USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1058 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 77 LYS NZ :NH3+ -125:sc= 0.669 (180deg=-0.966) USER MOD Set 1.2: A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot -140:sc= 0.0567 USER MOD Single : A 18 SER OG : rot 114:sc= 0.00236 USER MOD Single : A 19 ASN :FLIP amide:sc= 0 F(o=-0.63,f=0) USER MOD Single : A 24 SER OG : rot 180:sc= -0.171 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.0291 USER MOD Single : A 31 MET CE :methyl 156:sc= 0 (180deg=-0.325) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -0.077 X(o=-0.077,f=-0.065) USER MOD Single : A 42 ASN : amide:sc= -0.0126 K(o=-0.013,f=-0.87) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.119 USER MOD Single : A 51 HIS : no HD1:sc= -0.25 X(o=-0.25,f=-0.21) USER MOD Single : A 59 SER OG : rot -170:sc= -1.32 USER MOD Single : A 63 GLN : amide:sc= 0.00564 X(o=0.0056,f=-0.0029) USER MOD Single : A 65 THR OG1 : rot 180:sc=-0.00592 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 23:sc= 0.0434 USER MOD Single : A 78 SER OG : rot 180:sc= 0.185 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= -2.7 K(o=-2.7,f=-4.9!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -0.12 K(o=-0.12,f=-1.8!) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 153:sc= 0.0419 (180deg=-0.0331) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot -34:sc= 0.134 USER MOD Single : A 120 ASN : amide:sc= -3.56! C(o=-3.6!,f=-9.3!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 37:sc= -0.0852 USER MOD Single : A 126 CYS SG : rot -65:sc= -1.99 USER MOD Single : A 127 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 35:sc= 0.305 USER MOD Single : A 144 MET CE :methyl -159:sc= -4.24! (180deg=-4.54!) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= -0.454 USER MOD Single : A 150 CYS SG : rot -119:sc= 1.77 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -7.325 -9.792 10.333 1.00 0.00 N ATOM 88 CA ASP A 9 -8.160 -8.612 10.519 1.00 0.00 C ATOM 89 C ASP A 9 -8.900 -8.260 9.233 1.00 0.00 C ATOM 90 O ASP A 9 -8.339 -7.635 8.333 1.00 0.00 O ATOM 91 CB ASP A 9 -7.308 -7.424 10.974 1.00 0.00 C ATOM 92 CG ASP A 9 -7.335 -7.238 12.478 1.00 0.00 C ATOM 93 OD1 ASP A 9 -7.100 -8.227 13.203 1.00 0.00 O ATOM 94 OD2 ASP A 9 -7.591 -6.103 12.932 1.00 0.00 O ATOM 0 HA ASP A 9 -8.897 -8.838 11.290 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -6.279 -7.572 10.647 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -7.668 -6.516 10.491 1.00 0.00 H new ATOM 99 N ILE A 10 -10.163 -8.666 9.152 1.00 0.00 N ATOM 100 CA ILE A 10 -10.980 -8.393 7.976 1.00 0.00 C ATOM 101 C ILE A 10 -12.145 -7.469 8.318 1.00 0.00 C ATOM 102 O ILE A 10 -12.884 -7.712 9.272 1.00 0.00 O ATOM 103 CB ILE A 10 -11.529 -9.698 7.361 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.296 -9.400 6.070 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.421 -10.422 8.359 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.394 -10.588 5.139 1.00 0.00 C ATOM 0 H ILE A 10 -10.643 -9.185 9.887 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.336 -7.901 7.247 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.688 -10.347 7.118 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.301 -9.063 6.323 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.807 -8.578 5.547 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.800 -11.340 7.909 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.845 -10.666 9.252 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.258 -9.779 8.632 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.950 -10.305 4.245 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.393 -10.912 4.856 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -12.910 -11.404 5.644 1.00 0.00 H new ATOM 118 N VAL A 11 -12.302 -6.408 7.532 1.00 0.00 N ATOM 119 CA VAL A 11 -13.376 -5.448 7.751 1.00 0.00 C ATOM 120 C VAL A 11 -14.186 -5.230 6.478 1.00 0.00 C ATOM 121 O VAL A 11 -13.661 -4.760 5.469 1.00 0.00 O ATOM 122 CB VAL A 11 -12.829 -4.093 8.234 1.00 0.00 C ATOM 123 CG1 VAL A 11 -13.966 -3.172 8.648 1.00 0.00 C ATOM 124 CG2 VAL A 11 -11.849 -4.290 9.382 1.00 0.00 C ATOM 0 H VAL A 11 -11.699 -6.192 6.738 1.00 0.00 H new ATOM 0 HA VAL A 11 -14.021 -5.867 8.523 1.00 0.00 H new ATOM 0 HB VAL A 11 -12.296 -3.624 7.407 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -13.558 -2.220 8.986 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -14.625 -3.003 7.797 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -14.531 -3.633 9.458 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.473 -3.321 9.710 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.355 -4.783 10.212 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -11.016 -4.908 9.047 1.00 0.00 H new ATOM 134 N GLY A 12 -15.468 -5.576 6.531 1.00 0.00 N ATOM 135 CA GLY A 12 -16.330 -5.411 5.375 1.00 0.00 C ATOM 136 C GLY A 12 -15.854 -6.211 4.178 1.00 0.00 C ATOM 137 O GLY A 12 -16.248 -7.363 3.996 1.00 0.00 O ATOM 0 H GLY A 12 -15.926 -5.968 7.354 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -17.343 -5.719 5.634 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.376 -4.355 5.108 1.00 0.00 H new ATOM 141 N ILE A 13 -15.005 -5.599 3.359 1.00 0.00 N ATOM 142 CA ILE A 13 -14.476 -6.261 2.173 1.00 0.00 C ATOM 143 C ILE A 13 -12.972 -6.042 2.047 1.00 0.00 C ATOM 144 O ILE A 13 -12.433 -5.992 0.941 1.00 0.00 O ATOM 145 CB ILE A 13 -15.166 -5.757 0.892 1.00 0.00 C ATOM 146 CG1 ILE A 13 -14.992 -4.243 0.754 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.641 -6.127 0.905 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.435 -3.704 -0.589 1.00 0.00 C ATOM 0 H ILE A 13 -14.669 -4.646 3.495 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.678 -7.326 2.289 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.698 -6.237 0.032 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -15.560 -3.747 1.541 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -13.943 -3.990 0.910 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.115 -5.764 -0.007 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.744 -7.211 0.961 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -17.123 -5.672 1.770 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.283 -2.625 -0.616 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.850 -4.173 -1.380 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -16.492 -3.926 -0.739 1.00 0.00 H new ATOM 160 N TRP A 14 -12.299 -5.914 3.186 1.00 0.00 N ATOM 161 CA TRP A 14 -10.857 -5.700 3.202 1.00 0.00 C ATOM 162 C TRP A 14 -10.185 -6.605 4.231 1.00 0.00 C ATOM 163 O TRP A 14 -10.610 -6.674 5.384 1.00 0.00 O ATOM 164 CB TRP A 14 -10.541 -4.236 3.510 1.00 0.00 C ATOM 165 CG TRP A 14 -11.178 -3.277 2.551 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.477 -2.858 2.554 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.546 -2.619 1.447 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.691 -1.979 1.520 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.521 -1.816 0.826 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.249 -2.631 0.925 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.239 -1.033 -0.291 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -8.972 -1.853 -0.184 1.00 0.00 C ATOM 173 CH2 TRP A 14 -9.962 -1.063 -0.780 1.00 0.00 C ATOM 0 H TRP A 14 -12.729 -5.955 4.110 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.466 -5.948 2.215 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.876 -4.004 4.521 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.461 -4.093 3.492 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.227 -3.172 3.265 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.577 -1.522 1.304 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.478 -3.236 1.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.001 -0.424 -0.754 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -7.974 -1.855 -0.598 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -9.712 -0.465 -1.644 1.00 0.00 H new ATOM 184 N TRP A 15 -9.133 -7.297 3.805 1.00 0.00 N ATOM 185 CA TRP A 15 -8.402 -8.197 4.689 1.00 0.00 C ATOM 186 C TRP A 15 -6.909 -7.884 4.670 1.00 0.00 C ATOM 187 O TRP A 15 -6.344 -7.567 3.624 1.00 0.00 O ATOM 188 CB TRP A 15 -8.635 -9.652 4.276 1.00 0.00 C ATOM 189 CG TRP A 15 -8.410 -9.897 2.815 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.321 -9.745 1.809 1.00 0.00 C ATOM 191 CD2 TRP A 15 -7.197 -10.340 2.197 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.748 -10.067 0.602 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.444 -10.434 0.813 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.925 -10.664 2.676 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.467 -10.839 -0.092 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.956 -11.067 1.776 1.00 0.00 C ATOM 197 CH2 TRP A 15 -5.231 -11.150 0.406 1.00 0.00 C ATOM 0 H TRP A 15 -8.768 -7.252 2.854 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.773 -8.051 5.703 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.971 -10.297 4.852 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.656 -9.936 4.532 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.342 -9.419 1.942 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.217 -10.038 -0.303 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.703 -10.601 3.731 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.677 -10.905 -1.149 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.970 -11.322 2.136 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.452 -11.466 -0.272 1.00 0.00 H new ATOM 208 N THR A 16 -6.277 -7.975 5.835 1.00 0.00 N ATOM 209 CA THR A 16 -4.849 -7.700 5.953 1.00 0.00 C ATOM 210 C THR A 16 -4.029 -8.766 5.234 1.00 0.00 C ATOM 211 O THR A 16 -4.285 -9.962 5.375 1.00 0.00 O ATOM 212 CB THR A 16 -4.442 -7.635 7.426 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.555 -7.311 8.240 1.00 0.00 O ATOM 214 CG2 THR A 16 -3.358 -6.616 7.703 1.00 0.00 C ATOM 0 H THR A 16 -6.730 -8.237 6.711 1.00 0.00 H new ATOM 0 HA THR A 16 -4.649 -6.736 5.485 1.00 0.00 H new ATOM 0 HB THR A 16 -4.055 -8.626 7.663 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.275 -6.689 8.944 1.00 0.00 H new ATOM 0 HG21 THR A 16 -3.117 -6.621 8.766 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.467 -6.867 7.127 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.708 -5.625 7.416 1.00 0.00 H new ATOM 222 N VAL A 17 -3.041 -8.324 4.462 1.00 0.00 N ATOM 223 CA VAL A 17 -2.183 -9.241 3.720 1.00 0.00 C ATOM 224 C VAL A 17 -1.221 -9.969 4.653 1.00 0.00 C ATOM 225 O VAL A 17 -1.018 -9.559 5.796 1.00 0.00 O ATOM 226 CB VAL A 17 -1.370 -8.501 2.641 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.284 -8.002 1.532 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.589 -7.350 3.256 1.00 0.00 C ATOM 0 H VAL A 17 -2.815 -7.338 4.334 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.838 -9.967 3.238 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.657 -9.201 2.205 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.692 -7.482 0.779 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.794 -8.849 1.072 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.022 -7.317 1.949 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.021 -6.839 2.478 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.281 -6.648 3.720 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.096 -7.737 4.011 1.00 0.00 H new ATOM 238 N SER A 18 -0.632 -11.053 4.158 1.00 0.00 N ATOM 239 CA SER A 18 0.307 -11.840 4.948 1.00 0.00 C ATOM 240 C SER A 18 1.740 -11.613 4.474 1.00 0.00 C ATOM 241 O SER A 18 2.669 -11.554 5.279 1.00 0.00 O ATOM 242 CB SER A 18 -0.041 -13.327 4.861 1.00 0.00 C ATOM 243 OG SER A 18 -1.396 -13.555 5.209 1.00 0.00 O ATOM 0 H SER A 18 -0.789 -11.406 3.214 1.00 0.00 H new ATOM 0 HA SER A 18 0.230 -11.516 5.986 1.00 0.00 H new ATOM 0 HB2 SER A 18 0.144 -13.688 3.849 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.609 -13.895 5.526 1.00 0.00 H new ATOM 0 HG SER A 18 -1.887 -13.873 4.423 1.00 0.00 H new ATOM 249 N ASN A 19 1.909 -11.489 3.162 1.00 0.00 N ATOM 250 CA ASN A 19 3.229 -11.268 2.579 1.00 0.00 C ATOM 251 C ASN A 19 3.126 -10.470 1.283 1.00 0.00 C ATOM 252 O ASN A 19 2.030 -10.137 0.834 1.00 0.00 O ATOM 253 CB ASN A 19 3.929 -12.605 2.317 1.00 0.00 C ATOM 254 CG ASN A 19 2.985 -13.663 1.777 1.00 0.00 C ATOM 255 OD1 ASN A 19 2.619 -13.536 0.507 1.00 0.00 O flip ATOM 256 ND2 ASN A 19 2.590 -14.582 2.492 1.00 0.00 N flip ATOM 0 H ASN A 19 1.150 -11.538 2.482 1.00 0.00 H new ATOM 0 HA ASN A 19 3.820 -10.693 3.292 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.742 -12.452 1.607 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.378 -12.963 3.243 1.00 0.00 H new ATOM 0 HD21 ASN A 19 2.897 -14.641 3.463 1.00 0.00 H new ATOM 0 HD22 ASN A 19 1.955 -15.286 2.114 1.00 0.00 H new ATOM 263 N PHE A 20 4.275 -10.167 0.687 1.00 0.00 N ATOM 264 CA PHE A 20 4.315 -9.406 -0.557 1.00 0.00 C ATOM 265 C PHE A 20 3.527 -10.112 -1.657 1.00 0.00 C ATOM 266 O PHE A 20 2.768 -9.482 -2.392 1.00 0.00 O ATOM 267 CB PHE A 20 5.763 -9.200 -1.006 1.00 0.00 C ATOM 268 CG PHE A 20 5.912 -8.191 -2.108 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.778 -6.837 -1.849 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.187 -8.597 -3.404 1.00 0.00 C ATOM 271 CE1 PHE A 20 5.915 -5.906 -2.861 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.325 -7.671 -4.420 1.00 0.00 C ATOM 273 CZ PHE A 20 6.189 -6.324 -4.149 1.00 0.00 C ATOM 0 H PHE A 20 5.191 -10.437 1.046 1.00 0.00 H new ATOM 0 HA PHE A 20 3.855 -8.435 -0.372 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.358 -8.882 -0.150 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.170 -10.154 -1.341 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.564 -6.505 -0.844 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.295 -9.649 -3.622 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.808 -4.853 -2.645 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.539 -8.001 -5.426 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.297 -5.599 -4.942 1.00 0.00 H new ATOM 283 N GLY A 21 3.712 -11.424 -1.762 1.00 0.00 N ATOM 284 CA GLY A 21 3.013 -12.195 -2.774 1.00 0.00 C ATOM 285 C GLY A 21 1.507 -12.022 -2.704 1.00 0.00 C ATOM 286 O GLY A 21 0.807 -12.205 -3.700 1.00 0.00 O ATOM 0 H GLY A 21 4.334 -11.968 -1.164 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.364 -11.894 -3.761 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.259 -13.250 -2.656 1.00 0.00 H new ATOM 290 N GLU A 22 1.006 -11.668 -1.525 1.00 0.00 N ATOM 291 CA GLU A 22 -0.425 -11.470 -1.330 1.00 0.00 C ATOM 292 C GLU A 22 -0.835 -10.049 -1.709 1.00 0.00 C ATOM 293 O GLU A 22 -1.957 -9.816 -2.157 1.00 0.00 O ATOM 294 CB GLU A 22 -0.807 -11.752 0.124 1.00 0.00 C ATOM 295 CG GLU A 22 -0.744 -13.227 0.494 1.00 0.00 C ATOM 296 CD GLU A 22 -2.060 -13.749 1.038 1.00 0.00 C ATOM 297 OE1 GLU A 22 -3.103 -13.516 0.394 1.00 0.00 O ATOM 298 OE2 GLU A 22 -2.045 -14.393 2.109 1.00 0.00 O ATOM 0 H GLU A 22 1.571 -11.512 -0.690 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.954 -12.167 -1.979 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.142 -11.192 0.781 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.817 -11.383 0.304 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.463 -13.807 -0.385 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.038 -13.378 1.238 1.00 0.00 H new ATOM 305 N ILE A 23 0.083 -9.105 -1.526 1.00 0.00 N ATOM 306 CA ILE A 23 -0.185 -7.709 -1.848 1.00 0.00 C ATOM 307 C ILE A 23 -0.232 -7.494 -3.358 1.00 0.00 C ATOM 308 O ILE A 23 0.790 -7.222 -3.989 1.00 0.00 O ATOM 309 CB ILE A 23 0.881 -6.777 -1.240 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.066 -7.077 0.248 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.492 -5.320 -1.446 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.393 -6.603 0.799 1.00 0.00 C ATOM 0 H ILE A 23 1.017 -9.282 -1.157 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.156 -7.465 -1.418 1.00 0.00 H new ATOM 0 HB ILE A 23 1.829 -6.956 -1.748 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.259 -6.605 0.809 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.978 -8.152 0.407 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.255 -4.675 -1.011 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.407 -5.113 -2.513 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.465 -5.127 -0.962 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.456 -6.849 1.859 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.206 -7.094 0.264 