USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 960 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 91 LYS NZ :NH3+ -178:sc= 1.2 (180deg=0) USER MOD Set 1.2: A 94 ASN : amide:sc=-0.000969 K(o=1.2,f=-12!) USER MOD Set 2.1: A 63 MET CE :methyl 157:sc= -0.0451 (180deg=-0.857) USER MOD Set 2.2: A 71 THR OG1 : rot 85:sc= 1.2 USER MOD Set 3.1: A 7 LYS NZ :NH3+ -136:sc= 0.36 (180deg=-0.75) USER MOD Set 3.2: A 32 ASN : amide:sc= 0.924 K(o=1.3,f=-10!) USER MOD Single : A 15 SER OG : rot 180:sc= 0.0685 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -165:sc= -0.899 (180deg=-2.1!) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.0372 X(o=-0.037,f=-0.069) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 45 LYS NZ :NH3+ 166:sc= 1.14 (180deg=0.986) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 TYR OH : rot 152:sc= 0 USER MOD Single : A 56 SER OG : rot 74:sc= 0.535 USER MOD Single : A 59 ASN : amide:sc= 0.345 X(o=0.35,f=0) USER MOD Single : A 60 MET CE :methyl 180:sc= -0.0694 (180deg=-0.0694) USER MOD Single : A 62 ASN : amide:sc= -0.173 K(o=-0.17,f=-1.5) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -178:sc= 0 (180deg=-0.00678) USER MOD Single : A 79 SER OG : rot 180:sc= 0.105 USER MOD Single : A 85 MET CE :methyl -173:sc= 0 (180deg=-0.0344) USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.028 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.26 K(o=-0.26,f=-1.1) USER MOD Single : A 104 SER OG : rot -61:sc= 1.22 USER MOD Single : A 106 TYR OH : rot 168:sc= 0.673 USER MOD Single : A 109 LYS NZ :NH3+ -155:sc= 0.251 (180deg=0.0473) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.219 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=0.016) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl -125:sc= -0.341 (180deg=-1.82!) USER MOD ----------------------------------------------------------------- ATOM 79 N LEU A 6 11.389 -9.757 0.708 1.00 0.00 N ATOM 80 CA LEU A 6 10.036 -9.239 0.578 1.00 0.00 C ATOM 81 C LEU A 6 10.008 -7.747 0.245 1.00 0.00 C ATOM 82 O LEU A 6 10.346 -6.921 1.093 1.00 0.00 O ATOM 83 CB LEU A 6 9.269 -9.530 1.869 1.00 0.00 C ATOM 84 CG LEU A 6 7.774 -9.241 1.650 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.972 -10.543 1.687 1.00 0.00 C ATOM 86 CD2 LEU A 6 7.274 -8.236 2.681 1.00 0.00 C ATOM 0 HA LEU A 6 9.555 -9.742 -0.261 1.00 0.00 H new ATOM 0 HB2 LEU A 6 9.411 -10.570 2.163 1.00 0.00 H new ATOM 0 HB3 LEU A 6 9.655 -8.914 2.681 1.00 0.00 H new ATOM 0 HG LEU A 6 7.634 -8.797 0.664 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.916 -10.324 1.531 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.325 -11.210 0.900 1.00 0.00 H new ATOM 0 HD13 LEU A 6 7.103 -11.024 2.656 1.00 0.00 H new ATOM 0 HD21 LEU A 6 6.215 -8.040 2.515 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.415 -8.642 3.683 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.834 -7.306 2.584 1.00 0.00 H new ATOM 98 N LYS A 7 9.634 -7.391 -0.981 1.00 0.00 N ATOM 99 CA LYS A 7 9.646 -6.007 -1.426 1.00 0.00 C ATOM 100 C LYS A 7 8.300 -5.356 -1.118 1.00 0.00 C ATOM 101 O LYS A 7 7.245 -5.908 -1.444 1.00 0.00 O ATOM 102 CB LYS A 7 10.002 -5.936 -2.915 1.00 0.00 C ATOM 103 CG LYS A 7 10.424 -4.507 -3.297 1.00 0.00 C ATOM 104 CD LYS A 7 10.853 -4.403 -4.763 1.00 0.00 C ATOM 105 CE LYS A 7 12.319 -4.711 -5.057 1.00 0.00 C ATOM 106 NZ LYS A 7 13.242 -3.632 -4.665 1.00 0.00 N ATOM 0 H LYS A 7 9.316 -8.053 -1.689 1.00 0.00 H new ATOM 0 HA LYS A 7 10.411 -5.449 -0.886 1.00 0.00 H new ATOM 0 HB2 LYS A 7 10.811 -6.632 -3.136 1.00 0.00 H new ATOM 0 HB3 LYS A 7 9.145 -6.242 -3.515 1.00 0.00 H new ATOM 0 HG2 LYS A 7 9.595 -3.824 -3.114 1.00 0.00 H new ATOM 0 HG3 LYS A 7 11.246 -4.189 -2.656 1.00 0.00 H new ATOM 0 HD2 LYS A 7 10.235 -5.082 -5.350 1.00 0.00 H new ATOM 0 HD3 LYS A 7 10.638 -3.393 -5.113 1.00 0.00 H new ATOM 0 HE2 LYS A 7 12.601 -5.625 -4.535 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.433 -4.905 -6.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 13.940 -3.480 -5.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 12.705 -2.755 -4.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 13.734 -3.897 -3.788 1.00 0.00 H new ATOM 120 N PHE A 8 8.335 -4.169 -0.524 1.00 0.00 N ATOM 121 CA PHE A 8 7.194 -3.272 -0.413 1.00 0.00 C ATOM 122 C PHE A 8 7.124 -2.451 -1.692 1.00 0.00 C ATOM 123 O PHE A 8 8.159 -1.959 -2.142 1.00 0.00 O ATOM 124 CB PHE A 8 7.415 -2.301 0.752 1.00 0.00 C ATOM 125 CG PHE A 8 7.278 -2.903 2.132 1.00 0.00 C ATOM 126 CD1 PHE A 8 8.251 -3.775 2.656 1.00 0.00 C ATOM 127 CD2 PHE A 8 6.152 -2.579 2.904 1.00 0.00 C ATOM 128 CE1 PHE A 8 8.071 -4.325 3.935 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.968 -3.129 4.177 1.00 0.00 C ATOM 130 CZ PHE A 8 6.937 -4.000 4.700 1.00 0.00 C ATOM 0 H PHE A 8 9.181 -3.795 -0.095 1.00 0.00 H new ATOM 0 HA PHE A 8 6.283 -3.847 -0.251 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.412 -1.870 0.659 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.703 -1.481 0.659 1.00 0.00 H new ATOM 0 HD1 PHE A 8 9.130 -4.019 2.078 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.416 -1.894 2.509 1.00 0.00 H new ATOM 0 HE1 PHE A 8 8.810 -5.004 4.335 1.00 0.00 H new ATOM 0 HE2 PHE A 8 5.087 -2.886 4.753 1.00 0.00 H new ATOM 0 HZ PHE A 8 6.812 -4.419 5.687 1.00 0.00 H new ATOM 140 N LEU A 9 5.931 -2.220 -2.234 1.00 0.00 N ATOM 141 CA LEU A 9 5.708 -1.151 -3.197 1.00 0.00 C ATOM 142 C LEU A 9 4.968 -0.039 -2.470 1.00 0.00 C ATOM 143 O LEU A 9 4.078 -0.341 -1.675 1.00 0.00 O ATOM 144 CB LEU A 9 4.880 -1.656 -4.387 1.00 0.00 C ATOM 145 CG LEU A 9 4.946 -0.703 -5.590 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.332 -0.645 -6.250 1.00 0.00 C ATOM 147 CD2 LEU A 9 3.916 -1.164 -6.622 1.00 0.00 C ATOM 0 H LEU A 9 5.097 -2.767 -2.018 1.00 0.00 H new ATOM 0 HA LEU A 9 6.657 -0.790 -3.593 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.241 -2.640 -4.686 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.842 -1.777 -4.079 1.00 0.00 H new ATOM 0 HG LEU A 9 4.735 0.302 -5.225 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.305 0.047 -7.092 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.068 -0.303 -5.522 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.608 -1.638 -6.605 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.945 -0.501 -7.486 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.147 -2.181 -6.937 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.920 -1.139 -6.179 1.00 0.00 H new ATOM 159 N VAL A 10 5.319 1.215 -2.742 1.00 0.00 N ATOM 160 CA VAL A 10 4.680 2.390 -2.171 1.00 0.00 C ATOM 161 C VAL A 10 4.474 3.373 -3.328 1.00 0.00 C ATOM 162 O VAL A 10 5.433 4.012 -3.755 1.00 0.00 O ATOM 163 CB VAL A 10 5.538 2.960 -1.020 1.00 0.00 C ATOM 164 CG1 VAL A 10 4.796 4.109 -0.323 1.00 0.00 C ATOM 165 CG2 VAL A 10 5.918 1.919 0.052 1.00 0.00 C ATOM 0 H VAL A 10 6.077 1.445 -3.384 1.00 0.00 H new ATOM 0 HA VAL A 10 3.714 2.163 -1.719 1.00 0.00 H new ATOM 0 HB VAL A 10 6.459 3.304 -1.490 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.412 4.502 0.486 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.594 4.902 -1.043 1.00 0.00 H new ATOM 0 HG13 VAL A 10 3.854 3.740 0.084 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.520 2.396 0.825 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.012 1.509 0.498 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.491 1.115 -0.409 1.00 0.00 H new ATOM 175 N VAL A 11 3.262 3.454 -3.881 1.00 0.00 N ATOM 176 CA VAL A 11 2.946 4.313 -5.027 1.00 0.00 C ATOM 177 C VAL A 11 2.022 5.407 -4.527 1.00 0.00 C ATOM 178 O VAL A 11 0.803 5.230 -4.550 1.00 0.00 O ATOM 179 CB VAL A 11 2.351 3.519 -6.217 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.371 4.369 -7.493 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.136 2.222 -6.436 1.00 0.00 C ATOM 0 H VAL A 11 2.462 2.919 -3.543 1.00 0.00 H new ATOM 0 HA VAL A 11 3.858 4.755 -5.429 1.00 0.00 H new ATOM 0 HB VAL A 11 1.317 3.269 -5.981 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.950 3.796 -8.319 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.779 5.271 -7.338 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.398 4.645 -7.730 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.707 1.674 -7.275 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.178 2.459 -6.652 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.083 1.608 -5.537 1.00 0.00 H new ATOM 191 N ASP A 12 2.589 6.479 -3.977 1.00 0.00 N ATOM 192 CA ASP A 12 1.804 7.649 -3.613 1.00 0.00 C ATOM 193 C ASP A 12 1.749 8.667 -4.757 1.00 0.00 C ATOM 194 O ASP A 12 2.494 8.585 -5.747 1.00 0.00 O ATOM 195 CB ASP A 12 2.321 8.289 -2.323 1.00 0.00 C ATOM 196 CG ASP A 12 1.315 9.291 -1.731 1.00 0.00 C ATOM 197 OD1 ASP A 12 0.226 8.907 -1.264 1.00 0.00 O ATOM 198 OD2 ASP A 12 1.573 10.505 -1.776 1.00 0.00 O ATOM 0 H ASP A 12 3.586 6.558 -3.776 1.00 0.00 H new ATOM 0 HA ASP A 12 0.784 7.311 -3.427 1.00 0.00 H new ATOM 0 HB2 ASP A 12 2.529 7.509 -1.590 1.00 0.00 H new ATOM 0 HB3 ASP A 12 3.264 8.798 -2.524 1.00 0.00 H new ATOM 203 N ASP A 13 0.920 9.686 -4.581 1.00 0.00 N ATOM 204 CA ASP A 13 0.890 10.912 -5.358 1.00 0.00 C ATOM 205 C ASP A 13 2.152 11.765 -5.149 1.00 0.00 C ATOM 206 O ASP A 13 2.553 12.524 -6.030 1.00 0.00 O ATOM 207 CB ASP A 13 -0.342 11.708 -4.917 1.00 0.00 C ATOM 208 CG ASP A 13 -0.363 13.095 -5.562 1.00 0.00 C ATOM 209 OD1 ASP A 13 -0.279 13.184 -6.809 1.00 0.00 O ATOM 210 OD2 ASP A 13 -0.508 14.112 -4.842 1.00 0.00 O ATOM 0 H ASP A 13 0.210 9.676 -3.849 1.00 0.00 H new ATOM 0 HA ASP A 13 0.849 10.658 -6.417 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -1.246 11.164 -5.189 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.344 11.808 -3.832 1.00 0.00 H new ATOM 215 N PHE A 14 2.787 11.672 -3.984 1.00 0.00 N ATOM 216 CA PHE A 14 3.767 12.611 -3.472 1.00 0.00 C ATOM 217 C PHE A 14 4.968 11.810 -2.981 1.00 0.00 C ATOM 218 O PHE A 14 4.854 11.066 -2.013 1.00 0.00 O ATOM 219 CB PHE A 14 3.085 13.406 -2.343 1.00 0.00 C ATOM 220 CG PHE A 14 3.919 14.412 -1.575 1.00 0.00 C ATOM 221 CD1 PHE A 14 4.820 15.275 -2.229 1.00 0.00 C ATOM 222 CD2 PHE A 14 3.720 14.536 -0.186 1.00 0.00 C ATOM 223 CE1 PHE A 14 5.509 16.258 -1.494 1.00 0.00 C ATOM 224 CE2 PHE A 14 4.402 15.523 0.543 1.00 0.00 C ATOM 225 CZ PHE A 14 5.292 16.390 -0.112 1.00 0.00 C ATOM 0 H PHE A 14 2.619 10.897 -3.342 1.00 0.00 H new ATOM 0 HA PHE A 14 4.122 13.315 -4.225 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.236 13.936 -2.774 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.683 12.690 -1.627 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.982 15.183 -3.293 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.039 13.868 0.321 1.00 0.00 H new ATOM 0 HE1 PHE A 14 6.207 16.913 -1.994 1.00 0.00 H new ATOM 0 HE2 PHE A 14 4.242 15.616 1.607 1.00 0.00 H new ATOM 0 HZ PHE A 14 5.809 17.157 0.446 1.00 0.00 H new ATOM 235 N SER A 15 6.129 11.950 -3.629 1.00 0.00 N ATOM 236 CA SER A 15 7.325 11.152 -3.340 1.00 0.00 C ATOM 237 C SER A 15 7.664 11.139 -1.844 1.00 0.00 C ATOM 238 O SER A 15 8.009 10.095 -1.291 1.00 0.00 O ATOM 239 CB SER A 15 8.516 11.688 -4.145 1.00 0.00 C ATOM 240 OG SER A 15 8.119 12.184 -5.410 1.00 0.00 O ATOM 0 H SER A 15 6.266 12.629 -4.378 1.00 0.00 H new ATOM 0 HA SER A 15 7.114 10.124 -3.634 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.007 12.482 -3.582 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.249 10.893 -4.281 1.00 0.00 H new ATOM 0 HG SER A 15 8.904 12.518 -5.892 1.00 0.00 H new ATOM 246 N THR A 16 7.529 12.284 -1.161 1.00 0.00 N ATOM 247 CA THR A 16 7.761 12.415 0.272 1.00 0.00 C ATOM 248 C THR A 16 6.957 11.377 1.061 1.00 0.00 C ATOM 249 O THR A 16 7.497 10.804 2.003 1.00 0.00 O ATOM 250 CB THR A 16 7.451 13.858 0.684 1.00 0.00 C ATOM 251 OG1 THR A 16 8.406 14.725 0.093 1.00 0.00 O ATOM 252 CG2 THR A 16 7.471 14.102 2.190 1.00 0.00 C ATOM 0 H THR A 16 7.250 13.159 -1.604 1.00 0.00 H new ATOM 0 HA THR A 16 8.805 12.210 0.507 1.00 0.00 H new ATOM 0 HB THR A 16 6.436 14.053 0.339 1.00 0.00 H new ATOM 0 HG1 THR A 16 8.212 15.650 0.351 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.241 15.148 2.392 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.727 13.468 2.671 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.459 13.865 2.584 1.00 0.00 H new ATOM 260 N MET A 17 5.727 11.054 0.663 1.00 0.00 N ATOM 261 CA MET A 17 4.928 10.016 1.296 1.00 0.00 C ATOM 262 C MET A 17 5.661 8.668 1.232 1.00 0.00 C ATOM 263 O MET A 17 5.729 7.968 2.242 1.00 0.00 O ATOM 264 CB MET A 17 3.557 9.963 0.611 1.00 0.00 C ATOM 265 CG MET A 17 2.386 9.637 1.541 1.00 0.00 C ATOM 266 SD MET A 17 2.333 8.018 2.316 1.00 0.00 S ATOM 267 CE MET A 17 2.056 6.900 0.924 1.00 0.00 C ATOM 0 H MET A 17 5.256 11.513 -0.117 1.00 0.00 H new ATOM 0 HA MET A 17 4.777 10.243 2.351 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.367 10.925 0.135 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.592 9.216 -0.182 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.374 10.385 2.334 1.00 0.00 H new ATOM 0 HG3 MET A 17 1.465 9.762 0.971 1.00 0.00 H new ATOM 0 HE1 MET A 17 1.743 5.925 1.297 1.00 0.00 H new ATOM 0 HE2 MET A 17 1.278 7.308 0.279 1.00 0.00 H new ATOM 0 HE3 MET A 17 2.979 6.792 0.355 1.00 0.00 H new ATOM 277 N ARG A 18 6.305 8.325 0.102 1.00 0.00 N ATOM 278 CA ARG A 18 7.100 7.099 0.006 1.00 0.00 C ATOM 279 C ARG A 18 8.276 7.147 0.969 1.00 0.00 C ATOM 280 O ARG A 18 8.577 6.126 1.585 1.00 0.00 O ATOM 281 CB ARG A 18 7.525 6.817 -1.452 1.00 0.00 C ATOM 282 CG ARG A 18 8.327 5.509 -1.648 1.00 0.00 C ATOM 283 CD ARG A 18 9.860 5.654 -1.666 1.00 0.00 C ATOM 284 NE ARG A 18 10.309 6.490 -2.788 1.00 0.00 N ATOM 285 CZ ARG A 18 11.494 6.522 -3.409 1.00 0.00 C ATOM 286 NH1 ARG A 18 12.531 5.794 -3.009 1.00 0.00 N ATOM 287 NH2 ARG A 18 11.634 7.345 -4.434 1.00 0.00 N ATOM 0 H ARG A 18 6.287 8.882 -0.753 1.00 0.00 H new ATOM 0 HA ARG A 18 6.479 6.256 0.307 1.00 0.00 H new ATOM 0 HB2 ARG A 18 6.632 6.777 -2.076 1.00 0.00 H new ATOM 0 HB3 ARG A 18 8.126 7.653 -1.809 1.00 0.00 H new ATOM 0 HG2 ARG A 18 8.057 4.817 -0.850 1.00 0.00 H new ATOM 0 HG3 ARG A 18 8.014 5.051 -2.586 1.00 0.00 H new ATOM 0 HD2 ARG A 18 10.196 6.093 -0.727 1.00 0.00 H new ATOM 0 HD3 ARG A 18 10.319 4.668 -1.739 1.00 0.00 H new ATOM 0 HE ARG A 18 9.613 7.144 -3.147 1.00 0.00 H new ATOM 0 HH11 ARG A 18 12.441 5.180 -2.199 1.00 0.00 H new ATOM 0 HH12 ARG A 18 13.417 5.849 -3.512 1.00 0.00 H new ATOM 0 HH21 ARG A 18 10.852 7.930 -4.729 1.00 0.00 H new ATOM 0 HH22 ARG A 18 12.524 7.395 -4.930 1.00 0.00 H new ATOM 301 N ARG A 19 8.939 8.298 1.138 1.00 0.00 N ATOM 302 CA ARG A 19 10.004 8.422 2.139 1.00 0.00 C ATOM 303 C ARG A 19 9.438 8.190 3.530 1.00 0.00 C ATOM 304 O ARG A 19 10.034 