USER MOD reduce.3.24.130724 H: found=0, std=0, add=678, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 678 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 Single : A 0 HIS : no HD1:sc= -0.0435 X(o=-0.044,f=0) USER MOD Single : A 1 MET CE :methyl -168:sc= 0 (180deg=-0.121) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot 180:sc=-0.00835 USER MOD Single : A -2 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -33:sc= 0.0776 USER MOD Single : A 18 THR OG1 : rot -86:sc= 0.956 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0.00879 USER MOD Single : A 37 ASN : amide:sc= -0.0715 X(o=-0.071,f=-0.071) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot -32:sc= 0.482 USER MOD Single : A 43 SER OG : rot 170:sc= -0.111 USER MOD Single : A 58 GLN : amide:sc= -0.295 X(o=-0.3,f=-0.3) USER MOD Single : A 63 SER OG : rot 130:sc= -0.092 USER MOD Single : A 65 SER OG : rot 83:sc=0.000743 USER MOD Single : A 70 GLN : amide:sc= 0.0534 X(o=0.053,f=-0.35) USER MOD Single : A 72 LYS NZ :NH3+ 153:sc= -0.023 (180deg=-0.348) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 2.231 17.431 6.388 1.00 0.00 N ATOM 2 CA GLY A -2 3.524 17.081 7.008 1.00 0.00 C ATOM 3 C GLY A -2 3.718 15.594 7.307 1.00 0.00 C ATOM 4 O GLY A -2 4.342 15.320 8.325 1.00 0.00 O ATOM 0 H1 GLY A -2 2.191 18.457 6.223 1.00 0.00 H new ATOM 0 H2 GLY A -2 2.134 16.931 5.481 1.00 0.00 H new ATOM 0 H3 GLY A -2 1.455 17.152 7.022 1.00 0.00 H new ATOM 0 HA2 GLY A -2 4.327 17.411 6.349 1.00 0.00 H new ATOM 0 HA3 GLY A -2 3.626 17.639 7.939 1.00 0.00 H new ATOM 10 N SER A -1 3.231 14.641 6.486 1.00 0.00 N ATOM 11 CA SER A -1 3.291 13.206 6.844 1.00 0.00 C ATOM 12 C SER A -1 3.304 12.245 5.635 1.00 0.00 C ATOM 13 O SER A -1 3.013 12.657 4.515 1.00 0.00 O ATOM 14 CB SER A -1 2.146 12.822 7.812 1.00 0.00 C ATOM 15 OG SER A -1 1.316 13.906 8.205 1.00 0.00 O ATOM 0 H SER A -1 2.797 14.833 5.583 1.00 0.00 H new ATOM 0 HA SER A -1 4.253 13.082 7.342 1.00 0.00 H new ATOM 0 HB2 SER A -1 1.527 12.061 7.338 1.00 0.00 H new ATOM 0 HB3 SER A -1 2.579 12.370 8.705 1.00 0.00 H new ATOM 0 HG SER A -1 0.619 13.581 8.813 1.00 0.00 H new ATOM 21 N HIS A 0 3.656 10.968 5.881 1.00 0.00 N ATOM 22 CA HIS A 0 3.674 9.800 4.969 1.00 0.00 C ATOM 23 C HIS A 0 3.845 8.499 5.796 1.00 0.00 C ATOM 24 O HIS A 0 4.294 8.592 6.938 1.00 0.00 O ATOM 25 CB HIS A 0 4.826 9.953 3.953 1.00 0.00 C ATOM 26 CG HIS A 0 6.175 10.246 4.574 1.00 0.00 C ATOM 27 ND1 HIS A 0 6.769 11.492 4.654 1.00 0.00 N ATOM 28 CD2 HIS A 0 7.008 9.340 5.171 1.00 0.00 C ATOM 29 CE1 HIS A 0 7.945 11.346 5.298 1.00 0.00 C ATOM 30 NE2 HIS A 0 8.112 10.045 5.620 1.00 0.00 N ATOM 0 H HIS A 0 3.966 10.699 6.815 1.00 0.00 H new ATOM 0 HA HIS A 0 2.733 9.746 4.422 1.00 0.00 H new ATOM 0 HB2 HIS A 0 4.901 9.037 3.367 1.00 0.00 H new ATOM 0 HB3 HIS A 0 4.577 10.756 3.259 1.00 0.00 H new ATOM 0 HD2 HIS A 0 6.837 8.278 5.273 1.00 0.00 H new ATOM 0 HE1 HIS A 0 8.641 12.141 5.520 1.00 0.00 H new ATOM 0 HE2 HIS A 0 8.914 9.649 6.110 1.00 0.00 H new ATOM 39 N MET A 1 3.543 7.299 5.255 1.00 0.00 N ATOM 40 CA MET A 1 3.710 6.002 5.960 1.00 0.00 C ATOM 41 C MET A 1 3.673 4.775 5.009 1.00 0.00 C ATOM 42 O MET A 1 3.200 4.905 3.883 1.00 0.00 O ATOM 43 CB MET A 1 2.598 5.872 7.024 1.00 0.00 C ATOM 44 CG MET A 1 3.001 4.983 8.207 1.00 0.00 C ATOM 45 SD MET A 1 1.870 5.059 9.623 1.00 0.00 S ATOM 46 CE MET A 1 2.253 6.712 10.271 1.00 0.00 C ATOM 0 H MET A 1 3.173 7.198 4.310 1.00 0.00 H new ATOM 0 HA MET A 1 4.698 6.004 6.420 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.339 6.864 7.394 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.702 5.462 6.557 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.065 3.950 7.864 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.999 5.271 8.539 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.803 6.829 11.257 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.334 6.831 10.348 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.852 7.469 9.597 1.00 0.00 H new ATOM 56 N THR A 2 4.117 3.586 5.467 1.00 0.00 N ATOM 57 CA THR A 2 3.956 2.261 4.809 1.00 0.00 C ATOM 58 C THR A 2 3.805 1.144 5.862 1.00 0.00 C ATOM 59 O THR A 2 4.244 1.336 6.998 1.00 0.00 O ATOM 60 CB THR A 2 5.146 1.892 3.894 1.00 0.00 C ATOM 61 OG1 THR A 2 6.299 1.599 4.654 1.00 0.00 O ATOM 62 CG2 THR A 2 5.533 2.962 2.873 1.00 0.00 C ATOM 0 H THR A 2 4.624 3.514 6.349 1.00 0.00 H new ATOM 0 HA THR A 2 3.059 2.344 4.196 1.00 0.00 H new ATOM 0 HB THR A 2 4.789 1.022 3.343 1.00 0.00 H new ATOM 0 HG1 THR A 2 7.037 1.367 4.052 1.00 0.00 H new ATOM 0 HG21 THR A 2 6.377 2.610 2.279 1.00 0.00 H new ATOM 0 HG22 THR A 2 4.686 3.162 2.217 1.00 0.00 H new ATOM 0 HG23 THR A 2 5.813 3.878 3.394 1.00 0.00 H new ATOM 70 N LEU A 3 3.234 -0.020 5.504 1.00 0.00 N ATOM 71 CA LEU A 3 3.040 -1.187 6.396 1.00 0.00 C ATOM 72 C LEU A 3 3.391 -2.521 5.705 1.00 0.00 C ATOM 73 O LEU A 3 3.324 -2.612 4.486 1.00 0.00 O ATOM 74 CB LEU A 3 1.575 -1.247 6.880 1.00 0.00 C ATOM 75 CG LEU A 3 1.129 -0.326 8.035 1.00 0.00 C ATOM 76 CD1 LEU A 3 2.077 -0.386 9.240 1.00 0.00 C ATOM 77 CD2 LEU A 3 0.882 1.130 7.636 1.00 0.00 C ATOM 0 H LEU A 3 2.883 -0.184 4.560 1.00 0.00 H new ATOM 0 HA LEU A 3 3.717 -1.054 7.240 1.00 0.00 H new ATOM 0 HB2 LEU A 3 0.937 -1.032 6.023 1.00 0.00 H new ATOM 0 HB3 LEU A 3 1.370 -2.274 7.181 1.00 0.00 H new ATOM 0 HG LEU A 3 0.162 -0.736 8.326 1.00 0.00 H new ATOM 0 HD11 LEU A 3 1.714 0.281 10.022 1.00 0.00 H new ATOM 0 HD12 LEU A 3 2.115 -1.406 9.622 1.00 0.00 H new ATOM 0 HD13 LEU A 3 3.076 -0.076 8.933 1.00 0.00 H new ATOM 0 HD21 LEU A 3 0.573 1.700 8.512 1.00 0.00 H new ATOM 0 HD22 LEU A 3 1.799 1.557 7.231 1.00 0.00 H new ATOM 0 HD23 LEU A 3 0.098 1.172 6.880 1.00 0.00 H new ATOM 89 N ARG A 4 3.735 -3.571 6.475 1.00 0.00 N ATOM 90 CA ARG A 4 4.206 -4.884 5.971 1.00 0.00 C ATOM 91 C ARG A 4 3.055 -5.865 5.707 1.00 0.00 C ATOM 92 O ARG A 4 2.009 -5.752 6.342 1.00 0.00 O ATOM 93 CB ARG A 4 5.172 -5.517 6.994 1.00 0.00 C ATOM 94 CG ARG A 4 6.440 -4.680 7.231 1.00 0.00 C ATOM 95 CD ARG A 4 7.109 -5.010 8.576 1.00 0.00 C ATOM 96 NE ARG A 4 7.592 -3.785 9.243 1.00 0.00 N ATOM 97 CZ ARG A 4 6.848 -2.879 9.871 1.00 0.00 C ATOM 98 NH1 ARG A 4 5.554 -3.033 10.056 1.00 0.00 N ATOM 99 NH2 ARG A 4 7.395 -1.775 10.321 1.00 0.00 N ATOM 0 H ARG A 4 3.693 -3.533 7.493 1.00 0.00 H new ATOM 0 HA ARG A 4 4.710 -4.697 5.023 1.00 0.00 H new ATOM 0 HB2 ARG A 4 4.650 -5.650 7.942 1.00 0.00 H new ATOM 0 HB3 ARG A 4 5.460 -6.509 6.646 1.00 0.00 H new ATOM 0 HG2 ARG A 4 7.148 -4.858 6.421 1.00 0.00 H new ATOM 0 HG3 ARG A 4 6.185 -3.621 7.204 1.00 0.00 H new ATOM 0 HD2 ARG A 4 6.398 -5.524 9.223 1.00 0.00 H new ATOM 0 HD3 ARG A 4 7.943 -5.692 8.413 1.00 0.00 H new ATOM 0 HE ARG A 4 8.598 -3.616 9.220 1.00 0.00 H new ATOM 0 HH11 ARG A 4 5.086 -3.872 9.712 1.00 0.00 H new ATOM 0 HH12 ARG A 4 5.019 -2.314 10.543 1.00 0.00 H new ATOM 0 HH21 ARG A 4 8.393 -1.610 10.190 1.00 0.00 H new ATOM 0 HH22 ARG A 4 6.822 -1.082 10.802 1.00 0.00 H new ATOM 113 N ILE A 5 3.284 -6.911 4.892 1.00 0.00 N ATOM 114 CA ILE A 5 2.331 -8.035 4.708 1.00 0.00 C ATOM 115 C ILE A 5 1.879 -8.627 6.051 1.00 0.00 C ATOM 116 O ILE A 5 0.680 -8.758 6.286 1.00 0.00 O ATOM 117 CB ILE A 5 2.880 -9.097 3.712 1.00 0.00 C ATOM 118 CG1 ILE A 5 1.794 -9.975 3.033 1.00 0.00 C ATOM 119 CG2 ILE A 5 4.015 -9.971 4.273 1.00 0.00 C ATOM 120 CD1 ILE A 5 0.884 -10.833 3.925 1.00 0.00 C ATOM 0 H ILE A 5 4.136 -7.006 4.339 1.00 0.00 H new ATOM 0 HA ILE A 5 1.429 -7.634 4.246 1.00 0.00 H new ATOM 0 HB ILE A 5 3.314 -8.475 2.929 1.00 0.00 H new ATOM 0 HG12 ILE A 5 1.156 -9.317 2.444 1.00 0.00 H new ATOM 0 HG13 ILE A 5 2.297 -10.642 2.333 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.336 -10.682 3.512 1.00 0.00 H new ATOM 0 HG22 ILE A 5 4.856 -9.338 4.556 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.658 -10.513 5.149 1.00 0.00 H new ATOM 0 HD11 ILE A 5 0.181 -11.386 3.302 1.00 0.00 H new ATOM 0 HD12 ILE A 5 1.492 -11.534 4.497 1.00 0.00 H new ATOM 0 HD13 ILE A 5 0.333 -10.188 4.610 1.00 0.00 H new ATOM 132 N ARG A 6 2.820 -8.870 6.977 1.00 0.00 N ATOM 133 CA ARG A 6 2.539 -9.265 8.364 1.00 0.00 C ATOM 134 C ARG A 6 1.548 -8.313 9.042 1.00 0.00 C ATOM 135 O ARG A 6 0.576 -8.792 9.614 1.00 0.00 O ATOM 136 CB ARG A 6 3.857 -9.420 9.150 1.00 0.00 C ATOM 137 CG ARG A 6 4.472 -10.813 8.912 1.00 0.00 C ATOM 138 CD ARG A 6 5.977 -10.893 9.208 1.00 0.00 C ATOM 139 NE ARG A 6 6.305 -10.744 10.639 1.00 0.00 N ATOM 140 CZ ARG A 6 7.528 -10.609 11.149 1.00 0.00 C ATOM 141 NH1 ARG A 6 8.593 -10.525 10.386 1.00 0.00 N ATOM 142 NH2 ARG A 6 7.707 -10.557 12.449 1.00 0.00 N ATOM 0 H ARG A 6 3.817 -8.796 6.777 1.00 0.00 H new ATOM 0 HA ARG A 6 2.047 -10.238 8.354 1.00 0.00 H new ATOM 0 HB2 ARG A 6 4.563 -8.648 8.843 1.00 0.00 H new ATOM 0 HB3 ARG A 6 3.671 -9.276 10.214 1.00 0.00 H new ATOM 0 HG2 ARG A 6 3.951 -11.540 9.535 1.00 0.00 H new ATOM 0 HG3 ARG A 6 4.301 -11.102 7.875 1.00 0.00 H new ATOM 0 HD2 ARG A 6 6.358 -11.851 8.854 1.00 0.00 H new ATOM 0 HD3 ARG A 6 6.492 -10.116 8.643 1.00 0.00 H new ATOM 0 HE ARG A 6 5.525 -10.744 11.297 1.00 0.00 H new ATOM 0 HH11 ARG A 6 8.498 -10.563 9.371 1.00 0.00 H new ATOM 0 HH12 ARG A 6 9.516 -10.422 10.808 1.00 0.00 H new ATOM 0 HH21 ARG A 6 6.906 -10.620 13.077 1.00 0.00 H new ATOM 0 HH22 ARG A 6 8.647 -10.454 12.831 1.00 0.00 H new ATOM 156 N THR A 7 1.738 -6.990 8.939 1.00 0.00 N ATOM 157 CA THR A 7 0.797 -5.987 9.464 1.00 0.00 C ATOM 158 C THR A 7 -0.578 -6.073 8.788 1.00 0.00 C ATOM 159 O THR A 7 -1.585 -6.047 9.492 1.00 0.00 O ATOM 160 CB THR A 7 1.325 -4.548 9.316 1.00 0.00 C ATOM 161 OG1 THR A 7 2.686 -4.428 9.696 1.00 0.00 O ATOM 162 CG2 THR A 7 0.518 -3.575 10.191 1.00 0.00 C ATOM 0 H THR A 7 2.555 -6.581 8.486 1.00 0.00 H new ATOM 0 HA THR A 7 0.695 -6.221 10.524 1.00 0.00 H new ATOM 0 HB THR A 7 1.221 -4.302 8.259 1.00 0.00 H new ATOM 0 HG1 THR A 7 2.976 -3.499 9.583 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.910 -2.565 10.069 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.529 -3.597 9.889 1.00 0.00 H new ATOM 0 HG23 THR A 7 0.600 -3.872 11.236 1.00 0.00 H