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.475 -5.524 0.671 1.00 0.00 H new ATOM 324 N SER A 24 -1.425 -7.619 -3.931 1.00 0.00 N ATOM 325 CA SER A 24 -1.605 -7.439 -5.367 1.00 0.00 C ATOM 326 C SER A 24 -3.005 -6.917 -5.677 1.00 0.00 C ATOM 327 O SER A 24 -3.975 -7.281 -5.013 1.00 0.00 O ATOM 328 CB SER A 24 -1.366 -8.758 -6.103 1.00 0.00 C ATOM 329 OG SER A 24 -0.308 -9.491 -5.507 1.00 0.00 O ATOM 0 H SER A 24 -2.281 -7.844 -3.423 1.00 0.00 H new ATOM 0 HA SER A 24 -0.877 -6.704 -5.710 1.00 0.00 H new ATOM 0 HB2 SER A 24 -2.278 -9.355 -6.091 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.130 -8.557 -7.148 1.00 0.00 H new ATOM 0 HG SER A 24 -0.176 -10.331 -5.995 1.00 0.00 H new ATOM 335 N GLY A 25 -3.101 -6.063 -6.691 1.00 0.00 N ATOM 336 CA GLY A 25 -4.386 -5.505 -7.072 1.00 0.00 C ATOM 337 C GLY A 25 -4.793 -4.338 -6.194 1.00 0.00 C ATOM 338 O GLY A 25 -3.961 -3.754 -5.500 1.00 0.00 O ATOM 0 H GLY A 25 -2.312 -5.747 -7.256 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.343 -5.177 -8.111 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.148 -6.282 -7.015 1.00 0.00 H new ATOM 342 N THR A 26 -6.077 -3.995 -6.226 1.00 0.00 N ATOM 343 CA THR A 26 -6.592 -2.890 -5.427 1.00 0.00 C ATOM 344 C THR A 26 -6.376 -3.147 -3.939 1.00 0.00 C ATOM 345 O THR A 26 -6.704 -4.219 -3.431 1.00 0.00 O ATOM 346 CB THR A 26 -8.081 -2.680 -5.710 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.367 -2.901 -7.079 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.567 -1.292 -5.356 1.00 0.00 C ATOM 0 H THR A 26 -6.779 -4.466 -6.796 1.00 0.00 H new ATOM 0 HA THR A 26 -6.046 -1.988 -5.704 1.00 0.00 H new ATOM 0 HB THR A 26 -8.600 -3.400 -5.078 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.324 -2.764 -7.240 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.630 -1.210 -5.581 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.406 -1.110 -4.293 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.015 -0.554 -5.938 1.00 0.00 H new ATOM 356 N ILE A 27 -5.822 -2.157 -3.247 1.00 0.00 N ATOM 357 CA ILE A 27 -5.562 -2.278 -1.818 1.00 0.00 C ATOM 358 C ILE A 27 -5.695 -0.929 -1.120 1.00 0.00 C ATOM 359 O ILE A 27 -5.707 0.118 -1.768 1.00 0.00 O ATOM 360 CB ILE A 27 -4.156 -2.846 -1.547 1.00 0.00 C ATOM 361 CG1 ILE A 27 -3.089 -1.958 -2.189 1.00 0.00 C ATOM 362 CG2 ILE A 27 -4.051 -4.271 -2.069 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.855 -1.781 -1.333 1.00 0.00 C ATOM 0 H ILE A 27 -5.545 -1.263 -3.652 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.306 -2.967 -1.419 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.988 -2.860 -0.470 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.798 -2.389 -3.147 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.520 -0.979 -2.397 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -3.052 -4.659 -1.870 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.789 -4.897 -1.568 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.236 -4.280 -3.143 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.142 -1.140 -1.851 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -2.133 -1.322 -0.384 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.400 -2.753 -1.146 1.00 0.00 H new ATOM 375 N ALA A 28 -5.797 -0.961 0.204 1.00 0.00 N ATOM 376 CA ALA A 28 -5.930 0.259 0.990 1.00 0.00 C ATOM 377 C ALA A 28 -4.920 0.288 2.133 1.00 0.00 C ATOM 378 O ALA A 28 -4.632 -0.739 2.748 1.00 0.00 O ATOM 379 CB ALA A 28 -7.346 0.386 1.531 1.00 0.00 C ATOM 0 H ALA A 28 -5.790 -1.819 0.755 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.725 1.107 0.337 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.431 1.302 2.116 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.051 0.419 0.701 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.572 -0.472 2.165 1.00 0.00 H new ATOM 385 N ILE A 29 -4.385 1.473 2.412 1.00 0.00 N ATOM 386 CA ILE A 29 -3.407 1.637 3.481 1.00 0.00 C ATOM 387 C ILE A 29 -3.963 2.505 4.605 1.00 0.00 C ATOM 388 O ILE A 29 -4.748 3.422 4.364 1.00 0.00 O ATOM 389 CB ILE A 29 -2.103 2.269 2.958 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.607 1.519 1.720 1.00 0.00 C ATOM 391 CG2 ILE A 29 -1.039 2.267 4.046 1.00 0.00 C ATOM 392 CD1 ILE A 29 -0.694 2.347 0.839 1.00 0.00 C ATOM 0 H ILE A 29 -4.612 2.333 1.913 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.190 0.641 3.867 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.306 3.302 2.677 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.077 0.621 2.037 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.466 1.192 1.134 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.124 2.717 3.661 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.393 2.841 4.902 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.837 1.242 4.355 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.380 1.753 -0.020 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.227 3.232 0.493 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.183 2.652 1.409 1.00 0.00 H new ATOM 404 N GLU A 30 -3.553 2.208 5.834 1.00 0.00 N ATOM 405 CA GLU A 30 -4.012 2.962 6.996 1.00 0.00 C ATOM 406 C GLU A 30 -2.831 3.445 7.832 1.00 0.00 C ATOM 407 O GLU A 30 -2.082 2.643 8.389 1.00 0.00 O ATOM 408 CB GLU A 30 -4.940 2.101 7.855 1.00 0.00 C ATOM 409 CG GLU A 30 -5.690 2.887 8.917 1.00 0.00 C ATOM 410 CD GLU A 30 -6.196 2.010 10.045 1.00 0.00 C ATOM 411 OE1 GLU A 30 -6.568 0.849 9.773 1.00 0.00 O ATOM 412 OE2 GLU A 30 -6.219 2.483 11.200 1.00 0.00 O ATOM 0 H GLU A 30 -2.904 1.451 6.051 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.562 3.832 6.639 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.661 1.602 7.208 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.353 1.321 8.339 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.034 3.655 9.326 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.533 3.401 8.455 1.00 0.00 H new ATOM 419 N MET A 31 -2.673 4.762 7.916 1.00 0.00 N ATOM 420 CA MET A 31 -1.582 5.353 8.684 1.00 0.00 C ATOM 421 C MET A 31 -1.976 5.514 10.150 1.00 0.00 C ATOM 422 O MET A 31 -1.337 4.951 11.039 1.00 0.00 O ATOM 423 CB MET A 31 -1.194 6.711 8.097 1.00 0.00 C ATOM 424 CG MET A 31 -0.526 6.615 6.735 1.00 0.00 C ATOM 425 SD MET A 31 0.527 8.034 6.375 1.00 0.00 S ATOM 426 CE MET A 31 1.389 7.456 4.917 1.00 0.00 C ATOM 0 H MET A 31 -3.286 5.440 7.462 1.00 0.00 H new ATOM 0 HA MET A 31 -0.725 4.682 8.627 1.00 0.00 H new ATOM 0 HB2 MET A 31 -2.087 7.330 8.012 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.520 7.218 8.788 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.071 5.704 6.691 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.292 6.531 5.964 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.735 8.311 4.336 1.00 0.00 H new ATOM 0 HE2 MET A 31 2.245 6.851 5.216 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.713 6.854 4.310 1.00 0.00 H new ATOM 436 N ASP A 32 -3.029 6.286 10.392 1.00 0.00 N ATOM 437 CA ASP A 32 -3.507 6.522 11.750 1.00 0.00 C ATOM 438 C ASP A 32 -4.554 5.485 12.145 1.00 0.00 C ATOM 439 O ASP A 32 -4.892 4.599 11.360 1.00 0.00 O ATOM 440 CB ASP A 32 -4.093 7.931 11.868 1.00 0.00 C ATOM 441 CG ASP A 32 -3.174 8.878 12.614 1.00 0.00 C ATOM 442 OD1 ASP A 32 -3.064 8.748 13.852 1.00 0.00 O ATOM 443 OD2 ASP A 32 -2.562 9.749 11.962 1.00 0.00 O ATOM 0 H ASP A 32 -3.568 6.759 9.667 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.660 6.432 12.430 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -4.286 8.326 10.871 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.053 7.881 12.382 1.00 0.00 H new ATOM 448 N LYS A 33 -5.062 5.602 13.367 1.00 0.00 N ATOM 449 CA LYS A 33 -6.071 4.674 13.867 1.00 0.00 C ATOM 450 C LYS A 33 -7.457 5.046 13.350 1.00 0.00 C ATOM 451 O LYS A 33 -8.205 5.766 14.011 1.00 0.00 O ATOM 452 CB LYS A 33 -6.070 4.664 15.396 1.00 0.00 C ATOM 453 CG LYS A 33 -6.320 3.290 15.996 1.00 0.00 C ATOM 454 CD LYS A 33 -7.141 3.379 17.272 1.00 0.00 C ATOM 455 CE LYS A 33 -6.972 2.135 18.131 1.00 0.00 C ATOM 456 NZ LYS A 33 -7.977 2.077 19.228 1.00 0.00 N ATOM 0 H LYS A 33 -4.792 6.329 14.029 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.824 3.677 13.503 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.110 5.038 15.753 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.834 5.353 15.756 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -6.840 2.664 15.271 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.367 2.806 16.209 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -6.838 4.259 17.840 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -8.194 3.509 17.020 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.065 1.247 17.506 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.969 2.121 18.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.828 1.215 19.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -7.872 2.912 19.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -8.934 2.064 18.822 1.00 0.00 H new ATOM 470 N GLY A 34 -7.794 4.550 12.164 1.00 0.00 N ATOM 471 CA GLY A 34 -9.090 4.841 11.579 1.00 0.00 C ATOM 472 C GLY A 34 -8.993 5.774 10.388 1.00 0.00 C ATOM 473 O GLY A 34 -9.808 5.703 9.469 1.00 0.00 O ATOM 0 H GLY A 34 -7.193 3.952 11.597 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.563 3.909 11.269 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.734 5.289 12.336 1.00 0.00 H new ATOM 477 N ALA A 35 -7.996 6.651 10.406 1.00 0.00 N ATOM 478 CA ALA A 35 -7.796 7.602 9.319 1.00 0.00 C ATOM 479 C ALA A 35 -7.011 6.971 8.175 1.00 0.00 C ATOM 480 O ALA A 35 -6.103 6.170 8.399 1.00 0.00 O ATOM 481 CB ALA A 35 -7.081 8.844 9.830 1.00 0.00 C ATOM 0 H ALA A 35 -7.314 6.723 11.161 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.775 7.891 8.937 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.938 9.546 9.008 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.681 9.315 10.609 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.111 8.563 10.240 1.00 0.00 H new ATOM 487 N TYR A 36 -7.366 7.338 6.947 1.00 0.00 N ATOM 488 CA TYR A 36 -6.693 6.807 5.766 1.00 0.00 C ATOM 489 C TYR A 36 -6.046 7.928 4.959 1.00 0.00 C ATOM 490 O TYR A 36 -6.412 9.095 5.091 1.00 0.00 O ATOM 491 CB TYR A 36 -7.687 6.042 4.890 1.00 0.00 C ATOM 492 CG TYR A 36 -8.214 4.779 5.531 1.00 0.00 C ATOM 493 CD1 TYR A 36 -9.180 4.833 6.528 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.745 3.530 5.141 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.664 3.681 7.117 1.00 0.00 C ATOM 496 CE2 TYR A 36 -8.225 2.373 5.724 1.00 0.00 C ATOM 497 CZ TYR A 36 -9.184 2.454 6.712 1.00 0.00 C ATOM 498 OH TYR A 36 -9.663 1.304 7.296 1.00 0.00 O ATOM 0 H TYR A 36 -8.115 8.000 6.744 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.911 6.125 6.099 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.526 6.696 4.652 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.205 5.786 3.947 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.559 5.792 6.848 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.993 3.463 4.369 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -10.415 3.741 7.891 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.851 1.410 5.408 1.00 0.00 H new ATOM 0 HH TYR A 36 -9.222 0.526 6.896 1.00 0.00 H new ATOM 508 N ILE A 37 -5.081 7.563 4.120 1.00 0.00 N ATOM 509 CA ILE A 37 -4.382 8.537 3.290 1.00 0.00 C ATOM 510 C ILE A 37 -5.300 9.089 2.205 1.00 0.00 C ATOM 511 O ILE A 37 -5.739 8.359 1.317 1.00 0.00 O ATOM 512 CB ILE A 37 -3.137 7.918 2.625 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.280 7.190 3.665 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.324 8.992 1.918 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.864 5.800 3.239 1.00 0.00 C ATOM 0 H ILE A 37 -4.766 6.601 3.997 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.068 9.348 3.948 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.466 7.191 1.883 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.387 7.782 3.867 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.836 7.123 4.600 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.448 8.539 1.454 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.937 9.466 1.151 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.004 9.741 2.642 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.260 5.344 4.024 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.752 5.192 3.065 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.280 5.860 2.321 1.00 0.00 H new ATOM 527 N HIS A 38 -5.586 10.385 2.282 1.00 0.00 N ATOM 528 CA HIS A 38 -6.453 11.035 1.305 1.00 0.00 C ATOM 529 C HIS A 38 -5.631 11.696 0.204 1.00 0.00 C ATOM 530 O HIS A 38 -4.441 11.958 0.374 1.00 0.00 O ATOM 531 CB HIS A 38 -7.339 12.077 1.993 1.00 0.00 C ATOM 532 CG HIS A 38 -8.689 12.220 1.364 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.789 11.475 1.729 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.110 13.048 0.373 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.820 11.864 0.966 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.461 12.816 0.126 1.00 0.00 N ATOM 0 H HIS A 38 -5.231 11.005 3.010 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.086 10.272 0.852 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.462 11.803 3.041 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -6.833 13.042 1.973 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.495 13.771 -0.142 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.816 11.451 1.030 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.051 13.285 -0.562 1.00 0.00 H new ATOM 544 N ALA A 39 -6.276 11.964 -0.928 1.00 0.00 N ATOM 545 CA ALA A 39 -5.606 12.595 -2.059 1.00 0.00 C ATOM 546 C ALA A 39 -6.248 13.936 -2.398 1.00 0.00 C ATOM 547 O ALA A 39 -7.435 14.148 -2.150 1.00 0.00 O ATOM 548 CB ALA A 39 -5.634 11.673 -3.269 1.00 0.00 C ATOM 0 H ALA A 39 -7.262 11.754 -1.086 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.569 12.779 -1.780 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.131 12.156 -4.106 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.124 10.741 -3.028 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.668 11.461 -3.541 1.00 0.00 H new ATOM 554 N LEU A 40 -5.454 14.838 -2.968 1.00 0.00 N ATOM 555 CA LEU A 40 -5.945 16.160 -3.343 1.00 0.00 C ATOM 556 C LEU A 40 -5.792 16.391 -4.842 1.00 0.00 C ATOM 557 O LEU A 40 -4.830 15.931 -5.457 1.00 0.00 O ATOM 558 CB LEU A 40 -5.192 17.244 -2.569 1.00 0.00 C ATOM 559 CG LEU A 40 -5.646 17.439 -1.121 1.00 0.00 C ATOM 560 CD1 LEU A 40 -4.761 18.456 -0.417 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.102 17.876 -1.074 1.00 0.00 C ATOM 0 H LEU A 40 -4.469 14.678 -3.180 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.004 16.212 -3.092 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.130 16.999 -2.571 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.302 18.190 -3.099 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.555 16.486 -0.600 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.099 18.582 0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.729 18.104 -0.420 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.820 19.412 -0.938 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.408 18.010 -0.037 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.217 18.818 -1.611 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.726 17.114 -1.541 1.00 0.00 H new ATOM 573 N ASP A 41 -6.749 17.106 -5.425 1.00 0.00 N ATOM 574 CA ASP A 41 -6.721 17.400 -6.854 1.00 0.00 C ATOM 575 C ASP A 41 -5.573 18.344 -7.193 1.00 0.00 C ATOM 576 O ASP A 41 -4.973 18.248 -8.265 1.00 0.00 O ATOM 577 CB ASP A 41 -8.050 18.013 -7.296 1.00 0.00 C ATOM 578 CG ASP A 41 -8.481 19.162 -6.404 1.00 0.00 C ATOM 579 OD1 ASP A 41 -7.715 20.140 -6.285 1.00 0.00 O ATOM 580 OD2 ASP A 41 -9.586 19.082 -5.827 1.00 0.00 O ATOM 0 H ASP A 41 -7.553 17.492 -4.931 1.00 0.00 H new ATOM 0 HA ASP A 41 -6.566 16.463 -7.389 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -7.960 18.368 -8.323 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.822 17.243 -7.291 1.00 0.00 H new ATOM 585 N ASN A 42 -5.273 19.257 -6.275 1.00 0.00 N ATOM 586 CA ASN A 42 -4.197 20.221 -6.477 1.00 0.00 C ATOM 587 C ASN A 42 -2.862 19.513 -6.693 1.00 0.00 C ATOM 588 O ASN A 42 -1.961 20.049 -7.339 1.00 0.00 O ATOM 589 CB ASN A 42 -4.096 21.163 -5.276 1.00 0.00 C ATOM 590 CG ASN A 42 -3.261 22.393 -5.575 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.290 22.922 -6.685 1.00 0.00 O ATOM 592 ND2 ASN A 42 -2.510 22.854 -4.581 1.00 0.00 N ATOM 0 H ASN A 42 -5.760 19.350 -5.384 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.429 20.802 -7.370 