USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1024 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 24 THR OG1 : rot 161:sc= 1.03 USER MOD Set 1.2: A 94 THR OG1 : rot 180:sc= 0.35 USER MOD Set 1.3: A 95 GLN : amide:sc= 0.463 K(o=1.8,f=-1.8) USER MOD Set 2.1: A 55 CYS SG : rot 171:sc= -1.94 USER MOD Set 2.2: A 73 HIS : no HD1:sc= -1.17 X(o=-3.1,f=-3) USER MOD Set 3.1: A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 45 GLN : amide:sc=-0.00192 K(o=0.0052,f=-0.66) USER MOD Set 3.3: A 92 SER OG : rot 121:sc= 0.00713 USER MOD Single : A 1 GLY N :NH3+ -179:sc= -0.524 (180deg=-0.534) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -151:sc= -8.16! (180deg=-10.9!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= -0.231 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0.179 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 CYS SG : rot -150:sc= -0.305 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 TYR OH : rot 32:sc= -2.75! USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.565! USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.019 X(o=-0.019,f=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= -1.02 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0.195 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 CYS SG : rot 180:sc= -0.392 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.0467 K(o=-0.047,f=-1.8) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ -131:sc= -0.52 (180deg=-1.5) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 114 CYS SG : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl -164:sc= -10.1! (180deg=-10.6!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot -15:sc= 1.79 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.871 14.676 15.409 1.00 0.00 N ATOM 2 CA GLY A 1 -15.297 14.782 16.739 1.00 0.00 C ATOM 3 C GLY A 1 -14.721 16.179 16.978 1.00 0.00 C ATOM 4 O GLY A 1 -14.941 17.090 16.181 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.270 13.725 15.278 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.623 15.385 15.298 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.131 14.842 14.697 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.060 14.567 17.487 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.512 14.035 16.861 1.00 0.00 H new ATOM 8 N SER A 2 -13.996 16.305 18.080 1.00 0.00 N ATOM 9 CA SER A 2 -13.388 17.576 18.435 1.00 0.00 C ATOM 10 C SER A 2 -12.264 17.910 17.451 1.00 0.00 C ATOM 11 O SER A 2 -12.295 18.952 16.799 1.00 0.00 O ATOM 12 CB SER A 2 -12.849 17.549 19.866 1.00 0.00 C ATOM 13 OG SER A 2 -13.842 17.138 20.802 1.00 0.00 O ATOM 0 H SER A 2 -13.816 15.547 18.739 1.00 0.00 H new ATOM 0 HA SER A 2 -14.154 18.349 18.379 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.997 16.871 19.920 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.485 18.541 20.135 1.00 0.00 H new ATOM 0 HG SER A 2 -13.459 17.132 21.704 1.00 0.00 H new ATOM 19 N SER A 3 -11.298 17.006 17.376 1.00 0.00 N ATOM 20 CA SER A 3 -10.167 17.192 16.484 1.00 0.00 C ATOM 21 C SER A 3 -9.240 15.976 16.554 1.00 0.00 C ATOM 22 O SER A 3 -9.047 15.399 17.623 1.00 0.00 O ATOM 23 CB SER A 3 -9.396 18.467 16.830 1.00 0.00 C ATOM 24 OG SER A 3 -9.185 19.290 15.686 1.00 0.00 O ATOM 0 H SER A 3 -11.276 16.143 17.919 1.00 0.00 H new ATOM 0 HA SER A 3 -10.547 17.294 15.467 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.945 19.029 17.585 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.434 18.201 17.268 1.00 0.00 H new ATOM 0 HG SER A 3 -8.691 20.095 15.949 1.00 0.00 H new ATOM 30 N GLY A 4 -8.692 15.623 15.400 1.00 0.00 N ATOM 31 CA GLY A 4 -7.790 14.487 15.317 1.00 0.00 C ATOM 32 C GLY A 4 -7.097 14.436 13.954 1.00 0.00 C ATOM 33 O GLY A 4 -7.597 13.808 13.022 1.00 0.00 O ATOM 0 H GLY A 4 -8.855 16.104 14.515 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.042 14.553 16.107 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.346 13.564 15.481 1.00 0.00 H new ATOM 37 N SER A 5 -5.956 15.105 13.881 1.00 0.00 N ATOM 38 CA SER A 5 -5.188 15.144 12.648 1.00 0.00 C ATOM 39 C SER A 5 -3.696 15.008 12.956 1.00 0.00 C ATOM 40 O SER A 5 -3.127 15.835 13.667 1.00 0.00 O ATOM 41 CB SER A 5 -5.455 16.437 11.874 1.00 0.00 C ATOM 42 OG SER A 5 -4.840 16.426 10.589 1.00 0.00 O ATOM 0 H SER A 5 -5.544 15.625 14.656 1.00 0.00 H new ATOM 0 HA SER A 5 -5.501 14.307 12.023 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.530 16.576 11.760 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.083 17.286 12.447 1.00 0.00 H new ATOM 0 HG SER A 5 -5.035 17.267 10.126 1.00 0.00 H new ATOM 48 N SER A 6 -3.104 13.958 12.406 1.00 0.00 N ATOM 49 CA SER A 6 -1.689 13.703 12.613 1.00 0.00 C ATOM 50 C SER A 6 -0.974 13.594 11.264 1.00 0.00 C ATOM 51 O SER A 6 -0.131 14.427 10.936 1.00 0.00 O ATOM 52 CB SER A 6 -1.473 12.429 13.432 1.00 0.00 C ATOM 53 OG SER A 6 -0.788 12.690 14.654 1.00 0.00 O ATOM 0 H SER A 6 -3.579 13.274 11.817 1.00 0.00 H new ATOM 0 HA SER A 6 -1.269 14.539 13.173 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.437 11.969 13.648 1.00 0.00 H new ATOM 0 HB3 SER A 6 -0.902 11.711 12.843 1.00 0.00 H new ATOM 0 HG SER A 6 -0.671 11.852 15.149 1.00 0.00 H new ATOM 59 N GLY A 7 -1.338 12.560 10.520 1.00 0.00 N ATOM 60 CA GLY A 7 -0.742 12.331 9.214 1.00 0.00 C ATOM 61 C GLY A 7 -0.855 10.860 8.810 1.00 0.00 C ATOM 62 O GLY A 7 -1.864 10.445 8.242 1.00 0.00 O ATOM 0 H GLY A 7 -2.038 11.871 10.796 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.237 12.955 8.470 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.307 12.627 9.232 1.00 0.00 H new ATOM 66 N ILE A 8 0.194 10.112 9.118 1.00 0.00 N ATOM 67 CA ILE A 8 0.225 8.696 8.794 1.00 0.00 C ATOM 68 C ILE A 8 -0.997 8.010 9.409 1.00 0.00 C ATOM 69 O ILE A 8 -1.687 8.594 10.242 1.00 0.00 O ATOM 70 CB ILE A 8 1.558 8.078 9.220 1.00 0.00 C ATOM 71 CG1 ILE A 8 2.556 8.075 8.061 1.00 0.00 C ATOM 72 CG2 ILE A 8 1.351 6.678 9.802 1.00 0.00 C ATOM 73 CD1 ILE A 8 3.504 9.273 8.151 1.00 0.00 C ATOM 0 H ILE A 8 1.029 10.460 9.589 1.00 0.00 H new ATOM 0 HA ILE A 8 0.163 8.550 7.716 1.00 0.00 H new ATOM 0 HB ILE A 8 1.985 8.696 10.010 1.00 0.00 H new ATOM 0 HG12 ILE A 8 3.132 7.149 8.074 1.00 0.00 H new ATOM 0 HG13 ILE A 8 2.018 8.102 7.113 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.314 6.261 10.097 1.00 0.00 H new ATOM 0 HG22 ILE A 8 0.699 6.739 10.674 1.00 0.00 H new ATOM 0 HG23 ILE A 8 0.892 6.036 9.050 1.00 0.00 H new ATOM 0 HD11 ILE A 8 4.203 9.247 7.315 1.00 0.00 H new ATOM 0 HD12 ILE A 8 2.927 10.197 8.113 