ATOM 1713 C THR A 109 9.307 -3.185 11.764 1.00 0.00 C ATOM 1714 O THR A 109 9.512 -3.280 10.555 1.00 0.00 O ATOM 1715 CB THR A 109 7.844 -5.008 12.802 1.00 0.00 C ATOM 1716 OG1 THR A 109 9.088 -5.254 13.453 1.00 0.00 O ATOM 1717 CG2 THR A 109 7.840 -5.986 11.625 1.00 0.00 C ATOM 0 H THR A 109 6.694 -4.098 10.759 1.00 0.00 H new ATOM 0 HA THR A 109 7.821 -2.913 13.228 1.00 0.00 H new ATOM 0 HB THR A 109 6.937 -5.146 13.391 1.00 0.00 H new ATOM 0 HG1 THR A 109 9.110 -6.178 13.779 1.00 0.00 H new ATOM 0 HG21 THR A 109 7.769 -7.007 12.000 1.00 0.00 H new ATOM 0 HG22 THR A 109 6.986 -5.776 10.980 1.00 0.00 H new ATOM 0 HG23 THR A 109 8.762 -5.873 11.055 1.00 0.00 H new ATOM 1725 N GLU A 110 10.205 -2.774 12.648 1.00 0.00 N ATOM 1726 CA GLU A 110 11.544 -2.395 12.232 1.00 0.00 C ATOM 1727 C GLU A 110 12.054 -3.349 11.150 1.00 0.00 C ATOM 1728 O GLU A 110 12.277 -2.939 10.012 1.00 0.00 O ATOM 1729 CB GLU A 110 12.499 -2.359 13.427 1.00 0.00 C ATOM 1730 CG GLU A 110 13.872 -1.825 13.015 1.00 0.00 C ATOM 1731 CD GLU A 110 14.712 -1.466 14.243 1.00 0.00 C ATOM 1732 OE1 GLU A 110 14.250 -0.595 15.012 1.00 0.00 O ATOM 1733 OE2 GLU A 110 15.796 -2.071 14.386 1.00 0.00 O ATOM 0 H GLU A 110 10.031 -2.695 13.650 1.00 0.00 H new ATOM 0 HA GLU A 110 11.502 -1.390 11.812 1.00 0.00 H new ATOM 0 HB2 GLU A 110 12.081 -1.730 14.213 1.00 0.00 H new ATOM 0 HB3 GLU A 110 12.604 -3.361 13.843 1.00 0.00 H new ATOM 0 HG2 GLU A 110 14.394 -2.574 12.419 1.00 0.00 H new ATOM 0 HG3 GLU A 110 13.749 -0.945 12.384 1.00 0.00 H new ATOM 1740 N SER A 111 12.225 -4.602 11.544 1.00 0.00 N ATOM 1741 CA SER A 111 12.705 -5.617 10.621 1.00 0.00 C ATOM 1742 C SER A 111 12.073 -5.413 9.243 1.00 0.00 C ATOM 1743 O SER A 111 12.750 -5.006 8.300 1.00 0.00 O ATOM 1744 CB SER A 111 12.399 -7.023 11.142 1.00 0.00 C ATOM 1745 OG SER A 111 12.718 -7.162 12.524 1.00 0.00 O ATOM 0 H SER A 111 12.040 -4.938 12.489 1.00 0.00 H new ATOM 0 HA SER A 111 13.787 -5.517 10.535 1.00 0.00 H new ATOM 0 HB2 SER A 111 11.343 -7.244 10.990 1.00 0.00 H new ATOM 0 HB3 SER A 111 12.964 -7.755 10.564 1.00 0.00 H new ATOM 0 HG SER A 111 12.507 -8.072 12.819 1.00 0.00 H new ATOM 1751 N GLU A 112 10.782 -5.704 9.170 1.00 0.00 N ATOM 1752 CA GLU A 112 10.052 -5.557 7.922 1.00 0.00 C ATOM 1753 C GLU A 112 10.411 -4.231 7.250 1.00 0.00 C ATOM 1754 O GLU A 112 10.980 -4.218 6.159 1.00 0.00 O ATOM 1755 CB GLU A 112 8.543 -5.663 8.155 1.00 0.00 C ATOM 1756 CG GLU A 112 8.121 -7.119 8.362 1.00 0.00 C ATOM 1757 CD GLU A 112 8.265 -7.921 7.067 1.00 0.00 C ATOM 1758 OE1 GLU A 112 8.520 -7.278 6.026 1.00 0.00 O ATOM 1759 OE2 GLU A 112 8.116 -9.160 7.147 1.00 0.00 O ATOM 0 H GLU A 112 10.223 -6.041 9.954 1.00 0.00 H new ATOM 0 HA GLU A 112 10.342 -6.369 7.256 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.264 -5.072 9.027 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.009 -5.244 7.302 1.00 0.00 H new ATOM 0 HG2 GLU A 112 8.732 -7.571 9.144 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.087 -7.156 8.704 1.00 0.00 H new ATOM 1766 N PHE A 113 10.065 -3.147 7.928 1.00 0.00 N ATOM 1767 CA PHE A 113 10.344 -1.818 7.410 1.00 0.00 C ATOM 1768 C PHE A 113 11.698 -1.781 6.697 1.00 0.00 C ATOM 1769 O PHE A 113 11.772 -1.451 5.515 1.00 0.00 O ATOM 1770 CB PHE A 113 10.386 -0.870 8.609 1.00 0.00 C ATOM 1771 CG PHE A 113 10.609 0.597 8.236 1.00 0.00 C ATOM 1772 CD1 PHE A 113 9.844 1.177 7.273 1.00 0.00 C ATOM 1773 CD2 PHE A 113 11.573 1.321 8.866 1.00 0.00 C ATOM 1774 CE1 PHE A 113 10.050 2.538 6.926 1.00 0.00 C ATOM 1775 CE2 PHE A 113 11.779 2.682 8.519 1.00 0.00 C ATOM 1776 CZ PHE A 113 11.014 3.262 7.556 1.00 0.00 C ATOM 0 H PHE A 113 9.594 -3.162 8.832 1.00 0.00 H new ATOM 0 HA PHE A 113 9.577 -1.530 6.691 1.00 0.00 H new ATOM 0 HB2 PHE A 113 9.449 -0.956 9.160 1.00 0.00 H new ATOM 0 HB3 PHE A 113 11.182 -1.188 9.283 1.00 0.00 H new ATOM 0 HD1 PHE A 113 9.079 0.602 6.772 1.00 0.00 H new ATOM 0 HD2 PHE A 113 12.182 0.860 9.630 1.00 0.00 H new ATOM 0 HE1 PHE A 113 9.441 2.999 6.162 1.00 