7.427 4.287 1.00 0.00 O ATOM 305 CB ARG A 19 10.717 9.781 2.128 1.00 0.00 C ATOM 306 CG ARG A 19 11.675 9.980 0.954 1.00 0.00 C ATOM 307 CD ARG A 19 10.916 10.196 -0.351 1.00 0.00 C ATOM 308 NE ARG A 19 11.624 11.136 -1.219 1.00 0.00 N ATOM 309 CZ ARG A 19 12.603 10.862 -2.074 1.00 0.00 C ATOM 310 NH1 ARG A 19 12.860 9.610 -2.425 1.00 0.00 N ATOM 311 NH2 ARG A 19 13.317 11.864 -2.552 1.00 0.00 N ATOM 0 H ARG A 19 8.759 9.147 0.601 1.00 0.00 H new ATOM 0 HA ARG A 19 10.743 7.666 1.876 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.967 10.571 2.107 1.00 0.00 H new ATOM 0 HB3 ARG A 19 11.273 9.894 3.059 1.00 0.00 H new ATOM 0 HG2 ARG A 19 12.319 10.838 1.149 1.00 0.00 H new ATOM 0 HG3 ARG A 19 12.324 9.109 0.860 1.00 0.00 H new ATOM 0 HD2 ARG A 19 10.792 9.243 -0.866 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.917 10.575 -0.136 1.00 0.00 H new ATOM 0 HE ARG A 19 11.333 12.112 -1.161 1.00 0.00 H new ATOM 0 HH11 ARG A 19 12.304 8.847 -2.038 1.00 0.00 H new ATOM 0 HH12 ARG A 19 13.614 9.409 -3.082 1.00 0.00 H new ATOM 0 HH21 ARG A 19 13.111 12.820 -2.263 1.00 0.00 H new ATOM 0 HH22 ARG A 19 14.075 11.682 -3.210 1.00 0.00 H new ATOM 325 N ILE A 20 8.325 8.845 3.862 1.00 0.00 N ATOM 326 CA ILE A 20 7.684 8.778 5.162 1.00 0.00 C ATOM 327 C ILE A 20 7.352 7.321 5.475 1.00 0.00 C ATOM 328 O ILE A 20 7.846 6.809 6.477 1.00 0.00 O ATOM 329 CB ILE A 20 6.512 9.792 5.249 1.00 0.00 C ATOM 330 CG1 ILE A 20 6.972 11.129 5.877 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.351 9.289 6.114 1.00 0.00 C ATOM 332 CD1 ILE A 20 8.048 11.872 5.085 1.00 0.00 C ATOM 0 H ILE A 20 7.834 9.455 3.208 1.00 0.00 H new ATOM 0 HA ILE A 20 8.352 9.099 5.961 1.00 0.00 H new ATOM 0 HB ILE A 20 6.180 9.924 4.219 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.105 11.781 5.985 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.350 10.932 6.880 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.562 10.041 6.137 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.958 8.363 5.693 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.706 9.105 7.128 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.307 12.796 5.601 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.935 11.244 4.998 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.671 12.106 4.090 1.00 0.00 H new ATOM 344 N VAL A 21 6.566 6.649 4.632 1.00 0.00 N ATOM 345 CA VAL A 21 6.171 5.256 4.809 1.00 0.00 C ATOM 346 C VAL A 21 7.411 4.374 4.933 1.00 0.00 C ATOM 347 O VAL A 21 7.501 3.609 5.889 1.00 0.00 O ATOM 348 CB VAL A 21 5.258 4.823 3.643 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.977 3.317 3.596 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.915 5.547 3.738 1.00 0.00 C ATOM 0 H VAL A 21 6.179 7.071 3.788 1.00 0.00 H new ATOM 0 HA VAL A 21 5.601 5.144 5.732 1.00 0.00 H new ATOM 0 HB VAL A 21 5.800 5.086 2.735 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.329 3.094 2.749 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.916 2.775 3.487 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.486 3.009 4.519 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.275 5.237 2.912 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.433 5.298 4.683 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.078 6.624 3.687 1.00 0.00 H new ATOM 360 N ARG A 22 8.377 4.484 4.012 1.00 0.00 N ATOM 361 CA ARG A 22 9.619 3.714 4.066 1.00 0.00 C ATOM 362 C ARG A 22 10.306 3.906 5.415 1.00 0.00 C ATOM 363 O ARG A 22 10.733 2.929 6.020 1.00 0.00 O ATOM 364 CB ARG A 22 10.537 4.153 2.914 1.00 0.00 C ATOM 365 CG ARG A 22 11.913 3.472 2.937 1.00 0.00 C ATOM 366 CD ARG A 22 12.907 4.207 2.025 1.00 0.00 C ATOM 367 NE ARG A 22 14.224 4.257 2.671 1.00 0.00 N ATOM 368 CZ ARG A 22 15.348 3.663 2.272 1.00 0.00 C ATOM 369 NH1 ARG A 22 15.454 3.177 1.043 1.00 0.00 N ATOM 370 NH2 ARG A 22 16.357 3.537 3.121 1.00 0.00 N ATOM 0 H ARG A 22 8.316 5.111 3.209 1.00 0.00 H new ATOM 0 HA ARG A 22 9.395 2.653 3.956 1.00 0.00 H new ATOM 0 HB2 ARG A 22 10.047 3.934 1.965 1.00 0.00 H new ATOM 0 HB3 ARG A 22 10.674 5.233 2.960 1.00 0.00 H new ATOM 0 HG2 ARG A 22 12.296 3.453 3.957 1.00 0.00 H new ATOM 0 HG3 ARG A 22 11.815 2.436 2.614 1.00 0.00 H new ATOM 0 HD2 ARG A 22 12.981 3.697 1.065 1.00 0.00 H new ATOM 0 HD3 ARG A 22 12.552 5.217 1.822 1.00 0.00 H new ATOM 0 HE ARG A 22 14.286 4.811 3.525 1.00 0.00 H new ATOM 0 HH11 ARG A 22 14.671 3.256 0.394 1.00 0.00 H new ATOM 0 HH12 ARG A 22 16.318 2.724 0.747 1.00 0.00 H new ATOM 0 HH21 ARG A 22 16.270 3.893 4.073 1.00 0.00 H new ATOM 0 HH22 ARG A 22 17.221 3.083 2.823 1.00 0.00 H new ATOM 384 N ASN A 23 10.452 5.150 5.864 1.00 0.00 N ATOM 385 CA ASN A 23 11.152 5.459 7.100 1.00 0.00 C ATOM 386 C ASN A 23 10.399 4.860 8.279 1.00 0.00 C ATOM 387 O ASN A 23 11.023 4.204 9.096 1.00 0.00 O ATOM 388 CB ASN A 23 11.331 6.968 7.262 1.00 0.00 C ATOM 389 CG ASN A 23 12.028 7.312 8.572 1.00 0.00 C ATOM 390 OD1 ASN A 23 13.224 7.065 8.727 1.00 0.00 O ATOM 391 ND2 ASN A 23 11.317 7.908 9.512 1.00 0.00 N ATOM 0 H ASN A 23 10.087 5.970 5.379 1.00 0.00 H new ATOM 0 HA ASN A 23 12.148 5.017 7.065 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.912 7.358 6.426 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.357 7.456 7.228 1.00 0.00 H new ATOM 0 HD21 ASN A 23 11.758 8.175 10.392 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.327 8.101 9.358 1.00 0.00 H new ATOM 398 N LEU A 24 9.072 5.012 8.356 1.00 0.00 N ATOM 399 CA LEU A 24 8.254 4.437 9.430 1.00 0.00 C ATOM 400 C LEU A 24 8.347 2.907 9.416 1.00 0.00 C ATOM 401 O LEU A 24 8.449 2.285 10.468 1.00 0.00 O ATOM 402 CB LEU A 24 6.784 4.867 9.289 1.00 0.00 C ATOM 403 CG LEU A 24 6.528 6.385 9.410 1.00 0.00 C ATOM 404 CD1 LEU A 24 5.163 6.691 8.789 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.605 6.939 10.834 1.00 0.00 C ATOM 0 H LEU A 24 8.532 5.541 7.671 1.00 0.00 H new ATOM 0 HA LEU A 24 8.639 4.809 10.379 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.414 4.529 8.321 1.00 0.00 H new ATOM 0 HB3 LEU A 24 6.197 4.354 10.051 1.00 0.00 H new ATOM 0 HG LEU A 24 7.335 6.888 8.877 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.961 7.759 8.863 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.166 6.394 7.740 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.389 6.137 9.321 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.412 8.012 10.818 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.860 6.445 11.457 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.599 6.756 11.243 1.00 0.00 H new ATOM 417 N LEU A 25 8.344 2.285 8.235 1.00 0.00 N ATOM 418 CA LEU A 25 8.572 0.851 8.073 1.00 0.00 C ATOM 419 C LEU A 25 9.954 0.459 8.590 1.00 0.00 C ATOM 420 O LEU A 25 10.104 -0.604 9.188 1.00 0.00 O ATOM 421 CB LEU A 25 8.432 0.468 6.590 1.00 0.00 C ATOM 422 CG LEU A 25 6.968 0.313 6.151 1.00 0.00 C ATOM 423 CD1 LEU A 25 6.867 0.359 4.626 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.395 -1.013 6.653 1.00 0.00 C ATOM 0 H LEU A 25 8.181 2.772 7.354 1.00 0.00 H new ATOM 0 HA LEU A 25 7.826 0.312 8.657 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.912 1.230 5.976 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.962 -0.467 6.409 1.00 0.00 H new ATOM 0 HG LEU A 25 6.396 1.136 6.579 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.825 0.248 4.327 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.249 1.314 4.265 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.456 -0.452 4.198 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.357 -1.105 6.333 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.976 -1.839 6.243 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.442 -1.041 7.742 1.00 0.00 H new ATOM 436 N LYS A 26 10.965 1.300 8.380 1.00 0.00 N ATOM 437 CA LYS A 26 12.304 1.103 8.914 1.00 0.00 C ATOM 438 C LYS A 26 12.351 1.310 10.426 1.00 0.00 C ATOM 439 O LYS A 26 13.085 0.573 11.082 1.00 0.00 O ATOM 440 CB LYS A 26 13.292 2.026 8.177 1.00 0.00 C ATOM 441 CG LYS A 26 14.033 1.276 7.062 1.00 0.00 C ATOM 442 CD LYS A 26 15.153 0.439 7.689 1.00 0.00 C ATOM 443 CE LYS A 26 15.949 -0.351 6.652 1.00 0.00 C ATOM 444 NZ LYS A 26 17.013 -1.124 7.320 1.00 0.00 N ATOM 0 H LYS A 26 10.871 2.150 7.824 1.00 0.00 H new ATOM 0 HA LYS A 26 12.599 0.068 8.742 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.753 2.873 7.752 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.013 2.431 8.887 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.342 0.633 6.516 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.447 1.983 6.343 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.829 1.096 8.237 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.723 -0.252 8.414 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.286 -1.023 6.107 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.386 0.329 5.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.551 -1.660 6.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.652 -0.474 7.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.587 -1.784 8.001 1.00 0.00 H new ATOM 458 N GLU A 27 11.578 2.243 10.990 1.00 0.00 N ATOM 459 CA GLU A 27 11.436 2.400 12.436 1.00 0.00 C ATOM 460 C GLU A 27 10.873 1.104 13.022 1.00 0.00 C ATOM 461 O GLU A 27 11.337 0.653 14.068 1.00 0.00 O ATOM 462 CB GLU A 27 10.509 3.577 12.811 1.00 0.00 C ATOM 463 CG GLU A 27 10.986 4.980 12.411 1.00 0.00 C ATOM 464 CD GLU A 27 12.277 5.377 13.115 1.00 0.00 C ATOM 465 OE1 GLU A 27 12.211 5.785 14.300 1.00 0.00 O ATOM 466 OE2 GLU A 27 13.367 5.264 12.515 1.00 0.00 O ATOM 0 H GLU A 27 11.031 2.914 10.450 1.00 0.00 H new ATOM 0 HA GLU A 27 12.422 2.618 12.847 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.536 3.404 12.352 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.359 3.563 13.891 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.138 5.015 11.332 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.208 5.706 12.647 1.00 0.00 H new ATOM 473 N LEU A 28 9.882 0.495 12.358 1.00 0.00 N ATOM 474 CA LEU A 28 9.318 -0.789 12.762 1.00 0.00 C ATOM 475 C LEU A 28 10.379 -1.882 12.645 1.00 0.00 C ATOM 476 O LEU A 28 10.682 -2.529 13.650 1.00 0.00 O ATOM 477 CB LEU A 28 8.052 -1.134 11.958 1.00 0.00 C ATOM 478 CG LEU A 28 6.854 -0.215 12.266 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.715 -0.519 11.287 1.00 0.00 C ATOM 480 CD2 LEU A 28 6.353 -0.365 13.710 1.00 0.00 C ATOM 0 H LEU A 28 9.450 0.886 11.521 1.00 0.00 H new ATOM 0 HA LEU A 28 9.010 -0.718 13.805 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.280 -1.074 10.894 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.770 -2.166 12.166 1.00 0.00 H new ATOM 0 HG LEU A 28 7.191 0.815 12.149 1.00 0.00 H new ATOM 0 HD11 LEU A 28 4.866 0.130 11.503 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.056 -0.343 10.267 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.412 -1.560 11.394 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.509 0.305 13.874 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.038 -1.394 13.881 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.156 -0.112 14.402 1.00 0.00 H new ATOM 492 N GLY A 29 10.979 -2.070 11.467 1.00 0.00 N ATOM 493 CA GLY A 29 12.087 -3.004 11.297 1.00 0.00 C ATOM 494 C GLY A 29 12.293 -3.560 9.890 1.00 0.00 C ATOM 495 O GLY A 29 13.129 -4.447 9.733 1.00 0.00 O ATOM 0 H GLY A 29 10.711 -1.582 10.612 1.00 0.00 H new ATOM 0 HA2 GLY A 29 13.006 -2.505 11.606 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.936 -3.842 11.977 1.00 0.00 H new ATOM 499 N PHE A 30 11.545 -3.110 8.881 1.00 0.00 N ATOM 500 CA PHE A 30 11.587 -3.686 7.538 1.00 0.00 C ATOM 501 C PHE A 30 12.727 -3.112 6.693 1.00 0.00 C ATOM 502 O PHE A 30 13.376 -2.132 7.063 1.00 0.00 O ATOM 503 CB PHE A 30 10.238 -3.451 6.851 1.00 0.00 C ATOM 504 CG PHE A 30 9.103 -4.215 7.496 1.00 0.00 C ATOM 505 CD1 PHE A 30 8.860 -5.550 7.121 1.00 0.00 C ATOM 506 CD2 PHE A 30 8.296 -3.600 8.470 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.784 -6.252 7.685 1.00 0.00 C ATOM 508 CE2 PHE A 30 7.241 -4.315 9.058 1.00 0.00 C ATOM 509 CZ PHE A 30 6.974 -5.635 8.652 1.00 0.00 C ATOM 0 H PHE A 30 10.891 -2.333 8.974 1.00 0.00 H new ATOM 0 HA PHE A 30 11.778 -4.755 7.633 1.00 0.00 H new ATOM 0 HB2 PHE A 30 10.008 -2.386 6.870 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.315 -3.742 5.803 1.00 0.00 H new ATOM 0 HD1 PHE A 30 9.502 -6.034 6.399 1.00 0.00 H new ATOM 0 HD2 PHE A 30 8.488 -2.579 8.765 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.579 -7.266 7.376 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.634 -3.852 9.822 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.145 -6.175 9.085 1.00 0.00 H new ATOM 519 N ASN A 31 12.938 -3.703 5.514 1.00 0.00 N ATOM 520 CA ASN A 31 13.785 -3.201 4.438 1.00 0.00 C ATOM 521 C ASN A 31 13.113 -3.542 3.096 1.00 0.00 C ATOM 522 O ASN A 31 12.040 -4.144 3.092 1.00 0.00 O ATOM 523 CB ASN A 31 15.220 -3.761 4.568 1.00 0.00 C ATOM 524 CG ASN A 31 15.472 -5.041 3.774 1.00 0.00 C ATOM 525 OD1 ASN A 31 16.071 -4.988 2.705 1.00 0.00 O ATOM 526 ND2 ASN A 31 15.027 -6.189 4.248 1.00 0.00 N ATOM 0 H ASN A 31 12.497 -4.592 5.276 1.00 0.00 H new ATOM 0 HA ASN A 31 13.889 -2.118 4.496 1.00 0.00 H new ATOM 0 HB2 ASN A 31 15.926 -2.999 4.238 1.00 0.00 H new ATOM 0 HB3 ASN A 31 15.428 -3.954 5.620 1.00 0.00 H new ATOM 0 HD21 ASN A 31 15.179 -7.051 3.724 1.00 0.00 H new ATOM 0 HD22 ASN A 31 14.531 -6.215 5.139 1.00 0.00 H new ATOM 533 N ASN A 32 13.746 -3.160 1.982 1.00 0.00 N ATOM 534 CA ASN A 32 13.382 -3.447 0.593 1.00 0.00 C ATOM 535 C ASN A 32 12.062 -2.801 0.195 1.00 0.00 C ATOM 536 O ASN A 32 11.013 -3.439 0.190 1.00 0.00 O ATOM 537 CB ASN A 32 13.425 -4.945 0.238 1.00 0.00 C ATOM 538 CG ASN A 32 13.489 -5.169 -1.274 1.00 0.00 C ATOM 539 OD1 ASN A 32 13.788 -4.256 -2.038 1.00 0.00 O ATOM 540 ND2 ASN A 32 13.231 -6.372 -1.764 1.00 0.00 N ATOM 0 H ASN A 32 14.595 -2.597 2.034 1.00 0.00 H new ATOM 0 HA ASN A 32 14.162 -2.982 -0.010 1.00 0.00 H new ATOM 0 HB2 ASN A 32 14.292 -5.406 0.711 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.542 -5.440 0.642 1.00 0.00 H new ATOM 0 HD21 ASN A 32 13.281 -6.535 -2.770 1.00 0.00 H new ATOM 0 HD22 ASN A 32 12.982 -7.136 -1.136 1.00 0.00 H new ATOM 547 N VAL A 33 12.112 -1.521 -0.166 1.00 0.00 N ATOM 548 CA VAL A 33 10.949 -0.807 -0.680 1.00 0.00 C ATOM 549 C VAL A 33 11.204 -0.400 -2.132 1.00 0.00 C ATOM 550 O VAL A 33 12.369 -0.323 -2.548 1.00 0.00 O ATOM 551 CB VAL A 33 10.579 0.376 0.243 1.00 0.00 C ATOM 552 CG1 VAL A 33 10.563 -0.007 1.741 1.00 0.00 C ATOM 553 CG2 VAL A 33 11.514 1.583 0.073 1.00 0.00 C ATOM 0 H VAL A 33 12.957 -0.953 -0.110 1.00 0.00 H new ATOM 0 HA VAL A 33 10.076 -1.460 -0.680 1.00 0.00 H new ATOM 0 HB VAL A 33 9.572 0.650 -0.071 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.296 