new ATOM 170 N ILE A 8 -0.647 -6.189 7.451 1.00 0.00 N ATOM 171 CA ILE A 8 -1.940 -6.336 6.756 1.00 0.00 C ATOM 172 C ILE A 8 -2.663 -7.590 7.256 1.00 0.00 C ATOM 173 O ILE A 8 -3.823 -7.521 7.663 1.00 0.00 O ATOM 174 CB ILE A 8 -1.816 -6.356 5.213 1.00 0.00 C ATOM 175 CG1 ILE A 8 -1.002 -5.153 4.692 1.00 0.00 C ATOM 176 CG2 ILE A 8 -3.235 -6.356 4.609 1.00 0.00 C ATOM 177 CD1 ILE A 8 -1.132 -4.867 3.187 1.00 0.00 C ATOM 0 H ILE A 8 0.166 -6.184 6.835 1.00 0.00 H new ATOM 0 HA ILE A 8 -2.527 -5.449 6.997 1.00 0.00 H new ATOM 0 HB ILE A 8 -1.280 -7.255 4.910 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -1.310 -4.263 5.241 1.00 0.00 H new ATOM 0 HG13 ILE A 8 0.050 -5.321 4.922 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -3.167 -6.370 3.521 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -3.776 -7.239 4.950 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -3.766 -5.459 4.928 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -0.521 -4.003 2.927 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -0.793 -5.735 2.621 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -2.174 -4.660 2.945 1.00 0.00 H new ATOM 189 N ALA A 9 -1.975 -8.735 7.252 1.00 0.00 N ATOM 190 CA ALA A 9 -2.549 -10.003 7.672 1.00 0.00 C ATOM 191 C ALA A 9 -2.988 -9.985 9.146 1.00 0.00 C ATOM 192 O ALA A 9 -4.073 -10.478 9.463 1.00 0.00 O ATOM 193 CB ALA A 9 -1.548 -11.120 7.387 1.00 0.00 C ATOM 0 H ALA A 9 -1.001 -8.802 6.955 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.458 -10.184 7.098 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.970 -12.075 7.699 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -1.331 -11.151 6.319 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.627 -10.933 7.939 1.00 0.00 H new ATOM 199 N ARG A 10 -2.197 -9.349 10.029 1.00 0.00 N ATOM 200 CA ARG A 10 -2.472 -9.126 11.461 1.00 0.00 C ATOM 201 C ARG A 10 -3.823 -8.472 11.773 1.00 0.00 C ATOM 202 O ARG A 10 -4.257 -8.565 12.916 1.00 0.00 O ATOM 203 CB ARG A 10 -1.332 -8.301 12.090 1.00 0.00 C ATOM 204 CG ARG A 10 -0.164 -9.171 12.578 1.00 0.00 C ATOM 205 CD ARG A 10 -0.448 -9.778 13.961 1.00 0.00 C ATOM 206 NE ARG A 10 0.445 -9.218 14.994 1.00 0.00 N ATOM 207 CZ ARG A 10 0.439 -9.506 16.289 1.00 0.00 C ATOM 208 NH1 ARG A 10 -0.439 -10.330 16.810 1.00 0.00 N ATOM 209 NH2 ARG A 10 1.327 -8.966 17.090 1.00 0.00 N ATOM 0 H ARG A 10 -1.299 -8.955 9.748 1.00 0.00 H new ATOM 0 HA ARG A 10 -2.527 -10.121 11.902 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -0.963 -7.583 11.357 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -1.726 -7.727 12.929 1.00 0.00 H new ATOM 0 HG2 ARG A 10 0.019 -9.970 11.860 1.00 0.00 H new ATOM 0 HG3 ARG A 10 0.744 -8.569 12.624 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -1.486 -9.590 14.235 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -0.321 -10.860 13.917 1.00 0.00 H new ATOM 0 HE ARG A 10 1.139 -8.539 14.680 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -1.142 -10.769 16.215 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -0.418 -10.532 17.810 1.00 0.00 H new ATOM 0 HH21 ARG A 10 2.025 -8.322 16.718 1.00 0.00 H new ATOM 0 HH22 ARG A 10 1.319 -9.190 18.085 1.00 0.00 H new ATOM 223 N MET A 11 -4.524 -7.905 10.782 1.00 0.00 N ATOM 224 CA MET A 11 -5.944 -7.547 10.888 1.00 0.00 C ATOM 225 C MET A 11 -6.825 -8.708 11.380 1.00 0.00 C ATOM 226 O MET A 11 -7.814 -8.459 12.063 1.00 0.00 O ATOM 227 CB MET A 11 -6.461 -7.096 9.514 1.00 0.00 C ATOM 228 CG MET A 11 -5.998 -5.691 9.116 1.00 0.00 C ATOM 229 SD MET A 11 -7.139 -4.367 9.612 1.00 0.00 S ATOM 230 CE MET A 11 -6.037 -3.285 10.563 1.00 0.00 C ATOM 0 H MET A 11 -4.116 -7.680 9.875 1.00 0.00 H new ATOM 0 HA MET A 11 -6.010 -6.745 11.624 1.00 0.00 H new ATOM 0 HB2 MET A 11 -6.128 -7.807 8.758 1.00 0.00 H new ATOM 0 HB3 MET A 11 -7.551 -7.123 9.518 1.00 0.00 H new ATOM 0 HG2 MET A 11 -5.022 -5.501 9.563 1.00 0.00 H new ATOM 0 HG3 MET A 11 -5.866 -5.656 8.035 1.00 0.00 H new ATOM 0 HE1 MET A 11 -6.599 -2.427 10.932 1.00 0.00 H new ATOM 0 HE2 MET A 11 -5.623 -3.838 11.406 1.00 0.00 H new ATOM 0 HE3 MET A 11 -5.225 -2.939 9.923 1.00 0.00 H new ATOM 240 N THR A 12 -6.512 -9.959 11.004 1.00 0.00 N ATOM 241 CA THR A 12 -7.329 -11.135 11.374 1.00 0.00 C ATOM 242 C THR A 12 -6.628 -12.501 11.231 1.00 0.00 C ATOM 243 O THR A 12 -7.141 -13.510 11.706 1.00 0.00 O ATOM 244 CB THR A 12 -8.631 -11.109 10.546 1.00 0.00 C ATOM 245 OG1 THR A 12 -9.615 -11.971 11.059 1.00 0.00 O ATOM 246 CG2 THR A 12 -8.412 -11.493 9.087 1.00 0.00 C ATOM 0 H THR A 12 -5.693 -10.187 10.440 1.00 0.00 H new ATOM 0 HA THR A 12 -7.527 -11.045 12.442 1.00 0.00 H new ATOM 0 HB THR A 12 -8.968 -10.074 10.611 1.00 0.00 H new ATOM 0 HG1 THR A 12 -9.186 -12.756 11.459 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.362 -11.457 8.555 1.00 0.00 H new ATOM 0 HG22 THR A 12 -7.712 -10.795 8.628 1.00 0.00 H new ATOM 0 HG23 THR A 12 -8.004 -12.503 9.034 1.00 0.00 H new ATOM 254 N GLY A 13 -5.476 -12.580 10.556 1.00 0.00 N ATOM 255 CA GLY A 13 -4.747 -13.816 10.264 1.00 0.00 C ATOM 256 C GLY A 13 -5.380 -14.646 9.145 1.00 0.00 C ATOM 257 O GLY A 13 -4.666 -15.064 8.240 1.00 0.00 O ATOM 0 H GLY A 13 -5.009 -11.753 10.185 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -3.722 -13.568 9.987 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -4.695 -14.421 11.169 1.00 0.00 H new ATOM 261 N ILE A 14 -6.709 -14.834 9.148 1.00 0.00 N ATOM 262 CA ILE A 14 -7.445 -15.616 8.132 1.00 0.00 C ATOM 263 C ILE A 14 -7.166 -15.105 6.710 1.00 0.00 C ATOM 264 O ILE A 14 -7.062 -15.888 5.768 1.00 0.00 O ATOM 265 CB ILE A 14 -8.966 -15.764 8.457 1.00 0.00 C ATOM 266 CG1 ILE A 14 -9.971 -14.839 7.719 1.00 0.00 C ATOM 267 CG2 ILE A 14 -9.250 -15.643 9.969 1.00 0.00 C ATOM 268 CD1 ILE A 14 -10.344 -15.285 6.297 1.00 0.00 C ATOM 0 H ILE A 14 -7.316 -14.442 9.867 1.00 0.00 H new ATOM 0 HA ILE A 14 -7.055 -16.633 8.172 1.00 0.00 H new ATOM 0 HB ILE A 14 -9.151 -16.766 8.071 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -10.883 -14.772 8.313 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -9.548 -13.836 7.669 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -10.320 -15.752 10.148 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -8.711 -16.425 10.504 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -8.920 -14.667 10.324 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -11.050 -14.575 5.866 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -9.446 -15.323 5.680 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -10.801 -16.274 6.334 1.00 0.00 H new ATOM 280 N ARG A 15 -6.977 -13.785 6.570 1.00 0.00 N ATOM 281 CA ARG A 15 -6.598 -13.121 5.324 1.00 0.00 C ATOM 282 C ARG A 15 -5.169 -13.461 4.867 1.00 0.00 C ATOM 283 O ARG A 15 -4.917 -13.345 3.676 1.00 0.00 O ATOM 284 CB ARG A 15 -6.800 -11.597 5.453 1.00 0.00 C ATOM 285 CG ARG A 15 -8.280 -11.197 5.610 1.00 0.00 C ATOM 286 CD ARG A 15 -8.438 -9.742 6.086 1.00 0.00 C ATOM 287 NE ARG A 15 -9.858 -9.409 6.334 1.00 0.00 N ATOM 288 CZ ARG A 15 -10.346 -8.394 7.038 1.00 0.00 C ATOM 289 NH1 ARG A 15 -9.566 -7.531 7.649 1.00 0.00 N ATOM 290 NH2 ARG A 15 -11.644 -8.229 7.142 1.00 0.00 N ATOM 0 H ARG A 15 -7.088 -13.134 7.347 1.00 0.00 H new ATOM 0 HA ARG A 15 -7.256 -13.503 4.544 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -6.238 -11.233 6.313 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -6.388 -11.106 4.572 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -8.793 -11.324 4.657 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -8.762 -11.866 6.323 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -7.862 -9.591 6.999 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -8.029 -9.065 5.336 1.00 0.00 H new ATOM 0 HE ARG A 15 -10.545 -10.034 5.914 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -8.552 -7.629 7.591 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -9.974 -6.763 8.181 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -12.279 -8.881 6.682 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -12.017 -7.449 7.683 1.00 0.00 H new ATOM 304 N GLU A 16 -4.235 -13.917 5.716 1.00 0.00 N ATOM 305 CA GLU A 16 -2.848 -14.193 5.280 1.00 0.00 C ATOM 306 C GLU A 16 -2.805 -15.207 4.134 1.00 0.00 C ATOM 307 O GLU A 16 -2.160 -14.959 3.114 1.00 0.00 O ATOM 308 CB GLU A 16 -1.950 -14.667 6.441 1.00 0.00 C ATOM 309 CG GLU A 16 -0.446 -14.401 6.157 1.00 0.00 C ATOM 310 CD GLU A 16 0.441 -15.639 5.918 1.00 0.00 C ATOM 311 OE1 GLU A 16 -0.105 -16.751 5.767 1.00 0.00 O ATOM 312 OE2 GLU A 16 1.681 -15.456 5.803 1.00 0.00 O ATOM 0 H GLU A 16 -4.409 -14.103 6.704 1.00 0.00 H new ATOM 0 HA GLU A 16 -2.452 -13.244 4.918 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.242 -14.155 7.358 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -2.105 -15.733 6.608 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -0.374 -13.756 5.281 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -0.034 -13.844 6.998 1.00 0.00 H new ATOM 319 N ALA A 17 -3.593 -16.280 4.268 1.00 0.00 N ATOM 320 CA ALA A 17 -3.813 -17.294 3.247 1.00 0.00 C ATOM 321 C ALA A 17 -4.364 -16.722 1.929 1.00 0.00 C ATOM 322 O ALA A 17 -4.081 -17.285 0.874 1.00 0.00 O ATOM 323 CB ALA A 17 -4.761 -18.349 3.830 1.00 0.00 C ATOM 0 H ALA A 17 -4.112 -16.467 5.126 1.00 0.00 H new ATOM 0 HA ALA A 17 -2.852 -17.737 2.985 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.945 -19.124 3.086 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.308 -18.796 4.715 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.705 -17.878 4.104 1.00 0.00 H new ATOM 329 N THR A 18 -5.101 -15.598 1.957 1.00 0.00 N ATOM 330 CA THR A 18 -5.546 -14.911 0.737 1.00 0.00 C ATOM 331 C THR A 18 -4.495 -13.931 0.217 1.00 0.00 C ATOM 332 O THR A 18 -4.276 -13.891 -0.985 1.00 0.00 O ATOM 333 CB THR A 18 -6.945 -14.274 0.875 1.00 0.00 C ATOM 334 OG1 THR A 18 -7.582 -14.391 -0.374 1.00 0.00 O ATOM 335 CG2 THR A 18 -7.026 -12.784 1.227 1.00 0.00 C ATOM 0 H THR A 18 -5.402 -15.145 2.820 1.00 0.00 H new ATOM 0 HA THR A 18 -5.657 -15.682 -0.025 1.00 0.00 H new ATOM 0 HB THR A 18 -7.394 -14.807 1.713 