0.00 H new ATOM 0 HE2 PHE A 113 12.544 3.257 9.020 1.00 0.00 H new ATOM 0 HZ PHE A 113 11.172 4.297 7.291 1.00 0.00 H new ATOM 1786 N MET A 114 12.735 -2.124 7.447 1.00 0.00 N ATOM 1787 CA MET A 114 14.082 -2.134 6.902 1.00 0.00 C ATOM 1788 C MET A 114 14.216 -3.177 5.791 1.00 0.00 C ATOM 1789 O MET A 114 14.956 -2.974 4.830 1.00 0.00 O ATOM 1790 CB MET A 114 15.082 -2.444 8.018 1.00 0.00 C ATOM 1791 CG MET A 114 15.065 -1.351 9.088 1.00 0.00 C ATOM 1792 SD MET A 114 15.917 0.100 8.492 1.00 0.00 S ATOM 1793 CE MET A 114 15.196 1.341 9.554 1.00 0.00 C ATOM 0 H MET A 114 12.670 -2.397 8.428 1.00 0.00 H new ATOM 0 HA MET A 114 14.290 -1.151 6.479 1.00 0.00 H new ATOM 0 HB2 MET A 114 14.840 -3.405 8.471 1.00 0.00 H new ATOM 0 HB3 MET A 114 16.084 -2.532 7.599 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.036 -1.099 9.346 1.00 0.00 H new ATOM 0 HG3 MET A 114 15.542 -1.714 9.998 1.00 0.00 H new ATOM 0 HE1 MET A 114 14.585 2.019 8.958 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.573 0.858 10.307 1.00 0.00 H new ATOM 0 HE3 MET A 114 15.989 1.904 10.046 1.00 0.00 H new ATOM 1803 N LYS A 115 13.488 -4.272 5.960 1.00 0.00 N ATOM 1804 CA LYS A 115 13.517 -5.348 4.984 1.00 0.00 C ATOM 1805 C LYS A 115 12.943 -4.843 3.658 1.00 0.00 C ATOM 1806 O LYS A 115 13.521 -5.076 2.598 1.00 0.00 O ATOM 1807 CB LYS A 115 12.805 -6.586 5.531 1.00 0.00 C ATOM 1808 CG LYS A 115 13.680 -7.316 6.552 1.00 0.00 C ATOM 1809 CD LYS A 115 14.877 -7.984 5.871 1.00 0.00 C ATOM 1810 CE LYS A 115 15.584 -8.946 6.826 1.00 0.00 C ATOM 1811 NZ LYS A 115 16.535 -9.806 6.085 1.00 0.00 N ATOM 0 H LYS A 115 12.875 -4.437 6.758 1.00 0.00 H new ATOM 0 HA LYS A 115 14.543 -5.659 4.790 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.864 -6.293 5.997 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.558 -7.260 4.711 1.00 0.00 H new ATOM 0 HG2 LYS A 115 14.032 -6.611 7.305 1.00 0.00 H new ATOM 0 HG3 LYS A 115 13.087 -8.068 7.073 1.00 0.00 H new ATOM 0 HD2 LYS A 115 14.541 -8.525 4.986 1.00 0.00 H new ATOM 0 HD3 LYS A 115 15.579 -7.222 5.531 1.00 0.00 H new ATOM 0 HE2 LYS A 115 16.116 -8.382 7.592 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.848 -9.565 7.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 17.007 -10.453 6.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 16.019 -10.358 5.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 17.248 -9.211 5.616 1.00 0.00 H new ATOM 1825 N TRP A 116 11.811 -4.162 3.762 1.00 0.00 N ATOM 1826 CA TRP A 116 11.152 -3.622 2.585 1.00 0.00 C ATOM 1827 C TRP A 116 12.067 -2.557 1.977 1.00 0.00 C ATOM 1828 O TRP A 116 12.244 -2.506 0.761 1.00 0.00 O ATOM 1829 CB TRP A 116 9.761 -3.088 2.931 1.00 0.00 C ATOM 1830 CG TRP A 116 9.306 -1.920 2.054 1.00 0.00 C ATOM 1831 CD1 TRP A 116 8.815 -1.966 0.808 1.00 0.00 C ATOM 1832 CD2 TRP A 116 9.321 -0.521 2.409 1.00 0.00 C ATOM 1833 NE1 TRP A 116 8.514 -0.705 0.336 1.00 0.00 N ATOM 1834 CE2 TRP A 116 8.831 0.202 1.341 1.00 0.00 C ATOM 1835 CE3 TRP A 116 9.735 0.112 3.595 1.00 0.00 C ATOM 1836 CZ2 TRP A 116 8.708 1.597 1.351 1.00 0.00 C ATOM 1837 CZ3 TRP A 116 9.606 1.506 3.588 1.00 0.00 C ATOM 1838 CH2 TRP A 116 9.115 2.249 2.521 1.00 0.00 C ATOM 0 H TRP A 116 11.334 -3.972 4.643 1.00 0.00 H new ATOM 0 HA TRP A 116 10.987 -4.404 1.843 1.00 0.00 H new ATOM 0 HB2 TRP A 116 9.039 -3.899 2.841 1.00 0.00 H new ATOM 0 HB3 TRP A 116 9.754 -2.770 3.974 1.00 0.00 H new ATOM 0 HD1 TRP A 116 8.673 -2.876 0.244 1.00 0.00 H new ATOM 0 HE1 TRP A 116 8.130 -0.480 -0.582 1.00 0.00 H new ATOM 0 HE3 TRP A 116 10.121 -0.434 4.443 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 8.320 2.140 0.502 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 9.910 2.042 4.475 1.00 0.00 H new ATOM 0 HH2 TRP A 116 9.048 3.324 2.594 1.00 0.00 H new ATOM 1849 N LYS A 117 12.624 -1.732 2.851 1.00 0.00 N ATOM 1850 CA LYS A 117 13.517 -0.672 2.416 1.00 0.00 C ATOM 1851 C LYS A 117 14.565 -1.251 1.464 1.00 0.00 C ATOM 1852 O LYS A 117 14.824 -0.687 0.403 1.00 0.00 O ATOM 