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.058 9.229 9.089 1.00 0.00 H new ATOM 85 N VAL A 9 -1.226 6.779 8.974 1.00 0.00 N ATOM 86 CA VAL A 9 -2.351 6.007 9.471 1.00 0.00 C ATOM 87 C VAL A 9 -1.830 4.794 10.245 1.00 0.00 C ATOM 88 O VAL A 9 -2.137 4.627 11.424 1.00 0.00 O ATOM 89 CB VAL A 9 -3.277 5.626 8.314 1.00 0.00 C ATOM 90 CG1 VAL A 9 -4.301 4.578 8.754 1.00 0.00 C ATOM 91 CG2 VAL A 9 -3.970 6.862 7.736 1.00 0.00 C ATOM 0 H VAL A 9 -0.651 6.298 8.283 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.947 6.603 10.163 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.665 5.186 7.526 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -4.947 4.325 7.913 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -3.782 3.683 9.095 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.905 4.979 9.568 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -4.622 6.563 6.915 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.563 7.344 8.514 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -3.219 7.561 7.367 1.00 0.00 H new ATOM 101 N MET A 10 -1.052 3.979 9.549 1.00 0.00 N ATOM 102 CA MET A 10 -0.486 2.786 10.155 1.00 0.00 C ATOM 103 C MET A 10 0.699 2.266 9.339 1.00 0.00 C ATOM 104 O MET A 10 0.725 2.404 8.117 1.00 0.00 O ATOM 105 CB MET A 10 -1.560 1.700 10.245 1.00 0.00 C ATOM 106 CG MET A 10 -1.489 0.757 9.042 1.00 0.00 C ATOM 107 SD MET A 10 -2.863 -0.381 9.076 1.00 0.00 S ATOM 108 CE MET A 10 -2.204 -1.630 10.166 1.00 0.00 C ATOM 0 H MET A 10 -0.800 4.121 8.571 1.00 0.00 H new ATOM 0 HA MET A 10 -0.131 3.042 11.153 1.00 0.00 H new ATOM 0 HB2 MET A 10 -1.431 1.131 11.166 1.00 0.00 H new ATOM 0 HB3 MET A 10 -2.546 2.162 10.292 1.00 0.00 H new ATOM 0 HG2 MET A 10 -1.506 1.333 8.117 1.00 0.00 H new ATOM 0 HG3 MET A 10 -0.549 0.205 9.057 1.00 0.00 H new ATOM 0 HE1 MET A 10 -2.640 -2.597 9.917 1.00 0.00 H new ATOM 0 HE2 MET A 10 -1.121 -1.680 10.050 1.00 0.00 H new ATOM 0 HE3 MET A 10 -2.447 -1.377 11.198 1.00 0.00 H new ATOM 118 N ALA A 11 1.653 1.679 10.048 1.00 0.00 N ATOM 119 CA ALA A 11 2.838 1.137 9.404 1.00 0.00 C ATOM 120 C ALA A 11 3.192 -0.206 10.045 1.00 0.00 C ATOM 121 O ALA A 11 3.262 -0.315 11.268 1.00 0.00 O ATOM 122 CB ALA A 11 3.980 2.150 9.504 1.00 0.00 C ATOM 0 H ALA A 11 1.629 1.567 11.062 1.00 0.00 H new ATOM 0 HA ALA A 11 2.652 0.958 8.345 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.869 1.745 9.021 1.00 0.00 H new ATOM 0 HB2 ALA A 11 3.689 3.076 9.009 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.197 2.352 10.553 1.00 0.00 H new ATOM 128 N ASP A 12 3.405 -1.196 9.190 1.00 0.00 N ATOM 129 CA ASP A 12 3.750 -2.527 9.658 1.00 0.00 C ATOM 130 C ASP A 12 4.504 -3.271 8.553 1.00 0.00 C ATOM 131 O ASP A 12 4.592 -2.791 7.424 1.00 0.00 O ATOM 132 CB ASP A 12 2.496 -3.334 9.999 1.00 0.00 C ATOM 133 CG ASP A 12 2.714 -4.482 10.987 1.00 0.00 C ATOM 134 OD1 ASP A 12 3.485 -5.398 10.630 1.00 0.00 O ATOM 135 OD2 ASP A 12 2.104 -4.417 12.076 1.00 0.00 O ATOM 0 H ASP A 12 3.345 -1.102 8.176 1.00 0.00 H new ATOM 0 HA ASP A 12 4.365 -2.421 10.552 1.00 0.00 H new ATOM 0 HB2 ASP A 12 1.748 -2.657 10.411 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.083 -3.742 9.077 1.00 0.00 H new ATOM 140 N TRP A 13 5.029 -4.432 8.918 1.00 0.00 N ATOM 141 CA TRP A 13 5.772 -5.247 7.972 1.00 0.00 C ATOM 142 C TRP A 13 4.776 -6.145 7.236 1.00 0.00 C ATOM 143 O TRP A 13 4.259 -7.104 7.808 1.00 0.00 O ATOM 144 CB TRP A 13 6.878 -6.034 8.677 1.00 0.00 C ATOM 145 CG TRP A 13 7.972 -5.158 9.291 1.00 0.00 C ATOM 146 CD1 TRP A 13 8.005 -4.617 10.517 1.00 0.00 C ATOM 147 CD2 TRP A 13 9.198 -4.741 8.654 1.00 0.00 C ATOM 148 NE1 TRP A 13 9.157 -3.884 10.715 1.00 0.00 N ATOM 149 CE2 TRP A 13 9.906 -3.962 9.547 1.00 0.00 C ATOM 150 CE3 TRP A 13 9.692 -5.013 7.366 1.00 0.00 C ATOM 151 CZ2 TRP A 13 11.149 -3.391 9.248 1.00 0.00 C ATOM 152 CZ3 TRP A 13 10.935 -4.434 7.083 1.00 0.00 C ATOM 153 CH2 TRP A 13 11.661 -3.648 7.971 1.00 0.00 C ATOM 0 H TRP A 13 4.954 -4.827 9.855 1.00 0.00 H new ATOM 0 HA TRP A 13 6.282 -4.620 7.240 1.00 0.00 H new ATOM 0 HB2 TRP A 13 6.432 -6.644 9.463 1.00 0.00 H new ATOM 0 HB3 TRP A 13 7.334 -6.719 7.962 1.00 0.00 H new ATOM 0 HD1 TRP A 13 7.228 -4.739 11.257 1.00 0.00 H new ATOM 0 HE1 TRP A 13 9.412 -3.378 11.563 1.00 0.00 H new ATOM 0 HE3 TRP A 13 9.155 -5.620 6.652 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 11.684 -2.785 9.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.360 -4.610 6.106 1.00 0.00 H new ATOM 0 HH2 TRP A 13 12.616 -3.238 7.677 1.00 0.00 H new ATOM 164 N LEU A 14 4.536 -5.802 5.979 1.00 0.00 N ATOM 165 CA LEU A 14 3.610 -6.565 5.159 1.00 0.00 C ATOM 166 C LEU A 14 4.397 -7.356 4.111 1.00 0.00 C ATOM 167 O LEU A 14 5.477 -6.940 3.696 1.00 0.00 O ATOM 168 CB LEU A 14 2.542 -5.648 4.562 1.00 0.00 C ATOM 169 CG LEU A 14 1.873 -4.674 5.535 1.00 0.00 C ATOM 170 CD1 LEU A 14 0.922 -3.729 4.799 1.00 0.00 C ATOM 171 CD2 LEU A 14 1.172 -5.426 6.668 1.00 0.00 C ATOM 0 H LEU A 14 4.967 -5.006 5.508 1.00 0.00 H new ATOM 0 HA LEU A 14 3.070 -7.290 5.768 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.996 -5.071 3.756 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.768 -6.270 4.112 1.00 0.00 H new ATOM 0 HG LEU A 14 2.649 -4.058 5.989 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.460 -3.048 5.514 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.480 -3.155 4.059 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.147 -4.310 4.299 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.705 -4.711 7.345 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.409 -6.083 6.251 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.902 -6.021 7.216 1.00 0.00 H new ATOM 183 N LYS A 15 3.824 -8.483 3.715 1.00 0.00 N ATOM 184 CA LYS A 15 4.458 -9.336 2.724 1.00 0.00 C ATOM 185 C LYS A 15 3.745 -9.167 1.381 1.00 0.00 C ATOM 186 O LYS A 15 2.518 -9.226 1.313 1.00 0.00 O ATOM 187 CB LYS A 15 4.507 -10.784 3.216 1.00 0.00 C ATOM 188 CG LYS A 15 5.929 -11.177 3.622 1.00 0.00 C ATOM 189 CD LYS A 15 5.912 -12.151 4.802 1.00 0.00 C ATOM 190 CE LYS A 15 7.291 -12.778 5.015 1.00 0.00 C ATOM 191 NZ LYS A 15 7.196 -14.255 5.006 1.00 0.00 N ATOM 0 H LYS A 15 2.928 -8.825 4.062 1.00 0.00 H new ATOM 0 HA LYS A 15 5.496 -9.039 2.574 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.835 -10.906 4.066 1.00 0.00 H new ATOM 0 HB3 LYS A 15 4.152 -11.451 2.431 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.440 -11.635 2.775 1.00 0.00 H new ATOM 0 HG3 LYS A 15 6.494 -10.285 3.890 1.00 0.00 H new ATOM 0 HD2 LYS A 15 5.603 -11.627 5.706 1.00 0.00 H new ATOM 0 HD3 LYS A 15 5.176 -12.935 4.621 1.00 0.00 H new ATOM 0 HE2 LYS A 15 7.973 -12.447 4.231 1.00 0.00 H new ATOM 0 HE3 LYS A 15 7.708 -12.440 5.