1.00 0.00 H new ATOM 0 HG1 THR A 18 -7.337 -13.628 -0.939 1.00 0.00 H new ATOM 0 HG21 THR A 18 -8.071 -12.481 1.289 1.00 0.00 H new ATOM 0 HG22 THR A 18 -6.540 -12.610 2.187 1.00 0.00 H new ATOM 0 HG23 THR A 18 -6.524 -12.200 0.455 1.00 0.00 H new ATOM 343 N LEU A 19 -3.813 -13.178 1.087 1.00 0.00 N ATOM 344 CA LEU A 19 -2.782 -12.196 0.722 1.00 0.00 C ATOM 345 C LEU A 19 -1.583 -12.890 0.053 1.00 0.00 C ATOM 346 O LEU A 19 -1.168 -12.515 -1.045 1.00 0.00 O ATOM 347 CB LEU A 19 -2.342 -11.421 1.987 1.00 0.00 C ATOM 348 CG LEU A 19 -3.481 -10.638 2.678 1.00 0.00 C ATOM 349 CD1 LEU A 19 -3.171 -10.351 4.157 1.00 0.00 C ATOM 350 CD2 LEU A 19 -3.813 -9.330 1.961 1.00 0.00 C ATOM 0 H LEU A 19 -3.966 -13.235 2.094 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.196 -11.490 0.002 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.915 -12.125 2.701 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -1.550 -10.724 1.715 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.355 -11.287 2.623 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.999 -9.799 4.602 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.035 -11.292 4.689 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.259 -9.758 4.229 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.619 -8.821 2.488 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.930 -8.691 1.943 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.126 -9.545 0.939 1.00 0.00 H new ATOM 362 N ARG A 20 -1.061 -13.943 0.698 1.00 0.00 N ATOM 363 CA ARG A 20 0.036 -14.782 0.194 1.00 0.00 C ATOM 364 C ARG A 20 -0.361 -15.583 -1.043 1.00 0.00 C ATOM 365 O ARG A 20 0.489 -15.820 -1.896 1.00 0.00 O ATOM 366 CB ARG A 20 0.484 -15.742 1.301 1.00 0.00 C ATOM 367 CG ARG A 20 1.165 -15.022 2.474 1.00 0.00 C ATOM 368 CD ARG A 20 2.699 -15.019 2.396 1.00 0.00 C ATOM 369 NE ARG A 20 3.274 -15.598 3.623 1.00 0.00 N ATOM 370 CZ ARG A 20 4.512 -16.023 3.813 1.00 0.00 C ATOM 371 NH1 ARG A 20 5.453 -15.855 2.910 1.00 0.00 N ATOM 372 NH2 ARG A 20 4.819 -16.624 4.936 1.00 0.00 N ATOM 0 H ARG A 20 -1.400 -14.243 1.612 1.00 0.00 H new ATOM 0 HA ARG A 20 0.851 -14.119 -0.097 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -0.382 -16.292 1.671 1.00 0.00 H new ATOM 0 HB3 ARG A 20 1.172 -16.476 0.882 1.00 0.00 H new ATOM 0 HG2 ARG A 20 0.811 -13.992 2.510 1.00 0.00 H new ATOM 0 HG3 ARG A 20 0.859 -15.497 3.406 1.00 0.00 H new ATOM 0 HD2 ARG A 20 3.027 -15.590 1.528 1.00 0.00 H new ATOM 0 HD3 ARG A 20 3.061 -14.000 2.262 1.00 0.00 H new ATOM 0 HE ARG A 20 2.643 -15.681 4.420 1.00 0.00 H new ATOM 0 HH11 ARG A 20 5.238 -15.385 2.031 1.00 0.00 H new ATOM 0 HH12 ARG A 20 6.398 -16.195 3.089 1.00 0.00 H new ATOM 0 HH21 ARG A 20 4.106 -16.760 5.653 1.00 0.00 H new ATOM 0 HH22 ARG A 20 5.771 -16.956 5.093 1.00 0.00 H new ATOM 386 N ALA A 21 -1.638 -15.963 -1.174 1.00 0.00 N ATOM 387 CA ALA A 21 -2.173 -16.463 -2.434 1.00 0.00 C ATOM 388 C ALA A 21 -2.121 -15.369 -3.507 1.00 0.00 C ATOM 389 O ALA A 21 -1.476 -15.568 -4.535 1.00 0.00 O ATOM 390 CB ALA A 21 -3.591 -17.009 -2.234 1.00 0.00 C ATOM 0 H ALA A 21 -2.318 -15.931 -0.415 1.00 0.00 H new ATOM 0 HA ALA A 21 -1.554 -17.290 -2.783 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -3.976 -17.378 -3.184 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -3.568 -17.824 -1.510 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -4.238 -16.214 -1.865 1.00 0.00 H new ATOM 396 N TRP A 22 -2.773 -14.219 -3.283 1.00 0.00 N ATOM 397 CA TRP A 22 -2.869 -13.130 -4.255 1.00 0.00 C ATOM 398 C TRP A 22 -1.515 -12.672 -4.792 1.00 0.00 C ATOM 399 O TRP A 22 -1.450 -12.380 -5.981 1.00 0.00 O ATOM 400 CB TRP A 22 -3.613 -11.922 -3.700 1.00 0.00 C ATOM 401 CG TRP A 22 -5.020 -12.063 -3.214 1.00 0.00 C ATOM 402 CD1 TRP A 22 -5.909 -13.028 -3.539 1.00 0.00 C ATOM 403 CD2 TRP A 22 -5.721 -11.158 -2.313 1.00 0.00 C ATOM 404 NE1 TRP A 22 -7.105 -12.781 -2.893 1.00 0.00 N ATOM 405 CE2 TRP A 22 -7.052 -11.623 -2.143 1.00 0.00 C ATOM 406 CE3 TRP A 22 -5.357 -9.986 -1.619 1.00 0.00 C ATOM 407 CZ2 TRP A 22 -7.980 -10.954 -1.330 1.00 0.00 C ATOM 408 CZ3 TRP A 22 -6.281 -9.297 -0.813 1.00 0.00 C ATOM 409 CH2 TRP A 22 -7.591 -9.781 -0.662 1.00 0.00 C ATOM 0 H TRP A 22 -3.255 -14.020 -2.406 1.00 0.00 H new ATOM 0 HA TRP A 22 -3.436 -13.556 -5.083 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -3.022 -11.532 -2.871 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -3.615 -11.158 -4.478 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -5.715 -13.860 -4.199 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -7.927 -13.381 -2.962 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -4.349 -9.610 -1.708 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -8.984 -11.337 -1.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -5.982 -8.391 -0.307 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -8.296 -9.254 -0.036 1.00 0.00 H new ATOM 420 N GLU A 23 -0.451 -12.698 -3.976 1.00 0.00 N ATOM 421 CA GLU A 23 0.951 -12.507 -4.384 1.00 0.00 C ATOM 422 C GLU A 23 1.288 -13.240 -5.695 1.00 0.00 C ATOM 423 O GLU A 23 1.853 -12.637 -6.606 1.00 0.00 O ATOM 424 CB GLU A 23 1.861 -12.968 -3.225 1.00 0.00 C ATOM 425 CG GLU A 23 3.325 -12.495 -3.297 1.00 0.00 C ATOM 426 CD GLU A 23 4.329 -13.633 -3.599 1.00 0.00 C ATOM 427 OE1 GLU A 23 4.230 -14.269 -4.673 1.00 0.00 O ATOM 428 OE2 GLU A 23 5.208 -13.873 -2.732 1.00 0.00 O ATOM 0 H GLU A 23 -0.546 -12.859 -2.973 1.00 0.00 H new ATOM 0 HA GLU A 23 1.119 -11.450 -4.590 1.00 0.00 H new ATOM 0 HB2 GLU A 23 1.430 -12.616 -2.287 1.00 0.00 H new ATOM 0 HB3 GLU A 23 1.852 -14.057 -3.191 1.00 0.00 H new ATOM 0 HG2 GLU A 23 3.413 -11.730 -4.068 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.594 -12.026 -2.350 1.00 0.00 H new ATOM 435 N ARG A 24 0.849 -14.502 -5.818 1.00 0.00 N ATOM 436 CA ARG A 24 1.021 -15.363 -6.996 1.00 0.00 C ATOM 437 C ARG A 24 -0.232 -15.490 -7.875 1.00 0.00 C ATOM 438 O ARG A 24 -0.117 -15.886 -9.031 1.00 0.00 O ATOM 439 CB ARG A 24 1.523 -16.743 -6.518 1.00 0.00 C ATOM 440 CG ARG A 24 2.913 -17.051 -7.087 1.00 0.00 C ATOM 441 CD ARG A 24 3.600 -18.201 -6.337 1.00 0.00 C ATOM 442 NE ARG A 24 4.778 -17.714 -5.595 1.00 0.00 N ATOM 443 CZ ARG A 24 5.756 -18.451 -5.086 1.00 0.00 C ATOM 444 NH1 ARG A 24 5.710 -19.766 -5.086 1.00 0.00 N ATOM 445 NH2 ARG A 24 6.810 -17.871 -4.565 1.00 0.00 N ATOM 0 H ARG A 24 0.343 -14.970 -5.066 1.00 0.00 H new ATOM 0 HA ARG A 24 1.756 -14.891 -7.648 1.00 0.00 H new ATOM 0 HB2 ARG A 24 1.560 -16.763 -5.429 1.00 0.00 H new ATOM 0 HB3 ARG A 24 0.820 -17.517 -6.827 1.00 0.00 H new ATOM 0 HG2 ARG A 24 2.824 -17.309 -8.142 1.00 0.00 H new ATOM 0 HG3 ARG A 24 3.535 -16.158 -7.029 1.00 0.00 H new ATOM 0 HD2 ARG A 24 2.895 -18.663 -5.646 1.00 0.00 H new ATOM 0 HD3 ARG A 24 3.904 -18.972 -7.045 1.00 0.00 H new ATOM 0 HE ARG A 24 4.848 -16.705 -5.459 1.00 0.00 H new ATOM 0 HH11 ARG A 24 4.905 -20.248 -5.486 1.00 0.00 H new ATOM 0 HH12 ARG A 24 6.479 -20.303 -4.686 1.00 0.00 H new ATOM 0 HH21 ARG A 24 6.878 -16.853 -4.551 1.00 0.00 H new ATOM 0 HH22 ARG A 24 7.562 -18.437 -4.173 1.00 0.00 H new ATOM 459 N ARG A 25 -1.418 -15.163 -7.344 1.00 0.00 N ATOM 460 CA ARG A 25 -2.728 -15.317 -8.003 1.00 0.00 C ATOM 461 C ARG A 25 -3.140 -14.096 -8.846 1.00 0.00 C ATOM 462 O ARG A 25 -3.853 -14.276 -9.827 1.00 0.00 O ATOM 463 CB ARG A 25 -3.770 -15.654 -6.917 1.00 0.00 C ATOM 464 CG ARG A 25 -4.898 -16.618 -7.306 1.00 0.00 C ATOM 465 CD ARG A 25 -5.673 -16.958 -6.020 1.00 0.00 C ATOM 466 NE ARG A 25 -6.711 -17.984 -6.218 1.00 0.00 N ATOM 467 CZ ARG A 25 -7.417 -18.573 -5.257 1.00 0.00 C ATOM 468 NH1 ARG A 25 -7.297 -18.232 -3.992 1.00 0.00 N ATOM 469 NH2 ARG A 25 -8.266 -19.530 -5.550 1.00 0.00 N ATOM 0 H ARG A 25 -1.497 -14.768 -6.407 1.00 0.00 H new ATOM 0 HA ARG A 25 -2.662 -16.130 -8.726 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -3.243 -16.078 -6.062 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -4.223 -14.721 -6.582 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.558 -16.160 -8.043 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -4.492 -17.522 -7.760 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -4.971 -17.304 -5.262 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.138 -16.051 -5.634 1.00 0.00 H new ATOM 0 HE ARG A 25 -6.906 -18.268 -7.178 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -6.646 -17.494 -3.722 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -7.855 -18.705 -3.281 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -8.387 -19.826 -6.519 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -8.805 -19.978 -4.809 1.00 0.00 H new ATOM 483 N TYR A 26 -2.695 -12.880 -8.482 1.00 0.00 N ATOM 484 CA TYR A 26 -3.001 -11.607 -9.175 1.00 0.00 C ATOM 485 C TYR A 26 -1.872 -10.568 -9.079 1.00 0.00 C ATOM 486 O TYR A 26 -1.592 -9.864 -10.045 1.00 0.00 O ATOM 487 CB TYR A 26 -4.268 -10.949 -8.589 1.00 0.00 C ATOM 488 CG TYR A 26 -5.475 -11.856 -8.543 1.00 0.00 C ATOM 489 CD1 TYR A 26 -6.285 -12.025 -9.682 1.00 0.00 C ATOM 490 CD2 TYR A 26 -5.721 -12.606 -7.380 1.00 0.00 C ATOM 491 CE1 TYR A 26 -7.312 -12.987 -9.676 1.00 0.00 C ATOM 492 CE2 TYR A 26 -6.709 -13.602 -7.390 1.00 0.00 C ATOM 493 CZ TYR A 26 -7.502 -13.801 -8.542 1.00 0.00 C ATOM 494 OH TYR A 26 -8.447 -14.781 -8.559 1.00 0.00 O ATOM 0 H TYR A 26 -2.092 -12.748 -7.670 1.00 0.00 H new ATOM 0 HA TYR A 26 -3.139 -11.886 -10.220 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -4.049 -10.603 -7.579 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -4.513 -10.068 -9.182 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -6.118 -11.417 -10.559 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -5.152 -12.416 -6.482 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -7.953 -13.101 -10.538 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -6.863 -14.217 -6.516 1.00 0.00 H new ATOM 0 HH TYR A 26 -8.447 -15.250 -7.699 1.00 0.00 H new ATOM 504 N GLY A 27 -1.275 -10.434 -7.890 1.00 0.00 N ATOM 505 CA GLY A 27 -0.232 -9.481 -7.528 1.00 0.00 C ATOM 506 C GLY A 27 -0.665 -8.443 -6.487 1.00 0.00 C ATOM 507 O GLY