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.097 21.471 -4.974 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.660 20.627 -4.433 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -1.927 23.679 -4.723 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.517 22.383 -3.676 1.00 0.00 H new ATOM 599 N GLY A 43 -2.741 18.304 -6.152 1.00 0.00 N ATOM 600 CA GLY A 43 -1.513 17.545 -6.298 1.00 0.00 C ATOM 601 C GLY A 43 -0.828 17.286 -4.971 1.00 0.00 C ATOM 602 O GLY A 43 0.397 17.183 -4.907 1.00 0.00 O ATOM 0 H GLY A 43 -3.472 17.837 -5.615 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.734 16.593 -6.781 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.832 18.086 -6.955 1.00 0.00 H new ATOM 606 N LEU A 44 -1.620 17.182 -3.908 1.00 0.00 N ATOM 607 CA LEU A 44 -1.082 16.934 -2.575 1.00 0.00 C ATOM 608 C LEU A 44 -1.802 15.766 -1.910 1.00 0.00 C ATOM 609 O LEU A 44 -2.747 15.207 -2.467 1.00 0.00 O ATOM 610 CB LEU A 44 -1.211 18.187 -1.708 1.00 0.00 C ATOM 611 CG LEU A 44 -0.300 19.349 -2.109 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.003 20.680 -1.892 1.00 0.00 C ATOM 613 CD2 LEU A 44 1.003 19.299 -1.326 1.00 0.00 C ATOM 0 H LEU A 44 -2.636 17.266 -3.944 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.027 16.679 -2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.246 18.528 -1.741 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.997 17.918 -0.674 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.068 19.253 -3.170 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.339 21.494 -2.183 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.908 20.716 -2.498 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.266 20.785 -0.839 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.639 20.133 -1.624 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.789 19.369 -0.259 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.516 18.360 -1.533 1.00 0.00 H new ATOM 625 N PHE A 45 -1.348 15.400 -0.716 1.00 0.00 N ATOM 626 CA PHE A 45 -1.950 14.297 0.024 1.00 0.00 C ATOM 627 C PHE A 45 -2.038 14.623 1.513 1.00 0.00 C ATOM 628 O PHE A 45 -1.071 15.090 2.113 1.00 0.00 O ATOM 629 CB PHE A 45 -1.141 13.015 -0.183 1.00 0.00 C ATOM 630 CG PHE A 45 -1.491 12.280 -1.445 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.134 12.792 -2.682 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.178 11.078 -1.394 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.454 12.118 -3.845 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.501 10.399 -2.553 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.139 10.919 -3.780 1.00 0.00 C ATOM 0 H PHE A 45 -0.566 15.850 -0.241 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.960 14.146 -0.356 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.080 13.264 -0.200 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.300 12.354 0.669 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.599 13.729 -2.738 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.464 10.667 -0.437 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.169 12.527 -4.803 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.036 9.462 -2.499 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.391 10.390 -4.687 1.00 0.00 H new ATOM 645 N THR A 46 -3.204 14.374 2.099 1.00 0.00 N ATOM 646 CA THR A 46 -3.419 14.642 3.516 1.00 0.00 C ATOM 647 C THR A 46 -4.208 13.511 4.170 1.00 0.00 C ATOM 648 O THR A 46 -4.884 12.739 3.490 1.00 0.00 O ATOM 649 CB THR A 46 -4.161 15.967 3.700 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.511 16.162 5.059 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.429 16.061 2.881 1.00 0.00 C ATOM 0 H THR A 46 -4.014 13.987 1.615 1.00 0.00 H new ATOM 0 HA THR A 46 -2.444 14.709 3.999 1.00 0.00 H new ATOM 0 HB THR A 46 -3.468 16.736 3.357 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.983 17.015 5.156 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.906 17.025 3.058 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.187 15.965 1.823 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.110 15.261 3.171 1.00 0.00 H new ATOM 659 N LEU A 47 -4.116 13.419 5.493 1.00 0.00 N ATOM 660 CA LEU A 47 -4.822 12.382 6.236 1.00 0.00 C ATOM 661 C LEU A 47 -6.324 12.643 6.245 1.00 0.00 C ATOM 662 O LEU A 47 -6.788 13.640 6.797 1.00 0.00 O ATOM 663 CB LEU A 47 -4.299 12.308 7.672 1.00 0.00 C ATOM 664 CG LEU A 47 -4.633 11.014 8.418 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.754 9.875 7.927 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.471 11.207 9.917 1.00 0.00 C ATOM 0 H LEU A 47 -3.560 14.049 6.071 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.640 11.429 5.739 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.216 12.430 7.655 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.706 13.149 8.234 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.673 10.757 8.216 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.005 8.963 8.468 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.919 9.722 6.861 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.707 10.123 8.100 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.713 10.277 10.432 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.441 11.488 10.139 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.143 11.995 10.257 1.00 0.00 H new ATOM 678 N GLY A 48 -7.080 11.740 5.628 1.00 0.00 N ATOM 679 CA GLY A 48 -8.523 11.891 5.577 1.00 0.00 C ATOM 680 C GLY A 48 -9.180 11.618 6.915 1.00 0.00 C ATOM 681 O GLY A 48 -8.614 10.927 7.763 1.00 0.00 O ATOM 0 H GLY A 48 -6.719 10.907 5.163 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.769 12.903 5.254 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.931 11.210 4.830 1.00 0.00 H new ATOM 685 N ALA A 49 -10.378 12.159 7.105 1.00 0.00 N ATOM 686 CA ALA A 49 -11.113 11.969 8.350 1.00 0.00 C ATOM 687 C ALA A 49 -11.375 10.487 8.612 1.00 0.00 C ATOM 688 O ALA A 49 -11.621 9.720 7.682 1.00 0.00 O ATOM 689 CB ALA A 49 -12.425 12.739 8.310 1.00 0.00 C ATOM 0 H ALA A 49 -10.861 12.732 6.413 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.502 12.354 9.167 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.964 12.589 9.245 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.220 13.801 8.176 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -13.033 12.380 7.479 1.00 0.00 H new ATOM 695 N PRO A 50 -11.325 10.064 9.888 1.00 0.00 N ATOM 696 CA PRO A 50 -11.558 8.666 10.263 1.00 0.00 C ATOM 697 C PRO A 50 -13.026 8.272 10.146 1.00 0.00 C ATOM 698 O PRO A 50 -13.901 9.128 10.021 1.00 0.00 O ATOM 699 CB PRO A 50 -11.106 8.614 11.724 1.00 0.00 C ATOM 700 CG PRO A 50 -11.305 10.000 12.229 1.00 0.00 C ATOM 701 CD PRO A 50 -11.037 10.912 11.062 1.00 0.00 C ATOM 0 HA PRO A 50 -11.025 7.974 9.611 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.694 7.896 12.295 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.063 8.308 11.805 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.319 10.136 12.605 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.627 10.215 13.055 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.677 11.794 11.087 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -10.006 11.266 11.058 1.00 0.00 H new ATOM 709 N HIS A 51 -13.289 6.970 10.186 1.00 0.00 N ATOM 710 CA HIS A 51 -14.651 6.461 10.083 1.00 0.00 C ATOM 711 C HIS A 51 -15.284 6.320 11.464 1.00 0.00 C ATOM 712 O HIS A 51 -14.603 6.002 12.439 1.00 0.00 O ATOM 713 CB HIS A 51 -14.662 5.111 9.365 1.00 0.00 C ATOM 714 CG HIS A 51 -14.275 5.199 7.921 1.00 0.00 C ATOM 715 ND1 HIS A 51 -15.114 4.760 6.927 1.00 0.00 N ATOM 716 CD2 HIS A 51 -13.136 5.676 7.362 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.476 4.979 5.791 1.00 0.00 C ATOM 718 NE2 HIS A 51 -13.272 5.533 6.005 1.00 0.00 N ATOM 0 H HIS A 51 -12.576 6.248 10.289 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.236 7.176 9.505 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -13.979 4.432 9.875 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.659 4.677 9.440 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.286 6.089 7.884 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.873 4.742 4.815 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.589 5.797 5.295 1.00 0.00 H new ATOM 726 N ARG A 52 -16.589 6.558 11.539 1.00 0.00 N ATOM 727 CA ARG A 52 -17.312 6.458 12.801 1.00 0.00 C ATOM 728 C ARG A 52 -17.760 5.023 13.060 1.00 0.00 C ATOM 729 O ARG A 52 -17.830 4.580 14.205 1.00 0.00 O ATOM 730 CB ARG A 52 -18.527 7.389 12.794 1.00 0.00 C ATOM 731 CG ARG A 52 -18.889 7.925 14.169 1.00 0.00 C ATOM 732 CD ARG A 52 -20.395 7.987 14.367 1.00 0.00 C ATOM 733 NE ARG A 52 -20.790 7.561 15.707 1.00 0.00 N ATOM 734 CZ ARG A 52 -20.511 8.246 16.814 1.00 0.00 C ATOM 735 NH1 ARG A 52 -19.838 9.387 16.745 1.00 0.00 N ATOM 736 NH2 ARG A 52 -20.906 7.786 17.994 1.00 0.00 N ATOM 0 H ARG A 52 -17.167 6.821 10.741 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.636 6.760 13.601 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -18.328 8.228 12.127 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.383 6.853 12.385 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -18.447 7.289 14.936 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.464 8.921 14.296 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.741 9.006 14.194 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.884 7.354 13.627 1.00 0.00 H new ATOM 0 HE ARG A 52 -21.310 6.688 15.800 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -19.531 9.744 15.840 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -19.627 9.907 17.597 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -21.423 6.909 18.052 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -20.693 8.310 18.843 1.00 0.00 H new ATOM 750 N GLU A 53 -18.064 4.300 11.986 1.00 0.00 N ATOM 751 CA GLU A 53 -18.504 2.915 12.096 1.00 0.00 C ATOM 752 C GLU A 53 -17.310 1.972 12.217 1.00 0.00 C ATOM 753 O GLU A 53 -16.185 2.334 11.874 1.00 0.00 O ATOM 754 CB GLU A 53 -19.358 2.531 10.885 1.00 0.00 C ATOM 755 CG GLU A 53 -20.844 2.441 11.192 1.00 0.00 C ATOM 756 CD GLU A 53 -21.436 1.093 10.829 1.00 0.00 C ATOM 757 OE1 GLU A 53 -20.688 0.092 10.845 1.00 0.00 O ATOM 758 OE2 GLU A 53 -22.647 1.038 10.528 1.00 0.00 O ATOM 0 H GLU A 53 -18.013 4.651 11.030 1.00 0.00 H new ATOM 0 HA GLU A 53 -19.108 2.821 12.999 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -19.203 3.265 10.094 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -19.016 1.570 10.500 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -21.004 2.629 12.254 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -21.372 3.224 10.647 1.00 0.00 H new ATOM 765 N VAL A 54 -17.565 0.763 12.706 1.00 0.00 N ATOM 766 CA VAL A 54 -16.512 -0.231 12.871 1.00 0.00 C ATOM 767 C VAL A 54 -16.267 -0.994 11.574 1.00 0.00 C ATOM 768 O VAL A 54 -15.122 -1.253 11.201 1.00 0.00 O ATOM 769 CB VAL A 54 -16.857 -1.236 13.985 1.00 0.00 C ATOM 770 CG1 VAL A 54 -15.670 -2.139 14.280 1.00 0.00 C ATOM 771 CG2 VAL A 54 -17.305 -0.506 15.243 1.00 0.00 C ATOM 0 H VAL A 54 -18.491 0.448 12.995 1.00 0.00 H new ATOM 0 HA VAL A 54 -15.608 0.311 13.148 1.00 0.00 H new ATOM 0 HB VAL A 54 -17.681 -1.861 13.640 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -15.935 -2.842 15.070 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -15.400 -2.690 13.379 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -14.823 -1.533 14.602 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -17.545 -1.233 16.019 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -16.503 0.145 15.591 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -18.188 0.093 15.021 1.00 0.00 H new ATOM 781 N ASP A 55 -17.348 -1.350 10.889 1.00 0.00 N ATOM 782 CA ASP A 55 -17.251 -2.084 9.632 1.00 0.00 C ATOM 783 C ASP A 55 -17.646 -1.199 8.454 1.00 0.00 C ATOM 784 O ASP A 55 -18.830 -1.027 8.164 1.00 0.00 O ATOM 785 CB ASP A 55 -18.140 -3.327 9.674 1.00 0.00 C ATOM 786 CG ASP A 55 -17.496 -4.521 8.997 1.00 0.00 C ATOM 787 OD1 ASP A 55 -16.502 -5.046 9.540 1.00 0.00 O ATOM 788 OD2 ASP A 55 -17.986 -4.932 7.924 1.00 0.00 O ATOM 0 H ASP A 55 -18.302 -1.142 11.183 1.00 0.00 H new ATOM 0 HA ASP A 55 -16.214 -2.393 9.498 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -18.362 -3.577 10.712 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -19.091 -3.107 9.189 1.00 0.00 H new ATOM 793 N GLU A 56 -16.648 -0.640 7.779 1.00 0.00 N ATOM 794 CA GLU A 56 -16.892 0.227 6.633 1.00 0.00 C ATOM 795 C GLU A 56 -15.673 0.273 5.715 1.00 0.00 C ATOM 796 O GLU A 56 -14.539 0.112 6.166 1.00 0.00 O ATOM 797 CB GLU A 56 -17.246 1.639 7.101 1.00 0.00 C ATOM 798 CG GLU A 56 -17.885 2.497 6.021 1.00 0.00 C ATOM 799 CD GLU A 56 -19.354 2.179 5.819 1.00 0.00 C ATOM 800 OE1 GLU A 56 -19.694 0.982 5.715 1.00 0.00 O ATOM 801 OE2 GLU A 56 -20.164 3.128 5.765 1.00 0.00 O ATOM 0 H GLU A 56 -15.662 -0.772 8.006 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.732 -0.183 6.072 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -17.927 1.571 7.949 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.341 2.132 7.457 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.778 3.549 6.286 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.352 2.349 5.082 1.00 0.00 H new ATOM 808 N GLY A 57 -15.917 0.496 4.429 1.00 0.00 N ATOM 809 CA GLY A 57 -14.829 0.562 3.469 1.00 0.00 C ATOM 810 C GLY A 57 -14.392 1.986 3.184 1.00 0.00 C ATOM 811 O GLY A 57 -15.154 2.927 3.408 1.00 0.00 O ATOM 0 H GLY A 57 -16.847 0.632 4.033 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.980 -0.006 3.848 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.141 0.088 2.538 1.00 0.00 H new ATOM 815 N PRO A 58 -13.159 2.180 2.685 1.00 0.00 N ATOM 816 CA PRO A 58 -12.634 3.512 2.375 1.00 0.00 C ATOM 817 C PRO A 58 -13.301 4.126 1.147 1.00 0.00 C ATOM 818 O PRO A 58 -14.060 3.462 0.444 1.00 0.00 O ATOM 819 CB PRO A 58 -11.151 3.254 2.103 1.00 0.00 C ATOM 820 CG PRO A 58 -11.091 1.838 1.646 1.00 0.00 C ATOM 821 CD PRO A 58 -12.181 1.115 2.388 1.00 0.00 C ATOM 0 HA PRO A 58 -12.817 4.220 3.183 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.764 3.932 1.342 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.551 3.406 3.001 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.241 1.769 0.569 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.116 1.400 1.861 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.621 0.323 1.783 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.806 0.649 3.299 1.00 0.00 H new ATOM 829 N SER A 59 -13.010 5.399 0.899 1.00 0.00 N ATOM 830 CA SER A 59 -13.580 6.105 -0.242 1.00 0.00 C ATOM 831 C SER A 59 -12.820 5.770 -1.524 1.00 0.00 C ATOM 832 O SER A 59 -11.712 5.236 -1.477 1.00 0.00 O ATOM 833 CB SER A 59 -13.551 7.615 0.003 1.00 0.00 C ATOM 834 OG SER A 59 -12.246 8.136 -0.175 1.00 0.00 O ATOM 0 H SER A 59 -12.383 5.962 1.473 1.00 0.00 H new ATOM 0 HA SER A 59 -14.614 5.782 -0.360 1.00 0.00 H new ATOM 0 HB2 SER A 59 -14.240 8.111 -0.681 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.896 7.829 1.014 1.00 0.00 H new ATOM 0 HG SER A 59 -12.219 9.064 0.138 1.00 0.00 H new ATOM 840 N PRO A 60 -13.409 6.083 -2.692 1.00 0.00 N ATOM 841 CA PRO A 60 -12.781 5.812 -3.988 1.00 0.00 C ATOM 842 C PRO A 60 -11.367 6.388 -4.089 1.00 0.00 C ATOM 843 O PRO A 60 -10.441 5.693 -4.505 1.00 0.00 O ATOM 844 CB PRO A 60 -13.714 6.493 -4.994 1.00 0.00 C ATOM 845 CG PRO A 60 -15.032 6.560 -4.303 1.00 0.00 C ATOM 846 CD PRO A 60 -14.729 6.723 -2.841 1.00 0.00 C ATOM 0 HA PRO A 60 -12.660 4.742 -4.160 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.354 7.488 -5.257 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.781 5.923 -5.920 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -15.624 7.397 -4.674 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.612 5.655 -4.482 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -14.701 7.773 -2.551 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.482 6.240 -2.218 1.00 0.00 H new ATOM 854 N PRO A 61 -11.176 7.668 -3.712 1.00 0.00 N ATOM 855 CA PRO A 61 -9.860 8.311 -3.771 1.00 0.00 C ATOM 856 C PRO A 61 -8.919 7.805 -2.684 1.00 0.00 C ATOM 857 O PRO A 61 -7.698 7.838 -2.841 1.00 0.00 O ATOM 858 CB PRO A 61 -10.178 9.791 -3.560 1.00 0.00 C ATOM 859 CG PRO A 61 -11.435 9.796 -2.763 1.00 0.00 C ATOM 860 CD PRO A 61 -12.216 8.586 -3.201 1.00 0.00 C ATOM 0 HA PRO A 61 -9.346 8.103 -4.709 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.371 10.298 -3.031 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.310 10.308 -4.511 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.219 9.754 -1.695 