1853 CB LYS A 117 14.116 0.054 3.623 1.00 0.00 C ATOM 1854 CG LYS A 117 13.474 1.430 3.809 1.00 0.00 C ATOM 1855 CD LYS A 117 13.658 1.931 5.243 1.00 0.00 C ATOM 1856 CE LYS A 117 15.113 2.322 5.506 1.00 0.00 C ATOM 1857 NZ LYS A 117 15.250 3.794 5.575 1.00 0.00 N ATOM 0 H LYS A 117 12.474 -1.776 3.859 1.00 0.00 H new ATOM 0 HA LYS A 117 12.965 0.086 1.859 1.00 0.00 H new ATOM 0 HB2 LYS A 117 13.969 -0.545 4.522 1.00 0.00 H new ATOM 0 HB3 LYS A 117 15.192 0.166 3.488 1.00 0.00 H new ATOM 0 HG2 LYS A 117 13.919 2.140 3.112 1.00 0.00 H new ATOM 0 HG3 LYS A 117 12.411 1.375 3.573 1.00 0.00 H new ATOM 0 HD2 LYS A 117 13.010 2.790 5.418 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.354 1.154 5.945 1.00 0.00 H new ATOM 0 HE2 LYS A 117 15.453 1.875 6.440 1.00 0.00 H new ATOM 0 HE3 LYS A 117 15.750 1.928 4.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 16.244 4.042 5.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 14.945 4.214 4.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 14.657 4.162 6.346 1.00 0.00 H new ATOM 1871 N GLU A 118 15.139 -2.371 1.879 1.00 0.00 N ATOM 1872 CA GLU A 118 16.154 -3.033 1.076 1.00 0.00 C ATOM 1873 C GLU A 118 15.760 -3.009 -0.402 1.00 0.00 C ATOM 1874 O GLU A 118 16.539 -2.573 -1.248 1.00 0.00 O ATOM 1875 CB GLU A 118 16.385 -4.467 1.559 1.00 0.00 C ATOM 1876 CG GLU A 118 17.006 -4.481 2.957 1.00 0.00 C ATOM 1877 CD GLU A 118 18.522 -4.675 2.883 1.00 0.00 C ATOM 1878 OE1 GLU A 118 19.220 -3.647 2.750 1.00 0.00 O ATOM 1879 OE2 GLU A 118 18.948 -5.848 2.960 1.00 0.00 O ATOM 0 H GLU A 118 14.921 -2.837 2.760 1.00 0.00 H new ATOM 0 HA GLU A 118 17.092 -2.490 1.190 1.00 0.00 H new ATOM 0 HB2 GLU A 118 15.438 -5.007 1.572 1.00 0.00 H new ATOM 0 HB3 GLU A 118 17.040 -4.989 0.861 1.00 0.00 H new ATOM 0 HG2 GLU A 118 16.780 -3.545 3.468 1.00 0.00 H new ATOM 0 HG3 GLU A 118 16.562 -5.282 3.548 1.00 0.00 H new ATOM 1886 N ALA A 119 14.552 -3.484 -0.668 1.00 0.00 N ATOM 1887 CA ALA A 119 14.045 -3.522 -2.029 1.00 0.00 C ATOM 1888 C ALA A 119 14.176 -2.133 -2.657 1.00 0.00 C ATOM 1889 O ALA A 119 14.639 -2.001 -3.789 1.00 0.00 O ATOM 1890 CB ALA A 119 12.601 -4.025 -2.022 1.00 0.00 C ATOM 0 H ALA A 119 13.909 -3.846 0.037 1.00 0.00 H new ATOM 0 HA ALA A 119 14.628 -4.214 -2.636 1.00 0.00 H new ATOM 0 HB1 ALA A 119 12.221 -4.053 -3.043 1.00 0.00 H new ATOM 0 HB2 ALA A 119 12.567 -5.027 -1.594 1.00 0.00 H new ATOM 0 HB3 ALA A 119 11.985 -3.354 -1.424 1.00 0.00 H new ATOM 1896 N MET A 120 13.761 -1.133 -1.894 1.00 0.00 N ATOM 1897 CA MET A 120 13.826 0.242 -2.361 1.00 0.00 C ATOM 1898 C MET A 120 15.277 0.686 -2.558 1.00 0.00 C ATOM 1899 O MET A 120 15.594 1.368 -3.531 1.00 0.00 O ATOM 1900 CB MET A 120 13.144 1.160 -1.345 1.00 0.00 C ATOM 1901 CG MET A 120 11.712 0.701 -1.066 1.00 0.00 C ATOM 1902 SD MET A 120 10.598 1.411 -2.266 1.00 0.00 S ATOM 1903 CE MET A 120 10.926 3.146 -2.004 1.00 0.00 C ATOM 0 H MET A 120 13.378 -1.247 -0.955 1.00 0.00 H new ATOM 0 HA MET A 120 13.313 0.304 -3.321 1.00 0.00 H new ATOM 0 HB2 MET A 120 13.715 1.168 -0.416 1.00 0.00 H new ATOM 0 HB3 MET A 120 13.135 2.183 -1.722 1.00 0.00 H new ATOM 0 HG2 MET A 120 11.656 -0.387 -1.105 1.00 0.00 H new ATOM 0 HG3 MET A 120 11.415 1.000 -0.061 1.00 0.00 H new ATOM 0 HE1 MET A 120 10.806 3.685 -2.944 1.00 0.00 H new ATOM 0 HE2 MET A 120 10.227 3.541 -1.267 1.00 0.00 H new ATOM 0 HE3 MET A 120 11.946 3.273 -1.641 1.00 0.00 H new ATOM 1913 N PHE A 121 16.119 0.281 -1.618 1.00 0.00 N ATOM 1914 CA PHE A 121 17.528 0.629 -1.676 1.00 0.00 C ATOM 1915 C PHE A 121 18.222 -0.087 -2.837 1.00 0.00 C ATOM 1916 O PHE A 121 19.097 0.483 -3.488 1.00 0.00 O ATOM 1917 CB PHE A 121 18.157 0.168 -0.360 1.00 0.00 C ATOM 1918 CG PHE A 121 18.030 1.183 0.779 1.00 0.00 C ATOM 1919 CD1 PHE A 121 16.801 1.594 1.189 1.00 0.00 C ATOM 1920 CD2 PHE A 121 19.147 1.672 1.381 1.00 0.00 C ATOM 1921 CE1 PHE A 121 16.683 2.535 2.246 1.00 0.00 C ATOM 1922 CE2 PHE A 121 19.030 2.614 2.437 1.00 0.00 C ATOM 1923 CZ PHE A 121 17.800 3.025 2.848 