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 8.141 -14.665 5.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 6.562 -14.567 5.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 6.818 -14.573 4.091 1.00 0.00 H new ATOM 205 N ILE A 16 4.545 -8.960 0.345 1.00 0.00 N ATOM 206 CA ILE A 16 4.006 -8.782 -0.993 1.00 0.00 C ATOM 207 C ILE A 16 4.181 -10.078 -1.786 1.00 0.00 C ATOM 208 O ILE A 16 5.182 -10.776 -1.628 1.00 0.00 O ATOM 209 CB ILE A 16 4.634 -7.560 -1.665 1.00 0.00 C ATOM 210 CG1 ILE A 16 3.980 -6.267 -1.174 1.00 0.00 C ATOM 211 CG2 ILE A 16 4.582 -7.685 -3.189 1.00 0.00 C ATOM 212 CD1 ILE A 16 4.095 -6.137 0.346 1.00 0.00 C ATOM 0 H ILE A 16 5.562 -8.912 0.405 1.00 0.00 H new ATOM 0 HA ILE A 16 2.936 -8.578 -0.948 1.00 0.00 H new ATOM 0 HB ILE A 16 5.685 -7.517 -1.381 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.455 -5.411 -1.653 1.00 0.00 H new ATOM 0 HG13 ILE A 16 2.930 -6.253 -1.465 1.00 0.00 H new ATOM 0 HG21 ILE A 16 5.035 -6.803 -3.642 1.00 0.00 H new ATOM 0 HG22 ILE A 16 5.130 -8.575 -3.500 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.544 -7.766 -3.512 1.00 0.00 H new ATOM 0 HD11 ILE A 16 3.622 -5.209 0.669 1.00 0.00 H new ATOM 0 HD12 ILE A 16 3.598 -6.982 0.822 1.00 0.00 H new ATOM 0 HD13 ILE A 16 5.147 -6.127 0.632 1.00 0.00 H new ATOM 224 N ARG A 17 3.193 -10.362 -2.622 1.00 0.00 N ATOM 225 CA ARG A 17 3.226 -11.562 -3.440 1.00 0.00 C ATOM 226 C ARG A 17 4.647 -11.821 -3.946 1.00 0.00 C ATOM 227 O ARG A 17 5.349 -10.890 -4.337 1.00 0.00 O ATOM 228 CB ARG A 17 2.281 -11.440 -4.636 1.00 0.00 C ATOM 229 CG ARG A 17 2.254 -12.735 -5.450 1.00 0.00 C ATOM 230 CD ARG A 17 0.961 -13.514 -5.200 1.00 0.00 C ATOM 231 NE ARG A 17 0.995 -14.800 -5.930 1.00 0.00 N ATOM 232 CZ ARG A 17 0.637 -14.946 -7.213 1.00 0.00 C ATOM 233 NH1 ARG A 17 0.214 -13.885 -7.915 1.00 0.00 N ATOM 234 NH2 ARG A 17 0.700 -16.152 -7.794 1.00 0.00 N ATOM 0 H ARG A 17 2.364 -9.781 -2.750 1.00 0.00 H new ATOM 0 HA ARG A 17 2.900 -12.396 -2.818 1.00 0.00 H new ATOM 0 HB2 ARG A 17 1.276 -11.205 -4.287 1.00 0.00 H new ATOM 0 HB3 ARG A 17 2.599 -10.614 -5.272 1.00 0.00 H new ATOM 0 HG2 ARG A 17 2.344 -12.503 -6.511 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.112 -13.353 -5.185 1.00 0.00 H new ATOM 0 HD2 ARG A 17 0.837 -13.696 -4.132 1.00 0.00 H new ATOM 0 HD3 ARG A 17 0.103 -12.925 -5.525 1.00 0.00 H new ATOM 0 HE ARG A 17 1.311 -15.628 -5.425 1.00 0.00 H new ATOM 0 HH11 ARG A 17 0.165 -12.967 -7.472 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -0.059 -13.995 -8.892 1.00 0.00 H new ATOM 0 HH21 ARG A 17 1.021 -16.959 -7.260 1.00 0.00 H new ATOM 0 HH22 ARG A 17 0.427 -16.262 -8.771 1.00 0.00 H new ATOM 248 N GLY A 18 5.028 -13.090 -3.921 1.00 0.00 N ATOM 249 CA GLY A 18 6.352 -13.483 -4.372 1.00 0.00 C ATOM 250 C GLY A 18 6.299 -14.066 -5.786 1.00 0.00 C ATOM 251 O GLY A 18 5.291 -14.650 -6.183 1.00 0.00 O ATOM 0 H GLY A 18 4.443 -13.859 -3.595 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.017 -12.619 -4.356 1.00 0.00 H new ATOM 0 HA3 GLY A 18 6.770 -14.220 -3.686 1.00 0.00 H new ATOM 255 N THR A 19 7.396 -13.888 -6.507 1.00 0.00 N ATOM 256 CA THR A 19 7.487 -14.389 -7.867 1.00 0.00 C ATOM 257 C THR A 19 8.864 -15.006 -8.117 1.00 0.00 C ATOM 258 O THR A 19 8.971 -16.068 -8.728 1.00 0.00 O ATOM 259 CB THR A 19 7.156 -13.237 -8.818 1.00 0.00 C ATOM 260 OG1 THR A 19 7.977 -12.165 -8.365 1.00 0.00 O ATOM 261 CG2 THR A 19 5.729 -12.718 -8.634 1.00 0.00 C ATOM 0 H THR A 19 8.230 -13.403 -6.174 1.00 0.00 H new ATOM 0 HA THR A 19 6.770 -15.191 -8.042 1.00 0.00 H new ATOM 0 HB THR A 19 7.292 -13.567 -9.848 1.00 0.00 H new ATOM 0 HG1 THR A 19 7.827 -11.377 -8.928 1.00 0.00 H new ATOM 0 HG21 THR A 19 5.546 -11.902 -9.333 1.00 0.00 H new ATOM 0 HG22 THR A 19 5.021 -13.525 -8.825 1.00 0.00 H new ATOM 0 HG23 THR A 19 5.602 -12.357 -7.613 1.00 0.00 H new ATOM 269 N LEU A 20 9.885 -14.315 -7.631 1.00 0.00 N ATOM 270 CA LEU A 20 11.251 -14.781 -7.794 1.00 0.00 C ATOM 271 C LEU A 20 11.433 -16.090 -7.022 1.00 0.00 C ATOM 272 O LEU A 20 11.435 -17.168 -7.614 1.00 0.00 O ATOM 273 CB LEU A 20 12.242 -13.688 -7.393 1.00 0.00 C ATOM 274 CG LEU A 20 12.420 -12.543 -8.393 1.00 0.00 C ATOM 275 CD1 LEU A 20 12.903 -13.068 -9.746 1.00 0.00 C ATOM 276 CD2 LEU A 20 11.135 -11.723 -8.521 1.00 0.00 C ATOM 0 H LEU A 20 9.793 -13.435 -7.124 1.00 0.00 H new ATOM 0 HA LEU A 20 11.458 -14.996 -8.842 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.921 -13.266 -6.441 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.214 -14.151 -7.224 1.00 0.00 H new ATOM 0 HG LEU A 20 13.192 -11.874 -8.013 1.00 0.00 H new ATOM 0 HD11 LEU A 20 13.021 -12.235 -10.438 1.00 0.00 H new ATOM 0 HD12 LEU A 20 13.860 -13.574 -9.619 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.172 -13.771 -10.146 1.00 0.00 H new ATOM 0 HD21 LEU A 20 11.288 -10.916 -9.237 1.00 0.00 H new ATOM 0 HD22 LEU A 20 10.326 -12.366 -8.867 1.00 0.00 H new ATOM 0 HD23 LEU A 20 10.874 -11.302 -7.550 1.00 0.00 H new ATOM 288 N LYS A 21 11.582 -15.952 -5.713 1.00 0.00 N ATOM 289 CA LYS A 21 11.765 -17.110 -4.855 1.00 0.00 C ATOM 290 C LYS A 21 10.550 -17.255 -3.936 1.00 0.00 C ATOM 291 O LYS A 21 9.965 -18.333 -3.841 1.00 0.00 O ATOM 292 CB LYS A 21 13.095 -17.016 -4.104 1.00 0.00 C ATOM 293 CG LYS A 21 14.260 -16.814 -5.076 1.00 0.00 C ATOM 294 CD LYS A 21 14.544 -18.095 -5.863 1.00 0.00 C ATOM 295 CE LYS A 21 14.616 -17.811 -7.365 1.00 0.00 C ATOM 296 NZ LYS A 21 15.930 -18.220 -7.908 1.00 0.00 N ATOM 0 H LYS A 21 11.580 -15.056 -5.226 1.00 0.00 H new ATOM 0 HA LYS A 21 11.826 -18.020 -5.452 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.059 -16.188 -3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 21 13.254 -17.925 -3.524 1.00 0.00 H new ATOM 0 HG2 LYS A 21 14.027 -16.003 -5.766 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.152 -16.516 -4.524 1.00 0.00 H new ATOM 0 HD2 LYS A 21 15.484 -18.532 -5.526 1.00 0.00 H new ATOM 0 HD3 LYS A 21 13.763 -18.829 -5.665 1.00 0.00 H new ATOM 0 HE2 LYS A 21 13.820 -18.348 -7.881 1.00 0.00 H new ATOM 0 HE3 LYS A 21 14.455 -16.749 -7.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 15.961 -18.020 -8.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 16.685 -17.689 -7.