A 27 0.201 -7.810 -5.904 1.00 0.00 O ATOM 0 H GLY A 27 -1.529 -11.032 -7.104 1.00 0.00 H new ATOM 0 HA2 GLY A 27 0.628 -10.029 -7.143 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.098 -8.961 -8.427 1.00 0.00 H new ATOM 511 N PHE A 28 -1.966 -8.245 -6.239 1.00 0.00 N ATOM 512 CA PHE A 28 -2.495 -7.285 -5.257 1.00 0.00 C ATOM 513 C PHE A 28 -2.558 -7.891 -3.836 1.00 0.00 C ATOM 514 O PHE A 28 -3.032 -9.014 -3.709 1.00 0.00 O ATOM 515 CB PHE A 28 -3.898 -6.869 -5.723 1.00 0.00 C ATOM 516 CG PHE A 28 -4.745 -6.104 -4.720 1.00 0.00 C ATOM 517 CD1 PHE A 28 -5.511 -6.806 -3.765 1.00 0.00 C ATOM 518 CD2 PHE A 28 -4.844 -4.703 -4.796 1.00 0.00 C ATOM 519 CE1 PHE A 28 -6.402 -6.119 -2.926 1.00 0.00 C ATOM 520 CE2 PHE A 28 -5.725 -4.014 -3.947 1.00 0.00 C ATOM 521 CZ PHE A 28 -6.515 -4.724 -3.026 1.00 0.00 C ATOM 0 H PHE A 28 -2.699 -8.760 -6.727 1.00 0.00 H new ATOM 0 HA PHE A 28 -1.831 -6.422 -5.199 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.793 -6.256 -6.618 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -4.442 -7.768 -6.014 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -5.411 -7.878 -3.679 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -4.242 -4.157 -5.508 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -6.998 -6.661 -2.207 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -5.796 -2.938 -4.002 1.00 0.00 H new ATOM 0 HZ PHE A 28 -7.211 -4.194 -2.393 1.00 0.00 H new ATOM 531 N PRO A 29 -2.185 -7.171 -2.759 1.00 0.00 N ATOM 532 CA PRO A 29 -1.422 -5.930 -2.781 1.00 0.00 C ATOM 533 C PRO A 29 0.008 -6.201 -3.244 1.00 0.00 C ATOM 534 O PRO A 29 0.629 -7.197 -2.853 1.00 0.00 O ATOM 535 CB PRO A 29 -1.441 -5.401 -1.353 1.00 0.00 C ATOM 536 CG PRO A 29 -1.616 -6.654 -0.491 1.00 0.00 C ATOM 537 CD PRO A 29 -2.383 -7.624 -1.388 1.00 0.00 C ATOM 0 HA PRO A 29 -1.848 -5.204 -3.473 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -0.517 -4.876 -1.110 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.258 -4.695 -1.200 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -0.653 -7.067 -0.189 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.169 -6.435 0.422 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.016 -8.642 -1.260 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.443 -7.632 -1.132 1.00 0.00 H new ATOM 545 N ARG A 30 0.514 -5.287 -4.079 1.00 0.00 N ATOM 546 CA ARG A 30 1.790 -5.432 -4.779 1.00 0.00 C ATOM 547 C ARG A 30 2.936 -4.850 -3.947 1.00 0.00 C ATOM 548 O ARG A 30 2.811 -3.717 -3.486 1.00 0.00 O ATOM 549 CB ARG A 30 1.706 -4.747 -6.154 1.00 0.00 C ATOM 550 CG ARG A 30 2.008 -5.699 -7.328 1.00 0.00 C ATOM 551 CD ARG A 30 3.115 -5.146 -8.227 1.00 0.00 C ATOM 552 NE ARG A 30 2.960 -5.614 -9.615 1.00 0.00 N ATOM 553 CZ ARG A 30 3.418 -4.995 -10.695 1.00 0.00 C ATOM 554 NH1 ARG A 30 4.217 -3.957 -10.606 1.00 0.00 N ATOM 555 NH2 ARG A 30 3.068 -5.407 -11.891 1.00 0.00 N ATOM 0 H ARG A 30 0.037 -4.410 -4.290 1.00 0.00 H new ATOM 0 HA ARG A 30 1.995 -6.492 -4.926 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.708 -4.327 -6.283 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.408 -3.914 -6.181 1.00 0.00 H new ATOM 0 HG2 ARG A 30 2.305 -6.673 -6.940 1.00 0.00 H new ATOM 0 HG3 ARG A 30 1.103 -5.852 -7.916 1.00 0.00 H new ATOM 0 HD2 ARG A 30 3.095 -4.056 -8.204 1.00 0.00 H new ATOM 0 HD3 ARG A 30 4.087 -5.455 -7.843 1.00 0.00 H new ATOM 0 HE ARG A 30 2.457 -6.490 -9.758 1.00 0.00 H new ATOM 0 HH11 ARG A 30 4.500 -3.608 -9.690 1.00 0.00 H new ATOM 0 HH12 ARG A 30 4.555 -3.499 -11.453 1.00 0.00 H new ATOM 0 HH21 ARG A 30 2.442 -6.206 -11.992 1.00 0.00 H new ATOM 0 HH22 ARG A 30 3.422 -4.928 -12.719 1.00 0.00 H new ATOM 569 N PRO A 31 4.024 -5.606 -3.704 1.00 0.00 N ATOM 570 CA PRO A 31 5.122 -5.135 -2.863 1.00 0.00 C ATOM 571 C PRO A 31 5.813 -3.936 -3.527 1.00 0.00 C ATOM 572 O PRO A 31 5.984 -3.922 -4.746 1.00 0.00 O ATOM 573 CB PRO A 31 6.039 -6.347 -2.672 1.00 0.00 C ATOM 574 CG PRO A 31 5.755 -7.236 -3.884 1.00 0.00 C ATOM 575 CD PRO A 31 4.296 -6.939 -4.225 1.00 0.00 C ATOM 0 HA PRO A 31 4.795 -4.769 -1.890 1.00 0.00 H new ATOM 0 HB2 PRO A 31 7.087 -6.050 -2.634 1.00 0.00 H new ATOM 0 HB3 PRO A 31 5.821 -6.866 -1.739 1.00 0.00 H new ATOM 0 HG2 PRO A 31 6.416 -6.998 -4.717 1.00 0.00 H new ATOM 0 HG3 PRO A 31 5.904 -8.290 -3.650 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.132 -6.978 -5.302 1.00 0.00 H new ATOM 0 HD3 PRO A 31 3.632 -7.677 -3.774 1.00 0.00 H new ATOM 583 N LEU A 32 6.156 -2.919 -2.722 1.00 0.00 N ATOM 584 CA LEU A 32 6.598 -1.601 -3.196 1.00 0.00 C ATOM 585 C LEU A 32 7.933 -1.637 -3.966 1.00 0.00 C ATOM 586 O LEU A 32 7.941 -1.603 -5.195 1.00 0.00 O ATOM 587 CB LEU A 32 6.647 -0.626 -2.001 1.00 0.00 C ATOM 588 CG LEU A 32 5.268 -0.164 -1.494 1.00 0.00 C ATOM 589 CD1 LEU A 32 5.452 0.636 -0.200 1.00 0.00 C ATOM 590 CD2 LEU A 32 4.549 0.725 -2.510 1.00 0.00 C ATOM 0 H LEU A 32 6.133 -2.992 -1.705 1.00 0.00 H new ATOM 0 HA LEU A 32 5.869 -1.248 -3.926 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.180 -1.105 -1.180 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.227 0.251 -2.288 1.00 0.00 H new ATOM 0 HG LEU A 32 4.663 -1.055 -1.329 1.00 0.00 H new ATOM 0 HD11 LEU A 32 4.479 0.966 0.165 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.927 0.007 0.552 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.080 1.505 -0.396 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.581 1.026 -2.109 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.152 1.611 -2.709 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.401 0.172 -3.437 1.00 0.00 H new ATOM 602 N ARG A 33 9.068 -1.659 -3.253 1.00 0.00 N ATOM 603 CA ARG A 33 10.381 -1.959 -3.841 1.00 0.00 C ATOM 604 C ARG A 33 10.555 -3.479 -4.004 1.00 0.00 C ATOM 605 O ARG A 33 9.725 -4.275 -3.565 1.00 0.00 O ATOM 606 CB ARG A 33 11.516 -1.332 -2.999 1.00 0.00 C ATOM 607 CG ARG A 33 11.589 0.198 -3.145 1.00 0.00 C ATOM 608 CD ARG A 33 12.890 0.740 -2.535 1.00 0.00 C ATOM 609 NE ARG A 33 12.924 2.216 -2.524 1.00 0.00 N ATOM 610 CZ ARG A 33 13.984 2.991 -2.318 1.00 0.00 C ATOM 611 NH1 ARG A 33 15.193 2.498 -2.170 1.00 0.00 N ATOM 612 NH2 ARG A 33 13.846 4.295 -2.252 1.00 0.00 N ATOM 0 H ARG A 33 9.101 -1.469 -2.251 1.00 0.00 H new ATOM 0 HA ARG A 33 10.436 -1.511 -4.833 1.00 0.00 H new ATOM 0 HB2 ARG A 33 11.367 -1.586 -1.950 1.00 0.00 H new ATOM 0 HB3 ARG A 33 12.469 -1.767 -3.300 1.00 0.00 H new ATOM 0 HG2 ARG A 33 11.534 0.471 -4.199 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.732 0.657 -2.652 1.00 0.00 H new ATOM 0 HD2 ARG A 33 12.995 0.368 -1.516 1.00 0.00 H new ATOM 0 HD3 ARG A 33 13.741 0.362 -3.102 1.00 0.00 H new ATOM 0 HE ARG A 33 12.038 2.693 -2.693 1.00 0.00 H new ATOM 0 HH11 ARG A 33 15.341 1.490 -2.212 1.00 0.00 H new ATOM 0 HH12 ARG A 33 15.983 3.124 -2.013 1.00 0.00 H new ATOM 0 HH21 ARG A 33 12.923 4.716 -2.359 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.662 4.887 -2.094 1.00 0.00 H new ATOM 626 N SER A 34 11.655 -3.865 -4.652 1.00 0.00 N ATOM 627 CA SER A 34 12.163 -5.234 -4.746 1.00 0.00 C ATOM 628 C SER A 34 12.663 -5.768 -3.389 1.00 0.00 C ATOM 629 O SER A 34 12.436 -5.163 -2.340 1.00 0.00 O ATOM 630 CB SER A 34 13.268 -5.250 -5.812 1.00 0.00 C ATOM 631 OG SER A 34 14.264 -4.293 -5.500 1.00 0.00 O ATOM 0 H SER A 34 12.245 -3.198 -5.150 1.00 0.00 H new ATOM 0 HA SER A 34 11.355 -5.905 -5.036 1.00 0.00 H new ATOM 0 HB2 SER A 34 13.713 -6.243 -5.869 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.841 -5.035 -6.792 1.00 0.00 H new ATOM 0 HG SER A 34 14.964 -4.314 -6.186 1.00 0.00 H new ATOM 637 N GLU A 35 13.304 -6.944 -3.395 1.00 0.00 N ATOM 638 CA GLU A 35 13.877 -7.572 -2.201 1.00 0.00 C ATOM 639 C GLU A 35 15.050 -6.776 -1.581 1.00 0.00 C ATOM 640 O GLU A 35 15.514 -5.776 -2.132 1.00 0.00 O ATOM 641 CB GLU A 35 14.311 -9.013 -2.540 1.00 0.00 C ATOM 642 CG GLU A 35 13.812 -9.991 -1.469 1.00 0.00 C ATOM 643 CD GLU A 35 14.558 -11.324 -1.531 1.00 0.00 C ATOM 644 OE1 GLU A 35 15.732 -11.330 -1.101 1.00 0.00 O ATOM 645 OE2 GLU A 35 13.939 -12.311 -1.986 1.00 0.00 O ATOM 0 H GLU A 35 13.440 -7.493 -4.244 1.00 0.00 H new ATOM 0 HA GLU A 35 13.097 -7.583 -1.439 1.00 0.00 H new ATOM 0 HB2 GLU A 35 13.915 -9.299 -3.514 1.00 0.00 H new ATOM 0 HB3 GLU A 35 15.398 -9.065 -2.610 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.941 -9.547 -0.482 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.744 -10.165 -1.603 1.00 0.00 H new ATOM 652 N GLY A 36 15.547 -7.240 -0.427 1.00 0.00 N ATOM 653 CA GLY A 36 16.578 -6.576 0.372 1.00 0.00 C ATOM 654 C GLY A 36 16.144 -6.383 1.829 1.00 0.00 C ATOM 655 O GLY A 36 15.189 -7.003 2.293 1.00 0.00 O ATOM 0 H GLY A 36 15.230 -8.117 -0.013 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.494 -7.165 0.342 1.00 0.00 H new ATOM 0 HA3 GLY A 36 16.809 -5.606 -0.069 1.00 0.00 H new ATOM 659 N ASN A 37 16.868 -5.526 2.564 1.00 0.00 N ATOM 660 CA ASN A 37 16.628 -5.268 3.992 1.00 0.00 C ATOM 661 C ASN A 37 15.222 -4.717 4.275 1.00 0.00 C ATOM 662 O ASN A 37 14.636 -5.002 5.317 1.00 0.00 O ATOM 663 CB ASN A 37 17.662 -4.264 4.533 1.00 0.00 C ATOM 664 CG ASN A 37 19.092 -4.595 4.145 1.00 0.00 C ATOM 665 OD1 ASN A 37 19.667 -5.574 4.583 1.00 0.00 O ATOM 666 ND2 ASN A 37 19.695 -3.795 3.287 1.00 0.00 N ATOM 0 H ASN A 37 17.644 -4.987 2.180 1.00 0.00 H new ATOM 0 HA ASN A 37 16.721 -6.231 4.494 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.416 -3.268 4.165 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.588 -4.229 5.620 1.00 0.00 H new ATOM 0 HD21 ASN A 37 20.649 -3.995 2.987 1.00 0.00 H new ATOM 0 HD22 ASN A 37 19.207 -2.976 2.924 1.00 0.00 H new ATOM 673 N ASN A 38 14.687 -3.902 3.359 1.00 0.00 N ATOM 674 CA ASN A 38 13.337 -3.370 3.452 1.00 0.00 C ATOM 675 C ASN A 38 12.344 -4.497 3.136 1.00 0.00 C ATOM 676 O ASN A 38 12.119 -4.822 1.971 1.00 0.00 O ATOM 677 CB ASN A 38 13.189 -2.137 2.536 1.00 0.00 C ATOM 678 CG ASN A 38 12.368 -1.037 3.191 1.00 0.00 C ATOM 679 OD1 ASN A 38 12.847 0.061 3.420 1.00 0.00 O ATOM 680 ND2 ASN A 38 11.120 -1.288 3.532 1.00 0.00 N ATOM 0 H ASN A 38 15.190 -3.594 2.527 1.00 0.00 H new ATOM 