0.866 2.337 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.830 -0.797 1.907 1.00 0.00 H new ATOM 0 HG13 VAL A 33 11.551 -0.360 2.037 1.00 0.00 H new ATOM 0 HG21 VAL A 33 11.204 2.381 0.747 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.537 1.287 0.307 1.00 0.00 H new ATOM 0 HG23 VAL A 33 11.466 1.938 -0.956 1.00 0.00 H new ATOM 563 N GLU A 34 10.143 -0.075 -2.864 1.00 0.00 N ATOM 564 CA GLU A 34 10.163 0.568 -4.166 1.00 0.00 C ATOM 565 C GLU A 34 9.031 1.590 -4.272 1.00 0.00 C ATOM 566 O GLU A 34 8.136 1.639 -3.424 1.00 0.00 O ATOM 567 CB GLU A 34 10.042 -0.483 -5.290 1.00 0.00 C ATOM 568 CG GLU A 34 11.393 -0.813 -5.931 1.00 0.00 C ATOM 569 CD GLU A 34 12.039 0.362 -6.678 1.00 0.00 C ATOM 570 OE1 GLU A 34 11.556 1.519 -6.610 1.00 0.00 O ATOM 571 OE2 GLU A 34 13.068 0.132 -7.348 1.00 0.00 O ATOM 0 H GLU A 34 9.194 -0.266 -2.543 1.00 0.00 H new ATOM 0 HA GLU A 34 11.114 1.088 -4.279 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.603 -1.395 -4.885 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.360 -0.114 -6.056 1.00 0.00 H new ATOM 0 HG2 GLU A 34 12.077 -1.155 -5.154 1.00 0.00 H new ATOM 0 HG3 GLU A 34 11.260 -1.642 -6.626 1.00 0.00 H new ATOM 578 N GLU A 35 9.077 2.370 -5.348 1.00 0.00 N ATOM 579 CA GLU A 35 8.100 3.358 -5.779 1.00 0.00 C ATOM 580 C GLU A 35 7.639 2.969 -7.196 1.00 0.00 C ATOM 581 O GLU A 35 8.265 2.115 -7.839 1.00 0.00 O ATOM 582 CB GLU A 35 8.782 4.740 -5.723 1.00 0.00 C ATOM 583 CG GLU A 35 7.826 5.941 -5.741 1.00 0.00 C ATOM 584 CD GLU A 35 8.608 7.252 -5.830 1.00 0.00 C ATOM 585 OE1 GLU A 35 8.989 7.819 -4.780 1.00 0.00 O ATOM 586 OE2 GLU A 35 8.978 7.663 -6.955 1.00 0.00 O ATOM 0 H GLU A 35 9.866 2.321 -5.993 1.00 0.00 H new ATOM 0 HA GLU A 35 7.217 3.397 -5.142 1.00 0.00 H new ATOM 0 HB2 GLU A 35 9.388 4.792 -4.819 1.00 0.00 H new ATOM 0 HB3 GLU A 35 9.464 4.826 -6.569 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.146 5.859 -6.589 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.213 5.938 -4.840 1.00 0.00 H new ATOM 593 N ALA A 36 6.573 3.588 -7.707 1.00 0.00 N ATOM 594 CA ALA A 36 6.149 3.495 -9.101 1.00 0.00 C ATOM 595 C ALA A 36 5.651 4.857 -9.568 1.00 0.00 C ATOM 596 O ALA A 36 5.457 5.766 -8.757 1.00 0.00 O ATOM 597 CB ALA A 36 5.039 2.448 -9.269 1.00 0.00 C ATOM 0 H ALA A 36 5.965 4.184 -7.145 1.00 0.00 H new ATOM 0 HA ALA A 36 7.001 3.186 -9.706 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.741 2.398 -10.316 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.407 1.473 -8.950 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.179 2.728 -8.660 1.00 0.00 H new ATOM 603 N GLU A 37 5.405 4.975 -10.868 1.00 0.00 N ATOM 604 CA GLU A 37 4.911 6.208 -11.457 1.00 0.00 C ATOM 605 C GLU A 37 3.435 6.451 -11.123 1.00 0.00 C ATOM 606 O GLU A 37 3.055 7.603 -10.927 1.00 0.00 O ATOM 607 CB GLU A 37 5.139 6.181 -12.973 1.00 0.00 C ATOM 608 CG GLU A 37 6.640 6.216 -13.313 1.00 0.00 C ATOM 609 CD GLU A 37 7.003 7.378 -14.236 1.00 0.00 C ATOM 610 OE1 GLU A 37 6.858 8.565 -13.863 1.00 0.00 O ATOM 611 OE2 GLU A 37 7.485 7.122 -15.364 1.00 0.00 O ATOM 0 H GLU A 37 5.543 4.219 -11.539 1.00 0.00 H new ATOM 0 HA GLU A 37 5.469 7.040 -11.027 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.689 5.282 -13.395 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.640 7.033 -13.433 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.216 6.294 -12.391 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.924 5.277 -13.788 1.00 0.00 H new ATOM 618 N ASP A 38 2.616 5.399 -11.046 1.00 0.00 N ATOM 619 CA ASP A 38 1.173 5.434 -10.775 1.00 0.00 C ATOM 620 C ASP A 38 0.662 3.992 -10.764 1.00 0.00 C ATOM 621 O ASP A 38 1.439 3.076 -11.010 1.00 0.00 O ATOM 622 CB ASP A 38 0.367 6.261 -11.804 1.00 0.00 C ATOM 623 CG ASP A 38 -0.173 5.454 -12.985 1.00 0.00 C ATOM 624 OD1 ASP A 38 0.630 5.075 -13.863 1.00 0.00 O ATOM 625 OD2 ASP A 38 -1.398 5.192 -13.014 1.00 0.00 O ATOM 0 H ASP A 38 2.959 4.447 -11.178 1.00 0.00 H new ATOM 0 HA ASP A 38 1.028 5.927 -9.814 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -0.470 6.737 -11.293 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.002 7.060 -12.187 1.00 0.00 H new ATOM 630 N GLY A 39 -0.628 3.768 -10.503 1.00 0.00 N ATOM 631 CA GLY A 39 -1.328 2.494 -10.635 1.00 0.00 C ATOM 632 C GLY A 39 -1.000 1.669 -11.892 1.00 0.00 C ATOM 633 O GLY A 39 -0.849 0.445 -11.783 1.00 0.00 O ATOM 0 H GLY A 39 -1.243 4.513 -10.176 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.104 1.887 -9.758 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.400 2.689 -10.622 1.00 0.00 H new ATOM 637 N VAL A 40 -0.909 2.275 -13.082 1.00 0.00 N ATOM 638 CA VAL A 40 -0.566 1.540 -14.307 1.00 0.00 C ATOM 639 C VAL A 40 0.826 0.929 -14.155 1.00 0.00 C ATOM 640 O VAL A 40 1.023 -0.260 -14.424 1.00 0.00 O ATOM 641 CB VAL A 40 -0.683 2.434 -15.560 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.340 1.674 -16.850 1.00 0.00 C ATOM 643 CG2 VAL A 40 -2.113 2.963 -15.706 1.00 0.00 C ATOM 0 H VAL A 40 -1.068 3.273 -13.223 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.282 0.731 -14.452 1.00 0.00 H new ATOM 0 HB VAL A 40 0.027 3.249 -15.422 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.437 2.344 -17.704 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.684 1.304 -16.793 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.023 0.833 -16.970 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.179 3.592 -16.594 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.803 2.125 -15.802 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.376 3.550 -14.826 1.00 0.00 H new ATOM 653 N ASP A 41 1.791 1.718 -13.692 1.00 0.00 N ATOM 654 CA ASP A 41 3.135 1.223 -13.432 1.00 0.00 C ATOM 655 C ASP A 41 3.140 0.258 -12.242 1.00 0.00 C ATOM 656 O ASP A 41 3.828 -0.759 -12.272 1.00 0.00 O ATOM 657 CB ASP A 41 4.077 2.403 -13.197 1.00 0.00 C ATOM 658 CG ASP A 41 5.544 1.976 -13.140 1.00 0.00 C ATOM 659 OD1 ASP A 41 5.975 1.062 -13.883 1.00 0.00 O ATOM 660 OD2 ASP A 41 6.296 2.604 -12.362 1.00 0.00 O ATOM 0 H ASP A 41 1.664 2.709 -13.489 1.00 0.00 H new ATOM 0 HA ASP A 41 3.486 0.666 -14.301 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.945 3.134 -13.995 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.809 2.898 -12.264 1.00 0.00 H new ATOM 665 N ALA A 42 2.330 0.527 -11.212 1.00 0.00 N ATOM 666 CA ALA A 42 2.297 -0.188 -9.954 1.00 0.00 C ATOM 667 C ALA A 42 1.988 -1.649 -10.202 1.00 0.00 C ATOM 668 O ALA A 42 2.727 -2.514 -9.742 1.00 0.00 O ATOM 669 CB ALA A 42 1.241 0.409 -9.015 1.00 0.00 C ATOM 0 H ALA A 42 1.651 1.288 -11.246 1.00 0.00 H new ATOM 0 HA ALA A 42 3.275 -0.096 -9.481 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.234 -0.145 -8.076 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.478 1.454 -8.818 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.259 0.342 -9.483 1.00 0.00 H new ATOM 675 N LEU A 43 0.912 -1.919 -10.944 1.00 0.00 N ATOM 676 CA LEU A 43 0.480 -3.279 -11.240 1.00 0.00 C ATOM 677 C LEU A 43 1.606 -4.065 -11.916 1.00 0.00 C ATOM 678 O LEU A 43 1.903 -5.208 -11.562 1.00 0.00 O ATOM 679 CB LEU A 43 -0.770 -3.215 -12.122 1.00 0.00 C ATOM 680 CG LEU A 43 -1.530 -4.550 -12.128 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.531 -4.589 -10.968 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.263 -4.741 -13.457 1.00 0.00 C ATOM 0 H LEU A 43 0.318 -1.198 -11.355 1.00 0.00 H new ATOM 0 HA LEU A 43 0.235 -3.803 -10.316 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.428 -2.423 -11.764 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.484 -2.955 -13.141 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.811 -5.360 -12.006 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.065 -5.539 -10.980 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.997 -4.485 -10.023 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.243 -3.771 -11.074 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.796 -5.691 -13.445 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.974 -3.928 -13.600 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.541 -4.740 -14.274 1.00 0.00 H new ATOM 694 N ASN A 44 2.280 -3.420 -12.866 1.00 0.00 N ATOM 695 CA ASN A 44 3.376 -4.025 -13.600 1.00 0.00 C ATOM 696 C ASN A 44 4.635 -4.191 -12.739 1.00 0.00 C ATOM 697 O ASN A 44 5.440 -5.082 -13.004 1.00 0.00 O ATOM 698 CB ASN A 44 3.649 -3.171 -14.834 1.00 0.00 C ATOM 699 CG ASN A 44 4.550 -3.888 -15.821 1.00 0.00 C ATOM 700 OD1 ASN A 44 4.255 -5.008 -16.233 1.00 0.00 O ATOM 701 ND2 ASN A 44 5.605 -3.245 -16.282 1.00 0.00 N ATOM 0 H ASN A 44 2.076 -2.460 -13.145 1.00 0.00 H new ATOM 0 HA ASN A 44 3.092 -5.034 -13.900 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.706 -2.919 -15.318 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.113 -2.232 -14.532 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.194 -3.676 -16.994 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.832 -2.316 -15.926 1.00 0.00 H new ATOM 708 N LYS A 45 4.813 -3.385 -11.683 1.00 0.00 N ATOM 709 CA LYS A 45 5.814 -3.629 -10.639 1.00 0.00 C ATOM 710 C LYS A 45 5.450 -4.897 -9.876 1.00 0.00 C ATOM 711 O LYS A 45 6.345 -5.696 -9.637 1.00 0.00 O ATOM 712 CB LYS A 45 5.962 -2.445 -9.670 1.00 0.00 C ATOM 713 CG LYS A 45 6.306 -1.115 -10.357 1.00 0.00 C ATOM 714 CD LYS A 45 7.746 -0.667 -10.118 1.00 0.00 C ATOM 715 CE LYS A 45 7.909 0.701 -10.793 1.00 0.00 C ATOM 716 NZ LYS A 45 9.139 1.417 -10.405 1.00 0.00 N ATOM 0 H LYS A 45 4.262 -2.540 -11.530 1.00 0.00 H new ATOM 0 HA LYS A 45 6.780 -3.751 -11.130 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.032 -2.325 -9.114 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.740 -2.679 -8.943 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.137 -1.213 -11.429 1.00 0.00 H new ATOM 0 HG3 LYS A 45 5.628 -0.342 -9.997 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.956 -0.598 -9.051 1.00 0.00 H new ATOM 0 HD3 LYS A 45 8.448 -1.389 -10.535 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.906 0.564 -11.874 1.00 0.00 H new ATOM 0 HE3 LYS A 45 7.047 1.321 -10.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.303 2.206 -11.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.035 1.787 -9.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.947 0.763 -10.440 1.00 0.00 H new ATOM 730 N LEU A 46 4.177 -5.139 -9.535 1.00 0.00 N ATOM 731 CA LEU A 46 3.768 -6.398 -8.878 1.00 0.00 C ATOM 732 C LEU A 46 4.210 -7.564 -9.761 1.00 0.00 C ATOM 733 O LEU A 46 4.854 -8.505 -9.293 1.00 0.00 O ATOM 734 CB LEU A 46 2.246 -6.493 -8.585 1.00 0.00 C ATOM 735 CG LEU A 46 1.593 -5.170 -8.192 1.00 0.00 C ATOM 736 CD1 LEU A 46 0.083 -5.305 -8.055 1.00 0.00 C ATOM 737 CD2 LEU A 46 2.182 -4.518 -6.943 1.00 0.00 C ATOM 0 H LEU A 46 3.412 -4.485 -9.700 1.00 0.00 H new ATOM 0 HA LEU A 46 4.253 -6.430 -7.902 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.742 -6.884 -9.469 1.00 0.00 H new ATOM 0 HB3 LEU A 46 2.088 -7.214 -7.783 1.00 0.00 H new ATOM 0 HG LEU A 46 1.820 -4.498 -9.020 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.344 -4.342 -7.774 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.341 -5.627 -9.006 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.148 -6.042 -7.286 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.658 -3.584 -6.739 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.069 -5.191 -6.093 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.240 -4.313 -7.104 1.00 0.00 H new ATOM 749 N GLN A 47 3.929 -7.448 -11.060 1.00 0.00 N ATOM 750 CA GLN A 47 4.327 -8.406 -12.085 1.00 0.00 C ATOM 751 C GLN A 47 5.828 -8.366 -12.434 1.00 0.00 C ATOM 752 O GLN A 47 6.239 -9.010 -13.399 1.00 0.00 O ATOM 753 CB GLN A 47 3.444 -8.213 -13.324 1.00 0.00 C ATOM 754 CG GLN A 47 1.962 -8.442 -12.993 1.00 0.00 C ATOM 755 CD GLN A 47 1.136 -8.530 -14.265 1.00 0.00 C ATOM 756 OE1 GLN A 47 0.553 -7.544 -14.699 1.00 0.00 O ATOM 757 NE2 GLN A 47 1.079 -9.695 -14.894 1.00 0.00 N ATOM 0 H GLN A 47 3.402 -6.660 -11.436 1.00 0.00 H new ATOM 0 HA GLN A 47 4.173 -9.404 -11.676 1.00 0.00 H new ATOM 0 HB2 GLN A 47 3.580 -7.205 -13.717 1.00 0.00 H new ATOM 0 HB3 GLN A 47 3.755 -8.905 -14.107 1.00 0.00 H new ATOM 0 HG2 GLN A 47 1.851 -9.360 -12.417 1.00 0.00 H new ATOM 0 HG3 GLN A 47 1.593 -7.628 -12.369 1.00 0.00 H new ATOM 0 HE21 GLN A 47 1.572 -10.504 -14.515 1.00 0.00 H new ATOM 0 HE22 GLN A 47 0.542 -9.783 -15.757 1.00 0.00 H new ATOM 766 N ALA A 48 6.675 -7.665 -11.671 1.00 0.00 N ATOM 767 CA ALA A 48 8.114 -7.914 -11.673 1.00 0.00 C ATOM 768 C ALA A 48 8.453 -9.190 -10.886 1.00 0.00 C ATOM 769 O ALA A 48 9.625 -9.569 -10.817 1.00 0.00 O ATOM 770 CB ALA A 48 8.877 -6.719 -11.088 1.00 0.00 C ATOM 0 H ALA A 48 6.382 -6.917 -11.042 1.00 0.00 H new ATOM 0 HA ALA A 48 8.423 -8.052 -12.709 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.947 -6.929 -11.100 1.00 0.00 H new ATOM 0 HB2 ALA A 48 8.675 -5.830 -11.686 1.00 0.00 H new ATOM 0 HB3 ALA A 48 8.553 -6.548 -10.062 1.00 0.00 H new ATOM 776 N GLY A 49 7.480 -9.851 -10.251 1.00 0.00 N ATOM 777 CA GLY A 49 7.660 -11.146 -9.618 1.00 0.00 C ATOM 778 C GLY A 49 6.503 -11.437 -8.680 1.00 0.00 C ATOM 779 O GLY A 49 5.562 -12.148 -9.039 1.00 0.00 O ATOM 0 H GLY A 49 6.531 -9.488 -10.165 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.726 -11.924 -10.378 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.599 -11.161 -9.064 1.00 0.00 H new ATOM 783 N GLY A 50 6.592 -10.900 -7.468 1.00 0.00 N ATOM 784 CA GLY A 50 5.673 -11.170 -6.380 1.00 0.00 C ATOM 785 C GLY A 50 6.093 -10.311 -5.200 1.00 0.00 C ATOM 786 O GLY A 50 7.032 -10.662 -4.479 1.00 0.00 O ATOM 0 H GLY A 50 7.331 -10.245 -7.213 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.650 -10.939 -6.677 1.00 0.00 H new ATOM 0 HA3 GLY A 50 5.696 -12.226 -6.112 1.00 0.00 H new ATOM 790 N TYR A 51 5.480 -9.137 -5.075 1.00 0.00 N ATOM 791 CA TYR A 51 5.719 -8.196 -3.984 1.00 0.00 C ATOM 792 C TYR A 51 5.064 -8.696 -2.691 1.00 0.00 C ATOM 793 O TYR A 51 4.301 -9.662 -2.711 1.00 0.00 O ATOM 794 CB TYR A 51 5.186 -6.817 -4.400 1.00 0.00 C ATOM 795 CG TYR A 51 6.217 -5.952 -5.101 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.746 -6.299 -6.361 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.648 -4.771 -4.475 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.669 -5.445 -6.997 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.527 -3.893 -5.126 1.00 0.00 C ATOM 800 CZ TYR A 51 8.018 -4.210 -6.411 1.00 0.00 C ATOM 801 OH TYR A 51 8.851 -3.334 -7.037 1.00 0.00 O ATOM 0 H TYR A 51 4.787 -8.805 -5.746 1.00 0.00 H new ATOM 0 HA TYR A 51 6.788 -8.113 -3.785 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.329 -6.952 -5.060 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.827 -6.293 -3.514 