1.00 0.00 C ATOM 0 H PHE A 121 15.852 -0.285 -0.812 1.00 0.00 H new ATOM 0 HA PHE A 121 17.640 1.703 -1.827 1.00 0.00 H new ATOM 0 HB2 PHE A 121 17.689 -0.767 -0.053 1.00 0.00 H new ATOM 0 HB3 PHE A 121 19.213 -0.044 -0.528 1.00 0.00 H new ATOM 0 HD1 PHE A 121 15.914 1.205 0.711 1.00 0.00 H new ATOM 0 HD2 PHE A 121 20.123 1.344 1.056 1.00 0.00 H new ATOM 0 HE1 PHE A 121 15.706 2.862 2.572 1.00 0.00 H new ATOM 0 HE2 PHE A 121 19.917 3.004 2.914 1.00 0.00 H new ATOM 0 HZ PHE A 121 17.710 3.740 3.652 1.00 0.00 H new ATOM 1933 N SER A 122 17.807 -1.325 -3.060 1.00 0.00 N ATOM 1934 CA SER A 122 18.378 -2.124 -4.131 1.00 0.00 C ATOM 1935 C SER A 122 17.918 -1.586 -5.487 1.00 0.00 C ATOM 1936 O SER A 122 18.713 -1.486 -6.421 1.00 0.00 O ATOM 1937 CB SER A 122 17.991 -3.597 -3.985 1.00 0.00 C ATOM 1938 OG SER A 122 19.092 -4.466 -4.235 1.00 0.00 O ATOM 0 H SER A 122 17.082 -1.795 -2.517 1.00 0.00 H new ATOM 0 HA SER A 122 19.464 -2.054 -4.069 1.00 0.00 H new ATOM 0 HB2 SER A 122 17.611 -3.774 -2.979 1.00 0.00 H new ATOM 0 HB3 SER A 122 17.181 -3.829 -4.677 1.00 0.00 H new ATOM 0 HG SER A 122 18.804 -5.397 -4.130 1.00 0.00 H new ATOM 1944 N ALA A 123 16.637 -1.254 -5.553 1.00 0.00 N ATOM 1945 CA ALA A 123 16.062 -0.729 -6.780 1.00 0.00 C ATOM 1946 C ALA A 123 16.435 0.748 -6.922 1.00 0.00 C ATOM 1947 O ALA A 123 16.056 1.397 -7.895 1.00 0.00 O ATOM 1948 CB ALA A 123 14.549 -0.950 -6.770 1.00 0.00 C ATOM 0 H ALA A 123 15.981 -1.338 -4.777 1.00 0.00 H new ATOM 0 HA ALA A 123 16.462 -1.255 -7.647 1.00 0.00 H new ATOM 0 HB1 ALA A 123 14.118 -0.556 -7.690 1.00 0.00 H new ATOM 0 HB2 ALA A 123 14.338 -2.017 -6.698 1.00 0.00 H new ATOM 0 HB3 ALA A 123 14.112 -0.435 -5.915 1.00 0.00 H new ATOM 1954 N GLY A 124 17.173 1.236 -5.935 1.00 0.00 N ATOM 1955 CA GLY A 124 17.601 2.624 -5.938 1.00 0.00 C ATOM 1956 C GLY A 124 16.400 3.569 -6.013 1.00 0.00 C ATOM 1957 O GLY A 124 16.471 4.620 -6.647 1.00 0.00 O ATOM 0 H GLY A 124 17.485 0.695 -5.129 1.00 0.00 H new ATOM 0 HA2 GLY A 124 18.176 2.833 -5.036 1.00 0.00 H new ATOM 0 HA3 GLY A 124 18.262 2.802 -6.786 1.00 0.00 H new ATOM 1961 N MET A 125 15.324 3.159 -5.358 1.00 0.00 N ATOM 1962 CA MET A 125 14.108 3.955 -5.343 1.00 0.00 C ATOM 1963 C MET A 125 14.089 4.903 -4.142 1.00 0.00 C ATOM 1964 O MET A 125 15.084 5.030 -3.430 1.00 0.00 O ATOM 1965 CB MET A 125 12.892 3.029 -5.282 1.00 0.00 C ATOM 1966 CG MET A 125 12.434 2.632 -6.687 1.00 0.00 C ATOM 1967 SD MET A 125 10.689 2.953 -6.874 1.00 0.00 S ATOM 1968 CE MET A 125 10.032 1.345 -6.459 1.00 0.00 C ATOM 0 H MET A 125 15.269 2.286 -4.834 1.00 0.00 H new ATOM 0 HA MET A 125 14.075 4.552 -6.254 1.00 0.00 H new ATOM 0 HB2 MET A 125 13.140 2.135 -4.710 1.00 0.00 H new ATOM 0 HB3 MET A 125 12.077 3.527 -4.757 1.00 0.00 H new ATOM 0 HG2 MET A 125 12.997 3.192 -7.434 1.00 0.00 H new ATOM 0 HG3 MET A 125 12.638 1.575 -6.860 1.00 0.00 H new ATOM 0 HE1 MET A 125 9.128 1.160 -7.040 1.00 0.00 H new ATOM 0 HE2 MET A 125 10.773 0.579 -6.688 1.00 0.00 H new ATOM 0 HE3 MET A 125 9.793 1.313 -5.396 1.00 0.00 H new ATOM 1978 N GLN A 126 12.945 5.546 -3.955 1.00 0.00 N ATOM 1979 CA GLN A 126 12.783 6.479 -2.853 1.00 0.00 C ATOM 1980 C GLN A 126 11.539 6.125 -2.036 1.00 0.00 C ATOM 1981 O GLN A 126 10.544 5.655 -2.587 1.00 0.00 O ATOM 1982 CB GLN A 126 12.715 7.920 -3.361 1.00 0.00 C ATOM 1983 CG GLN A 126 13.948 8.266 -4.197 1.00 0.00 C ATOM 1984 CD GLN A 126 13.562 9.090 -5.427 1.00 0.00 C ATOM 1985 OE1 GLN A 126 12.610 8.795 -6.131 1.00 0.00 O ATOM 1986 NE2 GLN A 126 14.353 10.137 -5.647 1.00 0.00 N ATOM 0 H GLN A 126 12.122 5.439 -4.548 1.00 0.00 H new ATOM 0 HA GLN A 126 13.654 6.399 -2.203 1.00 0.00 H new ATOM 0 HB2 GLN A 126 11.815 8.056 -3.961 1.00 0.00 H new ATOM 0 HB3 GLN A 126 12.641 8.604 -2.516 1.00 0.00 H new ATOM 0 HG2 GLN A 126 14.659 8.825 -3.589 1.00 0.00 H new ATOM 0 HG3 GLN A 126 14.448 7.350 -4.511 1.00 0.00 H new ATOM 0 HE21 GLN A 126 15.133 10.328 -5.018 1.00 0.00 H new ATOM 0 HE22 GLN A 126 14.179 10.749 -6.444 1.00 0.00 H new