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 16.069 -19.239 -7.750 1.00 0.00 H new ATOM 310 N SER A 22 10.206 -16.155 -3.284 1.00 0.00 N ATOM 311 CA SER A 22 9.071 -16.146 -2.377 1.00 0.00 C ATOM 312 C SER A 22 8.583 -14.712 -2.162 1.00 0.00 C ATOM 313 O SER A 22 9.014 -13.795 -2.860 1.00 0.00 O ATOM 314 CB SER A 22 9.432 -16.790 -1.037 1.00 0.00 C ATOM 315 OG SER A 22 8.309 -16.870 -0.163 1.00 0.00 O ATOM 0 H SER A 22 10.694 -15.263 -3.366 1.00 0.00 H new ATOM 0 HA SER A 22 8.269 -16.732 -2.827 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.828 -17.791 -1.211 1.00 0.00 H new ATOM 0 HB3 SER A 22 10.223 -16.213 -0.559 1.00 0.00 H new ATOM 0 HG SER A 22 8.580 -17.288 0.681 1.00 0.00 H new ATOM 321 N TRP A 23 7.691 -14.563 -1.195 1.00 0.00 N ATOM 322 CA TRP A 23 7.139 -13.256 -0.880 1.00 0.00 C ATOM 323 C TRP A 23 8.246 -12.420 -0.233 1.00 0.00 C ATOM 324 O TRP A 23 9.278 -12.954 0.170 1.00 0.00 O ATOM 325 CB TRP A 23 5.894 -13.383 0.000 1.00 0.00 C ATOM 326 CG TRP A 23 4.716 -14.076 -0.686 1.00 0.00 C ATOM 327 CD1 TRP A 23 4.711 -15.250 -1.333 1.00 0.00 C ATOM 328 CD2 TRP A 23 3.360 -13.588 -0.767 1.00 0.00 C ATOM 329 NE1 TRP A 23 3.457 -15.552 -1.823 1.00 0.00 N ATOM 330 CE2 TRP A 23 2.610 -14.510 -1.469 1.00 0.00 C ATOM 331 CE3 TRP A 23 2.787 -12.406 -0.265 1.00 0.00 C ATOM 332 CZ2 TRP A 23 1.244 -14.346 -1.731 1.00 0.00 C ATOM 333 CZ3 TRP A 23 1.421 -12.257 -0.536 1.00 0.00 C ATOM 334 CH2 TRP A 23 0.652 -13.176 -1.241 1.00 0.00 C ATOM 0 H TRP A 23 7.336 -15.326 -0.618 1.00 0.00 H new ATOM 0 HA TRP A 23 6.804 -12.750 -1.786 1.00 0.00 H new ATOM 0 HB2 TRP A 23 6.154 -13.938 0.902 1.00 0.00 H new ATOM 0 HB3 TRP A 23 5.582 -12.388 0.317 1.00 0.00 H new ATOM 0 HD1 TRP A 23 5.579 -15.880 -1.455 1.00 0.00 H new ATOM 0 HE1 TRP A 23 3.199 -16.387 -2.349 1.00 0.00 H new ATOM 0 HE3 TRP A 23 3.355 -11.671 0.286 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 0.678 -15.083 -2.282 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 0.931 -11.366 -0.172 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -0.398 -12.988 -1.410 1.00 0.00 H new ATOM 345 N THR A 24 7.993 -11.121 -0.154 1.00 0.00 N ATOM 346 CA THR A 24 8.954 -10.206 0.437 1.00 0.00 C ATOM 347 C THR A 24 8.274 -9.319 1.482 1.00 0.00 C ATOM 348 O THR A 24 7.216 -8.748 1.222 1.00 0.00 O ATOM 349 CB THR A 24 9.612 -9.416 -0.695 1.00 0.00 C ATOM 350 OG1 THR A 24 10.360 -10.394 -1.413 1.00 0.00 O ATOM 351 CG2 THR A 24 10.671 -8.436 -0.187 1.00 0.00 C ATOM 0 H THR A 24 7.136 -10.681 -0.490 1.00 0.00 H new ATOM 0 HA THR A 24 9.735 -10.745 0.973 1.00 0.00 H new ATOM 0 HB THR A 24 8.847 -8.870 -1.247 1.00 0.00 H new ATOM 0 HG1 THR A 24 10.563 -10.057 -2.311 1.00 0.00 H new ATOM 0 HG21 THR A 24 11.107 -7.901 -1.031 1.00 0.00 H new ATOM 0 HG22 THR A 24 10.209 -7.722 0.495 1.00 0.00 H new ATOM 0 HG23 THR A 24 11.453 -8.985 0.337 1.00 0.00 H new ATOM 359 N LYS A 25 8.909 -9.232 2.641 1.00 0.00 N ATOM 360 CA LYS A 25 8.379 -8.424 3.726 1.00 0.00 C ATOM 361 C LYS A 25 8.965 -7.013 3.640 1.00 0.00 C ATOM 362 O LYS A 25 10.103 -6.784 4.049 1.00 0.00 O ATOM 363 CB LYS A 25 8.621 -9.109 5.072 1.00 0.00 C ATOM 364 CG LYS A 25 8.136 -8.233 6.229 1.00 0.00 C ATOM 365 CD LYS A 25 9.085 -8.329 7.425 1.00 0.00 C ATOM 366 CE LYS A 25 8.401 -9.005 8.615 1.00 0.00 C ATOM 367 NZ LYS A 25 9.410 -9.540 9.557 1.00 0.00 N ATOM 0 H LYS A 25 9.786 -9.708 2.853 1.00 0.00 H new ATOM 0 HA LYS A 25 7.297 -8.326 3.634 1.00 0.00 H new ATOM 0 HB2 LYS A 25 8.102 -10.067 5.095 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.684 -9.319 5.191 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.064 -7.196 5.900 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.135 -8.542 6.529 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.974 -8.893 7.144 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.418 -7.331 7.711 1.00 0.00 H new ATOM 0 HE2 LYS A 25 7.759 -8.289 9.128 1.00 0.00 H new ATOM 0 HE3 LYS A 25 7.759 -9.813 8.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 8.929 -9.996 10.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 10.005 -10.239 9.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.005 -8.762 9.907 1.00 0.00 H new ATOM 381 N LEU A 26 8.163 -6.105 3.106 1.00 0.00 N ATOM 382 CA LEU A 26 8.588 -4.723 2.961 1.00 0.00 C ATOM 383 C LEU A 26 7.896 -3.867 4.024 1.00 0.00 C ATOM 384 O LEU A 26 6.992 -4.337 4.713 1.00 0.00 O ATOM 385 CB LEU A 26 8.351 -4.236 1.530 1.00 0.00 C ATOM 386 CG LEU A 26 9.149 -4.951 0.437 1.00 0.00 C ATOM 387 CD1 LEU A 26 8.580 -4.642 -0.949 1.00 0.00 C ATOM 388 CD2 LEU A 26 10.638 -4.609 0.535 1.00 0.00 C ATOM 0 H LEU A 26 7.220 -6.299 2.768 1.00 0.00 H new ATOM 0 HA LEU A 26 9.661 -4.635 3.129 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.290 -4.339 1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.585 -3.172 1.486 1.00 0.00 H new ATOM 0 HG LEU A 26 9.053 -6.026 0.591 1.00 0.00 H new ATOM 0 HD11 LEU A 26 9.165 -5.162 -1.707 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.543 -4.975 -0.999 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.625 -3.568 -1.130 1.00 0.00 H new ATOM 0 HD21 LEU A 26 11.183 -5.129 -0.252 1.00 0.00 H new ATOM 0 HD22 LEU A 26 10.773 -3.533 0.420 1.00 0.00 H new ATOM 0 HD23 LEU A 26 11.020 -4.920 1.507 1.00 0.00 H new ATOM 400 N TRP A 27 8.348 -2.625 4.124 1.00 0.00 N ATOM 401 CA TRP A 27 7.784 -1.700 5.091 1.00 0.00 C ATOM 402 C TRP A 27 6.755 -0.829 4.368 1.00 0.00 C ATOM 403 O TRP A 27 7.114 0.152 3.718 1.00 0.00 O ATOM 404 CB TRP A 27 8.883 -0.884 5.775 1.00 0.00 C ATOM 405 CG TRP A 27 8.361 0.148 6.776 1.00 0.00 C ATOM 406 CD1 TRP A 27 8.333 1.482 6.648 1.00 0.00 C ATOM 407 CD2 TRP A 27 7.789 -0.125 8.073 1.00 0.00 C ATOM 408 NE1 TRP A 27 7.787 2.086 7.762 1.00 0.00 N ATOM 409 CE2 TRP A 27 7.446 1.078 8.656 1.00 0.00 C ATOM 410 CE3 TRP A 27 7.569 -1.348 8.731 1.00 0.00 C ATOM 411 CZ2 TRP A 27 6.862 1.175 9.925 1.00 0.00 C ATOM 412 CZ3 TRP A 27 6.985 -1.233 9.998 1.00 0.00 C ATOM 413 CH2 TRP A 27 6.634 -0.030 10.599 1.00 0.00 C ATOM 0 H TRP A 27 9.098 -2.239 3.551 1.00 0.00 H new ATOM 0 HA TRP A 27 7.281 -2.240 5.893 1.00 0.00 H new ATOM 0 HB2 TRP A 27 9.559 -1.566 6.291 1.00 0.00 H new ATOM 0 HB3 TRP A 27 9.468 -0.371 5.012 1.00 0.00 H new ATOM 0 HD1 TRP A 27 8.693 2.017 5.782 1.00 0.00 H new ATOM 0 HE1 TRP A 27 7.657 3.088 7.903 1.00 0.00 H new ATOM 0 HE3 TRP A 27 7.830 -2.300 8.294 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 6.602 2.129 10.360 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 6.794 -2.143 10.547 1.00 0.00 H new ATOM 0 HH2 TRP A 27 6.187 -0.025 11.582 1.00 0.00 H new ATOM 424 N CYS A 28 5.496 -1.218 4.506 