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.444 -7.219 -6.839 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.298 -4.536 -3.481 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.111 -5.737 -7.938 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.828 -2.975 -4.644 1.00 0.00 H new ATOM 0 HH TYR A 51 8.641 -2.421 -6.751 1.00 0.00 H new ATOM 811 N GLY A 52 5.349 -8.042 -1.565 1.00 0.00 N ATOM 812 CA GLY A 52 4.770 -8.384 -0.269 1.00 0.00 C ATOM 813 C GLY A 52 3.643 -7.457 0.169 1.00 0.00 C ATOM 814 O GLY A 52 2.749 -7.903 0.887 1.00 0.00 O ATOM 0 H GLY A 52 5.994 -7.253 -1.528 1.00 0.00 H new ATOM 0 HA2 GLY A 52 4.392 -9.405 -0.310 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.556 -8.365 0.485 1.00 0.00 H new ATOM 818 N PHE A 53 3.678 -6.187 -0.244 1.00 0.00 N ATOM 819 CA PHE A 53 2.671 -5.186 0.092 1.00 0.00 C ATOM 820 C PHE A 53 2.524 -4.232 -1.079 1.00 0.00 C ATOM 821 O PHE A 53 3.514 -3.945 -1.763 1.00 0.00 O ATOM 822 CB PHE A 53 3.087 -4.370 1.326 1.00 0.00 C ATOM 823 CG PHE A 53 3.338 -5.173 2.583 1.00 0.00 C ATOM 824 CD1 PHE A 53 2.277 -5.497 3.446 1.00 0.00 C ATOM 825 CD2 PHE A 53 4.643 -5.591 2.896 1.00 0.00 C ATOM 826 CE1 PHE A 53 2.521 -6.276 4.591 1.00 0.00 C ATOM 827 CE2 PHE A 53 4.887 -6.318 4.071 1.00 0.00 C ATOM 828 CZ PHE A 53 3.825 -6.684 4.909 1.00 0.00 C ATOM 0 H PHE A 53 4.425 -5.822 -0.834 1.00 0.00 H new ATOM 0 HA PHE A 53 1.734 -5.700 0.308 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.993 -3.814 1.084 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.308 -3.636 1.534 1.00 0.00 H new ATOM 0 HD1 PHE A 53 1.278 -5.149 3.230 1.00 0.00 H new ATOM 0 HD2 PHE A 53 5.460 -5.352 2.231 1.00 0.00 H new ATOM 0 HE1 PHE A 53 1.699 -6.562 5.230 1.00 0.00 H new ATOM 0 HE2 PHE A 53 5.898 -6.597 4.331 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.009 -7.276 5.793 1.00 0.00 H new ATOM 838 N VAL A 54 1.314 -3.705 -1.261 1.00 0.00 N ATOM 839 CA VAL A 54 0.974 -2.803 -2.352 1.00 0.00 C ATOM 840 C VAL A 54 0.389 -1.554 -1.701 1.00 0.00 C ATOM 841 O VAL A 54 -0.824 -1.436 -1.525 1.00 0.00 O ATOM 842 CB VAL A 54 0.009 -3.497 -3.339 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.043 -2.825 -4.712 1.00 0.00 C ATOM 844 CG2 VAL A 54 0.318 -4.978 -3.524 1.00 0.00 C ATOM 0 H VAL A 54 0.529 -3.899 -0.639 1.00 0.00 H new ATOM 0 HA VAL A 54 1.840 -2.524 -2.953 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.982 -3.400 -2.895 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.646 -3.336 -5.384 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.253 -1.781 -4.613 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.053 -2.879 -5.118 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.392 -5.413 -4.228 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.330 -5.093 -3.912 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.237 -5.489 -2.565 1.00 0.00 H new ATOM 854 N ILE A 55 1.253 -0.669 -1.214 1.00 0.00 N ATOM 855 CA ILE A 55 0.800 0.459 -0.421 1.00 0.00 C ATOM 856 C ILE A 55 0.586 1.590 -1.458 1.00 0.00 C ATOM 857 O ILE A 55 1.465 1.784 -2.304 1.00 0.00 O ATOM 858 CB ILE A 55 1.851 0.707 0.691 1.00 0.00 C ATOM 859 CG1 ILE A 55 1.679 -0.324 1.845 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.603 2.083 1.320 1.00 0.00 C ATOM 861 CD1 ILE A 55 2.974 -0.813 2.511 1.00 0.00 C ATOM 0 H ILE A 55 2.262 -0.713 -1.355 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.135 0.335 0.126 1.00 0.00 H new ATOM 0 HB ILE A 55 2.840 0.629 0.239 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.046 0.122 2.612 1.00 0.00 H new ATOM 0 HG13 ILE A 55 1.145 -1.190 1.455 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.339 2.263 2.103 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.691 2.854 0.555 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.602 2.111 1.750 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.731 -1.526 3.299 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.606 -1.296 1.766 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.505 0.036 2.941 1.00 0.00 H new ATOM 873 N SER A 56 -0.555 2.298 -1.469 1.00 0.00 N ATOM 874 CA SER A 56 -0.830 3.271 -2.545 1.00 0.00 C ATOM 875 C SER A 56 -1.587 4.526 -2.103 1.00 0.00 C ATOM 876 O SER A 56 -2.299 4.480 -1.097 1.00 0.00 O ATOM 877 CB SER A 56 -1.577 2.575 -3.700 1.00 0.00 C ATOM 878 OG SER A 56 -2.957 2.340 -3.433 1.00 0.00 O ATOM 0 H SER A 56 -1.288 2.221 -0.764 1.00 0.00 H new ATOM 0 HA SER A 56 0.145 3.629 -2.875 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.489 3.187 -4.598 1.00 0.00 H new ATOM 0 HB3 SER A 56 -1.091 1.623 -3.914 1.00 0.00 H new ATOM 0 HG SER A 56 -3.450 3.185 -3.492 1.00 0.00 H new ATOM 884 N ASP A 57 -1.525 5.589 -2.921 1.00 0.00 N ATOM 885 CA ASP A 57 -2.490 6.692 -2.915 1.00 0.00 C ATOM 886 C ASP A 57 -3.822 6.239 -3.540 1.00 0.00 C ATOM 887 O ASP A 57 -4.169 5.048 -3.535 1.00 0.00 O ATOM 888 CB ASP A 57 -1.957 8.008 -3.540 1.00 0.00 C ATOM 889 CG ASP A 57 -1.991 8.102 -5.062 1.00 0.00 C ATOM 890 OD1 ASP A 57 -1.152 7.457 -5.718 1.00 0.00 O ATOM 891 OD2 ASP A 57 -2.854 8.864 -5.548 1.00 0.00 O ATOM 0 H ASP A 57 -0.788 5.705 -3.617 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.666 6.947 -1.870 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -2.536 8.837 -3.134 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -0.927 8.148 -3.213 1.00 0.00 H new ATOM 896 N TRP A 58 -4.608 7.210 -4.005 1.00 0.00 N ATOM 897 CA TRP A 58 -5.991 7.099 -4.413 1.00 0.00 C ATOM 898 C TRP A 58 -6.268 7.801 -5.750 1.00 0.00 C ATOM 899 O TRP A 58 -7.172 7.404 -6.488 1.00 0.00 O ATOM 900 CB TRP A 58 -6.819 7.773 -3.311 1.00 0.00 C ATOM 901 CG TRP A 58 -8.285 7.672 -3.538 1.00 0.00 C ATOM 902 CD1 TRP A 58 -9.048 8.547 -4.231 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.149 6.559 -3.202 1.00 0.00 C ATOM 904 NE1 TRP A 58 -10.317 8.026 -4.373 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.435 6.797 -3.763 1.00 0.00 C ATOM 906 CE3 TRP A 58 -8.946 5.352 -2.510 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.481 5.871 -3.636 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -9.989 4.422 -2.387 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.249 4.680 -2.938 1.00 0.00 C ATOM 0 H TRP A 58 -4.259 8.163 -4.111 1.00 0.00 H new ATOM 0 HA TRP A 58 -6.246 6.049 -4.553 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.574 7.318 -2.351 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.539 8.824 -3.246 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -8.717 9.502 -4.612 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -11.075 8.494 -4.869 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -7.982 5.140 -2.071 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.449 6.074 -4.070 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -9.817 3.495 -1.860 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.045 3.958 -2.824 1.00 0.00 H new ATOM 920 N ASN A 59 -5.528 8.864 -6.055 1.00 0.00 N ATOM 921 CA ASN A 59 -5.861 9.918 -7.003 1.00 0.00 C ATOM 922 C ASN A 59 -4.855 9.996 -8.154 1.00 0.00 C ATOM 923 O ASN A 59 -4.626 11.078 -8.702 1.00 0.00 O ATOM 924 CB ASN A 59 -6.046 11.250 -6.245 1.00 0.00 C ATOM 925 CG ASN A 59 -4.795 11.754 -5.528 1.00 0.00 C ATOM 926 OD1 ASN A 59 -4.714 11.709 -4.304 1.00 0.00 O ATOM 927 ND2 ASN A 59 -3.822 12.279 -6.249 1.00 0.00 N ATOM 0 H ASN A 59 -4.620 9.020 -5.616 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.809 9.683 -7.486 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -6.375 12.012 -6.951 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.844 11.128 -5.513 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.992 12.653 -5.790 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.901 12.311 -7.265 1.00 0.00 H new ATOM 934 N MET A 60 -4.286 8.854 -8.542 1.00 0.00 N ATOM 935 CA MET A 60 -3.334 8.665 -9.634 1.00 0.00 C ATOM 936 C MET A 60 -3.730 9.408 -10.924 1.00 0.00 C ATOM 937 O MET A 60 -4.925 9.601 -11.193 1.00 0.00 O ATOM 938 CB MET A 60 -3.253 7.168 -9.968 1.00 0.00 C ATOM 939 CG MET A 60 -2.651 6.288 -8.870 1.00 0.00 C ATOM 940 SD MET A 60 -3.713 5.924 -7.451 1.00 0.00 S ATOM 941 CE MET A 60 -2.673 4.671 -6.661 1.00 0.00 C ATOM 0 H MET A 60 -4.494 7.976 -8.067 1.00 0.00 H new ATOM 0 HA MET A 60 -2.381 9.069 -9.292 1.00 0.00 H new ATOM 0 HB2 MET A 60 -4.257 6.807 -10.191 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.661 7.046 -10.875 1.00 0.00 H new ATOM 0 HG2 MET A 60 -2.347 5.343 -9.319 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.746 6.772 -8.503 1.00 0.00 H new ATOM 0 HE1 MET A 60 -3.159 4.314 -5.753 1.00 0.00 H new ATOM 0 HE2 MET A 60 -2.525 3.836 -7.346 1.00 0.00 H new ATOM 0 HE3 MET A 60 -1.707 5.107 -6.407 1.00 0.00 H new ATOM 951 N PRO A 61 -2.758 9.758 -11.789 1.00 0.00 N ATOM 952 CA PRO A 61 -3.025 10.401 -13.070 1.00 0.00 C ATOM 953 C PRO A 61 -3.731 9.476 -14.067 1.00 0.00 C ATOM 954 O PRO A 61 -4.446 9.972 -14.940 1.00 0.00 O ATOM 955 CB PRO A 61 -1.662 10.855 -13.599 1.00 0.00 C ATOM 956 CG PRO A 61 -0.674 9.898 -12.935 1.00 0.00 C ATOM 957 CD PRO A 61 -1.322 9.636 -11.578 1.00 0.00 C ATOM 0 HA PRO A 61 -3.711 11.238 -12.938 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -1.613 10.789 -14.686 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -1.455 11.891 -13.333 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -0.551 8.980 -13.509 1.00 0.00 H new ATOM 0 HG3 PRO A 61 0.315 10.344 -12.832 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -1.065 8.644 -11.208 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -0.974 10.353 -10.835 1.00 0.00 H new ATOM 965 N ASN A 62 -3.578 8.152 -13.951 1.00 0.00 N ATOM 966 CA ASN A 62 -4.240 7.184 -14.816 1.00 0.00 C ATOM 967 C ASN A 62 -5.114 6.277 -13.960 1.00 0.00 C ATOM 968 O ASN A 62 -6.205 6.694 -13.569 1.00 0.00 O ATOM 969 CB ASN A 62 -3.221 6.446 -15.698 1.00 0.00 C ATOM 970 CG ASN A 62 -3.889 5.712 -16.856 1.00 0.00 C ATOM 971 OD1 ASN A 62 -4.645 4.761 -16.671 1.00 0.00 O ATOM 972 ND2 ASN A 62 -3.617 6.119 -18.081 1.00 0.00 N ATOM 0 H ASN A 62 -2.982 7.723 -13.243 1.00 0.00 H new ATOM 0 HA ASN A 62 -4.901 7.685 -15.523 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -2.498 7.161 -16.091 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -2.665 5.732 -15.090 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -4.035 5.644 -18.881 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.989 6.909 -18.228 1.00 0.00 H new ATOM 979 N MET A 63 -4.642 5.075 -13.630 1.00 0.00 N ATOM 980 CA MET A 63 -5.457 4.083 -12.938 1.00 0.00 C ATOM 981 C MET A 63 -5.525 4.443 -11.458 1.00 0.00 C ATOM 982 O MET A 63 -4.536 4.296 -10.742 1.00 0.00 O ATOM 983 CB MET A 63 -4.935 2.662 -13.172 1.00 0.00 C ATOM 984 CG MET A 63 -5.962 1.646 -12.658 1.00 0.00 C ATOM 985 SD MET A 63 -5.539 -0.077 -13.020 1.00 0.00 S ATOM 986 CE MET A 63 -7.084 -0.683 -13.753 1.00 0.00 C ATOM 0 H MET A 63 -3.692 4.765 -13.834 1.00 0.00 H new ATOM 0 HA MET A 63 -6.468 4.096 -13.344 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.750 2.502 -14.234 1.00 0.00 H new ATOM 0 HB3 MET A 63 -3.983 2.524 -12.659 1.00 0.00 H new ATOM 0 HG2 MET A 63 -6.067 1.765 -11.580 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.933 1.871 -13.099 1.00 0.00 H new ATOM 0 HE1 MET A 63 -6.874 -1.550 -14.379 1.00 0.00 H new ATOM 0 HE2 MET A 63 -7.776 -0.967 -12.960 1.00 0.00 H new ATOM 0 HE3 MET A 63 -7.531 0.103 -14.361 1.00 0.00 H new ATOM 996 N ASP A 64 -6.682 4.949 -11.027 1.00 0.00 N ATOM 997 CA ASP A 64 -6.940 5.367 -9.652 1.00 0.00 C ATOM 998 C ASP A 64 -6.778 4.210 -8.665 1.00 0.00 C ATOM 999 O ASP A 64 -6.812 3.034 -9.041 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.318 6.037 -9.544 1.00 0.00 C ATOM 1001 CG ASP A 64 -9.476 5.087 -9.239 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -9.660 4.730 -8.054 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -10.258 4.797 -10.170 1.00 0.00 O ATOM 0 H ASP A 64 -7.485 5.082 -11.642 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.190 6.108 -9.376 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.276 6.797 -8.763 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.529 6.554 -10.480 1.00 0.00 H new ATOM 1008 N GLY A 65 -6.603 4.539 -7.386 1.00 0.00 N ATOM 1009 CA GLY A 65 -6.151 3.566 -6.402 1.00 0.00 C ATOM 1010 C GLY A 65 -7.186 2.478 -6.140 1.00 0.00 C ATOM 1011 O GLY A 65 -6.816 1.373 -5.731 1.00 0.00 O ATOM 0 H GLY A 65 -6.768 5.473 -7.010 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.225 3.107 -6.748 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.922 4.078 -5.467 1.00 0.00 H new ATOM 1015 N LEU A 66 -8.470 2.771 -6.369 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.562 1.828 -6.187 1.00 0.00 C ATOM 1017 C LEU A 66 -9.621 0.866 -7.369 1.00 0.00 C ATOM 1018 O LEU A 66 -9.908 -0.312 -7.177 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.881 2.610 -5.998 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.980 1.941 -5.157 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.825 0.884 -5.867 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.428 1.294 -3.891 1.00 0.00 C ATOM 0 H LEU A 66 -8.778 3.688 -6.692 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.399 1.226 -5.293 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.642 3.570 -5.540 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -11.293 2.822 -6.985 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.631 2.786 -4.931 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.565 0.484 -5.174 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -13.333 1.336 -6.719 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.181 0.077 -6.215 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.243 0.835 -3.332 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.699 0.530 -4.161 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.947 2.053 -3.274 1.00 0.00 H new ATOM 1034 N GLU A 67 -9.299 1.331 -8.576 1.00 0.00 N ATOM 1035 CA GLU A 67 -9.166 0.495 -9.765 1.00 0.00 C ATOM 1036 C GLU A 67 -7.906 -0.378 -9.687 1.00 0.00 C ATOM 1037 O GLU A 67 -7.952 -1.544 -10.087 1.00 0.00 O ATOM 1038 CB GLU A 67 -9.135 1.388 -11.013 1.00 0.00 C ATOM 1039 CG GLU A 67 -10.520 1.912 -11.402 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.292 0.921 -12.272 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.750 -0.127 -11.764 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -11.439 1.181 -13.490 1.00 0.00 O ATOM 0 H GLU A 67 -9.120 2.319 -8.756 1.00 0.00 H new ATOM 0 HA GLU A 67 -10.024 -0.175 -9.825 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.469 2.232 -10.834 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.717 0.824 -11.847 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -11.093 2.122 -10.499 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -10.412 