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.003 10.710 -2.938 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -12.769 8.144 -2.372 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -12.944 8.836 -3.972 1.00 0.00 H new ATOM 868 N GLU A 62 -9.494 7.337 -1.580 1.00 0.00 N ATOM 869 CA GLU A 62 -8.704 6.824 -0.467 1.00 0.00 C ATOM 870 C GLU A 62 -8.048 5.496 -0.832 1.00 0.00 C ATOM 871 O GLU A 62 -6.958 5.178 -0.356 1.00 0.00 O ATOM 872 CB GLU A 62 -9.586 6.650 0.772 1.00 0.00 C ATOM 873 CG GLU A 62 -9.450 7.781 1.779 1.00 0.00 C ATOM 874 CD GLU A 62 -10.339 7.592 2.993 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.779 6.448 3.234 1.00 0.00 O ATOM 876 OE2 GLU A 62 -10.594 8.587 3.703 1.00 0.00 O ATOM 0 H GLU A 62 -10.503 7.303 -1.433 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.918 7.546 -0.246 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.628 6.577 0.459 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.332 5.708 1.259 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.411 7.852 2.102 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.699 8.725 1.295 1.00 0.00 H new ATOM 883 N GLN A 63 -8.719 4.723 -1.681 1.00 0.00 N ATOM 884 CA GLN A 63 -8.202 3.429 -2.110 1.00 0.00 C ATOM 885 C GLN A 63 -7.048 3.604 -3.092 1.00 0.00 C ATOM 886 O GLN A 63 -6.931 4.637 -3.752 1.00 0.00 O ATOM 887 CB GLN A 63 -9.314 2.601 -2.754 1.00 0.00 C ATOM 888 CG GLN A 63 -10.427 2.223 -1.791 1.00 0.00 C ATOM 889 CD GLN A 63 -11.612 1.585 -2.491 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.452 0.673 -3.303 1.00 0.00 O ATOM 891 NE2 GLN A 63 -12.810 2.064 -2.178 1.00 0.00 N ATOM 0 H GLN A 63 -9.622 4.971 -2.085 1.00 0.00 H new ATOM 0 HA GLN A 63 -7.831 2.903 -1.230 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -9.740 3.164 -3.585 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -8.883 1.692 -3.172 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.037 1.533 -1.043 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -10.760 3.114 -1.259 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -12.895 2.821 -1.499 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.645 1.675 -2.616 1.00 0.00 H new ATOM 900 N PHE A 64 -6.197 2.587 -3.184 1.00 0.00 N ATOM 901 CA PHE A 64 -5.052 2.628 -4.086 1.00 0.00 C ATOM 902 C PHE A 64 -4.889 1.300 -4.818 1.00 0.00 C ATOM 903 O PHE A 64 -5.192 0.238 -4.275 1.00 0.00 O ATOM 904 CB PHE A 64 -3.776 2.956 -3.309 1.00 0.00 C ATOM 905 CG PHE A 64 -3.843 4.261 -2.570 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.575 5.455 -3.218 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.175 4.293 -1.224 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.637 6.657 -2.540 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.237 5.492 -0.540 1.00 0.00 C ATOM 910 CZ PHE A 64 -3.968 6.676 -1.199 1.00 0.00 C ATOM 0 H PHE A 64 -6.279 1.725 -2.645 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.230 3.410 -4.824 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.577 2.155 -2.597 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.935 2.983 -4.002 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.314 5.446 -4.266 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.388 3.370 -0.704 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.427 7.581 -3.058 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.495 5.504 0.509 1.00 0.00 H new ATOM 0 HZ PHE A 64 -4.016 7.615 -0.667 1.00 0.00 H new ATOM 920 N THR A 65 -4.409 1.367 -6.056 1.00 0.00 N ATOM 921 CA THR A 65 -4.205 0.171 -6.864 1.00 0.00 C ATOM 922 C THR A 65 -2.741 -0.256 -6.846 1.00 0.00 C ATOM 923 O THR A 65 -1.859 0.496 -7.262 1.00 0.00 O ATOM 924 CB THR A 65 -4.658 0.419 -8.303 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.612 1.465 -8.354 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.277 -0.798 -8.954 1.00 0.00 C ATOM 0 H THR A 65 -4.154 2.238 -6.521 1.00 0.00 H new ATOM 0 HA THR A 65 -4.804 -0.632 -6.435 1.00 0.00 H new ATOM 0 HB THR A 65 -3.752 0.682 -8.850 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.889 1.610 -9.283 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.576 -0.553 -9.973 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.549 -1.609 -8.975 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.152 -1.110 -8.384 1.00 0.00 H new ATOM 934 N ALA A 66 -2.489 -1.467 -6.361 1.00 0.00 N ATOM 935 CA ALA A 66 -1.133 -1.996 -6.290 1.00 0.00 C ATOM 936 C ALA A 66 -0.789 -2.797 -7.541 1.00 0.00 C ATOM 937 O ALA A 66 -1.642 -3.481 -8.106 1.00 0.00 O ATOM 938 CB ALA A 66 -0.966 -2.856 -5.047 1.00 0.00 C ATOM 0 H ALA A 66 -3.207 -2.101 -6.011 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.444 -1.153 -6.230 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.052 -3.244 -5.007 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -1.160 -2.254 -4.159 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.670 -3.687 -5.082 1.00 0.00 H new ATOM 944 N VAL A 67 0.466 -2.708 -7.969 1.00 0.00 N ATOM 945 CA VAL A 67 0.922 -3.426 -9.154 1.00 0.00 C ATOM 946 C VAL A 67 2.340 -3.954 -8.965 1.00 0.00 C ATOM 947 O VAL A 67 3.274 -3.185 -8.740 1.00 0.00 O ATOM 948 CB VAL A 67 0.883 -2.528 -10.404 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.167 -3.342 -11.657 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.458 -1.819 -10.512 1.00 0.00 C ATOM 0 H VAL A 67 1.185 -2.146 -7.513 1.00 0.00 H new ATOM 0 HA VAL A 67 0.241 -4.265 -9.297 1.00 0.00 H new ATOM 0 HB VAL A 67 1.661 -1.771 -10.308 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.135 -2.690 -12.530 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.155 -3.796 -11.580 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.415 -4.124 -11.761 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.466 -1.189 -11.402 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.256 -2.558 -10.584 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.615 -1.201 -9.628 1.00 0.00 H new ATOM 960 N LYS A 68 2.492 -5.271 -9.059 1.00 0.00 N ATOM 961 CA LYS A 68 3.797 -5.903 -8.899 1.00 0.00 C ATOM 962 C LYS A 68 4.710 -5.566 -10.074 1.00 0.00 C ATOM 963 O LYS A 68 4.251 -5.413 -11.206 1.00 0.00 O ATOM 964 CB LYS A 68 3.641 -7.420 -8.779 1.00 0.00 C ATOM 965 CG LYS A 68 3.183 -7.877 -7.404 1.00 0.00 C ATOM 966 CD LYS A 68 3.576 -9.320 -7.137 1.00 0.00 C ATOM 967 CE LYS A 68 5.059 -9.446 -6.830 1.00 0.00 C ATOM 968 NZ LYS A 68 5.650 -10.671 -7.438 1.00 0.00 N ATOM 0 H LYS A 68 1.728 -5.921 -9.245 1.00 0.00 H new ATOM 0 HA LYS A 68 4.251 -5.518 -7.986 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.924 -7.763 -9.524 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.594 -7.895 -9.012 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.620 -7.233 -6.641 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.101 -7.773 -7.327 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.996 -9.707 -6.299 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.330 -9.932 -8.005 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.583 -8.566 -7.204 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.205 -9.470 -5.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.662 -10.720 -7.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.167 -11.512 -7.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.533 -10.637 -8.471 1.00 0.00 H new ATOM 982 N LEU A 69 6.004 -5.450 -9.797 1.00 0.00 N ATOM 983 CA LEU A 69 6.980 -5.130 -10.831 1.00 0.00 C ATOM 984 C LEU A 69 8.194 -6.052 -10.741 1.00 0.00 C ATOM 985 O LEU A 69 8.368 -6.947 -11.568 1.00 0.00 O ATOM 986 CB LEU A 69 7.421 -3.670 -10.714 1.00 0.00 C ATOM 987 CG LEU A 69 6.300 -2.641 -10.876 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.820 -1.239 -10.602 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.696 -2.726 -12.270 1.00 0.00 C ATOM 0 H LEU A 69 6.401 -5.573 -8.865 1.00 0.00 H new ATOM 0 HA LEU A 69 6.505 -5.281 -11.801 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.889 -3.525 -9.741 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.184 -3.475 -11.467 1.00 0.00 H new ATOM 0 HG LEU A 69 5.519 -2.865 -10.150 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.009 -0.520 -10.722 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.204 -1.186 -9.583 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.620 -1.004 -11.304 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.900 -1.987 -12.368 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.468 -2.528 -13.014 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.286 -3.723 -12.429 1.00 0.00 H new ATOM 1001 N SER A 70 9.030 -5.829 -9.731 1.00 0.00 N ATOM 1002 CA SER A 70 10.226 -6.640 -9.534 1.00 0.00 C ATOM 1003 C SER A 70 11.005 -6.172 -8.308 1.00 0.00 C ATOM 1004 O SER A 70 10.851 -5.036 -7.860 1.00 0.00 O ATOM 1005 CB SER A 70 11.119 -6.581 -10.776 1.00 0.00 C ATOM 1006 OG SER A 70 11.392 -7.881 -11.270 1.00 0.00 O ATOM 0 H SER A 70 8.901 -5.093 -9.037 1.00 0.00 H new ATOM 0 HA SER A 70 9.913 -7.671 -9.370 1.00 0.00 H new ATOM 0 HB2 SER A 70 10.631 -5.989 -11.551 1.00 0.00 H new ATOM 0 HB3 SER A 70 12.054 -6.078 -10.532 1.00 0.00 H new ATOM 0 HG SER A 70 11.963 -7.816 -12.064 1.00 0.00 H new ATOM 1012 N ASP A 71 11.842 -7.054 -7.772 1.00 0.00 N ATOM 1013 CA ASP A 71 12.646 -6.731 -6.600 1.00 0.00 C ATOM 1014 C ASP A 71 11.760 -6.371 -5.412 1.00 0.00 C ATOM 1015 O ASP A 71 12.117 -5.524 -4.593 1.00 0.00 O ATOM 1016 CB ASP A 71 13.597 -5.573 -6.911 1.00 0.00 C ATOM 1017 CG ASP A 71 14.863 -6.035 -7.604 1.00 0.00 C ATOM 1018 OD1 ASP A 71 14.773 -6.489 -8.764 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.945 -5.944 -6.986 1.00 0.00 O ATOM 0 H ASP A 71 11.981 -7.999 -8.131 1.00 0.00 H new ATOM 0 HA ASP A 71 13.231 -7.613 -6.339 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.086 -4.846 -7.542 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.859 -5.063 -5.984 1.00 0.00 H new ATOM 1024 N SER A 72 10.603 -7.020 -5.324 1.00 0.00 N ATOM 1025 CA SER A 72 9.667 -6.768 -4.236 1.00 0.00 C ATOM 1026 C SER A 72 9.209 -5.312 -4.237 1.00 0.00 C ATOM 1027 O SER A 72 9.138 -4.671 -3.188 1.00 0.00 O ATOM 1028 CB SER A 72 10.312 -7.112 -2.891 1.00 0.00 C ATOM 1029 OG SER A 72 9.328 -7.390 -1.909 1.00 0.00 O ATOM 0 H SER A 72 10.292 -7.724 -5.993 1.00 0.00 H new ATOM 0 HA SER A 72 8.794 -7.404 -4.386 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.967 -7.975 -3.009 1.00 0.00 H new ATOM 0 HB3 SER A 72 10.936 -6.281 -2.560 1.00 0.00 H new ATOM 0 HG SER A 72 8.496 -7.665 -2.348 1.00 0.00 H new ATOM 1035 N ARG A 73 8.900 -4.796 -5.422 1.00 0.00 N ATOM 1036 CA ARG A 73 8.449 -3.416 -5.560 1.00 0.00 C ATOM 1037 C ARG A 73 7.061 -3.357 -6.190 1.00 0.00 C ATOM 1038 O ARG A 73 6.811 -3.976 -7.225 1.00 0.00 O ATOM 1039 CB ARG A 73 9.439 -2.616 -6.409 1.00 0.00 C ATOM 1040 CG ARG A 73 10.892 -2.840 -6.023 1.00 0.00 C ATOM 1041 CD ARG A 73 11.221 -2.190 -4.689 1.00 0.00 C ATOM 1042 NE ARG A 73 11.775 -0.849 -4.855 1.00 0.00 N ATOM 1043 CZ ARG A 73 13.038 -0.605 -5.195 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.883 -1.609 -5.403 1.00 0.00 N ATOM 1045 NH2 ARG A 73 13.460 0.645 -5.327 1.00 0.00 N ATOM 0 H ARG A 73 8.954 -5.312 -6.300 1.00 0.00 H new ATOM 0 HA ARG A 73 8.396 -2.977 -4.564 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.305 -2.884 -7.457 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.207 -1.555 -6.319 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.094 -3.910 -5.967 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.542 -2.433 -6.797 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.319 -2.137 -4.080 1.00 0.00 H new ATOM 0 HD3 ARG A 73 11.934 -2.812 -4.149 1.00 0.00 H new ATOM 0 HE ARG A 73 11.157 -0.052 -4.701 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.565 -2.573 -5.302 1.00 0.00 H new ATOM 0 HH12 ARG A 73 14.850 -1.416 -5.663 1.00 0.00 H new ATOM 0 HH21 ARG A 73 12.816 1.420 -5.168 1.00 0.00 H new ATOM 0 HH22 ARG A 73 14.428 0.832 -5.588 1.00 0.00 H new ATOM 1059 N ILE A 74 6.160 -2.611 -5.558 1.00 0.00 N ATOM 1060 CA ILE A 74 4.797 -2.471 -6.054 1.00 0.00 C ATOM 1061 C ILE A 74 4.479 -1.017 -6.385 1.00 0.00 C ATOM 1062 O ILE A 74 5.000 -0.098 -5.753 1.00 0.00 O ATOM 1063 CB ILE A 74 3.769 -2.989 -5.031 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.069 -2.422 -3.641 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.766 -4.512 -5.002 1.00 0.00 C ATOM 1066 CD1 ILE A 74 2.996 -2.727 -2.619 1.00 0.00 C ATOM 0 H ILE A 74 6.351 -2.094 -4.700 1.00 0.00 H new ATOM 0 HA ILE A 74 4.729 -3.071 -6.961 1.00 0.00 H new ATOM 0 HB ILE A 74 2.778 -2.652 -5.333 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.019 -2.826 -3.290 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.190 -1.341 -3.717 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.034 -4.861 -4.274 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.506 -4.894 -5.989 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.756 -4.873 -4.722 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.275 -2.295 -1.658 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.049 -2.299 -2.947 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.890 -3.807 -2.514 1.00 0.00 H new ATOM 1078 N ALA A 75 3.620 -0.814 -7.379 1.00 0.00 N ATOM 1079 CA ALA A 75 3.232 0.528 -7.791 1.00 0.00 C ATOM 1080 C ALA A 75 1.833 0.873 -7.294 1.00 0.00 C ATOM 1081 O ALA A 75 0.881 0.129 -7.525 1.00 0.00 O ATOM 1082 CB ALA A 75 3.301 0.654 -9.306 1.00 0.00 C ATOM 0 H ALA A 75 3.180 -1.563 -7.914 1.00 0.00 H new ATOM 0 HA ALA A 75 3.932 1.235 -7.345 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.009 1.662 -9.601 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.320 0.459 -9.641 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.624 -0.068 -9.762 1.00 0.00 H new ATOM 1088 N LEU A 76 1.717 2.006 -6.608 1.00 0.00 N ATOM 1089 CA LEU A 76 0.434 2.449 -6.076 1.00 0.00 C ATOM 1090 C LEU A 76 -0.214 3.475 -7.001 1.00 0.00 C ATOM 1091 O LEU A 76 0.442 4.404 -7.470 1.00 0.00 O ATOM 1092 CB LEU A 76 0.615 3.047 -4.680 1.00 0.00 C ATOM 1093 CG LEU A 76 0.817 2.024 -3.559 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.625 2.630 -2.423 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.526 1.521 -3.052 1.00 0.00 C ATOM 0 H LEU A 76 2.496 2.633 -6.408 1.00 0.00 H new ATOM 0 HA LEU A 76 -0.222 1.581 -6.009 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.473 3.719 -4.697 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.260 3.653 -4.445 1.00 0.00 H new ATOM 0 HG LEU A 76 1.373 1.177 -3.960 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.758 1.888 -1.635 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.600 2.942 -2.796 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.096 3.495 -2.021 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.365 0.795 -2.255 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.107 2.359 -2.667 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -1.070 1.048 -3.870 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.507 3.298 -7.258 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.245 4.208 -8.128 1.00 0.00 C ATOM 1109 C LYS A 77 -3.386 4.879 -7.369 1.00 0.00 C ATOM 1110 O LYS A 77 -4.313 4.214 -6.907 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.797 3.453 -9.338 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.551 4.338 -10.317 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.138 3.529 -11.461 1.00 0.00 C ATOM 1114 CE LYS A 77 -3.102 3.263 -12.543 1.00 0.00 C ATOM 1115 NZ LYS A 77 -2.494 4.523 -13.052 1.00 0.00 N ATOM 0 H LYS A 77 -2.065 2.534 -6.877 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.558 4.980 -8.473 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.972 2.969 -9.860 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.462 2.662 -8.990 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.350 4.863 -9.794 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.878 5.098 -10.715 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.520 2.582 -11.080 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.985 4.065 -11.890 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.319 2.617 -12.145 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.569 2.726 -13.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.605 4.569 -14.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.969 5.339 -12.