1.00 0.00 N ATOM 425 CA CYS A 28 4.413 -0.485 3.874 1.00 0.00 C ATOM 426 C CYS A 28 3.861 0.524 4.884 1.00 0.00 C ATOM 427 O CYS A 28 3.497 0.154 5.999 1.00 0.00 O ATOM 428 CB CYS A 28 3.323 -1.424 3.352 1.00 0.00 C ATOM 429 SG CYS A 28 4.084 -2.838 2.474 1.00 0.00 S ATOM 0 H CYS A 28 5.202 -2.032 5.046 1.00 0.00 H new ATOM 0 HA CYS A 28 4.792 0.046 3.001 1.00 0.00 H new ATOM 0 HB2 CYS A 28 2.714 -1.785 4.181 1.00 0.00 H new ATOM 0 HB3 CYS A 28 2.657 -0.883 2.680 1.00 0.00 H new ATOM 0 HG CYS A 28 3.279 -3.254 1.542 1.00 0.00 H new ATOM 435 N VAL A 29 3.817 1.777 4.457 1.00 0.00 N ATOM 436 CA VAL A 29 3.316 2.841 5.311 1.00 0.00 C ATOM 437 C VAL A 29 1.928 3.265 4.828 1.00 0.00 C ATOM 438 O VAL A 29 1.750 3.607 3.659 1.00 0.00 O ATOM 439 CB VAL A 29 4.316 3.998 5.346 1.00 0.00 C ATOM 440 CG1 VAL A 29 3.874 5.075 6.339 1.00 0.00 C ATOM 441 CG2 VAL A 29 5.724 3.496 5.673 1.00 0.00 C ATOM 0 H VAL A 29 4.120 2.080 3.531 1.00 0.00 H new ATOM 0 HA VAL A 29 3.210 2.490 6.337 1.00 0.00 H new ATOM 0 HB VAL A 29 4.343 4.448 4.353 1.00 0.00 H new ATOM 0 HG11 VAL A 29 4.602 5.886 6.344 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.900 5.464 6.044 1.00 0.00 H new ATOM 0 HG13 VAL A 29 3.805 4.643 7.337 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.415 4.338 5.692 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.719 3.009 6.648 1.00 0.00 H new ATOM 0 HG23 VAL A 29 6.042 2.783 4.913 1.00 0.00 H new ATOM 451 N LEU A 30 0.978 3.230 5.751 1.00 0.00 N ATOM 452 CA LEU A 30 -0.389 3.606 5.434 1.00 0.00 C ATOM 453 C LEU A 30 -0.576 5.101 5.701 1.00 0.00 C ATOM 454 O LEU A 30 -0.446 5.554 6.837 1.00 0.00 O ATOM 455 CB LEU A 30 -1.378 2.718 6.191 1.00 0.00 C ATOM 456 CG LEU A 30 -2.787 2.627 5.599 1.00 0.00 C ATOM 457 CD1 LEU A 30 -3.811 2.263 6.675 1.00 0.00 C ATOM 458 CD2 LEU A 30 -3.158 3.918 4.867 1.00 0.00 C ATOM 0 H LEU A 30 1.128 2.947 6.719 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.594 3.442 4.376 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.963 1.712 6.247 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.458 3.087 7.214 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.797 1.825 4.861 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.803 2.205 6.228 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.553 1.298 7.112 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.808 3.026 7.453 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.163 3.827 4.456 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.126 4.754 5.565 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -2.450 4.094 4.057 1.00 0.00 H new ATOM 470 N LYS A 31 -0.880 5.826 4.634 1.00 0.00 N ATOM 471 CA LYS A 31 -1.086 7.261 4.739 1.00 0.00 C ATOM 472 C LYS A 31 -2.555 7.582 4.453 1.00 0.00 C ATOM 473 O LYS A 31 -3.313 6.711 4.029 1.00 0.00 O ATOM 474 CB LYS A 31 -0.105 8.011 3.836 1.00 0.00 C ATOM 475 CG LYS A 31 1.082 8.544 4.640 1.00 0.00 C ATOM 476 CD LYS A 31 2.173 9.084 3.713 1.00 0.00 C ATOM 477 CE LYS A 31 3.541 9.049 4.399 1.00 0.00 C ATOM 478 NZ LYS A 31 4.351 10.221 3.998 1.00 0.00 N ATOM 0 H LYS A 31 -0.989 5.447 3.693 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.875 7.604 5.752 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.253 7.346 3.050 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.617 8.838 3.345 1.00 0.00 H new ATOM 0 HG2 LYS A 31 0.746 9.334 5.311 1.00 0.00 H new ATOM 0 HG3 LYS A 31 1.490 7.749 5.263 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.205 8.491 2.799 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.934 10.107 3.421 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.412 9.042 5.481 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.064 8.130 4.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.276 10.182 4.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.489 10.211 2.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.858 11.094 4.273 1.00 0.00 H new ATOM 492 N PRO A 32 -2.921 8.868 4.702 1.00 0.00 N ATOM 493 CA PRO A 32 -4.285 9.315 4.476 1.00 0.00 C ATOM 494 C PRO A 32 -4.564 9.489 2.982 1.00 0.00 C ATOM 495 O PRO A 32 -4.417 10.585 2.443 1.00 0.00 O ATOM 496 CB PRO A 32 -4.408 10.612 5.259 1.00 0.00 C ATOM 497 CG PRO A 32 -2.986 11.084 5.512 1.00 0.00 C ATOM 498 CD PRO A 32 -2.050 9.926 5.205 1.00 0.00 C ATOM 0 HA PRO A 32 -5.027 8.591 4.812 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.972 11.356 4.696 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.939 10.453 6.197 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -2.751 11.942 4.883 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -2.869 11.406 6.547 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -1.301 10.208 4.465 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -1.512 9.605 6.097 1.00 0.00 H new ATOM 506 N GLY A 33 -4.961 8.392 2.355 1.00 0.00 N ATOM 507 CA GLY A 33 -5.262 8.409 0.933 1.00 0.00 C ATOM 508 C GLY A 33 -4.011 8.113 0.104 1.00 0.00 C ATOM 509 O GLY A 33 -3.912 8.533 -1.048 1.00 0.00 O ATOM 0 H GLY A 33 -5.081 7.485 2.805 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.032 7.670 0.712 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.665 9.383 0.655 1.00 0.00 H new ATOM 513 N VAL A 34 -3.087 7.393 0.723 1.00 0.00 N ATOM 514 CA VAL A 34 -1.846 7.035 0.056 1.00 0.00 C ATOM 515 C VAL A 34 -1.125 5.961 0.873 1.00 0.00 C ATOM 516 O VAL A 34 -1.320 5.861 2.083 1.00 0.00 O ATOM 517 CB VAL A 34 -0.995 8.286 -0.170 1.00 0.00 C ATOM 518 CG1 VAL A 34 -1.423 9.017 -1.445 1.00 0.00 C ATOM 519 CG2 VAL A 34 -1.056 9.218 1.042 1.00 0.00 C ATOM 0 H VAL A 34 -3.172 7.048 1.679 1.00 0.00 H new ATOM 0 HA VAL A 34 -2.048 6.613 -0.928 1.00 0.00 H new ATOM 0 HB VAL A 34 0.040 7.968 -0.296 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.802 9.903 -1.582 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.304 8.354 -2.302 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -2.468 9.316 -1.360 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -0.442 10.099 0.855 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.088 9.524 1.214 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -0.681 8.695 1.922 1.00 0.00 H new ATOM 529 N LEU A 35 -0.307 5.185 0.178 1.00 0.00 N ATOM 530 CA LEU A 35 0.445 4.122 0.823 1.00 0.00 C ATOM 531 C LEU A 35 1.869 4.099 0.265 1.00 0.00 C ATOM 532 O LEU A 35 2.066 4.186 -0.946 1.00 0.00 O ATOM 533 CB LEU A 35 -0.290 2.787 0.688 1.00 0.00 C ATOM 534 CG LEU A 35 0.510 1.539 1.066 1.00 0.00 C ATOM 535 CD1 LEU A 35 0.293 1.174 2.536 1.00 0.00 C ATOM 536 CD2 LEU