2.855 -11.938 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.795 0.140 -9.144 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.589 -0.649 -8.871 1.00 0.00 C ATOM 1051 C LEU A 68 -5.934 -1.785 -7.907 1.00 0.00 C ATOM 1052 O LEU A 68 -5.650 -2.949 -8.203 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.469 0.249 -8.308 1.00 0.00 C ATOM 1054 CG LEU A 68 -3.173 -0.514 -7.943 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.453 -1.076 -9.179 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -2.222 0.428 -7.194 1.00 0.00 C ATOM 0 H LEU A 68 -6.709 1.122 -8.881 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.220 -1.082 -9.800 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.231 1.018 -9.042 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.840 0.760 -7.420 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.459 -1.358 -7.315 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.551 -1.602 -8.867 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.114 -1.768 -9.702 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.183 -0.258 -9.847 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.308 -0.107 -6.936 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.977 1.279 -7.830 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.704 0.783 -6.283 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.594 -1.451 -6.788 1.00 0.00 N ATOM 1069 CA LEU A 69 -7.120 -2.417 -5.832 1.00 0.00 C ATOM 1070 C LEU A 69 -7.976 -3.422 -6.577 1.00 0.00 C ATOM 1071 O LEU A 69 -7.644 -4.600 -6.565 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.867 -1.707 -4.688 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.908 -2.515 -3.868 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.577 -3.954 -3.426 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -9.210 -1.733 -2.585 1.00 0.00 C ATOM 0 H LEU A 69 -6.777 -0.483 -6.524 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.306 -2.962 -5.354 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -7.120 -1.326 -3.991 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.378 -0.843 -5.112 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.728 -2.631 -4.577 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.416 -4.364 -2.865 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.392 -4.571 -4.305 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.688 -3.945 -2.795 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.941 -2.280 -1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.292 -1.609 -2.010 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.612 -0.753 -2.842 1.00 0.00 H new ATOM 1087 N LYS A 70 -9.056 -2.999 -7.236 1.00 0.00 N ATOM 1088 CA LYS A 70 -9.988 -3.938 -7.854 1.00 0.00 C ATOM 1089 C LYS A 70 -9.335 -4.798 -8.937 1.00 0.00 C ATOM 1090 O LYS A 70 -9.778 -5.933 -9.112 1.00 0.00 O ATOM 1091 CB LYS A 70 -11.260 -3.228 -8.328 1.00 0.00 C ATOM 1092 CG LYS A 70 -12.153 -2.920 -7.114 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.510 -2.354 -7.536 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.454 -2.290 -6.334 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.838 -2.009 -6.751 1.00 0.00 N ATOM 0 H LYS A 70 -9.305 -2.017 -7.354 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.293 -4.645 -7.082 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.003 -2.305 -8.848 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.797 -3.856 -9.039 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.303 -3.830 -6.533 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.648 -2.206 -6.463 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.381 -1.358 -7.959 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.945 -2.978 -8.317 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.421 -3.235 -5.793 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -14.116 -1.516 -5.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.452 -1.972 -5.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.873 -1.095 -7.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -16.168 -2.761 -7.389 1.00 0.00 H new ATOM 1109 N THR A 71 -8.266 -4.338 -9.587 1.00 0.00 N ATOM 1110 CA THR A 71 -7.465 -5.166 -10.476 1.00 0.00 C ATOM 1111 C THR A 71 -6.738 -6.261 -9.693 1.00 0.00 C ATOM 1112 O THR A 71 -6.815 -7.426 -10.079 1.00 0.00 O ATOM 1113 CB THR A 71 -6.512 -4.284 -11.292 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.272 -3.346 -12.030 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.697 -5.102 -12.294 1.00 0.00 C ATOM 0 H THR A 71 -7.934 -3.377 -9.509 1.00 0.00 H new ATOM 0 HA THR A 71 -8.118 -5.678 -11.182 1.00 0.00 H new ATOM 0 HB THR A 71 -5.833 -3.798 -10.592 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.461 -2.565 -11.470 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.035 -4.439 -12.851 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.103 -5.844 -11.760 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.371 -5.607 -12.986 1.00 0.00 H new ATOM 1123 N ILE A 72 -6.065 -5.939 -8.588 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.408 -6.949 -7.753 1.00 0.00 C ATOM 1125 C ILE A 72 -6.491 -7.923 -7.230 1.00 0.00 C ATOM 1126 O ILE A 72 -6.322 -9.145 -7.244 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.622 -6.211 -6.642 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.298 -5.648 -7.217 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -4.278 -7.110 -5.444 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -2.839 -4.416 -6.428 1.00 0.00 C ATOM 0 H ILE A 72 -5.959 -4.983 -8.248 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.686 -7.554 -8.301 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.274 -5.413 -6.288 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.526 -6.416 -7.181 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.436 -5.383 -8.265 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.728 -6.532 -4.702 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.197 -7.491 -4.999 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.665 -7.946 -5.781 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.908 -4.039 -6.851 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.603 -3.641 -6.486 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.679 -4.690 -5.385 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.649 -7.382 -6.840 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.863 -8.081 -6.413 1.00 0.00 C ATOM 1144 C ARG A 73 -9.567 -8.840 -7.549 1.00 0.00 C ATOM 1145 O ARG A 73 -10.660 -9.365 -7.328 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.826 -7.062 -5.761 1.00 0.00 C ATOM 1147 CG ARG A 73 -10.055 -7.234 -4.259 1.00 0.00 C ATOM 1148 CD ARG A 73 -10.934 -8.440 -3.913 1.00 0.00 C ATOM 1149 NE ARG A 73 -10.129 -9.659 -3.812 1.00 0.00 N ATOM 1150 CZ ARG A 73 -9.401 -10.060 -2.767 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -9.430 -9.403 -1.613 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -8.631 -11.121 -2.919 1.00 0.00 N ATOM 0 H ARG A 73 -7.770 -6.370 -6.813 1.00 0.00 H new ATOM 0 HA ARG A 73 -8.565 -8.842 -5.692 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.439 -6.059 -5.938 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.790 -7.126 -6.267 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.091 -7.342 -3.762 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -10.519 -6.330 -3.864 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.450 -8.261 -2.970 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -11.701 -8.568 -4.677 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.124 -10.269 -4.630 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.017 -8.575 -1.512 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -8.866 -9.727 -0.827 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -8.605 -11.608 -3.815 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -8.062 -11.454 -2.141 1.00 0.00 H new ATOM 1166 N ALA A 74 -9.018 -8.889 -8.768 1.00 0.00 N ATOM 1167 CA ALA A 74 -9.531 -9.765 -9.819 1.00 0.00 C ATOM 1168 C ALA A 74 -9.306 -11.242 -9.468 1.00 0.00 C ATOM 1169 O ALA A 74 -9.896 -12.112 -10.114 1.00 0.00 O ATOM 1170 CB ALA A 74 -8.874 -9.434 -11.160 1.00 0.00 C ATOM 0 H ALA A 74 -8.214 -8.328 -9.049 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.605 -9.595 -9.901 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.268 -10.096 -11.931 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.090 -8.399 -11.425 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -7.796 -9.571 -11.080 1.00 0.00 H new ATOM 1205 N MET A 78 -3.273 -12.119 -8.160 1.00 0.00 N ATOM 1206 CA MET A 78 -2.783 -11.088 -7.246 1.00 0.00 C ATOM 1207 C MET A 78 -3.555 -11.036 -5.923 1.00 0.00 C ATOM 1208 O MET A 78 -3.129 -10.329 -5.020 1.00 0.00 O ATOM 1209 CB MET A 78 -2.807 -9.724 -7.946 1.00 0.00 C ATOM 1210 CG MET A 78 -2.036 -9.719 -9.271 1.00 0.00 C ATOM 1211 SD MET A 78 -1.949 -8.089 -10.048 1.00 0.00 S ATOM 1212 CE MET A 78 -1.423 -8.573 -11.714 1.00 0.00 C ATOM 0 HA MET A 78 -1.758 -11.350 -6.984 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.841 -9.435 -8.132 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.381 -8.973 -7.281 1.00 0.00 H new ATOM 0 HG2 MET A 78 -1.024 -10.083 -9.095 1.00 0.00 H new ATOM 0 HG3 MET A 78 -2.510 -10.417 -9.961 1.00 0.00 H new ATOM 0 HE1 MET A 78 -1.284 -7.681 -12.325 1.00 0.00 H new ATOM 0 HE2 MET A 78 -0.483 -9.122 -11.654 1.00 0.00 H new ATOM 0 HE3 MET A 78 -2.185 -9.207 -12.166 1.00 0.00 H new ATOM 1222 N SER A 79 -4.639 -11.805 -5.787 1.00 0.00 N ATOM 1223 CA SER A 79 -5.568 -11.882 -4.653 1.00 0.00 C ATOM 1224 C SER A 79 -4.900 -11.667 -3.289 1.00 0.00 C ATOM 1225 O SER A 79 -5.319 -10.806 -2.508 1.00 0.00 O ATOM 1226 CB SER A 79 -6.295 -13.246 -4.679 1.00 0.00 C ATOM 1227 OG SER A 79 -5.818 -14.104 -5.710 1.00 0.00 O ATOM 0 H SER A 79 -4.914 -12.446 -6.532 1.00 0.00 H new ATOM 0 HA SER A 79 -6.278 -11.063 -4.772 1.00 0.00 H new ATOM 0 HB2 SER A 79 -6.169 -13.739 -3.715 1.00 0.00 H new ATOM 0 HB3 SER A 79 -7.364 -13.081 -4.815 1.00 0.00 H new ATOM 0 HG SER A 79 -6.308 -14.952 -5.682 1.00 0.00 H new ATOM 1233 N ALA A 80 -3.859 -12.460 -3.023 1.00 0.00 N ATOM 1234 CA ALA A 80 -3.160 -12.540 -1.753 1.00 0.00 C ATOM 1235 C ALA A 80 -2.430 -11.255 -1.351 1.00 0.00 C ATOM 1236 O ALA A 80 -2.037 -11.149 -0.187 1.00 0.00 O ATOM 1237 CB ALA A 80 -2.146 -13.682 -1.850 1.00 0.00 C ATOM 0 H ALA A 80 -3.468 -13.090 -3.724 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.911 -12.709 -0.981 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -1.603 -13.768 -0.909 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.669 -14.616 -2.054 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.443 -13.476 -2.657 1.00 0.00 H new ATOM 1243 N LEU A 81 -2.206 -10.316 -2.277 1.00 0.00 N ATOM 1244 CA LEU A 81 -1.504 -9.070 -2.004 1.00 0.00 C ATOM 1245 C LEU A 81 -2.357 -8.196 -1.085 1.00 0.00 C ATOM 1246 O LEU A 81 -3.464 -7.818 -1.481 1.00 0.00 O ATOM 1247 CB LEU A 81 -1.223 -8.280 -3.295 1.00 0.00 C ATOM 1248 CG LEU A 81 0.028 -8.711 -4.081 1.00 0.00 C ATOM 1249 CD1 LEU A 81 0.137 -7.910 -5.390 1.00 0.00 C ATOM 1250 CD2 LEU A 81 1.313 -8.485 -3.267 1.00 0.00 C ATOM 0 H LEU A 81 -2.513 -10.407 -3.246 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.554 -9.324 -1.533 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.090 -8.369 -3.950 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.124 -7.225 -3.039 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.077 -9.775 -4.293 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.026 -8.225 -5.936 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.747 -8.090 -6.001 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.209 -6.847 -5.161 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.176 -8.801 -3.854 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.408 -7.427 -3.023 1.00 0.00 H new ATOM 0 HD23 LEU A 81 1.268 -9.067 -2.347 1.00 0.00 H new ATOM 1262 N PRO A 82 -1.862 -7.801 0.097 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.487 -6.750 0.876 1.00 0.00 C ATOM 1264 C PRO A 82 -2.265 -5.411 0.164 1.00 0.00 C ATOM 1265 O PRO A 82 -1.144 -4.886 0.165 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.807 -6.805 2.243 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.415 -7.359 1.941 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.633 -8.260 0.731 1.00 0.00 C ATOM 0 HA PRO A 82 -3.565 -6.869 0.989 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.753 -5.818 2.702 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.351 -7.448 2.934 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.294 -6.560 1.722 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -0.015 -7.917 2.788 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.208 -8.195 0.041 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.718 -9.304 1.033 1.00 0.00 H new ATOM 1276 N VAL A 83 -3.311 -4.853 -0.453 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.260 -3.448 -0.841 1.00 0.00 C ATOM 1278 C VAL A 83 -3.565 -2.632 0.411 1.00 0.00 C ATOM 1279 O VAL A 83 -4.503 -2.964 1.150 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.159 -3.095 -2.043 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -4.181 -4.200 -3.109 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.599 -2.763 -1.662 1.00 0.00 C ATOM 0 H VAL A 83 -4.177 -5.338 -0.687 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.265 -3.205 -1.215 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.698 -2.197 -2.455 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.829 -3.899 -3.932 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -3.171 -4.364 -3.484 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.559 -5.123 -2.669 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.168 -2.526 -2.561 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -6.050 -3.621 -1.163 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.609 -1.905 -0.989 1.00 0.00 H new ATOM 1292 N LEU A 84 -2.786 -1.590 0.673 1.00 0.00 N ATOM 1293 CA LEU A 84 -2.889 -0.787 1.882 1.00 0.00 C ATOM 1294 C LEU A 84 -2.903 0.668 1.452 1.00 0.00 C ATOM 1295 O LEU A 84 -1.905 1.206 0.980 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.741 -1.143 2.831 1.00 0.00 C ATOM 1297 CG LEU A 84 -1.651 -0.280 4.102 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.003 -0.033 4.780 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -0.695 -0.935 5.109 1.00 0.00 C ATOM 0 H LEU A 84 -2.052 -1.275 0.039 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.804 -0.984 2.440 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.845 -2.187 3.126 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.801 -1.058 2.286 