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.482 4.542 -12.811 1.00 0.00 H new ATOM 1129 N SER A 78 -3.311 6.200 -7.245 1.00 0.00 N ATOM 1130 CA SER A 78 -4.338 6.961 -6.543 1.00 0.00 C ATOM 1131 C SER A 78 -5.692 6.805 -7.226 1.00 0.00 C ATOM 1132 O SER A 78 -5.767 6.572 -8.433 1.00 0.00 O ATOM 1133 CB SER A 78 -3.953 8.440 -6.480 1.00 0.00 C ATOM 1134 OG SER A 78 -4.114 9.064 -7.742 1.00 0.00 O ATOM 0 H SER A 78 -2.550 6.766 -7.621 1.00 0.00 H new ATOM 0 HA SER A 78 -4.415 6.570 -5.529 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.570 8.948 -5.739 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.918 8.536 -6.153 1.00 0.00 H new ATOM 0 HG SER A 78 -3.863 10.009 -7.674 1.00 0.00 H new ATOM 1140 N GLY A 79 -6.761 6.934 -6.446 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.099 6.804 -6.994 1.00 0.00 C ATOM 1142 C GLY A 79 -8.382 7.823 -8.079 1.00 0.00 C ATOM 1143 O GLY A 79 -9.159 7.563 -8.998 1.00 0.00 O ATOM 0 H GLY A 79 -6.725 7.126 -5.445 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.226 5.801 -7.400 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.829 6.918 -6.193 1.00 0.00 H new ATOM 1147 N TYR A 80 -7.752 8.988 -7.972 1.00 0.00 N ATOM 1148 CA TYR A 80 -7.941 10.052 -8.953 1.00 0.00 C ATOM 1149 C TYR A 80 -7.469 9.609 -10.334 1.00 0.00 C ATOM 1150 O TYR A 80 -8.003 10.046 -11.353 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.185 11.310 -8.523 1.00 0.00 C ATOM 1152 CG TYR A 80 -7.995 12.232 -7.638 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.081 12.934 -8.145 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -7.673 12.400 -6.297 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -9.824 13.777 -7.340 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -8.410 13.241 -5.486 1.00 0.00 C ATOM 1157 CZ TYR A 80 -9.484 13.927 -6.012 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.220 14.766 -5.207 1.00 0.00 O ATOM 0 H TYR A 80 -7.107 9.220 -7.217 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.006 10.277 -9.008 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.279 11.016 -7.994 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -6.871 11.857 -9.412 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.349 12.819 -9.185 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -6.832 11.864 -5.882 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -10.666 14.315 -7.749 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -8.146 13.360 -4.446 1.00 0.00 H new ATOM 0 HH TYR A 80 -9.849 14.757 -4.300 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.465 8.738 -10.359 1.00 0.00 N ATOM 1169 CA GLY A 81 -5.937 8.251 -11.621 1.00 0.00 C ATOM 1170 C GLY A 81 -4.487 8.639 -11.832 1.00 0.00 C ATOM 1171 O GLY A 81 -4.067 8.910 -12.957 1.00 0.00 O ATOM 0 H GLY A 81 -6.008 8.361 -9.529 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.028 7.165 -11.654 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.538 8.646 -12.440 1.00 0.00 H new ATOM 1175 N LYS A 82 -3.720 8.666 -10.746 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.308 9.023 -10.817 1.00 0.00 C ATOM 1177 C LYS A 82 -1.463 8.070 -9.978 1.00 0.00 C ATOM 1178 O LYS A 82 -1.994 7.248 -9.232 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.100 10.462 -10.340 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.688 11.504 -11.278 1.00 0.00 C ATOM 1181 CD LYS A 82 -3.268 12.682 -10.510 1.00 0.00 C ATOM 1182 CE LYS A 82 -4.240 13.481 -11.364 1.00 0.00 C ATOM 1183 NZ LYS A 82 -3.755 14.868 -11.606 1.00 0.00 N ATOM 0 H LYS A 82 -4.053 8.445 -9.807 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.990 8.942 -11.857 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -2.550 10.578 -9.354 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.032 10.648 -10.227 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.915 11.858 -11.960 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.467 11.047 -11.888 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.779 12.320 -9.618 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.460 13.331 -10.173 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.385 12.975 -12.319 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.212 13.517 -10.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.445 15.380 -12.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -3.641 15.359 -10.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.840 14.835 -12.099 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.145 8.187 -10.106 1.00 0.00 N ATOM 1198 CA TYR A 83 0.772 7.335 -9.360 1.00 0.00 C ATOM 1199 C TYR A 83 1.384 8.090 -8.184 1.00 0.00 C ATOM 1200 O TYR A 83 1.783 9.247 -8.317 1.00 0.00 O ATOM 1201 CB TYR A 83 1.880 6.817 -10.279 1.00 0.00 C ATOM 1202 CG TYR A 83 1.445 5.672 -11.166 1.00 0.00 C ATOM 1203 CD1 TYR A 83 1.393 4.372 -10.679 1.00 0.00 C ATOM 1204 CD2 TYR A 83 1.088 5.892 -12.490 1.00 0.00 C ATOM 1205 CE1 TYR A 83 0.995 3.323 -11.487 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.689 4.849 -13.304 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.646 3.567 -12.798 1.00 0.00 C ATOM 1208 OH TYR A 83 0.250 2.526 -13.605 1.00 0.00 O ATOM 0 H TYR A 83 0.311 8.863 -10.719 1.00 0.00 H new ATOM 0 HA TYR A 83 0.206 6.489 -8.970 1.00 0.00 H new ATOM 0 HB2 TYR A 83 2.234 7.636 -10.905 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.724 6.493 -9.670 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.668 4.178 -9.653 1.00 0.00 H new ATOM 0 HD2 TYR A 83 1.123 6.895 -12.890 1.00 0.00 H new ATOM 0 HE1 TYR A 83 0.958 2.318 -11.093 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.412 5.037 -14.331 1.00 0.00 H new ATOM 0 HH TYR A 83 0.037 2.867 -14.499 1.00 0.00 H new ATOM 1218 N LEU A 84 1.451 7.429 -7.034 1.00 0.00 N ATOM 1219 CA LEU A 84 2.012 8.037 -5.833 1.00 0.00 C ATOM 1220 C LEU A 84 3.526 8.183 -5.953 1.00 0.00 C ATOM 1221 O LEU A 84 4.271 7.230 -5.727 1.00 0.00 O ATOM 1222 CB LEU A 84 1.666 7.199 -4.600 1.00 0.00 C ATOM 1223 CG LEU A 84 0.175 7.120 -4.270 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.068 6.134 -3.137 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.362 8.496 -3.906 1.00 0.00 C ATOM 0 H LEU A 84 1.124 6.471 -6.908 1.00 0.00 H new ATOM 0 HA LEU A 84 1.576 9.030 -5.723 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.044 6.188 -4.749 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.192 7.612 -3.739 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.357 6.766 -5.153 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.134 6.090 -2.915 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.282 5.145 -3.434 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.474 6.459 -2.249 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.424 8.422 -3.674 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.174 8.877 -3.037 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.221 9.176 -4.746 1.00 0.00 H new ATOM 1237 N GLY A 85 3.973 9.382 -6.312 1.00 0.00 N ATOM 1238 CA GLY A 85 5.396 9.631 -6.456 1.00 0.00 C ATOM 1239 C GLY A 85 5.908 10.660 -5.468 1.00 0.00 C ATOM 1240 O GLY A 85 5.343 11.746 -5.345 1.00 0.00 O ATOM 0 H GLY A 85 3.376 10.186 -6.506 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.941 8.697 -6.318 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.601 9.973 -7.471 1.00 0.00 H new ATOM 1244 N ILE A 86 6.979 10.316 -4.761 1.00 0.00 N ATOM 1245 CA ILE A 86 7.567 11.217 -3.778 1.00 0.00 C ATOM 1246 C ILE A 86 8.296 12.372 -4.457 1.00 0.00 C ATOM 1247 O ILE A 86 9.073 12.167 -5.389 1.00 0.00 O ATOM 1248 CB ILE A 86 8.554 10.476 -2.855 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.553 9.667 -3.682 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.799 9.571 -1.891 1.00 0.00 C ATOM 1251 CD1 ILE A 86 10.956 9.677 -3.116 1.00 0.00 C ATOM 0 H ILE A 86 7.457 9.420 -4.851 1.00 0.00 H new ATOM 0 HA ILE A 86 6.745 11.610 -3.179 1.00 0.00 H new ATOM 0 HB ILE A 86 9.108 11.213 -2.274 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.205 8.636 -3.750 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.577 10.063 -4.697 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.509 9.054 -1.245 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.124 10.172 -1.281 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.222 8.838 -2.456 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.610 9.083 -3.754 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.324 10.702 -3.073 1.00 0.00 H new ATOM 0 HD13 ILE A 86 10.946 9.253 -2.112 1.00 0.00 H new ATOM 1263 N ASN A 87 8.041 13.587 -3.982 1.00 0.00 N ATOM 1264 CA ASN A 87 8.673 14.775 -4.543 1.00 0.00 C ATOM 1265 C ASN A 87 10.116 14.899 -4.067 1.00 0.00 C ATOM 1266 O ASN A 87 10.580 14.106 -3.247 1.00 0.00 O ATOM 1267 CB ASN A 87 7.886 16.028 -4.155 1.00 0.00 C ATOM 1268 CG ASN A 87 6.818 16.378 -5.171 1.00 0.00 C ATOM 1269 OD1 ASN A 87 6.824 15.874 -6.295 1.00 0.00 O ATOM 1270 ND2 ASN A 87 5.891 17.246 -4.782 1.00 0.00 N ATOM 0 H ASN A 87 7.401 13.774 -3.210 1.00 0.00 H new ATOM 0 HA ASN A 87 8.675 14.677 -5.629 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.421 15.874 -3.181 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.573 16.868 -4.051 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.147 17.519 -5.424 1.00 0.00 H new ATOM 0 HD22 ASN A 87 5.923 17.640 -3.842 1.00 0.00 H new ATOM 1277 N SER A 88 10.823 15.898 -4.586 1.00 0.00 N ATOM 1278 CA SER A 88 12.214 16.124 -4.214 1.00 0.00 C ATOM 1279 C SER A 88 12.331 16.477 -2.735 1.00 0.00 C ATOM 1280 O SER A 88 13.261 16.044 -2.054 1.00 0.00 O ATOM 1281 CB SER A 88 12.816 17.243 -5.065 1.00 0.00 C ATOM 1282 OG SER A 88 13.445 16.721 -6.223 1.00 0.00 O ATOM 0 H SER A 88 10.455 16.564 -5.265 1.00 0.00 H new ATOM 0 HA SER A 88 12.766 15.202 -4.394 1.00 0.00 H new ATOM 0 HB2 SER A 88 12.033 17.943 -5.357 1.00 0.00 H new ATOM 0 HB3 SER A 88 13.541 17.803 -4.475 1.00 0.00 H new ATOM 0 HG SER A 88 13.820 17.456 -6.751 1.00 0.00 H new ATOM 1288 N ASP A 89 11.381 17.266 -2.243 1.00 0.00 N ATOM 1289 CA ASP A 89 11.377 17.677 -0.844 1.00 0.00 C ATOM 1290 C ASP A 89 11.086 16.491 0.071 1.00 0.00 C ATOM 1291 O ASP A 89 11.565 16.436 1.204 1.00 0.00 O ATOM 1292 CB ASP A 89 10.339 18.777 -0.616 1.00 0.00 C ATOM 1293 CG ASP A 89 10.917 20.166 -0.811 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.019 20.430 -0.285 1.00 0.00 O ATOM 1295 OD2 ASP A 89 10.269 20.989 -1.491 1.00 0.00 O ATOM 0 H ASP A 89 10.604 17.633 -2.793 1.00 0.00 H new ATOM 0 HA ASP A 89 12.367 18.065 -0.603 1.00 0.00 H new ATOM 0 HB2 ASP A 89 9.505 18.634 -1.303 1.00 0.00 H new ATOM 0 HB3 ASP A 89 9.939 18.691 0.394 1.00 0.00 H new ATOM 1300 N GLY A 90 10.299 15.543 -0.429 1.00 0.00 N ATOM 1301 CA GLY A 90 9.959 14.371 0.357 1.00 0.00 C ATOM 1302 C GLY A 90 8.494 14.340 0.748 1.00 0.00 C ATOM 1303 O GLY A 90 8.133 13.770 1.777 1.00 0.00 O ATOM 0 H GLY A 90 9.891 15.566 -1.364 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.199 13.473 -0.213 1.00 0.00 H new ATOM 0 HA3 GLY A 90 10.573 14.351 1.258 1.00 0.00 H new ATOM 1307 N LEU A 91 7.650 14.955 -0.074 1.00 0.00 N ATOM 1308 CA LEU A 91 6.217 14.995 0.192 1.00 0.00 C ATOM 1309 C LEU A 91 5.465 14.042 -0.731 1.00 0.00 C ATOM 1310 O LEU A 91 5.626 14.088 -1.950 1.00 0.00 O ATOM 1311 CB LEU A 91 5.685 16.418 0.020 1.00 0.00 C ATOM 1312 CG LEU A 91 4.413 16.735 0.810 1.00 0.00 C ATOM 1313 CD1 LEU A 91 4.759 17.143 2.234 1.00 0.00 C ATOM 1314 CD2 LEU A 91 3.616 17.829 0.117 1.00 0.00 C ATOM 0 H LEU A 91 7.934 15.432 -0.930 1.00 0.00 H new ATOM 0 HA LEU A 91 6.055 14.677 1.222 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.464 17.119 0.319 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.490 16.591 -1.038 1.00 0.00 H new ATOM 0 HG LEU A 91 3.798 15.836 0.851 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.843 17.365 2.782 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.288 16.328 2.728 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.394 18.029 2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.715 18.042 0.692 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.223 18.732 0.046 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.338 17.498 -0.884 1.00 0.00 H new ATOM 1326 N VAL A 92 4.643 13.181 -0.143 1.00 0.00 N ATOM 1327 CA VAL A 92 3.866 12.217 -0.913 1.00 0.00 C ATOM 1328 C VAL A 92 2.863 12.921 -1.820 1.00 0.00 C ATOM 1329 O VAL A 92 1.869 13.476 -1.351 1.00 0.00 O ATOM 1330 CB VAL A 92 3.110 11.241 0.007 1.00 0.00 C ATOM 1331 CG1 VAL A 92 2.468 10.127 -0.807 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.046 10.668 1.061 1.00 0.00 C ATOM 0 H VAL A 92 4.497 13.131 0.865 1.00 0.00 H new ATOM 0 HA VAL A 92 4.574 11.655 -1.523 1.00 0.00 H new ATOM 0 HB VAL A 92 2.318 11.790 0.516 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.938 9.447 -0.139 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.765 10.557 -1.520 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.241 9.578 -1.345 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.495 9.980 1.702 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.861 10.134 0.572 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.454 11.479 1.665 1.00 0.00 H new ATOM 1342 N VAL A 93 3.129 12.896 -3.121 1.00 0.00 N ATOM 1343 CA VAL A 93 2.250 13.531 -4.096 1.00 0.00 C ATOM 1344 C VAL A 93 1.863 12.558 -5.203 1.00 0.00 C ATOM 1345 O VAL A 93 2.484 11.507 -5.365 1.00 0.00 O ATOM 1346 CB VAL A 93 2.912 14.771 -4.725 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.113 15.858 -3.681 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.233 14.397 -5.379 1.00 0.00 C ATOM 0 H VAL A 93 3.948 12.442 -3.526 1.00 0.00 H new ATOM 0 HA VAL A 93 1.353 13.840 -3.559 1.00 0.00 H new ATOM 0 HB VAL A 93 2.249 15.161 -5.497 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.582 16.726 -4.145 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.147 16.146 -3.265 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.754 15.482 -2.883 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.686 15.286 -5.818 1.00 0.00 H new ATOM 0 HG22 VAL A 93 4.905 13.980 -4.629 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.056 13.657 -6.159 1.00 0.00 H new ATOM 1358 N GLY A 94 0.833 12.914 -5.965 1.00 0.00 N ATOM 1359 CA GLY A 94 0.382 12.062 -7.048 1.00 0.00 C ATOM 1360 C GLY A 94 -0.035 12.851 -8.273 1.00 0.00 C ATOM 1361 O GLY A 94 -1.166 13.332 -8.354 1.00 0.00 O ATOM 0 H GLY A 94 0.303 13.778 -5.851 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.181 11.371 -7.319 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.458 11.459 -6.705 1.00 0.00 H new ATOM 1365 N ARG A 95 0.878 12.984 -9.229 1.00 0.00 N ATOM 1366 CA ARG A 95 0.598 13.721 -10.455 1.00 0.00 C ATOM 1367 C ARG A 95 1.408 13.160 -11.622 1.00 0.00 C ATOM 1368 O ARG A 95 2.258 13.847 -12.189 1.00 0.00 O ATOM 1369 CB ARG A 95 0.911 15.206 -10.267 1.00 0.00 C ATOM 1370 CG ARG A 95 -0.108 15.937 -9.407 1.00 0.00 C ATOM 1371 CD ARG A 95 -0.320 17.364 -9.887 1.00 0.00 C ATOM 1372 NE ARG A 95 0.817 18.224 -9.566 1.00 0.00 N ATOM 1373 CZ ARG A 95 1.051 19.394 -10.158 1.00 0.00 C ATOM 1374 NH1 ARG A 95 0.231 19.846 -11.098 1.00 0.00 N ATOM 1375 NH2 ARG A 95 2.108 20.113 -9.806 1.00 0.00 N ATOM 0 H ARG A 95 1.818 12.591 -9.178 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.462 13.609 -10.684 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.897 15.307 -9.813 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.960 15.685 -11.245 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -1.056 15.400 -9.429 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.229 15.947 -8.370 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -0.481 17.364 -10.965 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -1.222 17.770 -9.430 1.00 0.00 H new ATOM 0 HE ARG A 95 1.469 17.910 -8.847 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -0.584 19.297 -11.371 1.00 0.00 H new ATOM 0 HH12 ARG A 95 0.416 20.743 -11.548 1.00 0.00 H new ATOM 0 HH21 ARG A 95 2.740 19.770 -9.083 1.00 0.00 H new ATOM 0 HH22 ARG A 95 2.289 21.009 -10.258 1.00 0.00 H new ATOM 1389 N SER A 96 1.138 11.907 -11.974 1.00 0.00 N ATOM 1390 CA SER A 96 1.840 11.252 -13.071 1.00 0.00 C ATOM 1391 C SER A 96 1.169 9.933 -13.437 1.00 0.00 C ATOM 1392 O SER A 96 0.802 9.149 -12.563 1.00 0.00 O ATOM 1393 CB SER A 96 3.303 11.008 -12.694 1.00 0.00 C ATOM 1394 OG SER A 96 4.156 11.206 -13.808 1.00 0.00 O ATOM 0 H SER A 96 0.437 11.325 -11.515 1.00 0.00 H new ATOM 0 HA SER A 96 1.801 11.910 -13.939 1.00 0.00 H new ATOM 0 HB2 SER A 96 3.591 11.682 -11.887 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.420 9.992 -12.318 1.00 0.00 H new ATOM 0 HG SER A 96 5.085 11.046 -13.541 1.00 0.00 H new ATOM 1400 N ASP A 97 1.012 9.695 -14.735 1.00 0.00 N ATOM 1401 CA ASP A 97 0.386 8.470 -15.217 1.00 0.00 C ATOM 1402 C ASP A 97 1.440 7.450 -15.641 1.00 0.00 C ATOM 1403 O ASP A 97 1.210 6.640 -16.539 1.00 0.00 O ATOM 1404 CB ASP A 97 -0.549 8.778 -16.390 1.00 0.00 C ATOM 1405 CG ASP A 97 -2.012 