A 35 0.182 0.373 0.131 1.00 0.00 C ATOM 0 H LEU A 35 -0.148 5.271 -0.826 1.00 0.00 H new ATOM 0 HA LEU A 35 0.525 4.308 1.894 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -1.184 2.823 1.310 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.624 2.681 -0.344 1.00 0.00 H new ATOM 0 HG LEU A 35 1.570 1.762 0.942 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.873 0.283 2.779 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.616 2.001 3.168 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.765 0.977 2.710 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.764 -0.501 0.422 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.881 0.140 0.199 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.429 0.648 -0.894 1.00 0.00 H new ATOM 548 N LEU A 36 2.825 3.981 1.174 1.00 0.00 N ATOM 549 CA LEU A 36 4.226 3.945 0.788 1.00 0.00 C ATOM 550 C LEU A 36 4.820 2.586 1.164 1.00 0.00 C ATOM 551 O LEU A 36 4.302 1.902 2.045 1.00 0.00 O ATOM 552 CB LEU A 36 4.978 5.133 1.390 1.00 0.00 C ATOM 553 CG LEU A 36 4.787 6.477 0.683 1.00 0.00 C ATOM 554 CD1 LEU A 36 3.899 7.410 1.508 1.00 0.00 C ATOM 555 CD2 LEU A 36 6.136 7.117 0.347 1.00 0.00 C ATOM 0 H LEU A 36 2.657 3.909 2.178 1.00 0.00 H new ATOM 0 HA LEU A 36 4.326 4.049 -0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.668 5.245 2.429 1.00 0.00 H new ATOM 0 HB3 LEU A 36 6.042 4.897 1.398 1.00 0.00 H new ATOM 0 HG LEU A 36 4.273 6.296 -0.261 1.00 0.00 H new ATOM 0 HD11 LEU A 36 3.780 8.358 0.983 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.922 6.949 1.652 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.362 7.589 2.478 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.971 8.071 -0.155 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.699 7.283 1.266 1.00 0.00 H new ATOM 0 HD23 LEU A 36 6.700 6.454 -0.310 1.00 0.00 H new ATOM 567 N ILE A 37 5.898 2.237 0.478 1.00 0.00 N ATOM 568 CA ILE A 37 6.567 0.972 0.729 1.00 0.00 C ATOM 569 C ILE A 37 8.081 1.193 0.727 1.00 0.00 C ATOM 570 O ILE A 37 8.621 1.811 -0.189 1.00 0.00 O ATOM 571 CB ILE A 37 6.099 -0.089 -0.268 1.00 0.00 C ATOM 572 CG1 ILE A 37 4.588 -0.307 -0.169 1.00 0.00 C ATOM 573 CG2 ILE A 37 6.879 -1.393 -0.087 1.00 0.00 C ATOM 574 CD1 ILE A 37 3.865 0.311 -1.367 1.00 0.00 C ATOM 0 H ILE A 37 6.325 2.808 -0.251 1.00 0.00 H new ATOM 0 HA ILE A 37 6.301 0.589 1.714 1.00 0.00 H new ATOM 0 HB ILE A 37 6.306 0.274 -1.275 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.373 -1.375 -0.121 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.213 0.135 0.754 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.527 -2.131 -0.808 1.00 0.00 H new ATOM 0 HG22 ILE A 37 7.941 -1.207 -0.247 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.726 -1.771 0.924 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.792 0.142 -1.272 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.062 1.383 -1.398 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.225 -0.150 -2.287 1.00 0.00 H new ATOM 586 N TYR A 38 8.724 0.676 1.764 1.00 0.00 N ATOM 587 CA TYR A 38 10.165 0.808 1.894 1.00 0.00 C ATOM 588 C TYR A 38 10.819 -0.550 2.155 1.00 0.00 C ATOM 589 O TYR A 38 10.301 -1.354 2.927 1.00 0.00 O ATOM 590 CB TYR A 38 10.398 1.714 3.104 1.00 0.00 C ATOM 591 CG TYR A 38 9.865 3.137 2.928 1.00 0.00 C ATOM 592 CD1 TYR A 38 8.530 3.407 3.156 1.00 0.00 C ATOM 593 CD2 TYR A 38 10.718 4.151 2.542 1.00 0.00 C ATOM 594 CE1 TYR A 38 8.028 4.747 2.991 1.00 0.00 C ATOM 595 CE2 TYR A 38 10.216 5.491 2.376 1.00 0.00 C ATOM 596 CZ TYR A 38 8.896 5.722 2.609 1.00 0.00 C ATOM 597 OH TYR A 38 8.422 6.988 2.453 1.00 0.00 O ATOM 0 H TYR A 38 8.273 0.165 2.522 1.00 0.00 H new ATOM 0 HA TYR A 38 10.597 1.213 0.979 1.00 0.00 H new ATOM 0 HB2 TYR A 38 9.925 1.265 3.977 1.00 0.00 H new ATOM 0 HB3 TYR A 38 11.467 1.760 3.310 1.00 0.00 H new ATOM 0 HD1 TYR A 38 7.862 2.614 3.458 1.00 0.00 H new ATOM 0 HD2 TYR A 38 11.762 3.940 2.364 1.00 0.00 H new ATOM 0 HE1 TYR A 38 6.986 4.972 3.167 1.00 0.00 H new ATOM 0 HE2 TYR A 38 10.872 6.294 2.074 1.00 0.00 H new ATOM 0 HH TYR A 38 7.690 7.144 3.086 1.00 0.00 H new ATOM 607 N LYS A 39 11.949 -0.763 1.495 1.00 0.00 N ATOM 608 CA LYS A 39 12.679 -2.010 1.646 1.00 0.00 C ATOM 609 C LYS A 39 12.768 -2.367 3.131 1.00 0.00 C ATOM 610 O LYS A 39 12.507 -3.506 3.516 1.00 0.00 O ATOM 611 CB LYS A 39 14.040 -1.921 0.953 1.00 0.00 C ATOM 612 CG LYS A 39 13.877 -1.608 -0.536 1.00 0.00 C ATOM 613 CD LYS A 39 15.218 -1.707 -1.267 1.00 0.00 C ATOM 614 CE LYS A 39 15.117 -2.641 -2.474 1.00 0.00 C ATOM 615 NZ LYS A 39 16.460 -2.911 -3.035 1.00 0.00 N ATOM 0 H LYS A 39 12.376 -0.093 0.855 1.00 0.00 H new ATOM 0 HA LYS A 39 12.148 -2.824 1.153 1.00 0.00 H new ATOM 0 HB2 LYS A 39 14.644 -1.147 1.427 1.00 0.00 H new ATOM 0 HB3 LYS A 39 14.576 -2.862 1.074 1.00 0.00 H new ATOM 0 HG2 LYS A 39 13.164 -2.302 -0.981 1.00 0.00 H new ATOM 0 HG3 LYS A 39 13.465 -0.606 -0.658 1.00 0.00 H new ATOM 0 HD2 LYS A 39 15.531 -0.716 -1.595 1.00 0.00 H new ATOM 0 HD3 LYS A 39 15.983 -2.073 -0.582 1.00 0.00 H new ATOM 0 HE2 LYS A 39 14.645 -3.578 -2.178 1.00 0.00 H new ATOM 0 HE3 LYS A 39 14.481 -2.191 -3.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 16.373 -3.547 -3.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 16.897 -2.016 -3.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 17.055 -3.360 -2.310 1.00 0.00 H new ATOM 629 N THR A 40 13.138 -1.373 3.925 1.00 0.00 N ATOM 630 CA THR A 40 13.265 -1.568 5.360 1.00 0.00 C ATOM 631 C THR A 40 12.914 -0.280 6.106 1.00 0.00 C ATOM 632 O THR A 40 12.662 0.752 5.486 1.00 0.00 O ATOM 633 CB THR A 40 14.682 -2.070 5.645 1.00 0.00 C ATOM 634 OG1 THR A 40 14.823 -1.926 7.056 1.00 0.00 O ATOM 635 CG2 THR A 40 15.757 -1.148 5.067 1.00 0.00 C ATOM 0 H THR A 40 13.354 -0.430 3.602 1.00 0.00 H new ATOM 0 HA THR A 40 12.561 -2.317 5.722 1.00 0.00 H new ATOM 0 HB THR A 40 14.803 -3.071 5.232 1.00 0.00 H new ATOM 0 HG1 THR A 40 15.714 -2.230 7.328 1.00 0.00 H new ATOM 0 HG21 THR A 40 16.744 -1.550 5.298 1.00 0.00 H new ATOM 0 HG22 THR A 40 15.636 -1.081 3.986 1.00 0.00 H new ATOM 0 HG23 THR A 40 15.659 -0.155 5.505 1.00 0.00 H new ATOM 643 N GLN A 41 12.911 -0.381 7.427 1.00 0.00 N ATOM 644 CA GLN A 41 12.595 0.763 8.265 1.00 0.00 C ATOM 645 C GLN A 41 13.877 1.499 8.663 1.00 0.00 C ATOM 646 O GLN A 41 13.864 2.713 8.860 1.00 0.00 O ATOM 647 CB GLN A 41 11.802 0.336 9.502 1.00 0.00 C ATOM 648 CG GLN A 41 10.406 0.962 9.501 1.00 0.00 C ATOM 649 CD GLN A 41 10.402 2.295 10.251 1.00 0.00 C ATOM 650 OE1 GLN A 41 10.609 3.356 9.685 