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.277 0.692 3.781 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.858 0.582 5.668 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.669 0.481 4.087 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.445 -0.987 5.068 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.635 -0.320 6.007 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.066 -1.926 5.372 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.296 -1.025 4.664 1.00 0.00 H new ATOM 1311 N MET A 85 -4.071 1.284 1.532 1.00 0.00 N ATOM 1312 CA MET A 85 -4.249 2.615 0.981 1.00 0.00 C ATOM 1313 C MET A 85 -3.716 3.584 2.035 1.00 0.00 C ATOM 1314 O MET A 85 -4.201 3.571 3.166 1.00 0.00 O ATOM 1315 CB MET A 85 -5.718 2.834 0.600 1.00 0.00 C ATOM 1316 CG MET A 85 -6.301 1.598 -0.115 1.00 0.00 C ATOM 1317 SD MET A 85 -7.762 1.870 -1.138 1.00 0.00 S ATOM 1318 CE MET A 85 -6.958 2.494 -2.638 1.00 0.00 C ATOM 0 H MET A 85 -4.903 0.887 1.969 1.00 0.00 H new ATOM 0 HA MET A 85 -3.699 2.773 0.053 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.301 3.047 1.496 1.00 0.00 H new ATOM 0 HB3 MET A 85 -5.802 3.706 -0.049 1.00 0.00 H new ATOM 0 HG2 MET A 85 -5.521 1.168 -0.743 1.00 0.00 H new ATOM 0 HG3 MET A 85 -6.548 0.853 0.641 1.00 0.00 H new ATOM 0 HE1 MET A 85 -7.717 2.834 -3.343 1.00 0.00 H new ATOM 0 HE2 MET A 85 -6.303 3.326 -2.380 1.00 0.00 H new ATOM 0 HE3 MET A 85 -6.371 1.697 -3.094 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.680 4.353 1.720 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.010 5.279 2.624 1.00 0.00 C ATOM 1330 C VAL A 86 -1.930 6.568 1.832 1.00 0.00 C ATOM 1331 O VAL A 86 -1.181 6.637 0.863 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.620 4.751 3.049 1.00 0.00 C ATOM 1333 CG1 VAL A 86 0.081 5.702 4.025 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.682 3.375 3.722 1.00 0.00 C ATOM 0 H VAL A 86 -2.267 4.347 0.787 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.543 5.416 3.565 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.060 4.676 2.117 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.054 5.292 4.297 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.217 6.674 3.551 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.528 5.817 4.922 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.324 3.059 3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.301 3.435 4.617 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.114 2.651 3.031 1.00 0.00 H new ATOM 1344 N THR A 87 -2.768 7.546 2.169 1.00 0.00 N ATOM 1345 CA THR A 87 -2.998 8.676 1.290 1.00 0.00 C ATOM 1346 C THR A 87 -3.230 9.957 2.093 1.00 0.00 C ATOM 1347 O THR A 87 -3.348 9.945 3.321 1.00 0.00 O ATOM 1348 CB THR A 87 -4.150 8.296 0.330 1.00 0.00 C ATOM 1349 OG1 THR A 87 -4.408 9.316 -0.613 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.464 7.947 1.045 1.00 0.00 C ATOM 0 H THR A 87 -3.294 7.573 3.042 1.00 0.00 H new ATOM 0 HA THR A 87 -2.121 8.899 0.683 1.00 0.00 H new ATOM 0 HB THR A 87 -3.795 7.399 -0.177 1.00 0.00 H new ATOM 0 HG1 THR A 87 -5.140 9.039 -1.203 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.224 7.692 0.306 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.303 7.097 1.708 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.799 8.804 1.629 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.302 11.092 1.399 1.00 0.00 N ATOM 1359 CA ALA A 88 -3.729 12.352 1.976 1.00 0.00 C ATOM 1360 C ALA A 88 -5.256 12.484 2.060 1.00 0.00 C ATOM 1361 O ALA A 88 -5.744 13.423 2.701 1.00 0.00 O ATOM 1362 CB ALA A 88 -3.135 13.494 1.151 1.00 0.00 C ATOM 0 H ALA A 88 -3.061 11.156 0.410 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.366 12.394 3.003 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.448 14.449 1.573 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -2.047 13.428 1.169 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.486 13.420 0.122 1.00 0.00 H new ATOM 1368 N GLU A 89 -5.994 11.584 1.407 1.00 0.00 N ATOM 1369 CA GLU A 89 -7.414 11.668 1.097 1.00 0.00 C ATOM 1370 C GLU A 89 -8.290 11.101 2.219 1.00 0.00 C ATOM 1371 O GLU A 89 -8.337 9.893 2.425 1.00 0.00 O ATOM 1372 CB GLU A 89 -7.648 10.899 -0.215 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.082 11.666 -1.421 1.00 0.00 C ATOM 1374 CD GLU A 89 -7.842 12.968 -1.683 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -8.996 13.105 -1.217 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -7.299 13.883 -2.340 1.00 0.00 O ATOM 0 H GLU A 89 -5.582 10.719 1.059 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.698 12.715 0.993 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.178 9.918 -0.152 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.716 10.733 -0.356 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.030 11.890 -1.246 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.131 11.034 -2.308 1.00 0.00 H new ATOM 1383 N ALA A 90 -8.989 11.969 2.959 1.00 0.00 N ATOM 1384 CA ALA A 90 -9.938 11.561 3.994 1.00 0.00 C ATOM 1385 C ALA A 90 -11.387 11.401 3.488 1.00 0.00 C ATOM 1386 O ALA A 90 -12.282 11.247 4.325 1.00 0.00 O ATOM 1387 CB ALA A 90 -9.924 12.562 5.154 1.00 0.00 C ATOM 0 H ALA A 90 -8.910 12.980 2.854 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.605 10.577 4.325 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -10.635 12.245 5.917 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.924 12.605 5.586 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.203 13.549 4.786 1.00 0.00 H new ATOM 1393 N LYS A 91 -11.669 11.555 2.184 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.041 11.578 1.657 1.00 0.00 C ATOM 1395 C LYS A 91 -13.789 10.320 2.097 1.00 0.00 C ATOM 1396 O LYS A 91 -13.379 9.198 1.790 1.00 0.00 O ATOM 1397 CB LYS A 91 -13.055 11.826 0.133 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.431 11.596 -0.531 1.00 0.00 C ATOM 1399 CD LYS A 91 -14.771 12.565 -1.686 1.00 0.00 C ATOM 1400 CE LYS A 91 -14.702 11.989 -3.108 1.00 0.00 C ATOM 1401 NZ LYS A 91 -13.340 11.633 -3.533 1.00 0.00 N ATOM 0 H LYS A 91 -10.952 11.667 1.467 1.00 0.00 H new ATOM 0 HA LYS A 91 -13.583 12.423 2.081 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -12.737 12.850 -0.060 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.322 11.170 -0.338 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -14.468 10.575 -0.911 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -15.204 11.680 0.233 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -15.777 12.950 -1.523 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -14.091 13.415 -1.629 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -15.334 11.103 -3.163 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -15.113 12.718 -3.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -13.362 11.283 -4.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -12.729 12.473 -3.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -12.964 10.891 -2.909 1.00 0.00 H new ATOM 1415 N LYS A 92 -14.893 10.508 2.828 1.00 0.00 N ATOM 1416 CA LYS A 92 -15.613 9.394 3.432 1.00 0.00 C ATOM 1417 C LYS A 92 -15.998 8.376 2.370 1.00 0.00 C ATOM 1418 O LYS A 92 -15.788 7.194 2.608 1.00 0.00 O ATOM 1419 CB LYS A 92 -16.841 9.891 4.210 1.00 0.00 C ATOM 1420 CG LYS A 92 -16.459 10.457 5.589 1.00 0.00 C ATOM 1421 CD LYS A 92 -17.528 11.389 6.179 1.00 0.00 C ATOM 1422 CE LYS A 92 -18.931 10.784 6.307 1.00 0.00 C ATOM 1423 NZ LYS A 92 -19.060 9.800 7.404 1.00 0.00 N ATOM 0 H LYS A 92 -15.303 11.423 3.013 1.00 0.00 H new ATOM 0 HA LYS A 92 -14.955 8.901 4.147 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -17.350 10.661 3.630 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -17.546 9.070 4.338 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -16.287 9.631 6.278 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -15.519 11.002 5.503 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -17.199 11.712 7.167 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -17.591 12.281 5.556 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -19.650 11.588 6.466 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -19.196 10.302 5.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -20.033 9.434 7.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -18.399 9.013 7.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -18.839 10.260 8.310 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.508 8.788 1.205 1.00 0.00 N ATOM 1438 CA GLU A 93 -16.889 7.808 0.192 1.00 0.00 C ATOM 1439 C GLU A 93 -15.670 7.026 -0.301 1.00 0.00 C ATOM 1440 O GLU A 93 -15.802 5.833 -0.532 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.637 8.475 -0.970 1.00 0.00 C ATOM 1442 CG GLU A 93 -18.512 7.496 -1.773 1.00 0.00 C ATOM 1443 CD GLU A 93 -17.794 6.679 -2.858 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -17.156 7.284 -3.750 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -17.979 5.443 -2.926 1.00 0.00 O ATOM 0 H GLU A 93 -16.662 9.763 0.948 1.00 0.00 H new ATOM 0 HA GLU A 93 -17.572 7.095 0.654 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -18.265 9.275 -0.577 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -16.913 8.938 -1.641 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -18.979 6.802 -1.074 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.315 8.062 -2.245 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.481 7.640 -0.369 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.241 6.916 -0.674 1.00 0.00 C ATOM 1454 C ASN A 94 -13.033 5.811 0.358 1.00 0.00 C ATOM 1455 O ASN A 94 -12.726 4.675 -0.002 1.00 0.00 O ATOM 1456 CB ASN A 94 -11.951 7.762 -0.674 1.00 0.00 C ATOM 1457 CG ASN A 94 -11.887 8.908 -1.662 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -12.840 9.205 -2.371 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -10.775 9.623 -1.689 1.00 0.00 N ATOM 0 H ASN A 94 -14.352 8.640 -0.216 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.388 6.551 -1.690 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -11.811 8.169 0.328 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.109 7.098 -0.869 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -10.704 10.433 -2.305 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -9.988 9.365 -1.093 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.190 6.140 1.649 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.053 5.137 2.708 1.00 0.00 C ATOM 1468 C ILE A 95 -14.063 3.994 2.491 1.00 0.00 C ATOM 1469 O ILE A 95 -13.668 2.830 2.643 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.151 5.773 4.122 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -11.819 6.452 4.526 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -13.466 4.715 5.205 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -11.662 7.899 4.048 1.00 0.00 C ATOM 0 H ILE A 95 -13.409 7.080 1.979 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.054 4.704 2.651 1.00 0.00 H new ATOM 0 HB ILE A 95 -13.956 6.506 4.065 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.733 6.432 5.612 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.992 5.862 4.130 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -13.526 5.199 6.180 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.418 4.235 4.979 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -12.676 3.964 5.221 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -10.699 8.289 4.379 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.712 7.930 2.960 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.463 8.509 4.465 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.333 4.294 2.179 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.353 3.275 1.913 1.00 0.00 C ATOM 1487 C ILE A 96 -15.888 2.438 0.732 1.00 0.00 C ATOM 1488 O ILE A 96 -15.773 1.228 0.881 1.00 0.00 O ATOM 1489 CB ILE A 96 -17.769 3.870 1.680 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.463 4.201 3.016 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.715 2.901 0.941 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.003 5.509 3.641 1.00 0.00 C ATOM 0 H ILE A 96 -15.679 5.251 2.105 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.460 2.648 2.798 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.599 4.762 1.078 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.540 4.246 2.854 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.281 3.389 3.720 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.688 3.373 0.808 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.295 2.655 -0.034 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -18.831 1.989 1.526 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -18.536 5.672 4.577 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -16.932 5.462 3.837 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.211 6.332 2.957 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.617 3.065 -0.411 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.237 2.407 -1.644 1.00 0.00 C ATOM 1506 C ALA A 97 -14.091 1.436 -1.389 1.00 0.00 C ATOM 1507 O ALA A 97 -14.166 0.291 -1.821 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.860 3.466 -2.680 1.00 0.00 C ATOM 0 H ALA A 97 -15.660 4.080 -0.500 1.00 0.00 H new ATOM 0 HA ALA A 97 -16.075 1.827 -2.032 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.573 2.978 -3.611 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.714 4.118 -2.861 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -14.024 4.058 -2.308 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.056 1.860 -0.658 1.00 0.00 N ATOM 1515 CA ALA A 98 -11.927 1.017 -0.300 1.00 0.00 C ATOM 1516 C ALA A 98 -12.354 -0.188 0.534 1.00 0.00 C ATOM 1517 O ALA A 98 -11.956 -1.316 0.239 1.00 0.00 O ATOM 1518 CB ALA A 98 -10.917 1.844 0.485 1.00 0.00 C ATOM 0 H ALA A 98 -12.984 2.811 -0.297 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.483 0.640 -1.221 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.067 1.218 0.757 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.573 2.676 -0.129 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.387 2.230 1.389 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.118 0.043 1.607 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.574 -1.030 2.480 1.00 0.00 C ATOM 1526 C ALA A 99 -14.438 -2.023 1.695 1.00 0.00 C ATOM 1527 O ALA A 99 -14.231 -3.231 1.795 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.325 -0.423 3.672 1.00 0.00 C ATOM 0 H ALA A 99 -13.432 0.972 1.888 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.721 -1.588 2.866 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.669 -1.221 4.330 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -13.658 0.239 4.223 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.183 0.145 3.311 