8.670 -16.007 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -2.472 7.540 -15.737 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -2.697 9.713 -15.975 1.00 0.00 O ATOM 0 H ASP A 97 1.310 10.335 -15.472 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.197 8.043 -14.401 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.346 9.784 -16.758 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.339 8.090 -17.209 1.00 0.00 H new ATOM 1412 N ALA A 98 2.596 7.495 -14.986 1.00 0.00 N ATOM 1413 CA ALA A 98 3.684 6.575 -15.295 1.00 0.00 C ATOM 1414 C ALA A 98 4.289 5.995 -14.021 1.00 0.00 C ATOM 1415 O ALA A 98 4.030 6.483 -12.920 1.00 0.00 O ATOM 1416 CB ALA A 98 4.753 7.280 -16.116 1.00 0.00 C ATOM 0 H ALA A 98 2.803 8.158 -14.239 1.00 0.00 H new ATOM 0 HA ALA A 98 3.276 5.751 -15.881 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.559 6.582 -16.340 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.317 7.641 -17.047 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.150 8.123 -15.550 1.00 0.00 H new ATOM 1422 N ILE A 99 5.095 4.950 -14.178 1.00 0.00 N ATOM 1423 CA ILE A 99 5.737 4.304 -13.040 1.00 0.00 C ATOM 1424 C ILE A 99 7.213 4.680 -12.955 1.00 0.00 C ATOM 1425 O ILE A 99 8.086 3.912 -13.361 1.00 0.00 O ATOM 1426 CB ILE A 99 5.614 2.770 -13.122 1.00 0.00 C ATOM 1427 CG1 ILE A 99 4.166 2.367 -13.410 1.00 0.00 C ATOM 1428 CG2 ILE A 99 6.102 2.130 -11.831 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.982 0.879 -13.614 1.00 0.00 C ATOM 0 H ILE A 99 5.319 4.533 -15.082 1.00 0.00 H new ATOM 0 HA ILE A 99 5.223 4.655 -12.145 1.00 0.00 H new ATOM 0 HB ILE A 99 6.240 2.413 -13.940 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.535 2.693 -12.583 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.821 2.893 -14.300 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.009 1.046 -11.904 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.147 2.394 -11.666 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.501 2.490 -10.996 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.932 0.666 -13.814 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.586 0.550 -14.460 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.296 0.347 -12.716 1.00 0.00 H new ATOM 1441 N GLY A 100 7.485 5.868 -12.425 1.00 0.00 N ATOM 1442 CA GLY A 100 8.856 6.327 -12.296 1.00 0.00 C ATOM 1443 C GLY A 100 9.482 5.922 -10.975 1.00 0.00 C ATOM 1444 O GLY A 100 8.822 5.305 -10.138 1.00 0.00 O ATOM 0 H GLY A 100 6.781 6.521 -12.082 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.450 5.922 -13.115 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.883 7.413 -12.389 1.00 0.00 H new ATOM 1448 N PRO A 101 10.766 6.257 -10.756 1.00 0.00 N ATOM 1449 CA PRO A 101 11.471 5.917 -9.515 1.00 0.00 C ATOM 1450 C PRO A 101 10.695 6.342 -8.273 1.00 0.00 C ATOM 1451 O PRO A 101 10.512 5.556 -7.345 1.00 0.00 O ATOM 1452 CB PRO A 101 12.779 6.702 -9.625 1.00 0.00 C ATOM 1453 CG PRO A 101 12.997 6.872 -11.088 1.00 0.00 C ATOM 1454 CD PRO A 101 11.628 6.993 -11.699 1.00 0.00 C ATOM 0 HA PRO A 101 11.612 4.842 -9.407 1.00 0.00 H new ATOM 0 HB2 PRO A 101 12.706 7.666 -9.121 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.605 6.162 -9.162 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.596 7.760 -11.293 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.536 6.021 -11.504 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.321 8.035 -11.794 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.594 6.558 -12.698 1.00 0.00 H new ATOM 1462 N ARG A 102 10.243 7.591 -8.264 1.00 0.00 N ATOM 1463 CA ARG A 102 9.487 8.121 -7.134 1.00 0.00 C ATOM 1464 C ARG A 102 8.189 7.346 -6.938 1.00 0.00 C ATOM 1465 O ARG A 102 7.699 7.209 -5.817 1.00 0.00 O ATOM 1466 CB ARG A 102 9.182 9.605 -7.350 1.00 0.00 C ATOM 1467 CG ARG A 102 10.423 10.457 -7.560 1.00 0.00 C ATOM 1468 CD ARG A 102 10.137 11.643 -8.466 1.00 0.00 C ATOM 1469 NE ARG A 102 11.216 12.628 -8.436 1.00 0.00 N ATOM 1470 CZ ARG A 102 12.364 12.490 -9.095 1.00 0.00 C ATOM 1471 NH1 ARG A 102 12.587 11.411 -9.835 1.00 0.00 N ATOM 1472 NH2 ARG A 102 13.293 13.433 -9.013 1.00 0.00 N ATOM 0 H ARG A 102 10.386 8.255 -9.025 1.00 0.00 H new ATOM 0 HA ARG A 102 10.095 8.009 -6.236 1.00 0.00 H new ATOM 0 HB2 ARG A 102 8.528 9.711 -8.216 1.00 0.00 H new ATOM 0 HB3 ARG A 102 8.633 9.984 -6.488 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.788 10.813 -6.597 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.215 9.848 -7.996 1.00 0.00 H new ATOM 0 HD2 ARG A 102 9.995 11.292 -9.488 1.00 0.00 H new ATOM 0 HD3 ARG A 102 9.205 12.117 -8.159 1.00 0.00 H new ATOM 0 HE ARG A 102 11.081 13.471 -7.877 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.877 10.682 -9.901 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.469 11.311 -10.338 1.00 0.00 H new ATOM 0 HH21 ARG A 102 13.128 14.264 -8.445 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.173 13.327 -9.518 1.00 0.00 H new ATOM 1486 N GLU A 103 7.635 6.840 -8.035 1.00 0.00 N ATOM 1487 CA GLU A 103 6.392 6.078 -7.984 1.00 0.00 C ATOM 1488 C GLU A 103 6.632 4.684 -7.413 1.00 0.00 C ATOM 1489 O GLU A 103 5.752 4.103 -6.777 1.00 0.00 O ATOM 1490 CB GLU A 103 5.777 5.971 -9.380 1.00 0.00 C ATOM 1491 CG GLU A 103 5.080 7.242 -9.837 1.00 0.00 C ATOM 1492 CD GLU A 103 6.054 8.362 -10.148 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.193 8.060 -10.563 1.00 0.00 O ATOM 1494 OE2 GLU A 103 5.679 9.541 -9.975 1.00 0.00 O ATOM 0 H GLU A 103 8.027 6.944 -8.971 1.00 0.00 H new ATOM 0 HA GLU A 103 5.698 6.605 -7.329 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.561 5.719 -10.095 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.060 5.150 -9.390 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.485 7.026 -10.724 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.389 7.572 -9.062 1.00 0.00 H new ATOM 1501 N GLN A 104 7.828 4.152 -7.645 1.00 0.00 N ATOM 1502 CA GLN A 104 8.182 2.825 -7.153 1.00 0.00 C ATOM 1503 C GLN A 104 8.176 2.789 -5.629 1.00 0.00 C ATOM 1504 O GLN A 104 8.548 3.762 -4.973 1.00 0.00 O ATOM 1505 CB GLN A 104 9.559 2.414 -7.680 1.00 0.00 C ATOM 1506 CG GLN A 104 9.637 2.351 -9.197 1.00 0.00 C ATOM 1507 CD GLN A 104 10.794 1.503 -9.687 1.00 0.00 C ATOM 1508 OE1 GLN A 104 11.309 0.655 -8.958 1.00 0.00 O ATOM 1509 NE2 GLN A 104 11.210 1.729 -10.927 1.00 0.00 N ATOM 0 H GLN A 104 8.568 4.619 -8.170 1.00 0.00 H new ATOM 0 HA GLN A 104 7.435 2.119 -7.517 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.304 3.121 -7.315 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.819 1.438 -7.270 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.704 1.946 -9.589 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.738 3.361 -9.594 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.754 2.442 -11.496 1.00 0.00 H new ATOM 0 HE22 GLN A 104 11.986 1.190 -11.311 1.00 0.00 H new ATOM 1518 N TRP A 105 7.754 1.658 -5.072 1.00 0.00 N ATOM 1519 CA TRP A 105 7.701 1.494 -3.623 1.00 0.00 C ATOM 1520 C TRP A 105 8.346 0.178 -3.202 1.00 0.00 C ATOM 1521 O TRP A 105 8.603 -0.693 -4.035 1.00 0.00 O ATOM 1522 CB TRP A 105 6.252 1.544 -3.136 1.00 0.00 C ATOM 1523 CG TRP A 105 5.575 2.849 -3.422 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.706 3.116 -4.441 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.710 4.067 -2.681 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.293 4.425 -4.380 1.00 0.00 N ATOM 1527 CE2 TRP A 105 4.896 5.029 -3.306 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.440 4.436 -1.547 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.792 6.337 -2.837 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.336 5.734 -1.083 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.517 6.670 -1.726 1.00 0.00 C ATOM 0 H TRP A 105 7.444 0.843 -5.601 1.00 0.00 H new ATOM 0 HA TRP A 105 8.258 2.313 -3.168 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.689 0.739 -3.609 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.230 1.359 -2.062 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.389 2.402 -5.187 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.645 4.874 -5.027 1.00 0.00 H new ATOM 0 HE3 TRP A 105 7.073 3.721 -1.043 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.162 7.061 -3.332 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.896 6.031 -0.209 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.456 7.676 -1.337 1.00 0.00 H new ATOM 1542 N GLU A 106 8.607 0.038 -1.907 1.00 0.00 N ATOM 1543 CA GLU A 106 9.223 -1.174 -1.377 1.00 0.00 C ATOM 1544 C GLU A 106 8.709 -1.479 0.029 1.00 0.00 C ATOM 1545 O GLU A 106 9.242 -0.970 1.014 1.00 0.00 O ATOM 1546 CB GLU A 106 10.745 -1.025 -1.355 1.00 0.00 C ATOM 1547 CG GLU A 106 11.483 -2.350 -1.233 1.00 0.00 C ATOM 1548 CD GLU A 106 12.572 -2.315 -0.179 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.662 -1.777 -0.467 1.00 0.00 O ATOM 1550 OE2 GLU A 106 12.335 -2.826 0.936 1.00 0.00 O ATOM 0 H GLU A 106 8.402 0.748 -1.204 1.00 0.00 H new ATOM 0 HA GLU A 106 8.953 -2.005 -2.029 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.066 -0.522 -2.267 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.027 -0.383 -0.521 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.770 -3.138 -0.988 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.923 -2.607 -2.197 1.00 0.00 H new ATOM 1557 N PRO A 107 7.665 -2.318 0.141 1.00 0.00 N ATOM 1558 CA PRO A 107 7.087 -2.686 1.438 1.00 0.00 C ATOM 1559 C PRO A 107 8.031 -3.551 2.267 1.00 0.00 C ATOM 1560 O PRO A 107 8.885 -4.251 1.723 1.00 0.00 O ATOM 1561 CB PRO A 107 5.830 -3.474 1.061 1.00 0.00 C ATOM 1562 CG PRO A 107 6.111 -4.007 -0.301 1.00 0.00 C ATOM 1563 CD PRO A 107 6.966 -2.973 -0.980 1.00 0.00 C ATOM 0 HA PRO A 107 6.885 -1.811 2.056 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.641 -4.280 1.770 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.947 -2.835 1.062 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.627 -4.966 -0.246 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.186 -4.173 -0.854 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.667 -3.428 -1.680 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.364 -2.264 -1.548 1.00 0.00 H new ATOM 1571 N VAL A 108 7.872 -3.498 3.585 1.00 0.00 N ATOM 1572 CA VAL A 108 8.710 -4.277 4.488 1.00 0.00 C ATOM 1573 C VAL A 108 7.865 -5.076 5.474 1.00 0.00 C ATOM 1574 O VAL A 108 6.703 -4.749 5.720 1.00 0.00 O ATOM 1575 CB VAL A 108 9.678 -3.374 5.275 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.678 -4.213 6.055 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.394 -2.413 4.338 1.00 0.00 C ATOM 0 H VAL A 108 7.170 -2.923 4.052 1.00 0.00 H new ATOM 0 HA VAL A 108 9.286 -4.964 3.868 1.00 0.00 H new ATOM 0 HB VAL A 108 9.098 -2.787 5.987 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.353 -3.557 6.604 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.145 -4.855 6.756 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.253 -4.829 5.364 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.074 -1.783 4.912 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.961 -2.980 3.600 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.661 -1.786 3.830 1.00 0.00 H new ATOM 1587 N PHE A 109 8.455 -6.125 6.036 1.00 0.00 N ATOM 1588 CA PHE A 109 7.758 -6.973 6.997 1.00 0.00 C ATOM 1589 C PHE A 109 8.735 -7.566 8.008 1.00 0.00 C ATOM 1590 O PHE A 109 9.532 -8.443 7.674 1.00 0.00 O ATOM 1591 CB PHE A 109 7.013 -8.095 6.272 1.00 0.00 C ATOM 1592 CG PHE A 109 5.842 -7.615 5.463 1.00 0.00 C ATOM 1593 CD1 PHE A 109 4.659 -7.247 6.083 1.00 0.00 C ATOM 1594 CD2 PHE A 109 5.924 -7.534 4.082 1.00 0.00 C ATOM 1595 CE1 PHE A 109 3.579 -6.806 5.341 1.00 0.00 C ATOM 1596 CE2 PHE A 109 4.849 -7.094 3.334 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.675 -6.729 3.965 1.00 0.00 C ATOM 0 H PHE A 109 9.415 -6.409 5.843 1.00 0.00 H new ATOM 0 HA PHE A 109 7.038 -6.356 7.534 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.709 -8.616 5.614 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.664 -8.821 7.006 1.00 0.00 H new ATOM 0 HD1 PHE A 109 4.580 -7.305 7.158 1.00 0.00 H new ATOM 0 HD2 PHE A 109 6.839 -7.818 3.584 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.662 -6.522 5.836 1.00 0.00 H new ATOM 0 HE2 PHE A 109 4.926 -7.035 2.258 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.833 -6.384 3.383 1.00 0.00 H new ATOM 1607 N GLN A 110 8.666 -7.083 9.244 1.00 0.00 N ATOM 1608 CA GLN A 110 9.546 -7.566 10.302 1.00 0.00 C ATOM 1609 C GLN A 110 8.768 -7.796 11.594 1.00 0.00 C ATOM 1610 O GLN A 110 8.180 -6.867 12.150 1.00 0.00 O ATOM 1611 CB GLN A 110 10.681 -6.569 10.547 1.00 0.00 C ATOM 1612 CG GLN A 110 11.866 -7.168 11.286 1.00 0.00 C ATOM 1613 CD GLN A 110 13.185 -6.539 10.881 1.00 0.00 C ATOM 1614 OE1 GLN A 110 13.655 -5.595 11.515 1.00 0.00 O ATOM 1615 NE2 GLN A 110 13.787 -7.059 9.819 1.00 0.00 N ATOM 0 H GLN A 110 8.011 -6.358 9.538 1.00 0.00 H new ATOM 0 HA GLN A 110 9.971 -8.517 9.980 1.00 0.00 H new ATOM 0 HB2 GLN A 110 11.022 -6.176 9.589 1.00 0.00 H new ATOM 0 HB3 GLN A 110 10.295 -5.725 11.119 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.722 -7.042 12.359 1.00 0.00 H new ATOM 0 HG3 GLN A 110 11.905 -8.240 11.094 1.00 0.00 H new ATOM 0 HE21 GLN A 110 13.361 -7.842 9.323 1.00 0.00 H new ATOM 0 HE22 GLN A 110 14.676 -6.676 9.498 1.00 0.00 H new ATOM 1624 N ASP A 111 8.770 -9.038 12.066 1.00 0.00 N ATOM 1625 CA ASP A 111 8.065 -9.391 13.294 1.00 0.00 C ATOM 1626 C ASP A 111 6.577 -9.078 13.178 1.00 0.00 C ATOM 1627 O ASP A 111 5.913 -8.793 14.175 1.00 0.00 O ATOM 1628 CB ASP A 111 8.665 -8.640 14.484 1.00 0.00 C ATOM 1629 CG ASP A 111 10.049 -9.139 14.844 1.00 0.00 C ATOM 1630 OD1 ASP A 111 10.161 -10.287 15.325 1.00 0.00 O ATOM 1631 OD2 ASP A 111 11.024 -8.383 14.646 1.00 0.00 O ATOM 0 H ASP A 111 9.252 -9.817 11.617 1.00 0.00 H new ATOM 0 HA ASP A 111 8.180 -10.463 13.454 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.715 -7.576 14.251 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.007 -8.747 15.347 1.00 0.00 H new ATOM 1636 N GLY A 112 6.057 -9.133 11.955 1.00 0.00 N ATOM 1637 CA GLY A 112 4.650 -8.853 11.735 1.00 0.00 C ATOM 1638 C GLY A 112 4.402 -7.416 11.318 1.00 0.00 C ATOM 1639 O GLY A 112 3.434 -7.125 10.616 1.00 0.00 O ATOM 0 H GLY A 112 6.585 -9.366 11.114 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.266 -9.523 10.966 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.094 -9.064 12.648 1.00 0.00 H new ATOM 1643 N LYS A 113 5.279 -6.516 11.752 1.00 0.00 N ATOM 1644 CA LYS A 113 5.149 -5.103 11.420 1.00 0.00 C ATOM 1645 C LYS A 113 5.251 -4.884 9.913 1.00 0.00 C ATOM 1646 O LYS A 113 5.437 -5.833 9.150 1.00 0.00 O ATOM 1647 CB LYS A 113 6.227 -4.287 12.137 1.00 0.00 C ATOM 1648 CG LYS A 113 6.226 -4.473 13.647 1.00 0.00 C ATOM 1649 CD LYS A 113 7.547 -4.041 14.262 1.00 0.00 C ATOM 1650 CE LYS A 113 7.332 -3.234 15.534 1.00 0.00 C ATOM 1651 NZ LYS A 113 7.413 -1.768 15.281 1.00 0.00 N ATOM 0 H LYS A 113 6.086 -6.741 12.334 1.00 0.00 H new ATOM 0 HA LYS A 113 4.166 -4.768 11.752 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.205 -4.568 11.745 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.084 -3.231 11.909 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.413 -3.894 14.085 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.037 -5.520 13.886 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.151 -4.921 14.486 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.107 -3.445 13.542 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.357 -3.476 15.957 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.080 -3.517 16.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 6.842 -1.262 15.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 8.403 -1.458 15.