0 HA ASN A 38 13.120 -3.018 4.461 1.00 0.00 H new ATOM 0 HB2 ASN A 38 14.177 -1.751 2.285 1.00 0.00 H new ATOM 0 HB3 ASN A 38 12.715 -2.435 1.601 1.00 0.00 H new ATOM 0 HD21 ASN A 38 10.560 -0.566 3.985 1.00 0.00 H new ATOM 0 HD22 ASN A 38 10.714 -2.204 3.343 1.00 0.00 H new ATOM 687 N TYR A 39 11.768 -5.103 4.181 1.00 0.00 N ATOM 688 CA TYR A 39 10.761 -6.164 4.064 1.00 0.00 C ATOM 689 C TYR A 39 9.577 -5.731 3.179 1.00 0.00 C ATOM 690 O TYR A 39 9.377 -4.535 2.956 1.00 0.00 O ATOM 691 CB TYR A 39 10.258 -6.565 5.465 1.00 0.00 C ATOM 692 CG TYR A 39 11.285 -6.500 6.585 1.00 0.00 C ATOM 693 CD1 TYR A 39 12.485 -7.233 6.499 1.00 0.00 C ATOM 694 CD2 TYR A 39 11.060 -5.655 7.691 1.00 0.00 C ATOM 695 CE1 TYR A 39 13.460 -7.112 7.507 1.00 0.00 C ATOM 696 CE2 TYR A 39 12.029 -5.533 8.705 1.00 0.00 C ATOM 697 CZ TYR A 39 13.238 -6.256 8.608 1.00 0.00 C ATOM 698 OH TYR A 39 14.196 -6.126 9.566 1.00 0.00 O ATOM 0 H TYR A 39 11.992 -4.866 5.147 1.00 0.00 H new ATOM 0 HA TYR A 39 11.233 -7.023 3.586 1.00 0.00 H new ATOM 0 HB2 TYR A 39 9.421 -5.918 5.728 1.00 0.00 H new ATOM 0 HB3 TYR A 39 9.870 -7.582 5.413 1.00 0.00 H new ATOM 0 HD1 TYR A 39 12.657 -7.889 5.658 1.00 0.00 H new ATOM 0 HD2 TYR A 39 10.138 -5.097 7.761 1.00 0.00 H new ATOM 0 HE1 TYR A 39 14.379 -7.675 7.438 1.00 0.00 H new ATOM 0 HE2 TYR A 39 11.848 -4.889 9.553 1.00 0.00 H new ATOM 0 HH TYR A 39 13.888 -5.499 10.254 1.00 0.00 H new ATOM 708 N ARG A 40 8.754 -6.693 2.730 1.00 0.00 N ATOM 709 CA ARG A 40 7.570 -6.471 1.878 1.00 0.00 C ATOM 710 C ARG A 40 6.549 -5.531 2.524 1.00 0.00 C ATOM 711 O ARG A 40 5.631 -5.966 3.226 1.00 0.00 O ATOM 712 CB ARG A 40 6.909 -7.800 1.493 1.00 0.00 C ATOM 713 CG ARG A 40 7.757 -8.604 0.502 1.00 0.00 C ATOM 714 CD ARG A 40 7.036 -9.915 0.185 1.00 0.00 C ATOM 715 NE ARG A 40 7.969 -10.962 -0.264 1.00 0.00 N ATOM 716 CZ ARG A 40 7.615 -12.148 -0.742 1.00 0.00 C ATOM 717 NH1 ARG A 40 6.352 -12.482 -0.837 1.00 0.00 N ATOM 718 NH2 ARG A 40 8.521 -13.008 -1.136 1.00 0.00 N ATOM 0 H ARG A 40 8.897 -7.677 2.956 1.00 0.00 H new ATOM 0 HA ARG A 40 7.928 -5.983 0.972 1.00 0.00 H new ATOM 0 HB2 ARG A 40 6.742 -8.394 2.391 1.00 0.00 H new ATOM 0 HB3 ARG A 40 5.930 -7.603 1.055 1.00 0.00 H new ATOM 0 HG2 ARG A 40 7.915 -8.030 -0.411 1.00 0.00 H new ATOM 0 HG3 ARG A 40 8.741 -8.807 0.925 1.00 0.00 H new ATOM 0 HD2 ARG A 40 6.503 -10.260 1.071 1.00 0.00 H new ATOM 0 HD3 ARG A 40 6.288 -9.740 -0.588 1.00 0.00 H new ATOM 0 HE ARG A 40 8.967 -10.759 -0.203 1.00 0.00 H new ATOM 0 HH11 ARG A 40 5.628 -11.827 -0.542 1.00 0.00 H new ATOM 0 HH12 ARG A 40 6.093 -13.397 -1.206 1.00 0.00 H new ATOM 0 HH21 ARG A 40 9.511 -12.769 -1.077 1.00 0.00 H new ATOM 0 HH22 ARG A 40 8.237 -13.917 -1.502 1.00 0.00 H new ATOM 732 N VAL A 41 6.746 -4.241 2.261 1.00 0.00 N ATOM 733 CA VAL A 41 5.884 -3.125 2.630 1.00 0.00 C ATOM 734 C VAL A 41 4.958 -2.718 1.480 1.00 0.00 C ATOM 735 O VAL A 41 5.221 -2.987 0.305 1.00 0.00 O ATOM 736 CB VAL A 41 6.695 -1.911 3.136 1.00 0.00 C ATOM 737 CG1 VAL A 41 7.270 -2.166 4.535 1.00 0.00 C ATOM 738 CG2 VAL A 41 7.829 -1.491 2.191 1.00 0.00 C ATOM 0 H VAL A 41 7.571 -3.928 1.748 1.00 0.00 H new ATOM 0 HA VAL A 41 5.261 -3.473 3.454 1.00 0.00 H new ATOM 0 HB VAL A 41 5.981 -1.088 3.174 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.835 -1.293 4.861 1.00 0.00 H new ATOM 0 HG12 VAL A 41 6.455 -2.353 5.235 1.00 0.00 H new ATOM 0 HG13 VAL A 41 7.929 -3.034 4.505 1.00 0.00 H new ATOM 0 HG21 VAL A 41 8.354 -0.633 2.611 1.00 0.00 H new ATOM 0 HG22 VAL A 41 8.527 -2.320 2.069 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.413 -1.221 1.220 1.00 0.00 H new ATOM 748 N TYR A 42 3.887 -2.031 1.874 1.00 0.00 N ATOM 749 CA TYR A 42 2.729 -1.613 1.098 1.00 0.00 C ATOM 750 C TYR A 42 2.305 -0.196 1.486 1.00 0.00 C ATOM 751 O TYR A 42 2.524 0.235 2.625 1.00 0.00 O ATOM 752 CB TYR A 42 1.586 -2.575 1.426 1.00 0.00 C ATOM 753 CG TYR A 42 1.845 -4.006 1.015 1.00 0.00 C ATOM 754 CD1 TYR A 42 2.040 -4.298 -0.342 1.00 0.00 C ATOM 755 CD2 TYR A 42 1.829 -5.047 1.964 1.00 0.00 C ATOM 756 CE1 TYR A 42 2.151 -5.632 -0.753 1.00 0.00 C ATOM 757 CE2 TYR A 42 1.857 -6.383 1.528 1.00 0.00 C ATOM 758 CZ TYR A 42 2.003 -6.682 0.162 1.00 0.00 C ATOM 759 OH TYR A 42 1.911 -7.957 -0.306 1.00 0.00 O ATOM 0 H TYR A 42 3.804 -1.724 2.843 1.00 0.00 H new ATOM 0 HA TYR A 42 2.972 -1.624 0.035 1.00 0.00 H new ATOM 0 HB2 TYR A 42 1.397 -2.545 2.499 1.00 0.00 H new ATOM 0 HB3 TYR A 42 0.679 -2.225 0.933 1.00 0.00 H new ATOM 0 HD1 TYR A 42 2.104 -3.499 -1.066 1.00 0.00 H new ATOM 0 HD2 TYR A 42 1.795 -4.820 3.019 1.00 0.00 H new ATOM 0 HE1 TYR A 42 2.354 -5.854 -1.790 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.766 -7.184 2.246 1.00 0.00 H new ATOM 0 HH TYR A 42 1.467 -7.954 -1.179 1.00 0.00 H new ATOM 769 N SER A 43 1.667 0.515 0.553 1.00 0.00 N ATOM 770 CA SER A 43 1.149 1.860 0.780 1.00 0.00 C ATOM 771 C SER A 43 -0.205 1.844 1.505 1.00 0.00 C ATOM 772 O SER A 43 -0.894 0.822 1.588 1.00 0.00 O ATOM 773 CB SER A 43 1.029 2.560 -0.576 1.00 0.00 C ATOM 774 OG SER A 43 0.761 3.938 -0.420 1.00 0.00 O ATOM 0 H SER A 43 1.495 0.166 -0.390 1.00 0.00 H new ATOM 0 HA SER A 43 1.838 2.401 1.429 1.00 0.00 H new ATOM 0 HB2 SER A 43 1.953 2.428 -1.139 1.00 0.00 H new ATOM 0 HB3 SER A 43 0.233 2.096 -1.158 1.00 0.00 H new ATOM 0 HG SER A 43 0.849 4.388 -1.286 1.00 0.00 H new ATOM 780 N ARG A 44 -0.618 3.017 1.996 1.00 0.00 N ATOM 781 CA ARG A 44 -1.944 3.260 2.580 1.00 0.00 C ATOM 782 C ARG A 44 -3.069 2.985 1.580 1.00 0.00 C ATOM 783 O ARG A 44 -4.078 2.426 1.985 1.00 0.00 O ATOM 784 CB ARG A 44 -2.025 4.700 3.125 1.00 0.00 C ATOM 785 CG ARG A 44 -1.979 4.779 4.660 1.00 0.00 C ATOM 786 CD ARG A 44 -3.335 4.479 5.328 1.00 0.00 C ATOM 787 NE ARG A 44 -3.623 5.464 6.390 1.00 0.00 N ATOM 788 CZ ARG A 44 -4.589 5.433 7.300 1.00 0.00 C ATOM 789 NH1 ARG A 44 -5.442 4.441 7.377 1.00 0.00 N ATOM 790 NH2 ARG A 44 -4.710 6.419 8.159 1.00 0.00 N ATOM 0 H ARG A 44 -0.025 3.847 1.999 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.080 2.562 3.406 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -1.200 5.282 2.714 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -2.947 5.162 2.773 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -1.235 4.073 5.031 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -1.649 5.775 4.956 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.127 4.501 4.580 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.324 3.474 5.750 1.00 0.00 H new ATOM 0 HE ARG A 44 -3.000 6.271 6.429 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.376 3.660 6.725 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -6.172 4.450 8.089 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.063 7.206 8.126 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.451 6.397 8.859 1.00 0.00 H new ATOM 804 N GLU A 45 -2.886 3.328 0.302 1.00 0.00 N ATOM 805 CA GLU A 45 -3.818 3.021 -0.798 1.00 0.00 C ATOM 806 C GLU A 45 -4.006 1.507 -0.997 1.00 0.00 C ATOM 807 O GLU A 45 -5.148 1.045 -0.983 1.00 0.00 O ATOM 808 CB GLU A 45 -3.389 3.708 -2.111 1.00 0.00 C ATOM 809 CG GLU A 45 -1.877 3.596 -2.348 1.00 0.00 C ATOM 810 CD GLU A 45 -1.369 3.968 -3.735 1.00 0.00 C ATOM 811 OE1 GLU A 45 -2.162 3.906 -4.703 1.00 0.00 O ATOM 812 OE2 GLU A 45 -0.160 4.293 -3.767 1.00 0.00 O ATOM 0 H GLU A 45 -2.062 3.842 -0.010 1.00 0.00 H new ATOM 0 HA GLU A 45 -4.787 3.427 -0.510 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.922 3.257 -2.948 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.675 4.759 -2.081 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -1.371 4.230 -1.620 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.576 2.569 -2.140 1.00 0.00 H new ATOM 819 N GLU A 46 -2.918 0.721 -1.116 1.00 0.00 N ATOM 820 CA GLU A 46 -3.000 -0.743 -1.135 1.00 0.00 C ATOM 821 C GLU A 46 -3.738 -1.233 0.104 1.00 0.00 C ATOM 822 O GLU A 46 -4.715 -1.956 -0.038 1.00 0.00 O ATOM 823 CB GLU A 46 -1.632 -1.450 -1.174 1.00 0.00 C ATOM 824 CG GLU A 46 -0.978 -1.562 -2.556 1.00 0.00 C ATOM 825 CD GLU A 46 -0.068 -0.373 -2.853 1.00 0.00 C ATOM 826 OE1 GLU A 46 0.845 -0.136 -2.024 1.00 0.00 O ATOM 827 OE2 GLU A 46 -0.299 0.269 -3.896 1.00 0.00 O ATOM 0 H GLU A 46 -1.968 1.084 -1.201 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.528 -0.993 -2.055 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.950 -0.917 -0.512 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -1.751 -2.454 -0.767 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.400 -2.484 -2.610 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.753 -1.626 -3.320 1.00 0.00 H new ATOM 834 N VAL A 47 -3.300 -0.849 1.309 1.00 0.00 N ATOM 835 CA VAL A 47 -3.931 -1.292 2.558 1.00 0.00 C ATOM 836 C VAL A 47 -5.422 -0.939 2.605 1.00 0.00 C ATOM 837 O VAL A 47 -6.223 -1.805 2.954 1.00 0.00 O ATOM 838 CB VAL A 47 -3.173 -0.743 3.781 1.00 0.00 C ATOM 839 CG1 VAL A 47 -3.925 -1.001 5.096 1.00 0.00 C ATOM 840 CG2 VAL A 47 -1.808 -1.429 3.901 1.00 0.00 C ATOM 0 H VAL A 47 -2.504 -0.227 1.446 1.00 0.00 H new ATOM 0 HA VAL A 47 -3.869 -2.380 2.590 1.00 0.00 H new ATOM 0 HB VAL A 47 -3.073 0.331 3.626 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.351 -0.596 5.929 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.901 -0.517 5.058 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.058 -2.074 5.235 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -1.278 -1.035 4.768 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.950 -2.503 4.019 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -1.224 -1.237 3.001 1.00 0.00 H new ATOM 850 N GLU A 48 -5.801 0.294 2.252 1.00 0.00 N ATOM 851 CA GLU A 48 -7.185 0.774 2.199 1.00 0.00 C ATOM 852 C GLU A 48 -8.031 -0.023 1.205 1.00 0.00 C ATOM 853 O GLU A 48 -9.128 -0.456 1.561 1.00 0.00 O ATOM 854 CB GLU A 48 -7.209 2.279 1.895 1.00 0.00 C ATOM 855 CG GLU A 48 -8.638 2.838 1.805 1.00 0.00 C ATOM 856 CD GLU A 48 -8.746 4.192 2.509 1.00 0.00 C ATOM 857 OE1 GLU A 48 -8.494 5.219 1.844 1.00 0.00 O ATOM 858 OE2 GLU A 48 -9.063 4.169 3.721 1.00 0.00 O ATOM 0 H GLU A 48 -5.127 1.011 1.986 1.00 0.00 H new