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.354 -1.516 0.871 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.227 -2.280 -0.003 1.00 0.00 C ATOM 1536 C GLN A 100 -15.428 -3.077 -1.030 1.00 0.00 C ATOM 1537 O GLN A 100 -15.686 -4.265 -1.203 1.00 0.00 O ATOM 1538 CB GLN A 100 -17.212 -1.332 -0.709 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.334 -0.804 0.203 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.198 -1.901 0.829 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -19.212 -3.053 0.392 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -19.942 -1.577 1.872 1.00 0.00 N ATOM 0 H GLN A 100 -15.511 -0.511 0.795 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.784 -2.992 0.606 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.658 -0.485 -1.114 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.660 -1.854 -1.555 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.890 -0.207 1.000 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.974 -0.138 -0.375 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.928 -0.623 2.231 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.530 -2.281 2.318 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.443 -2.463 -1.689 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.543 -3.137 -2.606 1.00 0.00 C ATOM 1553 C ALA A 101 -12.695 -4.206 -1.913 1.00 0.00 C ATOM 1554 O ALA A 101 -12.137 -5.052 -2.606 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.638 -2.100 -3.276 1.00 0.00 C ATOM 0 H ALA A 101 -14.251 -1.466 -1.593 1.00 0.00 H new ATOM 0 HA ALA A 101 -14.149 -3.649 -3.353 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.959 -2.601 -3.966 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -13.250 -1.383 -3.824 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -12.060 -1.576 -2.515 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.596 -4.204 -0.581 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.827 -5.186 0.163 1.00 0.00 C ATOM 1563 C GLY A 102 -10.357 -4.800 0.253 1.00 0.00 C ATOM 1564 O GLY A 102 -9.498 -5.690 0.268 1.00 0.00 O ATOM 0 H GLY A 102 -13.055 -3.511 0.010 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.239 -5.286 1.167 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.919 -6.160 -0.318 1.00 0.00 H new ATOM 1568 N ALA A 103 -10.053 -3.496 0.324 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.701 -3.038 0.612 1.00 0.00 C ATOM 1570 C ALA A 103 -8.315 -3.590 1.978 1.00 0.00 C ATOM 1571 O ALA A 103 -9.160 -3.635 2.884 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.595 -1.508 0.623 1.00 0.00 C ATOM 0 H ALA A 103 -10.730 -2.746 0.185 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.030 -3.393 -0.170 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.568 -1.216 0.842 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.883 -1.116 -0.352 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.258 -1.103 1.387 1.00 0.00 H new ATOM 1578 N SER A 104 -7.055 -3.981 2.144 1.00 0.00 N ATOM 1579 CA SER A 104 -6.656 -4.622 3.383 1.00 0.00 C ATOM 1580 C SER A 104 -6.585 -3.614 4.542 1.00 0.00 C ATOM 1581 O SER A 104 -6.599 -4.020 5.707 1.00 0.00 O ATOM 1582 CB SER A 104 -5.372 -5.418 3.151 1.00 0.00 C ATOM 1583 OG SER A 104 -4.211 -4.615 3.130 1.00 0.00 O ATOM 0 H SER A 104 -6.313 -3.868 1.453 1.00 0.00 H new ATOM 0 HA SER A 104 -7.416 -5.338 3.696 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.272 -6.168 3.935 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.451 -5.954 2.205 1.00 0.00 H new ATOM 0 HG SER A 104 -4.272 -3.971 2.394 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.597 -2.308 4.244 1.00 0.00 N ATOM 1590 CA GLY A 105 -6.643 -1.248 5.231 1.00 0.00 C ATOM 1591 C GLY A 105 -6.575 0.113 4.549 1.00 0.00 C ATOM 1592 O GLY A 105 -6.277 0.202 3.351 1.00 0.00 O ATOM 0 H GLY A 105 -6.574 -1.963 3.285 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.561 -1.325 5.814 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.812 -1.355 5.928 1.00 0.00 H new ATOM 1596 N TYR A 106 -6.825 1.167 5.327 1.00 0.00 N ATOM 1597 CA TYR A 106 -6.796 2.554 4.886 1.00 0.00 C ATOM 1598 C TYR A 106 -6.079 3.372 5.956 1.00 0.00 C ATOM 1599 O TYR A 106 -6.238 3.104 7.152 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.233 3.059 4.681 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.391 4.083 3.573 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.245 5.463 3.817 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -8.688 3.638 2.273 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.421 6.387 2.766 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -8.845 4.555 1.221 1.00 0.00 C ATOM 1606 CZ TYR A 106 -8.724 5.939 1.463 1.00 0.00 C ATOM 1607 OH TYR A 106 -8.891 6.826 0.443 1.00 0.00 O ATOM 0 H TYR A 106 -7.061 1.071 6.315 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.268 2.650 3.937 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -8.876 2.206 4.464 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -8.587 3.496 5.615 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.998 5.813 4.808 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.796 2.581 2.081 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.323 7.445 2.960 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -9.059 4.199 0.224 1.00 0.00 H new ATOM 0 HH TYR A 106 -8.909 6.344 -0.410 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.322 4.382 5.555 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.586 5.310 6.396 1.00 0.00 C ATOM 1619 C VAL A 107 -4.709 6.669 5.717 1.00 0.00 C ATOM 1620 O VAL A 107 -4.629 6.754 4.489 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.115 4.858 6.520 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.275 5.866 7.304 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -2.959 3.502 7.220 1.00 0.00 C ATOM 0 H VAL A 107 -5.198 4.588 4.564 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.979 5.353 7.412 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.766 4.779 5.490 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.247 5.511 7.369 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.295 6.830 6.795 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.684 5.977 8.308 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.902 3.241 7.276 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.371 3.563 8.227 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.492 2.737 6.655 1.00 0.00 H new ATOM 1633 N VAL A 108 -4.887 7.721 6.512 1.00 0.00 N ATOM 1634 CA VAL A 108 -4.918 9.085 6.021 1.00 0.00 C ATOM 1635 C VAL A 108 -3.836 9.857 6.774 1.00 0.00 C ATOM 1636 O VAL A 108 -3.598 9.604 7.958 1.00 0.00 O ATOM 1637 CB VAL A 108 -6.324 9.700 6.179 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -6.422 11.010 5.389 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -7.443 8.775 5.666 1.00 0.00 C ATOM 0 H VAL A 108 -5.014 7.644 7.521 1.00 0.00 H new ATOM 0 HA VAL A 108 -4.710 9.127 4.952 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.460 9.863 7.248 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.419 11.434 5.509 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -5.680 11.716 5.762 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.236 10.813 4.333 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.409 9.261 5.803 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.288 8.569 4.607 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.426 7.839 6.224 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.176 10.805 6.103 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.288 11.764 6.758 1.00 0.00 C ATOM 1651 C LYS A 109 -3.039 12.493 7.887 1.00 0.00 C ATOM 1652 O LYS A 109 -4.231 12.773 7.722 1.00 0.00 O ATOM 1653 CB LYS A 109 -1.693 12.729 5.707 1.00 0.00 C ATOM 1654 CG LYS A 109 -2.697 13.711 5.075 1.00 0.00 C ATOM 1655 CD LYS A 109 -2.809 15.068 5.779 1.00 0.00 C ATOM 1656 CE LYS A 109 -4.118 15.794 5.448 1.00 0.00 C ATOM 1657 NZ LYS A 109 -4.356 15.954 3.997 1.00 0.00 N ATOM 0 H LYS A 109 -3.243 10.928 5.093 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.451 11.243 7.223 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.894 13.303 6.176 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.237 12.139 4.912 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -2.412 13.880 4.037 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -3.681 13.243 5.063 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.741 14.921 6.857 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -1.966 15.695 5.489 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -4.950 15.243 5.886 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -4.106 16.778 5.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -4.978 16.772 3.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -3.449 16.107 3.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -4.809 15.096 3.623 1.00 0.00 H new ATOM 1671 N PRO A 110 -2.364 12.915 8.968 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.035 12.485 9.373 1.00 0.00 C ATOM 1673 C PRO A 110 -1.113 11.085 10.002 1.00 0.00 C ATOM 1674 O PRO A 110 -1.998 10.802 10.815 1.00 0.00 O ATOM 1675 CB PRO A 110 -0.592 13.539 10.389 1.00 0.00 C ATOM 1676 CG PRO A 110 -1.893 13.963 11.068 1.00 0.00 C ATOM 1677 CD PRO A 110 -2.924 13.836 9.945 1.00 0.00 C ATOM 0 HA PRO A 110 -0.331 12.408 8.544 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.118 13.129 11.107 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.102 14.382 9.902 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -2.136 13.319 11.913 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.835 14.982 11.450 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -3.873 13.462 10.330 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.125 14.807 9.492 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.140 10.223 9.721 1.00 0.00 N ATOM 1686 CA PHE A 111 -0.081 8.856 10.236 1.00 0.00 C ATOM 1687 C PHE A 111 1.323 8.519 10.739 1.00 0.00 C ATOM 1688 O PHE A 111 2.283 9.242 10.464 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.535 7.893 9.136 1.00 0.00 C ATOM 1690 CG PHE A 111 0.362 7.849 7.922 1.00 0.00 C ATOM 1691 CD1 PHE A 111 1.490 7.007 7.914 1.00 0.00 C ATOM 1692 CD2 PHE A 111 0.070 8.649 6.804 1.00 0.00 C ATOM 1693 CE1 PHE A 111 2.357 7.023 6.814 1.00 0.00 C ATOM 1694 CE2 PHE A 111 0.953 8.682 5.716 1.00 0.00 C ATOM 1695 CZ PHE A 111 2.107 7.887 5.738 1.00 0.00 C ATOM 0 H PHE A 111 0.647 10.459 9.116 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.751 8.757 11.090 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.603 6.890 9.556 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.539 8.174 8.818 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.686 6.353 8.751 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -0.835 9.238 6.783 1.00 0.00 H new ATOM 0 HE1 PHE A 111 3.217 6.370 6.794 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.746 9.316 4.866 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.810 7.940 4.920 1.00 0.00 H new ATOM 1705 N THR A 112 1.442 7.411 11.467 1.00 0.00 N ATOM 1706 CA THR A 112 2.648 7.017 12.186 1.00 0.00 C ATOM 1707 C THR A 112 2.925 5.528 12.013 1.00 0.00 C ATOM 1708 O THR A 112 2.091 4.780 11.492 1.00 0.00 O ATOM 1709 CB THR A 112 2.479 7.382 13.677 1.00 0.00 C ATOM 1710 OG1 THR A 112 1.150 7.119 14.100 1.00 0.00 O ATOM 1711 CG2 THR A 112 2.842 8.848 13.910 1.00 0.00 C ATOM 0 H THR A 112 0.678 6.744 11.575 1.00 0.00 H new ATOM 0 HA THR A 112 3.506 7.552 11.778 1.00 0.00 H new ATOM 0 HB THR A 112 3.156 6.765 14.268 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.056 7.353 15.047 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.718 9.090 14.965 1.00 0.00 H new ATOM 0 HG22 THR A 112 3.879 9.017 13.618 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.189 9.484 13.313 1.00 0.00 H new ATOM 1719 N ALA A 113 4.085 5.086 12.504 1.00 0.00 N ATOM 1720 CA ALA A 113 4.456 3.689 12.621 1.00 0.00 C ATOM 1721 C ALA A 113 3.399 2.947 13.437 1.00 0.00 C ATOM 1722 O ALA A 113 3.098 1.807 13.110 1.00 0.00 O ATOM 1723 CB ALA A 113 5.844 3.575 13.259 1.00 0.00 C ATOM 0 H ALA A 113 4.811 5.719 12.840 1.00 0.00 H new ATOM 0 HA ALA A 113 4.503 3.231 11.633 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.120 2.524 13.345 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.574 4.092 12.636 1.00 0.00 H new ATOM 0 HB3 ALA A 113 5.827 4.028 14.250 1.00 0.00 H new ATOM 1729 N ALA A 114 2.784 3.614 14.422 1.00 0.00 N ATOM 1730 CA ALA A 114 1.695 3.084 15.227 1.00 0.00 C ATOM 1731 C ALA A 114 0.551 2.580 14.348 1.00 0.00 C ATOM 1732 O ALA A 114 0.143 1.428 14.501 1.00 0.00 O ATOM 1733 CB ALA A 114 1.198 4.152 16.211 1.00 0.00 C ATOM 0 H ALA A 114 3.044 4.565 14.682 1.00 0.00 H new ATOM 0 HA ALA A 114 2.072 2.233 15.795 1.00 0.00 H new ATOM 0 HB1 ALA A 114 0.383 3.745 16.809 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.015 4.450 16.868 1.00 0.00 H new ATOM 0 HB3 ALA A 114 0.843 5.020 15.656 1.00 0.00 H new ATOM 1739 N THR A 115 0.016 3.414 13.447 1.00 0.00 N ATOM 1740 CA THR A 115 -1.080 2.970 12.592 1.00 0.00 C ATOM 1741 C THR A 115 -0.556 2.063 11.472 1.00 0.00 C ATOM 1742 O THR A 115 -1.260 1.136 11.081 1.00 0.00 O ATOM 1743 CB THR A 115 -1.921 4.164 12.095 1.00 0.00 C ATOM 1744 OG1 THR A 115 -3.260 3.774 11.869 1.00 0.00 O ATOM 1745 CG2 THR A 115 -1.433 4.787 10.795 1.00 0.00 C ATOM 0 H THR A 115 0.319 4.376 13.296 1.00 0.00 H new ATOM 0 HA THR A 115 -1.767 2.359 13.177 1.00 0.00 H new ATOM 0 HB THR A 115 -1.827 4.902 12.892 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.777 4.545 11.556 1.00 0.00 H new ATOM 0 HG21 THR A 115 -2.084 5.618 10.523 1.00 0.00 H new ATOM 0 HG22 THR A 115 -0.414 5.152 10.926 1.00 0.00 H new ATOM 0 HG23 THR A 115 -1.451 4.038 10.003 1.00 0.00 H new ATOM 1753 N LEU A 116 0.675 2.268 10.979 1.00 0.00 N ATOM 1754 CA LEU A 116 1.280 1.388 9.978 1.00 0.00 C ATOM 1755 C LEU A 116 1.252 -0.043 10.537 1.00 0.00 C ATOM 1756 O LEU A 116 0.647 -0.929 9.930 1.00 0.00 O ATOM 1757 CB LEU A 116 2.698 1.889 9.610 1.00 0.00 C ATOM 1758 CG LEU A 116 3.362 1.341 8.327 1.00 0.00 C ATOM 1759 CD1 LEU A 116 3.239 -0.169 8.212 1.00 0.00 C ATOM 1760 CD2 LEU A 116 2.848 1.953 7.016 1.00 0.00 C ATOM 0 H LEU A 116 1.272 3.044 11.263 1.00 0.00 H new ATOM 0 HA LEU A 116 0.721 1.396 9.042 1.00 0.00 H new ATOM 0 HB2 LEU A 116 2.654 2.975 9.523 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.358 1.663 10.448 1.00 0.00 H new ATOM 0 HG LEU A 116 4.404 1.637 8.449 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.721 -0.504 7.294 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.722 -0.640 9.068 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.185 -0.448 8.191 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.375 