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 7.050 -1.559 14.329 1.00 0.00 H new ATOM 1665 N MET A 114 5.129 -3.630 9.493 1.00 0.00 N ATOM 1666 CA MET A 114 5.208 -3.287 8.077 1.00 0.00 C ATOM 1667 C MET A 114 5.175 -1.775 7.881 1.00 0.00 C ATOM 1668 O MET A 114 4.550 -1.052 8.658 1.00 0.00 O ATOM 1669 CB MET A 114 4.056 -3.938 7.310 1.00 0.00 C ATOM 1670 CG MET A 114 2.698 -3.729 7.959 1.00 0.00 C ATOM 1671 SD MET A 114 1.340 -4.353 6.949 1.00 0.00 S ATOM 1672 CE MET A 114 0.477 -5.377 8.136 1.00 0.00 C ATOM 0 H MET A 114 4.975 -2.834 10.112 1.00 0.00 H new ATOM 0 HA MET A 114 6.154 -3.664 7.689 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.031 -3.535 6.297 1.00 0.00 H new ATOM 0 HB3 MET A 114 4.247 -5.008 7.223 1.00 0.00 H new ATOM 0 HG2 MET A 114 2.683 -4.227 8.929 1.00 0.00 H new ATOM 0 HG3 MET A 114 2.548 -2.665 8.145 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.391 -5.834 7.660 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.146 -6.158 8.497 1.00 0.00 H new ATOM 0 HE3 MET A 114 0.149 -4.764 8.975 1.00 0.00 H new ATOM 1682 N ALA A 115 5.852 -1.304 6.840 1.00 0.00 N ATOM 1683 CA ALA A 115 5.901 0.122 6.541 1.00 0.00 C ATOM 1684 C ALA A 115 6.243 0.365 5.075 1.00 0.00 C ATOM 1685 O ALA A 115 7.143 -0.269 4.524 1.00 0.00 O ATOM 1686 CB ALA A 115 6.911 0.815 7.443 1.00 0.00 C ATOM 0 H ALA A 115 6.375 -1.889 6.189 1.00 0.00 H new ATOM 0 HA ALA A 115 4.913 0.542 6.730 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.938 1.879 7.209 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.621 0.680 8.485 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.899 0.383 7.282 1.00 0.00 H new ATOM 1692 N LEU A 116 5.519 1.287 4.449 1.00 0.00 N ATOM 1693 CA LEU A 116 5.746 1.614 3.047 1.00 0.00 C ATOM 1694 C LEU A 116 6.999 2.468 2.883 1.00 0.00 C ATOM 1695 O LEU A 116 6.999 3.656 3.205 1.00 0.00 O ATOM 1696 CB LEU A 116 4.535 2.350 2.471 1.00 0.00 C ATOM 1697 CG LEU A 116 4.291 2.127 0.977 1.00 0.00 C ATOM 1698 CD1 LEU A 116 3.402 0.912 0.758 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.669 3.365 0.349 1.00 0.00 C ATOM 0 H LEU A 116 4.770 1.821 4.891 1.00 0.00 H new ATOM 0 HA LEU A 116 5.890 0.681 2.501 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.646 2.039 3.019 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.661 3.418 2.647 1.00 0.00 H new ATOM 0 HG LEU A 116 5.250 1.942 0.494 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.239 0.768 -0.310 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.885 0.028 1.173 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.444 1.068 1.254 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.502 3.189 -0.714 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.717 3.580 0.835 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.341 4.214 0.475 1.00 0.00 H new ATOM 1711 N LEU A 117 8.066 1.855 2.381 1.00 0.00 N ATOM 1712 CA LEU A 117 9.326 2.559 2.175 1.00 0.00 C ATOM 1713 C LEU A 117 9.387 3.166 0.777 1.00 0.00 C ATOM 1714 O LEU A 117 9.090 2.500 -0.214 1.00 0.00 O ATOM 1715 CB LEU A 117 10.507 1.608 2.383 1.00 0.00 C ATOM 1716 CG LEU A 117 11.889 2.254 2.245 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.604 2.283 3.588 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.726 1.513 1.211 1.00 0.00 C ATOM 0 H LEU A 117 8.083 0.872 2.109 1.00 0.00 H new ATOM 0 HA LEU A 117 9.386 3.366 2.905 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.427 1.165 3.376 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.430 0.793 1.663 1.00 0.00 H new ATOM 0 HG LEU A 117 11.754 3.281 1.906 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.584 2.746 3.469 1.00 0.00 H new ATOM 0 HD12 LEU A 117 12.015 2.859 4.301 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.726 1.265 3.957 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.704 1.987 1.127 1.00 0.00 H new ATOM 0 HD22 LEU A 117 12.851 0.475 1.520 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.223 1.546 0.245 1.00 0.00 H new ATOM 1730 N ALA A 118 9.775 4.435 0.706 1.00 0.00 N ATOM 1731 CA ALA A 118 9.876 5.133 -0.569 1.00 0.00 C ATOM 1732 C ALA A 118 11.142 4.732 -1.316 1.00 0.00 C ATOM 1733 O ALA A 118 11.999 4.032 -0.776 1.00 0.00 O ATOM 1734 CB ALA A 118 9.846 6.638 -0.350 1.00 0.00 C ATOM 0 H ALA A 118 10.025 5.001 1.517 1.00 0.00 H new ATOM 0 HA ALA A 118 9.019 4.848 -1.180 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.922 7.147 -1.311 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.910 6.917 0.135 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.684 6.930 0.283 1.00 0.00 H new ATOM 1740 N SER A 119 11.254 5.183 -2.562 1.00 0.00 N ATOM 1741 CA SER A 119 12.419 4.874 -3.383 1.00 0.00 C ATOM 1742 C SER A 119 13.663 5.603 -2.877 1.00 0.00 C ATOM 1743 O SER A 119 14.775 5.332 -3.326 1.00 0.00 O ATOM 1744 CB SER A 119 12.152 5.253 -4.842 1.00 0.00 C ATOM 1745 OG SER A 119 13.139 4.705 -5.700 1.00 0.00 O ATOM 0 H SER A 119 10.553 5.763 -3.024 1.00 0.00 H new ATOM 0 HA SER A 119 12.601 3.801 -3.316 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.167 4.894 -5.140 1.00 0.00 H new ATOM 0 HB3 SER A 119 12.140 6.338 -4.943 1.00 0.00 H new ATOM 0 HG SER A 119 14.001 4.684 -5.235 1.00 0.00 H new ATOM 1751 N ASN A 120 13.470 6.531 -1.940 1.00 0.00 N ATOM 1752 CA ASN A 120 14.582 7.292 -1.381 1.00 0.00 C ATOM 1753 C ASN A 120 15.106 6.646 -0.099 1.00 0.00 C ATOM 1754 O ASN A 120 15.739 7.306 0.723 1.00 0.00 O ATOM 1755 CB ASN A 120 14.145 8.730 -1.095 1.00 0.00 C ATOM 1756 CG ASN A 120 12.955 8.798 -0.158 1.00 0.00 C ATOM 1757 OD1 ASN A 120 12.631 7.825 0.523 1.00 0.00 O ATOM 1758 ND2 ASN A 120 12.298 9.951 -0.118 1.00 0.00 N ATOM 0 H ASN A 120 12.557 6.772 -1.555 1.00 0.00 H new ATOM 0 HA ASN A 120 15.388 7.297 -2.115 1.00 0.00 H new ATOM 0 HB2 ASN A 120 14.979 9.280 -0.659 1.00 0.00 H new ATOM 0 HB3 ASN A 120 13.893 9.224 -2.034 1.00 0.00 H new ATOM 0 HD21 ASN A 120 11.489 10.056 0.495 1.00 0.00 H new ATOM 0 HD22 ASN A 120 12.602 10.732 -0.700 1.00 0.00 H new ATOM 1765 N SER A 121 14.842 5.352 0.064 1.00 0.00 N ATOM 1766 CA SER A 121 15.292 4.623 1.246 1.00 0.00 C ATOM 1767 C SER A 121 14.790 5.289 2.525 1.00 0.00 C ATOM 1768 O SER A 121 15.554 5.510 3.464 1.00 0.00 O ATOM 1769 CB SER A 121 16.820 4.537 1.265 1.00 0.00 C ATOM 1770 OG SER A 121 17.335 4.317 -0.036 1.00 0.00 O ATOM 0 H SER A 121 14.320 4.788 -0.606 1.00 0.00 H new ATOM 0 HA SER A 121 14.878 3.616 1.200 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.234 5.459 1.672 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.134 3.728 1.925 1.00 0.00 H new ATOM 0 HG SER A 121 18.313 4.268 0.003 1.00 0.00 H new ATOM 1776 N CYS A 122 13.499 5.606 2.553 1.00 0.00 N ATOM 1777 CA CYS A 122 12.896 6.246 3.716 1.00 0.00 C ATOM 1778 C CYS A 122 11.397 5.970 3.774 1.00 0.00 C ATOM 1779 O CYS A 122 10.714 5.977 2.750 1.00 0.00 O ATOM 1780 CB CYS A 122 13.147 7.755 3.680 1.00 0.00 C ATOM 1781 SG CYS A 122 14.597 8.284 4.622 1.00 0.00 S ATOM 0 H CYS A 122 12.852 5.430 1.785 1.00 0.00 H new ATOM 0 HA CYS A 122 13.359 5.828 4.610 1.00 0.00 H new ATOM 0 HB2 CYS A 122 13.267 8.068 2.643 1.00 0.00 H new ATOM 0 HB3 CYS A 122 12.267 8.268 4.068 1.00 0.00 H new ATOM 0 HG CYS A 122 15.538 7.394 4.507 1.00 0.00 H new ATOM 1787 N PHE A 123 10.893 5.727 4.980 1.00 0.00 N ATOM 1788 CA PHE A 123 9.474 5.449 5.173 1.00 0.00 C ATOM 1789 C PHE A 123 8.637 6.699 4.925 1.00 0.00 C ATOM 1790 O PHE A 123 9.171 7.761 4.604 1.00 0.00 O ATOM 1791 CB PHE A 123 9.224 4.926 6.589 1.00 0.00 C ATOM 1792 CG PHE A 123 9.785 3.554 6.830 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.460 2.502 5.990 1.00 0.00 C ATOM 1794 CD2 PHE A 123 10.638 3.318 7.896 1.00 0.00 C ATOM 1795 CE1 PHE A 123 9.974 1.238 6.209 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.155 2.055 8.120 1.00 0.00 C ATOM 1797 CZ PHE A 123 10.823 1.015 7.275 1.00 0.00 C ATOM 0 H PHE A 123 11.445 5.717 5.837 1.00 0.00 H new ATOM 0 HA PHE A 123 9.177 4.686 4.454 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.662 5.620 7.306 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.150 4.909 6.777 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.797 2.671 5.154 1.00 0.00 H new ATOM 0 HD2 PHE A 123 10.902 4.129 8.559 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.712 0.426 5.547 1.00 0.00 H new ATOM 0 HE2 PHE A 123 11.818 1.882 8.955 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.227 0.028 7.447 1.00 0.00 H new ATOM 1807 N ILE A 124 7.324 6.565 5.074 1.00 0.00 N ATOM 1808 CA ILE A 124 6.414 7.685 4.864 1.00 0.00 C ATOM 1809 C ILE A 124 5.363 7.756 5.965 1.00 0.00 C ATOM 1810 O ILE A 124 4.958 6.734 6.519 1.00 0.00 O ATOM 1811 CB ILE A 124 5.707 7.587 3.499 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.962 6.256 3.381 1.00 0.00 C ATOM 1813 CG2 ILE A 124 6.712 7.740 2.368 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.870 6.266 2.333 1.00 0.00 C ATOM 0 H ILE A 124 6.866 5.693 5.339 1.00 0.00 H new ATOM 0 HA ILE A 124 7.020 8.591 4.887 1.00 0.00 H new ATOM 0 HB ILE A 124 4.981 8.397 3.424 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.677 5.469 3.142 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.525 6.007 4.348 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.196 7.668 1.411 1.00 0.00 H new ATOM 0 HG22 ILE A 124 7.201 8.711 2.445 1.00 0.00 H new ATOM 0 HG23 ILE A 124 7.460 6.950 2.437 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.384 5.291 2.304 1.00 0.00 H new ATOM 0 HD12 ILE A 124 3.134 7.031 2.582 1.00 0.00 H new ATOM 0 HD13 ILE A 124 4.304 6.484 1.357 1.00 0.00 H new ATOM 1826 N ARG A 125 4.924 8.971 6.278 1.00 0.00 N ATOM 1827 CA ARG A 125 3.918 9.179 7.313 1.00 0.00 C ATOM 1828 C ARG A 125 3.283 10.559 7.177 1.00 0.00 C ATOM 1829 O ARG A 125 3.711 11.371 6.356 1.00 0.00 O ATOM 1830 CB ARG A 125 4.542 9.024 8.700 1.00 0.00 C ATOM 1831 CG ARG A 125 5.601 10.070 9.013 1.00 0.00 C ATOM 1832 CD ARG A 125 5.704 10.327 10.508 1.00 0.00 C ATOM 1833 NE ARG A 125 4.436 10.785 11.074 1.00 0.00 N ATOM 1834 CZ ARG A 125 4.197 10.876 12.380 1.00 0.00 C ATOM 1835 NH1 ARG A 125 5.133 10.539 13.258 1.00 0.00 N ATOM 1836 NH2 ARG A 125 3.018 11.304 12.809 1.00 0.00 N ATOM 0 H ARG A 125 5.250 9.827 5.829 1.00 0.00 H new ATOM 0 HA ARG A 125 3.140 8.425 7.189 1.00 0.00 H new ATOM 0 HB2 ARG A 125 3.755 9.080 9.452 1.00 0.00 H new ATOM 0 HB3 ARG A 125 4.988 8.033 8.780 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.567 9.737 8.632 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.359 11.000 8.498 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.017 9.413 11.012 1.00 0.00 H new ATOM 0 HD3 ARG A 125 6.475 11.074 10.695 1.00 0.00 H new ATOM 0 HE ARG A 125 3.691 11.050 10.430 1.00 0.00 H new ATOM 0 HH11 ARG A 125 6.042 10.208 12.933 1.00 0.00 H new ATOM 0 HH12 ARG A 125 4.944 10.611 14.258 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.295 11.563 12.138 1.00 0.00 H new ATOM 0 HH22 ARG A 125 2.834 11.374 13.810 1.00 0.00 H new ATOM 1850 N CYS A 126 2.261 10.819 7.984 1.00 0.00 N ATOM 1851 CA CYS A 126 1.570 12.102 7.949 1.00 0.00 C ATOM 1852 C CYS A 126 1.609 12.781 9.314 1.00 0.00 C ATOM 1853 O CYS A 126 1.773 12.123 10.342 1.00 0.00 O ATOM 1854 CB CYS A 126 0.119 11.912 7.505 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.786 13.457 7.255 1.00 0.00 S ATOM 0 H CYS A 126 1.893 10.159 8.670 1.00 0.00 H new ATOM 0 HA CYS A 126 2.083 12.741 7.231 1.00 0.00 H new ATOM 0 HB2 CYS A 126 0.106 11.342 6.576 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.403 11.315 8.253 1.00 0.00 H new ATOM 0 HG CYS A 126 -0.913 14.074 8.392 1.00 0.00 H new ATOM 1861 N ASN A 127 1.458 14.101 9.317 1.00 0.00 N ATOM 1862 CA ASN A 127 1.475 14.872 10.553 1.00 0.00 C ATOM 1863 C ASN A 127 0.059 15.226 10.992 1.00 0.00 C ATOM 1864 O ASN A 127 -0.915 14.871 10.328 1.00 0.00 O ATOM 1865 CB ASN A 127 2.300 16.148 10.373 1.00 0.00 C ATOM 1866 CG ASN A 127 3.792 15.878 10.373 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.385 15.608 11.418 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.406 15.948 9.199 1.00 0.00 N ATOM 0 H ASN A 127 1.322 14.660 8.475 1.00 0.00 H new ATOM 0 HA ASN A 127 1.934 14.258 11.328 1.00 0.00 H new ATOM 0 HB2 ASN A 127 2.021 16.628 9.435 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.060 16.848 11.173 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.409 15.775 9.137 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.875 16.175 8.358 1.00 0.00 H new ATOM 1875 N GLU A 128 -0.050 15.930 12.115 1.00 0.00 N ATOM 1876 CA GLU A 128 -1.350 16.333 12.641 1.00 0.00 C ATOM 1877 C GLU A 128 -2.002 17.376 11.739 1.00 0.00 C ATOM 1878 O GLU A 128 -3.225 17.415 11.602 1.00 0.00 O ATOM 1879 CB GLU A 128 -1.199 16.888 14.060 1.00 0.00 C ATOM 1880 CG GLU A 128 -1.530 15.877 15.147 1.00 0.00 C ATOM 1881 CD GLU A 128 -2.291 16.494 16.303 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -3.171 17.343 16.049 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -2.007 16.128 17.463 1.00 0.00 O ATOM 0 H GLU A 128 0.745 16.233 12.678 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.992 15.453 12.670 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.175 17.236 14.198 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.848 17.756 14.173 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -2.121 15.068 14.718 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -0.606 15.434 15.520 1.00 0.00 H new ATOM 1890 N ALA A 129 -1.178 18.218 11.125 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.674 19.260 10.235 1.00 0.00 C ATOM 1892 C ALA A 129 -2.232 18.664 8.947 1.00 0.00 C ATOM 1893 O ALA A 129 -3.151 19.216 8.344 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.569 20.257 9.922 1.00 0.00 C ATOM 0 H ALA A 129 -0.163 18.199 11.228 1.00 0.00 H new ATOM 0 HA ALA A 129 -2.485 19.781 10.744 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.954 21.030 9.256 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -0.220 20.716 10.847 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.260 19.741 9.438 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.668 17.534 8.531 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.122 16.882 7.316 1.00 0.00 C ATOM 1902 C GLY A 130 -1.083 16.923 6.214 1.00 0.00 C ATOM 1903 O GLY A 130 -1.423 16.961 5.032 1.00 0.00 O ATOM 0 H GLY A 130 -0.905 17.059 9.013 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.373 15.844 7.536 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -3.036 17.364 6.968 1.00 0.00 H new ATOM 1907 N ASP A 131 0.189 16.915 6.601 1.00 0.00 N ATOM 1908 CA ASP A 131 1.282 16.952 5.637 1.00 0.00 C ATOM 1909 C ASP A 131 1.972 15.594 5.546 1.00 0.00 C ATOM 1910 O ASP A 131 2.739 15.215 6.429 1.00 0.00 O ATOM 1911 CB ASP A 131 2.298 18.027 6.026 1.00 0.00 C ATOM 1912 CG ASP A 131 1.690 19.415 6.047 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.502 19.538 6.414 1.00 0.00 O ATOM 1914 OD2 ASP A 131 2.401 20.381 5.698 1.00 0.00 O ATOM 0 H ASP A 131 0.488 16.883 7.576 1.00 0.00 H new ATOM 0 HA ASP A 131 0.863 17.194 4.660 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.707 17.797 7.010 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.130 18.008 5.322 1.00 0.00 H new ATOM 1919 N ILE A 132 1.692 14.865 4.470 1.00 0.00 N ATOM 1920 CA ILE A 132 2.284 13.550 4.263 1.00 0.00 C ATOM 1921 C ILE A 132 3.661 13.663 3.617 1.00 0.00 C ATOM 1922 O ILE A 132 3.782 14.041 2.452 1.00 0.00 O ATOM 1923 CB ILE A 132 1.388 12.660 3.380 1.00 0.00 C ATOM 1924 CG1 ILE A 132 -0.063 12.720 3.865 1.00 0.00 C ATOM 1925 CG2 ILE A 132 1.896 11.226 3.385 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -1.006 11.848 3.065 1.00 0.00 C ATOM 0 H ILE A 132 1.059 15.164 3.728 1.00 0.00 H new ATOM 0 HA ILE A 132 2.382 13.091 5.247 1.00 0.00 H new ATOM 0 HB ILE A 132 1.425 13.033 2.357 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -0.100 12.416 4.911 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.410 13.752 3.820 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.253 10.610 2.757 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.914 11.199 2.998 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.885 10.840 4.404 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -2.016 11.941 3.465 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -0.998 12.165 2.022 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.684 10.809 3.130 1.00 0.00 H new ATOM 1938 N GLU A 133 4.696 13.335 4.383 1.00 0.00 N ATOM 1939 CA GLU A 133 6.066 13.400 3.885 1.00 0.00 C ATOM 1940 C GLU A 133 6.849 12.152 4.279 1.00 0.00 C ATOM 1941 O GLU A 133 6.399 11.359 5.106 1.00 0.00 O ATOM 1942 CB GLU A 133 6.768 14.648 4.425 1.00 0.00 C ATOM 1943 CG GLU A 133 6.644 14.813 5.931 1.00 0.00 C ATOM 1944 CD GLU A 133 7.882 14.348 6.673 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.506 13.363 6.226 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.226 14.969 7.700 1.00 0.00 O ATOM 0 H GLU A 133 4.613 13.022 5.350 1.00 0.00 H new ATOM 0 HA GLU A 133 6.028 13.454 2.797 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.824 14.604 4.159 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.352 15.529 3.936 1.00 0.00 H new ATOM 0 HG2 GLU A 133 6.458 15.861 6.164 1.00 0.00 H new ATOM 0 HG3 GLU A 133 5.780 14.250 6.284 1.00 0.00 H new ATOM 1953 N ALA A 134 8.025 11.984 3.680 1.00 0.00 N ATOM 1954 CA ALA A 134 8.871 10.832 3.969 1.00 0.00 C ATOM 1955 C ALA A 134 9.746 11.087 5.191 1.00 0.00 C ATOM 1956 O ALA A 134 10.438 12.103 5.271 1.00 0.00 O ATOM 1957 CB ALA A 134 9.732 10.496 2.761 1.00 0.00 C ATOM 0 H ALA A 134 8.412 12.630 2.993 1.00 0.00 H new ATOM 0 HA ALA A 134 8.225 9.982 4.189 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.359 9.634 2.990 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.091 10.263 1.911 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.364 11.350 2.516 1.00 0.00 H new ATOM 1963 N LYS A 135 9.711 10.159 6.142 1.00 0.00 N ATOM 1964 CA LYS A 135 10.502 10.283 7.361 1.00 0.00 C ATOM 1965 C LYS A 135 11.830 9.545 7.226 1.00 0.00 C ATOM 1966 O LYS A 135 12.070 8.855 6.235 1.00 0.00 O ATOM 1967 CB LYS A 135 9.718 9.739 8.559 1.00 0.00 C ATOM 1968 CG LYS A 135 9.102 10.825 9.425 1.00 0.00 C ATOM 1969 CD LYS A 135 9.925 11.073 10.680 1.00 0.00 C ATOM 1970 CE LYS A 135 9.957 12.549 11.044 1.00 0.00 C ATOM 1971 NZ LYS A 135 11.312 12.984 11.482 1.00 0.00 N ATOM 0 H LYS A 135 9.143 9.313 6.092 1.00 0.00 H new ATOM 0 HA LYS A 135 10.712 11.340 7.524 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.927 9.082 8.197 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.383 9.130 9.172 1.00 0.00 H new ATOM 0 HG2 LYS A 135 9.025 11.749 8.851 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.088 10.537 9.705 1.00 0.00 H new ATOM 0 HD2 LYS A 135 9.507 10.502 11.509 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.942 10.713 10.526 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.646 13.142 10.184 1.00 0.00 H new ATOM 0 HE3 LYS A 135 9.239 12.742 11.