ATOM 0 HA GLU A 48 -7.638 0.615 3.178 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -6.662 2.812 2.672 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -6.690 2.465 0.955 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -8.925 2.945 0.759 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.336 2.133 2.256 1.00 0.00 H new ATOM 865 N ALA A 49 -7.513 -0.280 0.000 1.00 0.00 N ATOM 866 CA ALA A 49 -8.136 -1.220 -0.918 1.00 0.00 C ATOM 867 C ALA A 49 -8.247 -2.608 -0.267 1.00 0.00 C ATOM 868 O ALA A 49 -9.348 -3.122 -0.108 1.00 0.00 O ATOM 869 CB ALA A 49 -7.354 -1.234 -2.234 1.00 0.00 C ATOM 0 H ALA A 49 -6.662 0.154 -0.357 1.00 0.00 H new ATOM 0 HA ALA A 49 -9.155 -0.908 -1.147 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -7.818 -1.938 -2.925 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -7.362 -0.236 -2.672 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -6.325 -1.538 -2.043 1.00 0.00 H new ATOM 875 N VAL A 50 -7.132 -3.212 0.153 1.00 0.00 N ATOM 876 CA VAL A 50 -7.040 -4.584 0.672 1.00 0.00 C ATOM 877 C VAL A 50 -7.986 -4.844 1.831 1.00 0.00 C ATOM 878 O VAL A 50 -8.706 -5.835 1.783 1.00 0.00 O ATOM 879 CB VAL A 50 -5.609 -4.916 1.102 1.00 0.00 C ATOM 880 CG1 VAL A 50 -5.511 -6.260 1.833 1.00 0.00 C ATOM 881 CG2 VAL A 50 -4.684 -5.002 -0.103 1.00 0.00 C ATOM 0 H VAL A 50 -6.228 -2.740 0.141 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.337 -5.234 -0.151 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.313 -4.110 1.773 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.475 -6.446 2.115 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -6.132 -6.233 2.728 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.857 -7.058 1.176 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.674 -5.239 0.230 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.036 -5.783 -0.777 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.679 -4.046 -0.626 1.00 0.00 H new ATOM 891 N ARG A 51 -8.011 -3.990 2.864 1.00 0.00 N ATOM 892 CA ARG A 51 -8.937 -4.159 3.993 1.00 0.00 C ATOM 893 C ARG A 51 -10.396 -4.187 3.520 1.00 0.00 C ATOM 894 O ARG A 51 -11.195 -4.967 4.038 1.00 0.00 O ATOM 895 CB ARG A 51 -8.690 -3.085 5.071 1.00 0.00 C ATOM 896 CG ARG A 51 -9.072 -1.666 4.617 1.00 0.00 C ATOM 897 CD ARG A 51 -8.890 -0.599 5.698 1.00 0.00 C ATOM 898 NE ARG A 51 -10.188 0.025 6.013 1.00 0.00 N ATOM 899 CZ ARG A 51 -10.520 0.711 7.094 1.00 0.00 C ATOM 900 NH1 ARG A 51 -9.647 0.974 8.038 1.00 0.00 N ATOM 901 NH2 ARG A 51 -11.751 1.138 7.246 1.00 0.00 N ATOM 0 H ARG A 51 -7.401 -3.176 2.941 1.00 0.00 H new ATOM 0 HA ARG A 51 -8.741 -5.127 4.453 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -9.261 -3.339 5.964 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -7.637 -3.098 5.352 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -8.468 -1.398 3.750 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -10.113 -1.667 4.293 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -8.465 -1.048 6.596 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -8.185 0.160 5.357 1.00 0.00 H new ATOM 0 HE ARG A 51 -10.920 -0.086 5.311 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -8.685 0.647 7.948 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -9.931 1.505 8.861 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -12.451 0.941 6.531 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -12.008 1.667 8.079 1.00 0.00 H new ATOM 915 N ARG A 52 -10.727 -3.360 2.516 1.00 0.00 N ATOM 916 CA ARG A 52 -12.054 -3.240 1.917 1.00 0.00 C ATOM 917 C ARG A 52 -12.376 -4.484 1.099 1.00 0.00 C ATOM 918 O ARG A 52 -13.384 -5.127 1.371 1.00 0.00 O ATOM 919 CB ARG A 52 -12.111 -1.974 1.048 1.00 0.00 C ATOM 920 CG ARG A 52 -13.550 -1.491 0.853 1.00 0.00 C ATOM 921 CD ARG A 52 -13.715 -0.724 -0.471 1.00 0.00 C ATOM 922 NE ARG A 52 -14.433 0.549 -0.297 1.00 0.00 N ATOM 923 CZ ARG A 52 -15.669 0.735 0.150 1.00 0.00 C ATOM 924 NH1 ARG A 52 -16.460 -0.269 0.457 1.00 0.00 N ATOM 925 NH2 ARG A 52 -16.127 1.953 0.308 1.00 0.00 N ATOM 0 H ARG A 52 -10.046 -2.734 2.086 1.00 0.00 H new ATOM 0 HA ARG A 52 -12.804 -3.155 2.704 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -11.521 -1.185 1.514 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -11.660 -2.178 0.077 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.226 -2.346 0.866 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -13.834 -0.847 1.685 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -12.732 -0.528 -0.899 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -14.254 -1.348 -1.184 1.00 0.00 H new ATOM 0 HE ARG A 52 -13.918 1.392 -0.551 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -16.129 -1.228 0.354 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -17.404 -0.089 0.798 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -15.534 2.753 0.088 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -17.076 2.100 0.651 1.00 0.00 H new ATOM 939 N VAL A 53 -11.492 -4.841 0.160 1.00 0.00 N ATOM 940 CA VAL A 53 -11.504 -6.073 -0.635 1.00 0.00 C ATOM 941 C VAL A 53 -11.720 -7.268 0.295 1.00 0.00 C ATOM 942 O VAL A 53 -12.709 -7.976 0.159 1.00 0.00 O ATOM 943 CB VAL A 53 -10.215 -6.181 -1.495 1.00 0.00 C ATOM 944 CG1 VAL A 53 -10.100 -7.532 -2.204 1.00 0.00 C ATOM 945 CG2 VAL A 53 -10.145 -5.059 -2.549 1.00 0.00 C ATOM 0 H VAL A 53 -10.702 -4.241 -0.079 1.00 0.00 H new ATOM 0 HA VAL A 53 -12.332 -6.060 -1.344 1.00 0.00 H new ATOM 0 HB VAL A 53 -9.383 -6.081 -0.798 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.183 -7.557 -2.792 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -10.078 -8.331 -1.463 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -10.957 -7.671 -2.863 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -9.231 -5.165 -3.133 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -11.008 -5.127 -3.211 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.146 -4.090 -2.050 1.00 0.00 H new ATOM 955 N ALA A 54 -10.865 -7.453 1.299 1.00 0.00 N ATOM 956 CA ALA A 54 -10.943 -8.541 2.264 1.00 0.00 C ATOM 957 C ALA A 54 -12.227 -8.555 3.117 1.00 0.00 C ATOM 958 O ALA A 54 -12.702 -9.637 3.464 1.00 0.00 O ATOM 959 CB ALA A 54 -9.698 -8.481 3.140 1.00 0.00 C ATOM 0 H ALA A 54 -10.076 -6.829 1.466 1.00 0.00 H new ATOM 0 HA ALA A 54 -10.988 -9.475 1.704 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.730 -9.286 3.874 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.810 -8.592 2.518 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.662 -7.522 3.656 1.00 0.00 H new ATOM 965 N ARG A 55 -12.813 -7.392 3.455 1.00 0.00 N ATOM 966 CA ARG A 55 -14.144 -7.326 4.080 1.00 0.00 C ATOM 967 C ARG A 55 -15.263 -7.674 3.090 1.00 0.00 C ATOM 968 O ARG A 55 -16.162 -8.422 3.455 1.00 0.00 O ATOM 969 CB ARG A 55 -14.373 -5.958 4.747 1.00 0.00 C ATOM 970 CG ARG A 55 -15.545 -6.030 5.742 1.00 0.00 C ATOM 971 CD ARG A 55 -15.810 -4.694 6.450 1.00 0.00 C ATOM 972 NE ARG A 55 -16.867 -3.912 5.780 1.00 0.00 N ATOM 973 CZ ARG A 55 -17.383 -2.762 6.198 1.00 0.00 C ATOM 974 NH1 ARG A 55 -16.893 -2.121 7.235 1.00 0.00 N ATOM 975 NH2 ARG A 55 -18.416 -2.237 5.583 1.00 0.00 N ATOM 0 H ARG A 55 -12.381 -6.480 3.304 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.176 -8.084 4.862 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.467 -5.644 5.266 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -14.581 -5.206 3.986 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -16.446 -6.340 5.213 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.335 -6.796 6.489 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -16.099 -4.883 7.484 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.890 -4.110 6.478 1.00 0.00 H new ATOM 0 HE ARG A 55 -17.238 -4.293 4.909 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.095 -2.505 7.742 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -17.310 -1.239 7.533 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -18.827 -2.712 4.780 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -18.808 -1.353 5.908 1.00 0.00 H new ATOM 989 N LEU A 56 -15.192 -7.204 1.842 1.00 0.00 N ATOM 990 CA LEU A 56 -16.093 -7.613 0.758 1.00 0.00 C ATOM 991 C LEU A 56 -15.999 -9.128 0.470 1.00 0.00 C ATOM 992 O LEU A 56 -17.012 -9.786 0.237 1.00 0.00 O ATOM 993 CB LEU A 56 -15.782 -6.798 -0.516 1.00 0.00 C ATOM 994 CG LEU A 56 -16.670 -5.585 -0.852 1.00 0.00 C ATOM 995 CD1 LEU A 56 -18.158 -5.931 -0.856 1.00 0.00 C ATOM 996 CD2 LEU A 56 -16.426 -4.386 0.065 1.00 0.00 C ATOM 0 H LEU A 56 -14.496 -6.518 1.550 1.00 0.00 H new ATOM 0 HA LEU A 56 -17.115 -7.410 1.077 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.754 -6.444 -0.439 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.821 -7.482 -1.364 1.00 0.00 H new ATOM 0 HG LEU A 56 -16.375 -5.300 -1.862 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -18.738 -5.041 -1.099 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -18.350 -6.703 -1.601 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -18.449 -6.297 0.129 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.083 -3.566 -0.225 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -16.633 -4.669 1.097 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -15.387 -4.067 -0.022 1.00 0.00 H new ATOM 1008 N ILE A 57 -14.799 -9.715 0.533 1.00 0.00 N ATOM 1009 CA ILE A 57 -14.578 -11.165 0.442 1.00 0.00 C ATOM 1010 C ILE A 57 -15.336 -11.943 1.521 1.00 0.00 C ATOM 1011 O ILE A 57 -15.786 -13.049 1.235 1.00 0.00 O ATOM 1012 CB ILE A 57 -13.063 -11.486 0.444 1.00 0.00 C ATOM 1013 CG1 ILE A 57 -12.506 -11.558 -0.997 1.00 0.00 C ATOM 1014 CG2 ILE A 57 -12.664 -12.785 1.173 1.00 0.00 C ATOM 1015 CD1 ILE A 57 -11.552 -10.417 -1.319 1.00 0.00 C ATOM 0 H ILE A 57 -13.935 -9.185 0.651 1.00 0.00 H new ATOM 0 HA ILE A 57 -14.990 -11.501 -0.509 1.00 0.00 H new ATOM 0 HB ILE A 57 -12.627 -10.658 1.003 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -11.989 -12.508 -1.135 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -13.336 -11.542 -1.704 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -11.584 -12.917 1.116 