1.00 0.00 O ATOM 651 NE2 GLN A 41 10.157 2.182 11.553 1.00 0.00 N ATOM 0 H GLN A 41 13.123 -1.238 7.938 1.00 0.00 H new ATOM 0 HA GLN A 41 11.969 1.446 7.691 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.717 -0.750 9.527 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.338 0.635 10.403 1.00 0.00 H new ATOM 0 HG2 GLN A 41 10.074 1.117 8.474 1.00 0.00 H new ATOM 0 HG3 GLN A 41 9.696 0.277 9.965 1.00 0.00 H new ATOM 0 HE21 GLN A 41 9.992 1.263 11.963 1.00 0.00 H new ATOM 0 HE22 GLN A 41 10.134 3.015 12.142 1.00 0.00 H new ATOM 660 N LYS A 42 14.952 0.732 8.769 1.00 0.00 N ATOM 661 CA LYS A 42 16.239 1.296 9.140 1.00 0.00 C ATOM 662 C LYS A 42 16.654 2.338 8.099 1.00 0.00 C ATOM 663 O LYS A 42 16.290 3.508 8.207 1.00 0.00 O ATOM 664 CB LYS A 42 17.272 0.186 9.344 1.00 0.00 C ATOM 665 CG LYS A 42 17.250 -0.325 10.786 1.00 0.00 C ATOM 666 CD LYS A 42 18.334 0.355 11.625 1.00 0.00 C ATOM 667 CE LYS A 42 19.250 -0.681 12.280 1.00 0.00 C ATOM 668 NZ LYS A 42 20.529 -0.057 12.688 1.00 0.00 N ATOM 0 H LYS A 42 14.958 -0.275 8.605 1.00 0.00 H new ATOM 0 HA LYS A 42 16.166 1.812 10.097 1.00 0.00 H new ATOM 0 HB2 LYS A 42 17.067 -0.637 8.660 1.00 0.00 H new ATOM 0 HB3 LYS A 42 18.267 0.561 9.102 1.00 0.00 H new ATOM 0 HG2 LYS A 42 16.271 -0.136 11.228 1.00 0.00 H new ATOM 0 HG3 LYS A 42 17.401 -1.404 10.796 1.00 0.00 H new ATOM 0 HD2 LYS A 42 18.924 1.020 10.994 1.00 0.00 H new ATOM 0 HD3 LYS A 42 17.870 0.973 12.394 1.00 0.00 H new ATOM 0 HE2 LYS A 42 18.756 -1.114 13.150 1.00 0.00 H new ATOM 0 HE3 LYS A 42 19.442 -1.497 11.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 21.139 -0.773 13.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 21.006 0.335 11.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 20.341 0.706 13.369 1.00 0.00 H new ATOM 682 N ASN A 43 17.410 1.874 7.114 1.00 0.00 N ATOM 683 CA ASN A 43 17.878 2.751 6.054 1.00 0.00 C ATOM 684 C ASN A 43 16.675 3.407 5.372 1.00 0.00 C ATOM 685 O ASN A 43 16.574 4.632 5.327 1.00 0.00 O ATOM 686 CB ASN A 43 18.654 1.968 4.993 1.00 0.00 C ATOM 687 CG ASN A 43 19.999 1.486 5.542 1.00 0.00 C ATOM 688 OD1 ASN A 43 21.009 2.165 5.463 1.00 0.00 O ATOM 689 ND2 ASN A 43 19.954 0.280 6.101 1.00 0.00 N ATOM 0 H ASN A 43 17.710 0.903 7.028 1.00 0.00 H new ATOM 0 HA ASN A 43 18.533 3.499 6.500 1.00 0.00 H new ATOM 0 HB2 ASN A 43 18.064 1.113 4.663 1.00 0.00 H new ATOM 0 HB3 ASN A 43 18.819 2.598 4.119 1.00 0.00 H new ATOM 0 HD21 ASN A 43 20.800 -0.130 6.497 1.00 0.00 H new ATOM 0 HD22 ASN A 43 19.074 -0.235 6.133 1.00 0.00 H new ATOM 696 N GLY A 44 15.794 2.562 4.858 1.00 0.00 N ATOM 697 CA GLY A 44 14.602 3.044 4.180 1.00 0.00 C ATOM 698 C GLY A 44 14.953 3.650 2.820 1.00 0.00 C ATOM 699 O GLY A 44 14.973 4.870 2.666 1.00 0.00 O ATOM 0 H GLY A 44 15.881 1.546 4.897 1.00 0.00 H new ATOM 0 HA2 GLY A 44 13.898 2.222 4.046 1.00 0.00 H new ATOM 0 HA3 GLY A 44 14.105 3.792 4.798 1.00 0.00 H new ATOM 703 N GLN A 45 15.220 2.769 1.866 1.00 0.00 N ATOM 704 CA GLN A 45 15.569 3.202 0.524 1.00 0.00 C ATOM 705 C GLN A 45 14.304 3.523 -0.275 1.00 0.00 C ATOM 706 O GLN A 45 14.383 4.049 -1.384 1.00 0.00 O ATOM 707 CB GLN A 45 16.415 2.146 -0.190 1.00 0.00 C ATOM 708 CG GLN A 45 17.430 1.518 0.767 1.00 0.00 C ATOM 709 CD GLN A 45 18.506 0.749 -0.002 1.00 0.00 C ATOM 710 OE1 GLN A 45 18.990 1.176 -1.037 1.00 0.00 O ATOM 711 NE2 GLN A 45 18.852 -0.405 0.561 1.00 0.00 N ATOM 0 H GLN A 45 15.201 1.758 1.997 1.00 0.00 H new ATOM 0 HA GLN A 45 16.168 4.109 0.600 1.00 0.00 H new ATOM 0 HB2 GLN A 45 15.767 1.371 -0.598 1.00 0.00 H new ATOM 0 HB3 GLN A 45 16.937 2.601 -1.032 1.00 0.00 H new ATOM 0 HG2 GLN A 45 17.896 2.297 1.371 1.00 0.00 H new ATOM 0 HG3 GLN A 45 16.918 0.845 1.455 1.00 0.00 H new ATOM 0 HE21 GLN A 45 18.406 -0.703 1.429 1.00 0.00 H new ATOM 0 HE22 GLN A 45 19.563 -0.992 0.125 1.00 0.00 H new ATOM 720 N TRP A 46 13.167 3.192 0.319 1.00 0.00 N ATOM 721 CA TRP A 46 11.887 3.438 -0.324 1.00 0.00 C ATOM 722 C TRP A 46 11.798 2.540 -1.559 1.00 0.00 C ATOM 723 O TRP A 46 12.783 2.361 -2.273 1.00 0.00 O ATOM 724 CB TRP A 46 11.714 4.923 -0.650 1.00 0.00 C ATOM 725 CG TRP A 46 10.369 5.267 -1.292 1.00 0.00 C ATOM 726 CD1 TRP A 46 9.142 5.084 -0.784 1.00 0.00 C ATOM 727 CD2 TRP A 46 10.162 5.864 -2.589 1.00 0.00 C ATOM 728 NE1 TRP A 46 8.164 5.518 -1.656 1.00 0.00 N ATOM 729 CE2 TRP A 46 8.804 6.007 -2.789 1.00 0.00 C ATOM 730 CE3 TRP A 46 11.092 6.269 -3.563 1.00 0.00 C ATOM 731 CZ2 TRP A 46 8.254 6.557 -3.953 1.00 0.00 C ATOM 732 CZ3 TRP A 46 10.526 6.816 -4.720 1.00 0.00 C ATOM 733 CH2 TRP A 46 9.162 6.968 -4.936 1.00 0.00 C ATOM 0 H TRP A 46 13.105 2.755 1.239 1.00 0.00 H new ATOM 0 HA TRP A 46 11.064 3.190 0.346 1.00 0.00 H new ATOM 0 HB2 TRP A 46 11.825 5.501 0.267 1.00 0.00 H new ATOM 0 HB3 TRP A 46 12.515 5.233 -1.321 1.00 0.00 H new ATOM 0 HD1 TRP A 46 8.944 4.651 0.186 1.00 0.00 H new ATOM 0 HE1 TRP A 46 7.157 5.486 -1.498 1.00 0.00 H new ATOM 0 HE3 TRP A 46 12.159 6.166 -3.429 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 7.187 6.659 -4.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 11.197 7.143 -5.500 1.00 0.00 H new ATOM 0 HH2 TRP A 46 8.804 7.401 -5.858 1.00 0.00 H new ATOM 744 N VAL A 47 10.608 2.000 -1.774 1.00 0.00 N ATOM 745 CA VAL A 47 10.377 1.125 -2.910 1.00 0.00 C ATOM 746 C VAL A 47 9.461 1.829 -3.913 1.00 0.00 C ATOM 747 O VAL A 47 9.834 2.025 -5.069 1.00 0.00 O ATOM 748 CB VAL A 47 9.820 -0.218 -2.433 1.00 0.00 C ATOM 749 CG1 VAL A 47 9.462 -1.116 -3.619 1.00 0.00 C ATOM 750 CG2 VAL A 47 10.805 -0.917 -1.494 1.00 0.00 C ATOM 0 H VAL A 47 9.793 2.152 -1.180 1.00 0.00 H new ATOM 0 HA VAL A 47 11.315 0.909 -3.422 1.00 0.00 H new ATOM 0 HB VAL A 47 8.905 -0.022 -1.874 1.00 0.00 H new ATOM 0 HG11 VAL A 47 9.069 -2.064 -3.252 1.00 0.00 H new ATOM 0 HG12 VAL A 47 8.708 -0.624 -4.233 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.354 -1.301 -4.218 1.00 0.00 H new ATOM 0 HG21 VAL A 47 10.385 -1.869 -1.169 1.00 0.00 H new ATOM 0 HG22 VAL A 47 11.744 -1.094 -2.018 1.00 0.00 H new ATOM 0 HG23 VAL A 47 10.989 -0.286 -0.624 1.00 0.00 H new ATOM 760 N GLY A 48 8.279 2.190 -3.434 1.00 0.00 N ATOM 761 CA GLY A 48 7.307 2.868 -4.274 1.00 0.00 C ATOM 762 C GLY A 48 6.130 3.384 -3.444 1.00 0.00 C ATOM 763 O GLY A 48 6.085 3.182 -2.231 1.00 0.00 O ATOM 0 H GLY A 48 7.973 2.026 -2.475 1.00 0.00 H new ATOM 0 HA2 GLY A 48 7.785 3.700 -4.790 1.00 0.00 H new ATOM 0 HA3 GLY A 48 6.944 2.184 -5.041 1.00 0.00 H new ATOM 767 N THR A 49 5.206 4.041 -4.130 1.00 0.00 N ATOM 768 CA THR A 49 4.032 4.588 -3.470 1.00 