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 11.291 13.996 11.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 11.599 12.436 12.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 11.993 12.824 10.713 1.00 0.00 H new ATOM 1985 N ASN A 136 12.689 9.696 8.229 1.00 0.00 N ATOM 1986 CA ASN A 136 13.993 9.043 8.222 1.00 0.00 C ATOM 1987 C ASN A 136 13.844 7.526 8.164 1.00 0.00 C ATOM 1988 O ASN A 136 12.735 6.997 8.251 1.00 0.00 O ATOM 1989 CB ASN A 136 14.792 9.442 9.464 1.00 0.00 C ATOM 1990 CG ASN A 136 15.659 10.663 9.228 1.00 0.00 C ATOM 1991 OD1 ASN A 136 15.250 11.605 8.550 1.00 0.00 O ATOM 1992 ND2 ASN A 136 16.863 10.650 9.786 1.00 0.00 N ATOM 0 H ASN A 136 12.506 10.264 9.056 1.00 0.00 H new ATOM 0 HA ASN A 136 14.530 9.370 7.332 1.00 0.00 H new ATOM 0 HB2 ASN A 136 14.104 9.642 10.286 1.00 0.00 H new ATOM 0 HB3 ASN A 136 15.422 8.607 9.771 1.00 0.00 H new ATOM 0 HD21 ASN A 136 17.492 11.443 9.661 1.00 0.00 H new ATOM 0 HD22 ASN A 136 17.160 9.847 10.340 1.00 0.00 H new ATOM 1999 N LYS A 137 14.967 6.832 8.015 1.00 0.00 N ATOM 2000 CA LYS A 137 14.962 5.375 7.945 1.00 0.00 C ATOM 2001 C LYS A 137 14.375 4.768 9.215 1.00 0.00 C ATOM 2002 O LYS A 137 13.804 3.678 9.187 1.00 0.00 O ATOM 2003 CB LYS A 137 16.382 4.849 7.725 1.00 0.00 C ATOM 2004 CG LYS A 137 17.054 5.413 6.484 1.00 0.00 C ATOM 2005 CD LYS A 137 18.447 4.837 6.293 1.00 0.00 C ATOM 2006 CE LYS A 137 19.515 5.761 6.857 1.00 0.00 C ATOM 2007 NZ LYS A 137 19.993 5.307 8.192 1.00 0.00 N ATOM 0 H LYS A 137 15.892 7.255 7.940 1.00 0.00 H new ATOM 0 HA LYS A 137 14.337 5.081 7.102 1.00 0.00 H new ATOM 0 HB2 LYS A 137 16.989 5.090 8.598 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.350 3.762 7.649 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.445 5.192 5.607 1.00 0.00 H new ATOM 0 HG3 LYS A 137 17.116 6.498 6.564 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.510 3.865 6.782 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.631 4.672 5.231 1.00 0.00 H new ATOM 0 HE2 LYS A 137 20.357 5.807 6.166 1.00 0.00 H new ATOM 0 HE3 LYS A 137 19.114 6.771 6.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 20.720 5.963 8.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 19.195 5.287 8.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 20.399 4.353 8.109 1.00 0.00 H new ATOM 2021 N THR A 138 14.517 5.481 10.328 1.00 0.00 N ATOM 2022 CA THR A 138 14.000 5.011 11.609 1.00 0.00 C ATOM 2023 C THR A 138 12.496 4.762 11.533 1.00 0.00 C ATOM 2024 O THR A 138 11.730 5.645 11.151 1.00 0.00 O ATOM 2025 CB THR A 138 14.304 6.028 12.709 1.00 0.00 C ATOM 2026 OG1 THR A 138 13.697 7.276 12.421 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.785 6.273 12.906 1.00 0.00 C ATOM 0 H THR A 138 14.986 6.386 10.369 1.00 0.00 H new ATOM 0 HA THR A 138 14.494 4.069 11.847 1.00 0.00 H new ATOM 0 HB THR A 138 13.899 5.593 13.623 1.00 0.00 H new ATOM 0 HG1 THR A 138 12.838 7.126 11.973 1.00 0.00 H new ATOM 0 HG21 THR A 138 15.930 7.005 13.701 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.275 5.339 13.179 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.217 6.653 11.980 1.00 0.00 H new ATOM 2035 N ALA A 139 12.084 3.553 11.899 1.00 0.00 N ATOM 2036 CA ALA A 139 10.673 3.187 11.872 1.00 0.00 C ATOM 2037 C ALA A 139 10.037 3.351 13.249 1.00 0.00 C ATOM 2038 O ALA A 139 10.222 2.514 14.133 1.00 0.00 O ATOM 2039 CB ALA A 139 10.509 1.756 11.381 1.00 0.00 C ATOM 0 H ALA A 139 12.707 2.811 12.218 1.00 0.00 H new ATOM 0 HA ALA A 139 10.162 3.858 11.182 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.451 1.496 11.366 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.919 1.667 10.375 1.00 0.00 H new ATOM 0 HB3 ALA A 139 11.040 1.079 12.050 1.00 0.00 H new ATOM 2045 N GLY A 140 9.286 4.434 13.423 1.00 0.00 N ATOM 2046 CA GLY A 140 8.635 4.687 14.694 1.00 0.00 C ATOM 2047 C GLY A 140 7.425 3.800 14.912 1.00 0.00 C ATOM 2048 O GLY A 140 7.052 3.020 14.036 1.00 0.00 O ATOM 0 H GLY A 140 9.117 5.140 12.707 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.349 4.528 15.502 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.329 5.732 14.740 1.00 0.00 H new ATOM 2052 N GLU A 141 6.811 3.917 16.086 1.00 0.00 N ATOM 2053 CA GLU A 141 5.637 3.120 16.416 1.00 0.00 C ATOM 2054 C GLU A 141 4.442 3.529 15.561 1.00 0.00 C ATOM 2055 O GLU A 141 3.677 2.682 15.099 1.00 0.00 O ATOM 2056 CB GLU A 141 5.293 3.271 17.900 1.00 0.00 C ATOM 2057 CG GLU A 141 5.920 2.203 18.781 1.00 0.00 C ATOM 2058 CD GLU A 141 5.297 2.148 20.163 1.00 0.00 C ATOM 2059 OE1 GLU A 141 4.180 1.604 20.289 1.00 0.00 O ATOM 2060 OE2 GLU A 141 5.927 2.649 21.118 1.00 0.00 O ATOM 0 H GLU A 141 7.108 4.556 16.823 1.00 0.00 H new ATOM 0 HA GLU A 141 5.868 2.075 16.208 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.622 4.252 18.243 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.210 3.238 18.019 1.00 0.00 H new ATOM 0 HG2 GLU A 141 5.813 1.231 18.299 1.00 0.00 H new ATOM 0 HG3 GLU A 141 6.989 2.396 18.875 1.00 0.00 H new ATOM 2067 N GLU A 142 4.288 4.833 15.353 1.00 0.00 N ATOM 2068 CA GLU A 142 3.187 5.355 14.553 1.00 0.00 C ATOM 2069 C GLU A 142 3.432 5.117 13.066 1.00 0.00 C ATOM 2070 O GLU A 142 2.489 4.991 12.285 1.00 0.00 O ATOM 2071 CB GLU A 142 3.001 6.850 14.819 1.00 0.00 C ATOM 2072 CG GLU A 142 2.727 7.180 16.277 1.00 0.00 C ATOM 2073 CD GLU A 142 1.457 7.987 16.466 1.00 0.00 C ATOM 2074 OE1 GLU A 142 0.436 7.642 15.835 1.00 0.00 O ATOM 2075 OE2 GLU A 142 1.484 8.964 17.244 1.00 0.00 O ATOM 0 H GLU A 142 4.912 5.547 15.728 1.00 0.00 H new ATOM 0 HA GLU A 142 2.279 4.825 14.841 1.00 0.00 H new ATOM 0 HB2 GLU A 142 3.896 7.382 14.497 1.00 0.00 H new ATOM 0 HB3 GLU A 142 2.175 7.219 14.210 1.00 0.00 H new ATOM 0 HG2 GLU A 142 2.652 6.254 16.847 1.00 0.00 H new ATOM 0 HG3 GLU A 142 3.571 7.737 16.684 1.00 0.00 H new ATOM 2082 N GLU A 143 4.702 5.057 12.680 1.00 0.00 N ATOM 2083 CA GLU A 143 5.070 4.835 11.286 1.00 0.00 C ATOM 2084 C GLU A 143 4.463 3.536 10.761 1.00 0.00 C ATOM 2085 O GLU A 143 4.168 3.413 9.573 1.00 0.00 O ATOM 2086 CB GLU A 143 6.592 4.798 11.138 1.00 0.00 C ATOM 2087 CG GLU A 143 7.187 6.107 10.642 1.00 0.00 C ATOM 2088 CD GLU A 143 6.977 6.315 9.155 1.00 0.00 C ATOM 2089 OE1 GLU A 143 6.052 5.691 8.592 1.00 0.00 O ATOM 2090 OE2 GLU A 143 7.737 7.102 8.552 1.00 0.00 O ATOM 0 H GLU A 143 5.495 5.159 13.314 1.00 0.00 H new ATOM 0 HA GLU A 143 4.675 5.662 10.696 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.036 4.548 12.101 1.00 0.00 H new ATOM 0 HB3 GLU A 143 6.862 4.000 10.446 1.00 0.00 H new ATOM 0 HG2 GLU A 143 6.738 6.936 11.188 1.00 0.00 H new ATOM 0 HG3 GLU A 143 8.255 6.123 10.860 1.00 0.00 H new ATOM 2097 N MET A 144 4.279 2.569 11.655 1.00 0.00 N ATOM 2098 CA MET A 144 3.707 1.281 11.282 1.00 0.00 C ATOM 2099 C MET A 144 2.313 1.455 10.689 1.00 0.00 C ATOM 2100 O MET A 144 1.421 2.014 11.328 1.00 0.00 O ATOM 2101 CB MET A 144 3.645 0.354 12.497 1.00 0.00 C ATOM 2102 CG MET A 144 5.000 0.101 13.140 1.00 0.00 C ATOM 2103 SD MET A 144 6.206 -0.562 11.976 1.00 0.00 S ATOM 2104 CE MET A 144 7.395 0.777 11.921 1.00 0.00 C ATOM 0 H MET A 144 4.518 2.654 12.643 1.00 0.00 H new ATOM 0 HA MET A 144 4.351 0.833 10.525 1.00 0.00 H new ATOM 0 HB2 MET A 144 2.975 0.787 13.240 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.212 -0.599 12.194 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.379 1.033 13.559 1.00 0.00 H new ATOM 0 HG3 MET A 144 4.880 -0.596 13.970 1.00 0.00 H new ATOM 0 HE1 MET A 144 7.982 0.705 11.006 1.00 0.00 H new ATOM 0 HE2 MET A 144 6.869 1.732 11.940 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.058 0.710 12.784 1.00 0.00 H new ATOM 2114 N ILE A 145 2.131 0.973 9.464 1.00 0.00 N ATOM 2115 CA ILE A 145 0.845 1.077 8.785 1.00 0.00 C ATOM 2116 C ILE A 145 0.173 -0.287 8.669 1.00 0.00 C ATOM 2117 O ILE A 145 0.805 -1.321 8.880 1.00 0.00 O ATOM 2118 CB ILE A 145 1.001 1.680 7.376 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.044 0.899 6.574 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.387 3.149 7.467 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.202 1.387 5.151 1.00 0.00 C ATOM 0 H ILE A 145 2.858 0.507 8.921 1.00 0.00 H new ATOM 0 HA ILE A 145 0.221 1.737 9.388 1.00 0.00 H new ATOM 0 HB ILE A 145 0.044 1.607 6.859 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.006 0.967 7.082 1.00 0.00 H new ATOM 0 HG13 ILE A 145 1.765 -0.155 6.559 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.493 3.560 6.463 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.612 3.696 8.003 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.333 3.244 8.000 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.957 0.788 4.643 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.251 1.293 4.627 1.00 0.00 H new ATOM 0 HD13 ILE A 145 2.512 2.432 5.157 1.00 0.00 H new ATOM 2133 N LYS A 146 -1.112 -0.280 8.330 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.871 -1.517 8.186 1.00 0.00 C ATOM 2135 C LYS A 146 -2.364 -1.689 6.753 1.00 0.00 C ATOM 2136 O LYS A 146 -3.357 -1.081 6.349 1.00 0.00 O ATOM 2137 CB LYS A 146 -3.060 -1.527 9.149 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.659 -1.405 10.611 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.772 -0.791 11.446 1.00 0.00 C ATOM 2140 CE LYS A 146 -4.172 -1.697 12.600 1.00 0.00 C ATOM 2141 NZ LYS A 146 -5.479 -1.299 13.192 1.00 0.00 N ATOM 0 H LYS A 146 -1.649 0.568 8.150 1.00 0.00 H new ATOM 0 HA LYS A 146 -1.209 -2.349 8.427 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.730 -0.706 8.895 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.621 -2.451 9.011 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -2.409 -2.391 11.004 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -1.761 -0.792 10.693 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -3.445 0.173 11.836 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -4.640 -0.602 10.814 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -4.231 -2.727 12.249 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -3.401 -1.666 13.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -5.715 -1.941 13.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -5.416 -0.325 13.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -6.220 -1.353 12.465 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.664 -2.519 5.987 1.00 0.00 N ATOM 2156 CA ILE A 147 -2.031 -2.771 4.598 1.00 0.00 C ATOM 2157 C ILE A 147 -3.208 -3.736 4.508 1.00 0.00 C ATOM 2158 O ILE A 147 -3.175 -4.827 5.077 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.846 -3.347 3.800 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.411 -2.509 4.034 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.185 -3.403 2.318 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.683 -3.182 3.564 1.00 0.00 C ATOM 0 H ILE A 147 -0.839 -3.029 6.304 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.317 -1.812 4.167 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.651 -4.362 4.147 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.303 -1.555 3.519 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.498 -2.289 5.098 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.339 -3.812 1.766 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.057 -4.039 2.168 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.402 -2.398 1.956 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.534 -2.530 3.762 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.815 -4.123 4.098 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.617 -3.378 2.494 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.248 -3.327 3.787 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.436 -4.157 3.621 1.00 0.00 C ATOM 2176 C ARG A 148 -5.733 -4.393 2.144 1.00 0.00 C ATOM 2177 O ARG A 148 -5.608 -3.485 1.322 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.641 -3.498 4.296 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.585 -3.538 5.815 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.475 -2.472 6.432 1.00 0.00 C ATOM 2181 NE ARG A 148 -7.032 -2.099 7.774 1.00 0.00 N ATOM 2182 CZ ARG A 148 -7.284 -2.819 8.865 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -7.973 -3.950 8.777 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.844 -2.407 10.046 1.00 0.00 N ATOM 0 H ARG A 148 -4.292 -2.427 3.309 1.00 0.00 H new ATOM 0 HA ARG A 148 -5.245 -5.121 4.093 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.706 -2.460 3.970 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.551 -3.995 3.961 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.897 -4.522 6.166 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.557 -3.392 6.146 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.479 -1.589 5.793 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.501 -2.838 6.477 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.498 -1.236 7.881 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -8.312 -4.271 7.870 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -8.163 -4.498 9.616 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -6.313 -1.539 10.118 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -7.037 -2.958 10.883 1.00 0.00 H new ATOM 2198 N SER A 149 -6.126 -5.618 1.814 1.00 0.00 N ATOM 2199 CA SER A 149 -6.442 -5.975 0.436 1.00 0.00 C ATOM 2200 C SER A 149 -7.923 -6.301 0.282 1.00 0.00 C ATOM 2201 O SER A 149 -8.576 -6.732 1.233 1.00 0.00 O ATOM 2202 CB SER A 149 -5.597 -7.169 -0.010 1.00 0.00 C ATOM 2203 OG SER A 149 -5.390 -7.155 -1.412 1.00 0.00 O ATOM 0 H SER A 149 -6.233 -6.381 2.482 1.00 0.00 H new ATOM 0 HA SER A 149 -6.211 -5.117 -0.196 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.635 -7.149 0.502 1.00 0.00 H new ATOM 0 HB3 SER A 149 -6.092 -8.096 0.278 1.00 0.00 H new ATOM 0 HG SER A 149 -4.846 -7.928 -1.670 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.449 -6.092 -0.920 1.00 0.00 N ATOM 2210 CA CYS A 150 -9.855 -6.364 -1.198 1.00 0.00 C ATOM 2211 C CYS A 150 -10.007 -7.203 -2.463 1.00 0.00 C ATOM 2212 O CYS A 150 -10.985 -7.066 -3.197 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.629 -5.053 -1.347 1.00 0.00 C ATOM 2214 SG CYS A 150 -9.895 -3.890 -2.520 1.00 0.00 S ATOM 0 H CYS A 150 -7.923 -5.735 -1.718 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.263 -6.927 -0.359 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.647 -5.279 -1.665 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.699 -4.572 -0.371 1.00 0.00 H new ATOM 0 HG CYS A 150 -9.573 -2.793 -1.900 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.032 -8.072 -2.710 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.057 -8.934 -3.886 1.00 0.00 C ATOM 2222 C ALA A 151 -9.955 -10.145 -3.660 1.00 0.00 C ATOM 2223 O ALA A 151 -10.593 -10.271 -2.614 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.647 -9.379 -4.244 1.00 0.00 C ATOM 0 H ALA A 151 -8.215 -8.198 -2.112 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.467 -8.361 -4.717 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.681 -10.022 -5.124 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.032 -8.504 -4.457 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.216 -9.930 -3.408 1.00 0.00 H new