ATOM 1995 N LEU A 127 11.635 6.365 -0.737 1.00 0.00 N ATOM 1996 CA LEU A 127 10.529 6.077 0.161 1.00 0.00 C ATOM 1997 C LEU A 127 9.660 7.328 0.310 1.00 0.00 C ATOM 1998 O LEU A 127 9.908 8.341 -0.341 1.00 0.00 O ATOM 1999 CB LEU A 127 11.047 5.527 1.491 1.00 0.00 C ATOM 2000 CG LEU A 127 12.377 4.773 1.432 1.00 0.00 C ATOM 2001 CD1 LEU A 127 13.212 5.034 2.688 1.00 0.00 C ATOM 2002 CD2 LEU A 127 12.150 3.279 1.195 1.00 0.00 C ATOM 0 H LEU A 127 12.461 6.756 -0.284 1.00 0.00 H new ATOM 0 HA LEU A 127 9.895 5.294 -0.255 1.00 0.00 H new ATOM 0 HB2 LEU A 127 11.154 6.358 2.188 1.00 0.00 H new ATOM 0 HB3 LEU A 127 10.291 4.859 1.904 1.00 0.00 H new ATOM 0 HG LEU A 127 12.946 5.151 0.583 1.00 0.00 H new ATOM 0 HD11 LEU A 127 14.152 4.486 2.620 1.00 0.00 H new ATOM 0 HD12 LEU A 127 13.419 6.101 2.772 1.00 0.00 H new ATOM 0 HD13 LEU A 127 12.661 4.701 3.567 1.00 0.00 H new ATOM 0 HD21 LEU A 127 13.111 2.766 1.157 1.00 0.00 H new ATOM 0 HD22 LEU A 127 11.551 2.868 2.008 1.00 0.00 H new ATOM 0 HD23 LEU A 127 11.625 3.136 0.250 1.00 0.00 H new ATOM 2014 N PRO A 128 8.632 7.212 1.193 1.00 0.00 N ATOM 2015 CA PRO A 128 7.725 8.321 1.435 1.00 0.00 C ATOM 2016 C PRO A 128 8.391 9.395 2.297 1.00 0.00 C ATOM 2017 O PRO A 128 8.922 9.097 3.366 1.00 0.00 O ATOM 2018 CB PRO A 128 6.509 7.696 2.099 1.00 0.00 C ATOM 2019 CG PRO A 128 6.968 6.345 2.624 1.00 0.00 C ATOM 2020 CD PRO A 128 8.308 6.027 1.981 1.00 0.00 C ATOM 0 HA PRO A 128 7.440 8.840 0.520 1.00 0.00 H new ATOM 0 HB2 PRO A 128 6.140 8.325 2.909 1.00 0.00 H new ATOM 0 HB3 PRO A 128 5.691 7.581 1.387 1.00 0.00 H new ATOM 0 HG2 PRO A 128 7.061 6.369 3.710 1.00 0.00 H new ATOM 0 HG3 PRO A 128 6.236 5.573 2.384 1.00 0.00 H new ATOM 0 HD2 PRO A 128 9.072 5.831 2.734 1.00 0.00 H new ATOM 0 HD3 PRO A 128 8.245 5.139 1.352 1.00 0.00 H new ATOM 2028 N THR A 129 8.341 10.622 1.801 1.00 0.00 N ATOM 2029 CA THR A 129 8.932 11.743 2.512 1.00 0.00 C ATOM 2030 C THR A 129 8.077 12.116 3.724 1.00 0.00 C ATOM 2031 O THR A 129 6.851 12.163 3.633 1.00 0.00 O ATOM 2032 CB THR A 129 9.112 12.892 1.518 1.00 0.00 C ATOM 2033 OG1 THR A 129 7.949 12.826 0.697 1.00 0.00 O ATOM 2034 CG2 THR A 129 10.268 12.650 0.546 1.00 0.00 C ATOM 0 H THR A 129 7.900 10.865 0.914 1.00 0.00 H new ATOM 0 HA THR A 129 9.912 11.485 2.913 1.00 0.00 H new ATOM 0 HB THR A 129 9.285 13.820 2.063 1.00 0.00 H new ATOM 0 HG1 THR A 129 7.983 13.538 0.024 1.00 0.00 H new ATOM 0 HG21 THR A 129 10.352 13.495 -0.137 1.00 0.00 H new ATOM 0 HG22 THR A 129 11.197 12.542 1.105 1.00 0.00 H new ATOM 0 HG23 THR A 129 10.080 11.740 -0.024 1.00 0.00 H new ATOM 2042 N LEU A 130 8.757 12.371 4.832 1.00 0.00 N ATOM 2043 CA LEU A 130 8.075 12.739 6.062 1.00 0.00 C ATOM 2044 C LEU A 130 6.932 13.703 5.737 1.00 0.00 C ATOM 2045 O LEU A 130 5.853 13.611 6.319 1.00 0.00 O ATOM 2046 CB LEU A 130 9.072 13.289 7.084 1.00 0.00 C ATOM 2047 CG LEU A 130 10.053 12.275 7.676 1.00 0.00 C ATOM 2048 CD1 LEU A 130 10.640 12.785 8.993 1.00 0.00 C ATOM 2049 CD2 LEU A 130 9.395 10.903 7.834 1.00 0.00 C ATOM 0 H LEU A 130 9.774 12.330 4.904 1.00 0.00 H new ATOM 0 HA LEU A 130 7.629 11.860 6.528 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.645 14.086 6.610 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.511 13.742 7.901 1.00 0.00 H new ATOM 0 HG LEU A 130 10.883 12.155 6.979 1.00 0.00 H new ATOM 0 HD11 LEU A 130 11.334 12.045 9.393 1.00 0.00 H new ATOM 0 HD12 LEU A 130 11.169 13.721 8.817 1.00 0.00 H new ATOM 0 HD13 LEU A 130 9.836 12.952 9.709 1.00 0.00 H new ATOM 0 HD21 LEU A 130 10.114 10.201 8.257 1.00 0.00 H new ATOM 0 HD22 LEU A 130 8.535 10.986 8.499 1.00 0.00 H new ATOM 0 HD23 LEU A 130 9.066 10.543 6.859 1.00 0.00 H new ATOM 2061 N ASP A 131 7.209 14.607 4.808 1.00 0.00 N ATOM 2062 CA ASP A 131 6.217 15.587 4.399 1.00 0.00 C ATOM 2063 C ASP A 131 5.004 14.864 3.810 1.00 0.00 C ATOM 2064 O ASP A 131 3.869 15.128 4.203 1.00 0.00 O ATOM 2065 CB ASP A 131 6.778 16.522 3.325 1.00 0.00 C ATOM 2066 CG ASP A 131 5.849 17.667 2.916 1.00 0.00 C