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -12.968 -12.724 2.218 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -13.158 -13.634 0.701 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -11.194 -10.520 -2.343 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -12.073 -9.466 -1.211 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -10.705 -10.446 -0.634 1.00 0.00 H new ATOM 1027 N GLN A 58 -15.535 -11.380 2.719 1.00 0.00 N ATOM 1028 CA GLN A 58 -16.385 -12.006 3.734 1.00 0.00 C ATOM 1029 C GLN A 58 -17.859 -12.121 3.300 1.00 0.00 C ATOM 1030 O GLN A 58 -18.585 -12.913 3.896 1.00 0.00 O ATOM 1031 CB GLN A 58 -16.257 -11.275 5.091 1.00 0.00 C ATOM 1032 CG GLN A 58 -15.467 -12.049 6.158 1.00 0.00 C ATOM 1033 CD GLN A 58 -16.020 -13.444 6.437 1.00 0.00 C ATOM 1034 OE1 GLN A 58 -17.064 -13.618 7.041 1.00 0.00 O ATOM 1035 NE2 GLN A 58 -15.321 -14.490 6.035 1.00 0.00 N ATOM 0 H GLN A 58 -15.119 -10.494 3.007 1.00 0.00 H new ATOM 0 HA GLN A 58 -16.022 -13.027 3.854 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -15.774 -10.312 4.927 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -17.256 -11.069 5.475 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -14.429 -12.136 5.837 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -15.467 -11.475 7.085 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -14.446 -14.355 5.529 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -15.656 -15.433 6.231 1.00 0.00 H new ATOM 1044 N GLU A 59 -18.307 -11.388 2.268 1.00 0.00 N ATOM 1045 CA GLU A 59 -19.674 -11.491 1.744 1.00 0.00 C ATOM 1046 C GLU A 59 -19.816 -12.620 0.706 1.00 0.00 C ATOM 1047 O GLU A 59 -20.793 -13.363 0.758 1.00 0.00 O ATOM 1048 CB GLU A 59 -20.153 -10.138 1.180 1.00 0.00 C ATOM 1049 CG GLU A 59 -19.860 -8.963 2.134 1.00 0.00 C ATOM 1050 CD GLU A 59 -20.783 -7.760 1.909 1.00 0.00 C ATOM 1051 OE1 GLU A 59 -20.700 -7.154 0.819 1.00 0.00 O ATOM 1052 OE2 GLU A 59 -21.537 -7.430 2.852 1.00 0.00 O ATOM 0 H GLU A 59 -17.729 -10.707 1.775 1.00 0.00 H new ATOM 0 HA GLU A 59 -20.322 -11.754 2.580 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -19.666 -9.954 0.222 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -21.225 -10.187 0.988 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -19.963 -9.305 3.164 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -18.825 -8.648 2.005 1.00 0.00 H new ATOM 1059 N GLU A 60 -18.844 -12.781 -0.209 1.00 0.00 N ATOM 1060 CA GLU A 60 -18.873 -13.822 -1.263 1.00 0.00 C ATOM 1061 C GLU A 60 -17.516 -14.424 -1.662 1.00 0.00 C ATOM 1062 O GLU A 60 -17.466 -15.565 -2.115 1.00 0.00 O ATOM 1063 CB GLU A 60 -19.513 -13.255 -2.545 1.00 0.00 C ATOM 1064 CG GLU A 60 -21.005 -13.584 -2.659 1.00 0.00 C ATOM 1065 CD GLU A 60 -21.551 -13.100 -4.005 1.00 0.00 C ATOM 1066 OE1 GLU A 60 -21.231 -13.757 -5.023 1.00 0.00 O ATOM 1067 OE2 GLU A 60 -22.263 -12.072 -4.008 1.00 0.00 O ATOM 0 H GLU A 60 -18.011 -12.193 -0.242 1.00 0.00 H new ATOM 0 HA GLU A 60 -19.451 -14.628 -0.812 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -19.382 -12.173 -2.563 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -18.990 -13.654 -3.414 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -21.156 -14.659 -2.562 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -21.553 -13.110 -1.844 1.00 0.00 H new ATOM 1074 N GLY A 61 -16.418 -13.668 -1.577 1.00 0.00 N ATOM 1075 CA GLY A 61 -15.084 -14.112 -1.994 1.00 0.00 C ATOM 1076 C GLY A 61 -14.746 -13.805 -3.459 1.00 0.00 C ATOM 1077 O GLY A 61 -13.590 -13.519 -3.757 1.00 0.00 O ATOM 0 H GLY A 61 -16.430 -12.716 -1.211 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -14.340 -13.638 -1.354 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -15.005 -15.187 -1.833 1.00 0.00 H new ATOM 1081 N LEU A 62 -15.734 -13.750 -4.365 1.00 0.00 N ATOM 1082 CA LEU A 62 -15.567 -13.254 -5.745 1.00 0.00 C ATOM 1083 C LEU A 62 -14.876 -11.881 -5.782 1.00 0.00 C ATOM 1084 O LEU A 62 -14.048 -11.628 -6.660 1.00 0.00 O ATOM 1085 CB LEU A 62 -16.946 -13.254 -6.438 1.00 0.00 C ATOM 1086 CG LEU A 62 -17.136 -12.288 -7.628 1.00 0.00 C ATOM 1087 CD1 LEU A 62 -16.175 -12.528 -8.806 1.00 0.00 C ATOM 1088 CD2 LEU A 62 -18.573 -12.395 -8.139 1.00 0.00 C ATOM 0 H LEU A 62 -16.686 -14.053 -4.159 1.00 0.00 H new ATOM 0 HA LEU A 62 -14.902 -13.919 -6.296 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -17.148 -14.266 -6.788 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -17.701 -13.019 -5.688 1.00 0.00 H new ATOM 0 HG LEU A 62 -16.911 -11.293 -7.243 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -16.380 -11.805 -9.596 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -15.146 -12.412 -8.466 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -16.318 -13.537 -9.192 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -18.712 -11.715 -8.979 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -18.769 -13.417 -8.463 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -19.264 -12.130 -7.339 1.00 0.00 H new ATOM 1100 N SER A 63 -15.141 -11.037 -4.777 1.00 0.00 N ATOM 1101 CA SER A 63 -14.470 -9.754 -4.567 1.00 0.00 C ATOM 1102 C SER A 63 -12.941 -9.817 -4.497 1.00 0.00 C ATOM 1103 O SER A 63 -12.333 -8.760 -4.565 1.00 0.00 O ATOM 1104 CB SER A 63 -15.047 -9.021 -3.352 1.00 0.00 C ATOM 1105 OG SER A 63 -15.750 -7.878 -3.797 1.00 0.00 O ATOM 0 H SER A 63 -15.848 -11.236 -4.069 1.00 0.00 H new ATOM 0 HA SER A 63 -14.682 -9.183 -5.471 1.00 0.00 H new ATOM 0 HB2 SER A 63 -15.713 -9.680 -2.796 1.00 0.00 H new ATOM 0 HB3 SER A 63 -14.246 -8.730 -2.672 1.00 0.00 H new ATOM 0 HG SER A 63 -16.641 -7.863 -3.389 1.00 0.00 H new ATOM 1111 N VAL A 64 -12.302 -10.997 -4.474 1.00 0.00 N ATOM 1112 CA VAL A 64 -10.916 -11.149 -4.940 1.00 0.00 C ATOM 1113 C VAL A 64 -10.773 -10.530 -6.335 1.00 0.00 C ATOM 1114 O VAL A 64 -10.285 -9.412 -6.464 1.00 0.00 O ATOM 1115 CB VAL A 64 -10.473 -12.630 -4.917 1.00 0.00 C ATOM 1116 CG1 VAL A 64 -9.101 -12.814 -5.566 1.00 0.00 C ATOM 1117 CG2 VAL A 64 -10.352 -13.191 -3.499 1.00 0.00 C ATOM 0 H VAL A 64 -12.725 -11.862 -4.137 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.252 -10.617 -4.258 1.00 0.00 H new ATOM 0 HB VAL A 64 -11.251 -13.161 -5.466 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.821 -13.867 -5.532 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -9.142 -12.482 -6.603 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.361 -12.224 -5.025 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.038 -14.234 -3.546 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -9.614 -12.614 -2.941 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.318 -13.125 -2.998 1.00 0.00 H new ATOM 1127 N SER A 65 -11.208 -11.231 -7.386 1.00 0.00 N ATOM 1128 CA SER A 65 -11.021 -10.746 -8.752 1.00 0.00 C ATOM 1129 C SER A 65 -11.894 -9.520 -9.018 1.00 0.00 C ATOM 1130 O SER A 65 -11.437 -8.585 -9.666 1.00 0.00 O ATOM 1131 CB SER A 65 -11.293 -11.863 -9.764 1.00 0.00 C ATOM 1132 OG SER A 65 -10.512 -11.647 -10.920 1.00 0.00 O ATOM 0 H SER A 65 -11.688 -12.128 -7.316 1.00 0.00 H new ATOM 0 HA SER A 65 -9.982 -10.439 -8.870 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.054 -12.832 -9.326 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.351 -11.883 -10.025 1.00 0.00 H new ATOM 0 HG SER A 65 -9.609 -12.000 -10.775 1.00 0.00 H new ATOM 1138 N GLU A 66 -13.112 -9.482 -8.459 1.00 0.00 N ATOM 1139 CA GLU A 66 -14.034 -8.351 -8.604 1.00 0.00 C ATOM 1140 C GLU A 66 -13.478 -7.061 -7.993 1.00 0.00 C ATOM 1141 O GLU A 66 -13.322 -6.095 -8.730 1.00 0.00 O ATOM 1142 CB GLU A 66 -15.426 -8.707 -8.049 1.00 0.00 C ATOM 1143 CG GLU A 66 -16.484 -8.898 -9.148 1.00 0.00 C ATOM 1144 CD GLU A 66 -17.371 -7.661 -9.247 1.00 0.00 C ATOM 1145 OE1 GLU A 66 -18.327 -7.573 -8.447 1.00 0.00 O ATOM 1146 OE2 GLU A 66 -17.023 -6.754 -10.036 1.00 0.00 O ATOM 0 H GLU A 66 -13.486 -10.242 -7.890 1.00 0.00 H new ATOM 0 HA GLU A 66 -14.143 -8.152 -9.670 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.353 -9.622 -7.461 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.753 -7.918 -7.372 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -15.996 -9.082 -10.105 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -17.093 -9.775 -8.928 1.00 0.00 H new ATOM 1153 N ALA A 67 -13.145 -7.004 -6.692 1.00 0.00 N ATOM 1154 CA ALA A 67 -12.685 -5.749 -6.101 1.00 0.00 C ATOM 1155 C ALA A 67 -11.251 -5.385 -6.520 1.00 0.00 C ATOM 1156 O ALA A 67 -10.943 -4.196 -6.589 1.00 0.00 O ATOM 1157 CB ALA A 67 -12.859 -5.749 -4.584 1.00 0.00 C ATOM 0 H ALA A 67 -13.186 -7.794 -6.048 1.00 0.00 H new ATOM 0 HA ALA A 67 -13.323 -4.961 -6.502 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -12.507 -4.801 -4.177 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -13.913 -5.880 -4.339 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -12.282 -6.566 -4.152 1.00 0.00 H new ATOM 1163 N ILE A 68 -10.391 -6.362 -6.869 1.00 0.00 N ATOM 1164 CA ILE A 68 -9.107 -6.076 -7.529 1.00 0.00 C ATOM 1165 C ILE A 68 -9.363 -5.438 -8.902 1.00 0.00 C ATOM 1166 O ILE A 68 -8.880 -4.334 -9.151 1.00 0.00 O ATOM 1167 CB ILE A 68 -8.187 -7.320 -7.607 1.00 0.00 C ATOM 1168 CG1 ILE A 68 -7.769 -7.748 -6.180 1.00 0.00 C ATOM 1169 CG2 ILE A 68 -6.919 -7.005 -8.428 1.00 0.00 C ATOM 1170 CD1 ILE A 68 -7.115 -9.137 -6.085 1.00 0.00 C ATOM 0 H ILE A 68 -10.564 -7.354 -6.704 1.00 0.00 H new ATOM 0 HA ILE A 68 -8.558 -5.359 -6.918 1.00 0.00 H new ATOM 0 HB ILE A 68 -8.737 -8.126 -8.093 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -7.074 -7.008 -5.783 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -8.651 -7.733 -5.539 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -6.285 -7.890 -8.472 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -7.203 -6.712 -9.439 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -6.372 -6.190 -7.954 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -6.857 -9.348 -5.047 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -7.812 -9.893 -6.446 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -6.211 -9.156 -6.694 1.00 0.00 H new ATOM 1182 N ALA A 69 -10.134 -6.086 -9.787 1.00 