1.504 6.174 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.779 1.761 6.919 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.025 3.029 7.023 1.00 0.00 H new ATOM 1772 N GLU A 117 1.837 -0.272 11.718 1.00 0.00 N ATOM 1773 CA GLU A 117 1.873 -1.594 12.327 1.00 0.00 C ATOM 1774 C GLU A 117 0.483 -2.088 12.735 1.00 0.00 C ATOM 1775 O GLU A 117 0.290 -3.289 12.892 1.00 0.00 O ATOM 1776 CB GLU A 117 2.868 -1.691 13.493 1.00 0.00 C ATOM 1777 CG GLU A 117 2.469 -1.013 14.813 1.00 0.00 C ATOM 1778 CD GLU A 117 2.951 -1.830 16.011 1.00 0.00 C ATOM 1779 OE1 GLU A 117 2.285 -2.847 16.330 1.00 0.00 O ATOM 1780 OE2 GLU A 117 3.940 -1.445 16.676 1.00 0.00 O ATOM 0 H GLU A 117 2.294 0.453 12.271 1.00 0.00 H new ATOM 0 HA GLU A 117 2.238 -2.263 11.548 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.049 -2.747 13.696 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.815 -1.263 13.166 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.895 -0.011 14.856 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.386 -0.901 14.856 1.00 0.00 H new ATOM 1787 N GLU A 118 -0.495 -1.203 12.914 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.871 -1.584 13.199 1.00 0.00 C ATOM 1789 C GLU A 118 -2.480 -2.253 11.970 1.00 0.00 C ATOM 1790 O GLU A 118 -3.083 -3.324 12.071 1.00 0.00 O ATOM 1791 CB GLU A 118 -2.658 -0.341 13.620 1.00 0.00 C ATOM 1792 CG GLU A 118 -4.052 -0.645 14.150 1.00 0.00 C ATOM 1793 CD GLU A 118 -4.561 0.588 14.888 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -5.107 1.502 14.233 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -4.449 0.631 16.135 1.00 0.00 O ATOM 0 H GLU A 118 -0.351 -0.194 12.864 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.907 -2.302 14.019 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -2.096 0.190 14.388 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -2.743 0.330 12.765 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.723 -0.901 13.330 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -4.025 -1.505 14.820 1.00 0.00 H new ATOM 1802 N LYS A 119 -2.319 -1.640 10.790 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.820 -2.250 9.565 1.00 0.00 C ATOM 1804 C LYS A 119 -1.999 -3.498 9.239 1.00 0.00 C ATOM 1805 O LYS A 119 -2.601 -4.490 8.839 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.869 -1.270 8.383 1.00 0.00 C ATOM 1807 CG LYS A 119 -3.413 0.140 8.673 1.00 0.00 C ATOM 1808 CD LYS A 119 -4.734 0.250 9.449 1.00 0.00 C ATOM 1809 CE LYS A 119 -4.979 1.743 9.709 1.00 0.00 C ATOM 1810 NZ LYS A 119 -6.334 2.050 10.203 1.00 0.00 N ATOM 0 H LYS A 119 -1.855 -0.741 10.664 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.855 -2.543 9.738 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.860 -1.169 7.983 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -3.480 -1.715 7.598 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -2.651 0.686 9.229 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.540 0.653 7.720 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.555 -0.181 8.876 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.677 -0.301 10.388 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.249 2.100 10.435 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -4.806 2.296 8.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -6.424 3.075 10.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.037 1.741 9.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.498 1.551 11.101 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.674 -3.488 9.459 1.00 0.00 N ATOM 1825 CA LEU A 120 0.167 -4.677 9.282 1.00 0.00 C ATOM 1826 C LEU A 120 -0.337 -5.811 10.162 1.00 0.00 C ATOM 1827 O LEU A 120 -0.584 -6.899 9.662 1.00 0.00 O ATOM 1828 CB LEU A 120 1.646 -4.451 9.622 1.00 0.00 C ATOM 1829 CG LEU A 120 2.469 -3.614 8.632 1.00 0.00 C ATOM 1830 CD1 LEU A 120 3.890 -3.467 9.183 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.553 -4.253 7.245 1.00 0.00 C ATOM 0 H LEU A 120 -0.161 -2.660 9.762 1.00 0.00 H new ATOM 0 HA LEU A 120 0.099 -4.921 8.222 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.699 -3.970 10.599 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.124 -5.426 9.720 1.00 0.00 H new ATOM 0 HG LEU A 120 1.972 -2.650 8.523 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.489 -2.874 8.491 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.855 -2.968 10.152 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.339 -4.453 9.299 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.146 -3.618 6.587 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.023 -5.233 7.324 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.550 -4.364 6.834 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.480 -5.593 11.471 1.00 0.00 N ATOM 1844 CA ASN A 121 -0.856 -6.671 12.379 1.00 0.00 C ATOM 1845 C ASN A 121 -2.271 -7.166 12.075 1.00 0.00 C ATOM 1846 O ASN A 121 -2.550 -8.358 12.219 1.00 0.00 O ATOM 1847 CB ASN A 121 -0.689 -6.254 13.843 1.00 0.00 C ATOM 1848 CG ASN A 121 -0.387 -7.461 14.719 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -1.209 -8.351 14.904 1.00 0.00 O ATOM 1850 ND2 ASN A 121 0.822 -7.546 15.250 1.00 0.00 N ATOM 0 H ASN A 121 -0.342 -4.688 11.920 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.177 -7.508 12.215 1.00 0.00 H new ATOM 0 HB2 ASN A 121 0.118 -5.526 13.928 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.598 -5.764 14.192 1.00 0.00 H new ATOM 0 HD21 ASN A 121 1.074 -8.356 15.817 1.00 0.00 H new ATOM 0 HD22 ASN A 121 1.502 -6.802 15.092 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.154 -6.290 11.574 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.411 -6.729 10.976 1.00 0.00 C ATOM 1859 C LYS A 122 -4.161 -7.728 9.859 1.00 0.00 C ATOM 1860 O LYS A 122 -4.681 -8.830 9.956 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.291 -5.549 10.537 1.00 0.00 C ATOM 1862 CG LYS A 122 -6.206 -5.166 11.702 1.00 0.00 C ATOM 1863 CD LYS A 122 -7.171 -4.030 11.375 1.00 0.00 C ATOM 1864 CE LYS A 122 -6.511 -2.658 11.506 1.00 0.00 C ATOM 1865 NZ LYS A 122 -7.544 -1.606 11.539 1.00 0.00 N ATOM 0 H LYS A 122 -3.017 -5.279 11.574 1.00 0.00 H new ATOM 0 HA LYS A 122 -4.982 -7.247 11.746 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.671 -4.701 10.248 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.884 -5.823 9.664 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -6.779 -6.042 12.006 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -5.592 -4.876 12.555 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -7.547 -4.155 10.359 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -8.031 -4.083 12.042 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -5.910 -2.619 12.415 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.834 -2.489 10.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.089 -0.675 11.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.099 -1.637 10.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -8.173 -1.763 12.352 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.405 -7.402 8.812 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.182 -8.357 7.721 1.00 0.00 C ATOM 1881 C ILE A 123 -2.341 -9.571 8.130 1.00 0.00 C ATOM 1882 O ILE A 123 -2.488 -10.623 7.503 1.00 0.00 O ATOM 1883 CB ILE A 123 -2.649 -7.673 6.450 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.363 -6.860 6.677 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -3.766 -6.786 5.897 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -0.909 -6.018 5.485 1.00 0.00 C ATOM 0 H ILE A 123 -2.942 -6.501 8.694 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.166 -8.758 7.477 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.368 -8.447 5.736 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.515 -6.200 7.531 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.560 -7.547 6.944 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.419 -6.285 4.993 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.635 -7.400 5.661 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.041 -6.040 6.642 1.00 0.00 H new ATOM 0 HD11 ILE A 123 0.005 -5.483 5.744 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -0.719 -6.669 4.631 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.689 -5.301 5.228 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.529 -9.474 9.187 1.00 0.00 N ATOM 1899 CA PHE A 124 -0.890 -10.636 9.785 1.00 0.00 C ATOM 1900 C PHE A 124 -1.996 -11.593 10.199 1.00 0.00 C ATOM 1901 O PHE A 124 -2.133 -12.664 9.622 1.00 0.00 O ATOM 1902 CB PHE A 124 0.025 -10.283 10.975 1.00 0.00 C ATOM 1903 CG PHE A 124 1.250 -9.413 10.730 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.690 -9.074 9.435 1.00 0.00 C ATOM 1905 CD2 PHE A 124 1.991 -8.968 11.842 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.832 -8.279 9.250 1.00 0.00 C ATOM 1907 CE2 PHE A 124 3.144 -8.186 11.660 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.556 -7.831 10.365 1.00 0.00 C ATOM 0 H PHE A 124 -1.301 -8.592 9.645 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.227 -11.096 9.053 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.588 -9.784 11.725 1.00 0.00 H new ATOM 0 HB3 PHE A 124 0.369 -11.219 11.415 1.00 0.00 H new ATOM 0 HD1 PHE A 124 1.142 -9.430 8.575 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.671 -9.229 12.840 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.152 -8.013 8.253 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.714 -7.858 12.517 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.431 -7.213 10.228 1.00 0.00 H new ATOM 1918 N GLU A 125 -2.833 -11.202 11.157 1.00 0.00 N ATOM 1919 CA GLU A 125 -3.753 -12.159 11.752 1.00 0.00 C ATOM 1920 C GLU A 125 -4.938 -12.469 10.834 1.00 0.00 C ATOM 1921 O GLU A 125 -5.469 -13.579 10.874 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.237 -11.654 13.117 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.060 -11.418 14.079 1.00 0.00 C ATOM 1924 CD GLU A 125 -3.480 -10.925 15.465 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -4.534 -10.265 15.594 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -2.716 -11.157 16.428 1.00 0.00 O ATOM 0 H GLU A 125 -2.892 -10.254 11.528 1.00 0.00 H new ATOM 0 HA GLU A 125 -3.209 -13.093 11.893 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -4.794 -10.726 12.987 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -4.924 -12.380 13.552 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.502 -12.348 14.189 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -2.382 -10.689 13.635 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.362 -11.508 10.007 1.00 0.00 N ATOM 1934 CA LYS A 126 -6.481 -11.652 9.086 1.00 0.00 C ATOM 1935 C LYS A 126 -6.085 -12.584 7.948 1.00 0.00 C ATOM 1936 O LYS A 126 -6.691 -13.648 7.808 1.00 0.00 O ATOM 1937 CB LYS A 126 -6.948 -10.278 8.570 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.186 -10.389 7.670 1.00 0.00 C ATOM 1939 CD LYS A 126 -8.453 -9.086 6.902 1.00 0.00 C ATOM 1940 CE LYS A 126 -9.422 -9.361 5.746 1.00 0.00 C ATOM 1941 NZ LYS A 126 -9.836 -8.127 5.049 1.00 0.00 N ATOM 0 H LYS A 126 -4.922 -10.589 9.963 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.327 -12.095 9.611 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.173 -9.631 9.417 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.138 -9.805 8.015 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.048 -11.206 6.962 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.056 -10.637 8.278 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.874 -8.336 7.572 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -7.517 -8.680 6.517 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -8.949 -10.036 5.033 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -10.305 -9.871 6.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -10.490 -8.367 4.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -10.312 -7.492 5.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -8.998 -7.652 4.657 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.158 -12.141 7.091 1.00 0.00 N ATOM 1956 CA LEU A 127 -4.762 -12.839 5.875 1.00 0.00 C ATOM 1957 C LEU A 127 -3.806 -13.991 6.170 1.00 0.00 C ATOM 1958 O LEU A 127 -3.810 -14.969 5.422 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.054 -11.891 4.884 1.00 0.00 C ATOM 1960 CG LEU A 127 -4.664 -10.496 4.657 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -3.993 -9.808 3.465 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.176 -10.520 4.437 1.00 0.00 C ATOM 0 H LEU A 127 -4.654 -11.266 7.232 1.00 0.00 H new ATOM 0 HA LEU A 127 -5.684 -13.222 5.438 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.028 -11.755 5.227 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.003 -12.394 3.919 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.481 -9.937 5.574 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.435 -8.823 3.317 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.926 -9.701 3.660 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.140 -10.410 2.568 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.538 -9.503 4.284 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -6.406 -11.123 3.559 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.664 -10.951 5.311 1.00 0.00 H new ATOM 1974 N GLY A 128 -2.973 -13.873 7.206 1.00 0.00 N ATOM 1975 CA GLY A 128 -1.812 -14.725 7.430 1.00 0.00 C ATOM 1976 C GLY A 128 -0.526 -14.082 6.899 1.00 0.00 C ATOM 1977 O GLY A 128 0.343 -14.815 6.427 1.00 0.00 O ATOM 0 H GLY A 128 -3.094 -13.163 7.928 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -1.706 -14.923 8.497 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -1.967 -15.687 6.941 1.00 0.00 H new ATOM 1981 N MET A 129 -0.407 -12.743 6.876 1.00 0.00 N ATOM 1982 CA MET A 129 0.818 -12.088 6.385 1.00 0.00 C ATOM 1983 C MET A 129 1.972 -12.238 7.369 1.00 0.00 C ATOM 1984 O MET A 129 1.735 -12.303 8.592 1.00 0.00 O ATOM 1985 CB MET A 129 0.584 -10.611 6.042 1.00 0.00 C ATOM 1986 CG MET A 129 -0.213 -10.366 4.759 1.00 0.00 C ATOM 1987 SD MET A 129 0.585 -10.826 3.196 1.00 0.00 S ATOM 1988 CE MET A 129 0.020 -12.536 2.998 1.00 0.00 C ATOM 1989 OXT MET A 129 3.132 -12.275 6.901 1.00 0.00 O ATOM 0 H MET A 129 -1.135 -12.100 7.188 1.00 0.00 H new ATOM 0 HA MET A 129 1.095 -12.600 5.463 1.00 0.00 H new ATOM 0 HB2 MET A 129 0.061 -10.139 6.873 1.00 0.00 H new ATOM 0 HB3 MET A 129 1.551 -10.116 5.952 1.00 0.00 H new ATOM 0 HG2 MET A 129 -1.153 -10.913 4.834 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.464 -9.306 4.713 1.00 0.00 H new ATOM 0 HE1 MET A 129 0.882 -13.192 2.878 1.00 0.00 H new ATOM 0 HE2 MET A 129 -0.545 -12.837 3.880 1.00 0.00 H new ATOM 0 HE3 MET A 129 -0.617 -12.609 2.117 1.00 0.00 H new