ATOM 2067 OD1 ASP A 131 5.128 18.160 3.810 1.00 0.00 O ATOM 2068 OD2 ASP A 131 5.881 18.023 1.718 1.00 0.00 O ATOM 0 H ASP A 131 8.106 14.681 4.327 1.00 0.00 H new ATOM 0 HA ASP A 131 5.938 16.171 5.276 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.715 16.946 3.687 1.00 0.00 H new ATOM 0 HB3 ASP A 131 7.016 15.933 2.439 1.00 0.00 H new ATOM 2073 N GLU A 132 5.286 13.966 2.877 1.00 0.00 N ATOM 2074 CA GLU A 132 4.232 13.204 2.230 1.00 0.00 C ATOM 2075 C GLU A 132 3.467 12.373 3.263 1.00 0.00 C ATOM 2076 O GLU A 132 2.249 12.230 3.171 1.00 0.00 O ATOM 2077 CB GLU A 132 4.800 12.314 1.123 1.00 0.00 C ATOM 2078 CG GLU A 132 4.579 12.943 -0.254 1.00 0.00 C ATOM 2079 CD GLU A 132 4.147 11.890 -1.276 1.00 0.00 C ATOM 2080 OE1 GLU A 132 4.959 10.973 -1.525 1.00 0.00 O ATOM 2081 OE2 GLU A 132 3.013 12.024 -1.785 1.00 0.00 O ATOM 0 H GLU A 132 6.229 13.749 2.554 1.00 0.00 H new ATOM 0 HA GLU A 132 3.536 13.904 1.768 1.00 0.00 H new ATOM 0 HB2 GLU A 132 5.866 12.158 1.288 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.324 11.334 1.160 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.818 13.721 -0.184 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.498 13.425 -0.589 1.00 0.00 H new ATOM 2088 N ILE A 133 4.214 11.848 4.223 1.00 0.00 N ATOM 2089 CA ILE A 133 3.622 11.035 5.272 1.00 0.00 C ATOM 2090 C ILE A 133 2.556 11.853 6.003 1.00 0.00 C ATOM 2091 O ILE A 133 1.409 11.422 6.121 1.00 0.00 O ATOM 2092 CB ILE A 133 4.707 10.475 6.193 1.00 0.00 C ATOM 2093 CG1 ILE A 133 5.660 9.558 5.424 1.00 0.00 C ATOM 2094 CG2 ILE A 133 4.090 9.774 7.405 1.00 0.00 C ATOM 2095 CD1 ILE A 133 5.243 8.092 5.565 1.00 0.00 C ATOM 0 H ILE A 133 5.224 11.970 4.297 1.00 0.00 H new ATOM 0 HA ILE A 133 3.121 10.166 4.845 1.00 0.00 H new ATOM 0 HB ILE A 133 5.298 11.309 6.570 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.669 9.838 4.371 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.676 9.688 5.797 1.00 0.00 H new ATOM 0 HG21 ILE A 133 4.883 9.385 8.043 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.487 10.486 7.969 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.460 8.951 7.068 1.00 0.00 H new ATOM 0 HD11 ILE A 133 5.937 7.461 5.009 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.259 7.809 6.617 1.00 0.00 H new ATOM 0 HD13 ILE A 133 4.236 7.960 5.169 1.00 0.00 H new ATOM 2107 N ASN A 134 2.971 13.019 6.477 1.00 0.00 N ATOM 2108 CA ASN A 134 2.066 13.901 7.194 1.00 0.00 C ATOM 2109 C ASN A 134 0.925 14.319 6.264 1.00 0.00 C ATOM 2110 O ASN A 134 -0.245 14.107 6.578 1.00 0.00 O ATOM 2111 CB ASN A 134 2.785 15.169 7.658 1.00 0.00 C ATOM 2112 CG ASN A 134 2.078 15.790 8.865 1.00 0.00 C ATOM 2113 OD1 ASN A 134 1.481 16.851 8.788 1.00 0.00 O ATOM 2114 ND2 ASN A 134 2.179 15.072 9.979 1.00 0.00 N ATOM 0 H ASN A 134 3.922 13.373 6.378 1.00 0.00 H new ATOM 0 HA ASN A 134 1.688 13.362 8.063 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.816 14.932 7.919 1.00 0.00 H new ATOM 0 HB3 ASN A 134 2.820 15.891 6.842 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.741 15.401 10.839 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.694 14.192 9.973 1.00 0.00 H new ATOM 2121 N LYS A 135 1.305 14.905 5.139 1.00 0.00 N ATOM 2122 CA LYS A 135 0.328 15.354 4.161 1.00 0.00 C ATOM 2123 C LYS A 135 -0.672 14.228 3.892 1.00 0.00 C ATOM 2124 O LYS A 135 -1.882 14.448 3.926 1.00 0.00 O ATOM 2125 CB LYS A 135 1.028 15.869 2.902 1.00 0.00 C ATOM 2126 CG LYS A 135 1.518 17.306 3.095 1.00 0.00 C ATOM 2127 CD LYS A 135 2.144 17.849 1.809 1.00 0.00 C ATOM 2128 CE LYS A 135 1.129 18.669 1.010 1.00 0.00 C ATOM 2129 NZ LYS A 135 0.899 18.056 -0.318 1.00 0.00 N ATOM 0 H LYS A 135 2.277 15.080 4.882 1.00 0.00 H new ATOM 0 HA LYS A 135 -0.240 16.199 4.550 1.00 0.00 H new ATOM 0 HB2 LYS A 135 1.872 15.223 2.661 1.00 0.00 H new ATOM 0 HB3 LYS A 135 0.341 15.826 2.056 1.00 0.00 H new ATOM 0 HG2 LYS A 135 0.684 17.941 3.394 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.250 17.339 3.902 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.006 18.469 2.054 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.509 17.022 1.200 1.00 0.00 H new ATOM 0 HE2 LYS A 135 0.188 18.728 1.558 1.00 0.00 H new ATOM 0 HE3 LYS A 135 1.492 19.690 0.