0.00 N ATOM 1183 CA ALA A 69 -10.457 -5.523 -11.096 1.00 0.00 C ATOM 1184 C ALA A 69 -11.172 -4.170 -10.980 1.00 0.00 C ATOM 1185 O ALA A 69 -10.800 -3.254 -11.705 1.00 0.00 O ATOM 1186 CB ALA A 69 -11.265 -6.522 -11.930 1.00 0.00 C ATOM 0 H ALA A 69 -10.545 -7.004 -9.614 1.00 0.00 H new ATOM 0 HA ALA A 69 -9.518 -5.333 -11.615 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -11.495 -6.083 -12.901 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.683 -7.432 -12.072 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -12.193 -6.762 -11.411 1.00 0.00 H new ATOM 1192 N GLN A 70 -12.118 -4.007 -10.044 1.00 0.00 N ATOM 1193 CA GLN A 70 -12.729 -2.719 -9.711 1.00 0.00 C ATOM 1194 C GLN A 70 -11.663 -1.696 -9.321 1.00 0.00 C ATOM 1195 O GLN A 70 -11.490 -0.740 -10.062 1.00 0.00 O ATOM 1196 CB GLN A 70 -13.784 -2.843 -8.609 1.00 0.00 C ATOM 1197 CG GLN A 70 -15.105 -3.462 -9.090 1.00 0.00 C ATOM 1198 CD GLN A 70 -15.981 -3.896 -7.915 1.00 0.00 C ATOM 1199 OE1 GLN A 70 -15.981 -3.304 -6.845 1.00 0.00 O ATOM 1200 NE2 GLN A 70 -16.757 -4.945 -8.063 1.00 0.00 N ATOM 0 H GLN A 70 -12.484 -4.781 -9.490 1.00 0.00 H new ATOM 0 HA GLN A 70 -13.240 -2.369 -10.608 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -13.381 -3.451 -7.799 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -13.985 -1.854 -8.197 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -15.646 -2.739 -9.701 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -14.895 -4.322 -9.726 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -16.769 -5.450 -8.949 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -17.348 -5.255 -7.292 1.00 0.00 H new ATOM 1209 N VAL A 71 -10.914 -1.879 -8.224 1.00 0.00 N ATOM 1210 CA VAL A 71 -9.959 -0.853 -7.768 1.00 0.00 C ATOM 1211 C VAL A 71 -8.859 -0.551 -8.804 1.00 0.00 C ATOM 1212 O VAL A 71 -8.329 0.557 -8.819 1.00 0.00 O ATOM 1213 CB VAL A 71 -9.396 -1.190 -6.369 1.00 0.00 C ATOM 1214 CG1 VAL A 71 -8.191 -2.141 -6.392 1.00 0.00 C ATOM 1215 CG2 VAL A 71 -9.013 0.091 -5.618 1.00 0.00 C ATOM 0 H VAL A 71 -10.948 -2.715 -7.641 1.00 0.00 H new ATOM 0 HA VAL A 71 -10.517 0.078 -7.669 1.00 0.00 H new ATOM 0 HB VAL A 71 -10.201 -1.711 -5.852 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -7.855 -2.328 -5.372 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -8.480 -3.083 -6.857 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -7.381 -1.688 -6.963 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -8.619 -0.167 -4.635 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -8.253 0.631 -6.183 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -9.894 0.721 -5.501 1.00 0.00 H new ATOM 1225 N LYS A 72 -8.546 -1.497 -9.707 1.00 0.00 N ATOM 1226 CA LYS A 72 -7.644 -1.277 -10.849 1.00 0.00 C ATOM 1227 C LYS A 72 -8.297 -0.596 -12.063 1.00 0.00 C ATOM 1228 O LYS A 72 -7.598 0.121 -12.774 1.00 0.00 O ATOM 1229 CB LYS A 72 -7.019 -2.604 -11.296 1.00 0.00 C ATOM 1230 CG LYS A 72 -6.045 -3.206 -10.262 1.00 0.00 C ATOM 1231 CD LYS A 72 -4.688 -3.606 -10.856 1.00 0.00 C ATOM 1232 CE LYS A 72 -4.825 -4.603 -12.018 1.00 0.00 C ATOM 1233 NZ LYS A 72 -4.525 -3.971 -13.327 1.00 0.00 N ATOM 0 H LYS A 72 -8.917 -2.446 -9.663 1.00 0.00 H new ATOM 0 HA LYS A 72 -6.884 -0.587 -10.481 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.815 -3.322 -11.495 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.488 -2.448 -12.235 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -5.883 -2.482 -9.463 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -6.506 -4.083 -9.809 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -4.171 -2.713 -11.207 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -4.069 -4.046 -10.075 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -4.150 -5.443 -11.857 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -5.838 -5.006 -12.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -4.181 -4.694 -13.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -5.389 -3.534 -13.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -3.795 -3.241 -13.201 1.00 0.00 H new ATOM 1247 N THR A 73 -9.581 -0.849 -12.347 1.00 0.00 N ATOM 1248 CA THR A 73 -10.335 -0.232 -13.458 1.00 0.00 C ATOM 1249 C THR A 73 -10.988 1.103 -13.054 1.00 0.00 C ATOM 1250 O THR A 73 -11.352 1.906 -13.911 1.00 0.00 O ATOM 1251 CB THR A 73 -11.354 -1.239 -14.034 1.00 0.00 C ATOM 1252 OG1 THR A 73 -11.582 -0.994 -15.400 1.00 0.00 O ATOM 1253 CG2 THR A 73 -12.724 -1.262 -13.353 1.00 0.00 C ATOM 0 H THR A 73 -10.142 -1.503 -11.801 1.00 0.00 H new ATOM 0 HA THR A 73 -9.628 0.018 -14.249 1.00 0.00 H new ATOM 0 HB THR A 73 -10.881 -2.204 -13.852 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.229 -1.644 -15.745 1.00 0.00 H new ATOM 0 HG21 THR A 73 -13.359 -2.004 -13.837 1.00 0.00 H new ATOM 0 HG22 THR A 73 -12.603 -1.519 -12.301 1.00 0.00 H new ATOM 0 HG23 THR A 73 -13.188 -0.279 -13.435 1.00 0.00 H new ATOM 1261 N GLU A 74 -11.111 1.357 -11.746 1.00 0.00 N ATOM 1262 CA GLU A 74 -11.526 2.621 -11.145 1.00 0.00 C ATOM 1263 C GLU A 74 -10.558 3.779 -11.465 1.00 0.00 C ATOM 1264 O GLU A 74 -9.390 3.558 -11.795 1.00 0.00 O ATOM 1265 CB GLU A 74 -11.654 2.453 -9.614 1.00 0.00 C ATOM 1266 CG GLU A 74 -13.080 2.081 -9.184 1.00 0.00 C ATOM 1267 CD GLU A 74 -13.273 2.324 -7.684 1.00 0.00 C ATOM 1268 OE1 GLU A 74 -12.967 1.398 -6.899 1.00 0.00 O ATOM 1269 OE2 GLU A 74 -13.719 3.443 -7.345 1.00 0.00 O ATOM 0 H GLU A 74 -10.912 0.645 -11.044 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.492 2.882 -11.578 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.963 1.681 -9.277 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.360 3.381 -9.123 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -13.801 2.671 -9.749 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -13.274 1.034 -9.416 1.00 0.00 H new ATOM 1276 N PRO A 75 -11.024 5.038 -11.343 1.00 0.00 N ATOM 1277 CA PRO A 75 -10.203 6.209 -11.620 1.00 0.00 C ATOM 1278 C PRO A 75 -9.133 6.413 -10.525 1.00 0.00 C ATOM 1279 O PRO A 75 -9.485 6.488 -9.345 1.00 0.00 O ATOM 1280 CB PRO A 75 -11.185 7.379 -11.707 1.00 0.00 C ATOM 1281 CG PRO A 75 -12.380 6.946 -10.857 1.00 0.00 C ATOM 1282 CD PRO A 75 -12.376 5.423 -10.954 1.00 0.00 C ATOM 0 HA PRO A 75 -9.639 6.107 -12.547 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -10.740 8.298 -11.326 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -11.481 7.572 -12.738 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -12.276 7.280 -9.825 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -13.311 7.367 -11.236 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -12.649 4.972 -10.000 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -13.104 5.079 -11.688 1.00 0.00 H new ATOM 1290 N PRO A 76 -7.838 6.538 -10.880 1.00 0.00 N ATOM 1291 CA PRO A 76 -6.764 6.738 -9.909 1.00 0.00 C ATOM 1292 C PRO A 76 -6.840 8.131 -9.270 1.00 0.00 C ATOM 1293 O PRO A 76 -7.136 9.125 -9.941 1.00 0.00 O ATOM 1294 CB PRO A 76 -5.463 6.543 -10.695 1.00 0.00 C ATOM 1295 CG PRO A 76 -5.840 6.943 -12.121 1.00 0.00 C ATOM 1296 CD PRO A 76 -7.301 6.509 -12.233 1.00 0.00 C ATOM 0 HA PRO A 76 -6.835 6.035 -9.079 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.660 7.167 -10.303 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -5.116 5.511 -10.647 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -5.725 8.015 -12.282 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -5.214 6.441 -12.859 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -7.857 7.180 -12.887 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -7.379 5.510 -12.661 1.00 0.00 H new ATOM 1304 N ARG A 77 -6.542 8.211 -7.965 1.00 0.00 N ATOM 1305 CA ARG A 77 -6.542 9.465 -7.208 1.00 0.00 C ATOM 1306 C ARG A 77 -5.578 9.384 -6.025 1.00 0.00 C ATOM 1307 O ARG A 77 -5.729 8.511 -5.174 1.00 0.00 O ATOM 1308 CB ARG A 77 -7.986 9.777 -6.757 1.00 0.00 C ATOM 1309 CG ARG A 77 -8.272 11.278 -6.617 1.00 0.00 C ATOM 1310 CD ARG A 77 -8.163 11.981 -7.979 1.00 0.00 C ATOM 1311 NE ARG A 77 -8.778 13.319 -7.967 1.00 0.00 N ATOM 1312 CZ ARG A 77 -8.835 14.151 -8.999 1.00 0.00 C ATOM 1313 NH1 ARG A 77 -8.295 13.847 -10.158 1.00 0.00 N ATOM 1314 NH2 ARG A 77 -9.442 15.309 -8.885 1.00 0.00 N ATOM 0 H ARG A 77 -6.292 7.397 -7.403 1.00 0.00 H new ATOM 0 HA ARG A 77 -6.192 10.280 -7.841 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -8.684 9.348 -7.476 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -8.173 9.289 -5.801 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -9.270 11.426 -6.205 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -7.567 11.724 -5.915 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -7.113 12.069 -8.257 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -8.645 11.369 -8.741 1.00 0.00 H new ATOM 0 HE ARG A 77 -9.196 13.633 -7.091 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -7.818 12.954 -10.280 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -8.353 14.504 -10.936 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -9.873 15.574 -7.999 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -9.482 15.944 -9.682 1.00 0.00 H new ATOM 1328 N GLU A 78 -4.596 10.288 -5.997 1.00 0.00 N ATOM 1329 CA GLU A 78 -3.506 10.347 -5.016 1.00 0.00 C ATOM 1330 C GLU A 78 -3.335 11.784 -4.505 1.00 0.00 C ATOM 1331 O GLU A 78 -3.199 12.683 -5.367 1.00 0.00 O ATOM 1332 CB GLU A 78 -2.230 9.781 -5.672 1.00 0.00 C ATOM 1333 CG GLU A 78 -1.223 9.191 -4.673 1.00 0.00 C ATOM 1334 CD GLU A 78 -0.036 8.535 -5.402 1.00 0.00 C ATOM 1335 OE1 GLU A 78 -0.283 7.637 -6.238 1.00 0.00 O ATOM 1336 OE2 GLU A 78 1.113 8.963 -5.142 1.00 0.00 O ATOM 1337 OXT GLU A 78 -3.425 11.964 -3.271 1.00 0.00 O ATOM 0 H GLU A 78 -4.535 11.034 -6.689 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.732 9.738 -4.141 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.513 9.008 -6.386 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.742 10.575 -6.238 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.858 9.978 -4.013 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -1.720 8.452 -4.044 1.00 0.00 H new TER 1344 GLU A 78