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 0.208 18.624 -0.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 1.795 18.022 -0.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 0.532 17.091 -0.196 1.00 0.00 H new ATOM 2143 N LYS A 136 -0.130 13.048 3.632 1.00 0.00 N ATOM 2144 CA LYS A 136 -0.961 11.887 3.357 1.00 0.00 C ATOM 2145 C LYS A 136 -1.755 11.525 4.613 1.00 0.00 C ATOM 2146 O LYS A 136 -2.971 11.348 4.554 1.00 0.00 O ATOM 2147 CB LYS A 136 -0.111 10.737 2.814 1.00 0.00 C ATOM 2148 CG LYS A 136 -0.953 9.473 2.627 1.00 0.00 C ATOM 2149 CD LYS A 136 -2.270 9.793 1.916 1.00 0.00 C ATOM 2150 CE LYS A 136 -2.025 10.183 0.458 1.00 0.00 C ATOM 2151 NZ LYS A 136 -3.289 10.140 -0.310 1.00 0.00 N ATOM 0 H LYS A 136 0.874 12.870 3.606 1.00 0.00 H new ATOM 0 HA LYS A 136 -1.686 12.114 2.575 1.00 0.00 H new ATOM 0 HB2 LYS A 136 0.333 11.027 1.862 1.00 0.00 H new ATOM 0 HB3 LYS A 136 0.711 10.532 3.500 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -0.392 8.740 2.048 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -1.160 9.022 3.598 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -2.930 8.927 1.958 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -2.778 10.607 2.433 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -1.598 11.185 0.410 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -1.298 9.505 0.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -3.124 10.504 -1.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -3.628 9.158 -0.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -4.004 10.727 0.165 1.00 0.00 H new ATOM 2165 N GLU A 137 -1.036 11.427 5.722 1.00 0.00 N ATOM 2166 CA GLU A 137 -1.658 11.089 6.990 1.00 0.00 C ATOM 2167 C GLU A 137 -2.956 11.879 7.172 1.00 0.00 C ATOM 2168 O GLU A 137 -4.032 11.294 7.289 1.00 0.00 O ATOM 2169 CB GLU A 137 -0.698 11.337 8.156 1.00 0.00 C ATOM 2170 CG GLU A 137 -1.235 10.721 9.449 1.00 0.00 C ATOM 2171 CD GLU A 137 -0.574 11.356 10.674 1.00 0.00 C ATOM 2172 OE1 GLU A 137 -0.366 12.588 10.632 1.00 0.00 O ATOM 2173 OE2 GLU A 137 -0.293 10.595 11.625 1.00 0.00 O ATOM 0 H GLU A 137 -0.028 11.576 5.768 1.00 0.00 H new ATOM 0 HA GLU A 137 -1.900 10.026 6.981 1.00 0.00 H new ATOM 0 HB2 GLU A 137 0.278 10.912 7.925 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -0.555 12.409 8.292 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -2.315 10.860 9.501 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -1.051 9.647 9.448 1.00 0.00 H new ATOM 2180 N LEU A 138 -2.812 13.196 7.189 1.00 0.00 N ATOM 2181 CA LEU A 138 -3.960 14.072 7.354 1.00 0.00 C ATOM 2182 C LEU A 138 -5.085 13.611 6.426 1.00 0.00 C ATOM 2183 O LEU A 138 -6.235 13.499 6.847 1.00 0.00 O ATOM 2184 CB LEU A 138 -3.552 15.532 7.149 1.00 0.00 C ATOM 2185 CG LEU A 138 -3.048 16.269 8.392 1.00 0.00 C ATOM 2186 CD1 LEU A 138 -3.962 16.010 9.591 1.00 0.00 C ATOM 2187 CD2 LEU A 138 -1.592 15.905 8.692 1.00 0.00 C ATOM 0 H LEU A 138 -1.918 13.678 7.091 1.00 0.00 H new ATOM 0 HA LEU A 138 -4.343 14.012 8.373 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.772 15.567 6.389 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.409 16.076 6.751 1.00 0.00 H new ATOM 0 HG LEU A 138 -3.078 17.340 8.190 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.581 16.545 10.461 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.969 16.359 9.363 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -3.988 14.941 9.805 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.258 16.442 9.580 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -1.514 14.832 8.866 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -0.966 16.181 7.844 1.00 0.00 H new ATOM 2199 N SER A 139 -4.715 13.357 5.179 1.00 0.00 N ATOM 2200 CA SER A 139 -5.679 12.912 4.188 1.00 0.00 C ATOM 2201 C SER A 139 -6.469 11.717 4.727 1.00 0.00 C ATOM 2202 O SER A 139 -7.681 11.634 4.537 1.00 0.00 O ATOM 2203 CB SER A 139 -4.987 12.542 2.874 1.00 0.00 C ATOM 2204 OG SER A 139 -5.432 13.352 1.790 1.00 0.00 O ATOM 0 H SER A 139 -3.760 13.451 4.833 1.00 0.00 H new ATOM 0 HA SER A 139 -6.367 13.733 3.986 1.00 0.00 H new ATOM 0 HB2 SER A 139 -3.909 12.651 2.989 1.00 0.00 H new ATOM 0 HB3 SER A 139 -5.179 11.494 2.646 1.00 0.00 H new ATOM 0 HG SER A 139 -4.966 13.086 0.970 1.00 0.00 H new ATOM 2210 N ILE A 140 -5.750 10.822 5.387 1.00 0.00 N ATOM 2211 CA ILE A 140 -6.368 9.636 5.954 1.00 0.00 C ATOM 2212 C ILE A 140 -7.331 10.051 7.068 1.00 0.00 C ATOM 2213 O ILE A 140 -8.528 9.779 6.993 1.00 0.00 O ATOM 2214 CB ILE A 140 -5.300 8.638 6.406 1.00 0.00 C ATOM 2215 CG1 ILE A 140 -4.694 7.904 5.207 1.00 0.00 C ATOM 2216 CG2 ILE A 140 -5.861 7.668 7.448 1.00 0.00 C ATOM 2217 CD1 ILE A 140 -3.444 8.624 4.698 1.00 0.00 C ATOM 0 H ILE A 140 -4.744 10.894 5.542 1.00 0.00 H new ATOM 0 HA ILE A 140 -6.957 9.116 5.198 1.00 0.00 H new ATOM 0 HB ILE A 140 -4.494 9.194 6.885 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -4.439 6.883 5.492 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -5.431 7.837 4.407 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -5.081 6.970 7.752 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -6.206 8.228 8.317 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -6.696 7.115 7.018 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -3.033 8.082 3.846 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -3.707 9.636 4.391 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -2.700 8.667 5.493 1.00 0.00 H new ATOM 2229 N LYS A 141 -6.772 10.704 8.077 1.00 0.00 N ATOM 2230 CA LYS A 141 -7.567 11.160 9.205 1.00 0.00 C ATOM 2231 C LYS A 141 -8.886 11.742 8.692 1.00 0.00 C ATOM 2232 O LYS A 141 -9.961 11.287 9.081 1.00 0.00 O ATOM 2233 CB LYS A 141 -6.761 12.132 10.069 1.00 0.00 C ATOM 2234 CG LYS A 141 -5.841 11.377 11.031 1.00 0.00 C ATOM 2235 CD LYS A 141 -4.389 11.423 10.549 1.00 0.00 C ATOM 2236 CE LYS A 141 -3.596 12.496 11.298 1.00 0.00 C ATOM 2237 NZ LYS A 141 -3.039 11.946 12.554 1.00 0.00 N ATOM 0 H LYS A 141 -5.779 10.928 8.137 1.00 0.00 H new ATOM 0 HA LYS A 141 -7.819 10.323 9.857 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -6.167 12.786 9.430 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -7.440 12.770 10.635 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -5.912 11.815 12.027 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -6.168 10.341 11.115 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -3.922 10.450 10.698 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -4.364 11.628 9.479 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -2.788 12.867 10.667 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -4.242 13.345 11.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -2.295 12.580 12.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -3.795 11.866 13.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -2.634 11.005 12.372 1.00 0.00 H new ATOM 2251 N GLU A 142 -8.761 12.738 7.828 1.00 0.00 N ATOM 2252 CA GLU A 142 -9.930 13.386 7.259 1.00 0.00 C ATOM 2253 C GLU A 142 -10.969 12.341 6.850 1.00 0.00 C ATOM 2254 O GLU A 142 -12.116 12.394 7.293 1.00 0.00 O ATOM 2255 CB GLU A 142 -9.543 14.269 6.070 1.00 0.00 C ATOM 2256 CG GLU A 142 -9.299 15.712 6.516 1.00 0.00 C ATOM 2257 CD GLU A 142 -10.010 16.700 5.589 1.00 0.00 C ATOM 2258 OE1 GLU A 142 -9.465 16.938 4.489 1.00 0.00 O ATOM 2259 OE2 GLU A 142 -11.082 17.194 6.000 1.00 0.00 O ATOM 0 H GLU A 142 -7.868 13.112 7.508 1.00 0.00 H new ATOM 0 HA GLU A 142 -10.371 14.030 8.020 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -8.644 13.874 5.596 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -10.335 14.245 5.321 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -9.655 15.846 7.538 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -8.229 15.919 6.522 1.00 0.00 H new