0.00 C ATOM 769 C THR A 49 2.759 4.133 -4.186 1.00 0.00 C ATOM 770 O THR A 49 2.709 4.106 -5.415 1.00 0.00 O ATOM 771 CB THR A 49 4.187 6.109 -3.413 1.00 0.00 C ATOM 772 OG1 THR A 49 5.111 6.324 -2.350 1.00 0.00 O ATOM 773 CG2 THR A 49 2.911 6.810 -2.945 1.00 0.00 C ATOM 0 H THR A 49 5.246 4.207 -5.136 1.00 0.00 H new ATOM 0 HA THR A 49 3.943 4.218 -2.449 1.00 0.00 H new ATOM 0 HB THR A 49 4.466 6.483 -4.398 1.00 0.00 H new ATOM 0 HG1 THR A 49 5.271 7.285 -2.245 1.00 0.00 H new ATOM 0 HG21 THR A 49 3.075 7.887 -2.922 1.00 0.00 H new ATOM 0 HG22 THR A 49 2.097 6.581 -3.633 1.00 0.00 H new ATOM 0 HG23 THR A 49 2.650 6.462 -1.946 1.00 0.00 H new ATOM 781 N VAL A 50 1.760 3.788 -3.387 1.00 0.00 N ATOM 782 CA VAL A 50 0.490 3.336 -3.928 1.00 0.00 C ATOM 783 C VAL A 50 -0.553 4.444 -3.763 1.00 0.00 C ATOM 784 O VAL A 50 -0.714 4.992 -2.674 1.00 0.00 O ATOM 785 CB VAL A 50 0.076 2.021 -3.264 1.00 0.00 C ATOM 786 CG1 VAL A 50 -1.217 1.481 -3.878 1.00 0.00 C ATOM 787 CG2 VAL A 50 1.199 0.986 -3.351 1.00 0.00 C ATOM 0 H VAL A 50 1.805 3.813 -2.368 1.00 0.00 H new ATOM 0 HA VAL A 50 0.581 3.131 -4.995 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.113 2.222 -2.209 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.489 0.546 -3.389 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.017 2.209 -3.741 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.067 1.303 -4.943 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.879 0.061 -2.872 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.433 0.790 -4.397 1.00 0.00 H new ATOM 0 HG23 VAL A 50 2.086 1.368 -2.846 1.00 0.00 H new ATOM 797 N LEU A 51 -1.234 4.739 -4.861 1.00 0.00 N ATOM 798 CA LEU A 51 -2.257 5.771 -4.851 1.00 0.00 C ATOM 799 C LEU A 51 -3.608 5.142 -4.505 1.00 0.00 C ATOM 800 O LEU A 51 -3.997 4.135 -5.096 1.00 0.00 O ATOM 801 CB LEU A 51 -2.257 6.538 -6.175 1.00 0.00 C ATOM 802 CG LEU A 51 -1.031 7.414 -6.443 1.00 0.00 C ATOM 803 CD1 LEU A 51 -1.345 8.493 -7.481 1.00 0.00 C ATOM 804 CD2 LEU A 51 -0.489 8.010 -5.143 1.00 0.00 C ATOM 0 H LEU A 51 -1.097 4.282 -5.763 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.043 6.511 -4.080 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.350 5.819 -6.989 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.144 7.170 -6.206 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.245 6.784 -6.861 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -0.457 9.102 -7.653 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.649 8.021 -8.416 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.153 9.126 -7.115 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.382 8.628 -5.361 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.260 8.622 -4.674 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.202 7.206 -4.466 1.00 0.00 H new ATOM 816 N LEU A 52 -4.286 5.761 -3.550 1.00 0.00 N ATOM 817 CA LEU A 52 -5.585 5.273 -3.119 1.00 0.00 C ATOM 818 C LEU A 52 -6.655 6.309 -3.469 1.00 0.00 C ATOM 819 O LEU A 52 -7.515 6.621 -2.647 1.00 0.00 O ATOM 820 CB LEU A 52 -5.552 4.901 -1.635 1.00 0.00 C ATOM 821 CG LEU A 52 -4.187 4.496 -1.075 1.00 0.00 C ATOM 822 CD1 LEU A 52 -4.203 4.485 0.455 1.00 0.00 C ATOM 823 CD2 LEU A 52 -3.734 3.153 -1.653 1.00 0.00 C ATOM 0 H LEU A 52 -3.960 6.596 -3.063 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.843 4.356 -3.648 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.921 5.750 -1.060 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.248 4.078 -1.471 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.456 5.243 -1.384 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -3.221 4.194 0.827 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -4.450 5.481 0.823 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -4.950 3.773 0.806 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.761 2.888 -1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.460 2.382 -1.395 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -3.658 3.231 -2.738 1.00 0.00 H new ATOM 835 N ASN A 53 -6.568 6.812 -4.692 1.00 0.00 N ATOM 836 CA ASN A 53 -7.518 7.806 -5.161 1.00 0.00 C ATOM 837 C ASN A 53 -8.941 7.284 -4.950 1.00 0.00 C ATOM 838 O ASN A 53 -9.813 8.019 -4.488 1.00 0.00 O ATOM 839 CB ASN A 53 -7.333 8.083 -6.655 1.00 0.00 C ATOM 840 CG ASN A 53 -6.700 9.457 -6.883 1.00 0.00 C ATOM 841 OD1 ASN A 53 -7.373 10.447 -7.120 1.00 0.00 O ATOM 842 ND2 ASN A 53 -5.373 9.462 -6.800 1.00 0.00 N ATOM 0 H ASN A 53 -5.854 6.550 -5.372 1.00 0.00 H new ATOM 0 HA ASN A 53 -7.349 8.725 -4.600 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -6.703 7.311 -7.097 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -8.298 8.035 -7.160 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -4.857 10.331 -6.938 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -4.871 8.597 -6.598 1.00 0.00 H new ATOM 849 N ALA A 54 -9.132 6.020 -5.299 1.00 0.00 N ATOM 850 CA ALA A 54 -10.434 5.392 -5.154 1.00 0.00 C ATOM 851 C ALA A 54 -10.299 3.887 -5.396 1.00 0.00 C ATOM 852 O ALA A 54 -10.958 3.335 -6.276 1.00 0.00 O ATOM 853 CB ALA A 54 -11.428 6.050 -6.112 1.00 0.00 C ATOM 0 H ALA A 54 -8.406 5.414 -5.682 1.00 0.00 H new ATOM 0 HA ALA A 54 -10.816 5.530 -4.143 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.405 5.579 -6.003 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -11.509 7.112 -5.879 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.079 5.929 -7.138 1.00 0.00 H new ATOM 859 N CYS A 55 -9.440 3.267 -4.601 1.00 0.00 N ATOM 860 CA CYS A 55 -9.211 1.837 -4.718 1.00 0.00 C ATOM 861 C CYS A 55 -10.101 1.122 -3.700 1.00 0.00 C ATOM 862 O CYS A 55 -10.562 1.733 -2.737 1.00 0.00 O ATOM 863 CB CYS A 55 -7.733 1.484 -4.532 1.00 0.00 C ATOM 864 SG CYS A 55 -6.694 2.570 -5.576 1.00 0.00 S ATOM 0 H CYS A 55 -8.894 3.728 -3.873 1.00 0.00 H new ATOM 0 HA CYS A 55 -9.473 1.506 -5.723 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -7.453 1.596 -3.485 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -7.564 0.440 -4.797 1.00 0.00 H new ATOM 0 HG CYS A 55 -5.442 2.397 -5.271 1.00 0.00 H new ATOM 870 N GLU A 56 -10.315 -0.162 -3.947 1.00 0.00 N ATOM 871 CA GLU A 56 -11.142 -0.966 -3.064 1.00 0.00 C ATOM 872 C GLU A 56 -10.402 -2.244 -2.661 1.00 0.00 C ATOM 873 O GLU A 56 -9.369 -2.576 -3.241 1.00 0.00 O ATOM 874 CB GLU A 56 -12.486 -1.294 -3.718 1.00 0.00 C ATOM 875 CG GLU A 56 -13.446 -0.106 -3.623 1.00 0.00 C ATOM 876 CD GLU A 56 -14.872 -0.576 -3.328 1.00 0.00 C ATOM 877 OE1 GLU A 56 -15.317 -1.512 -4.028 1.00 0.00 O ATOM 878 OE2 GLU A 56 -15.485 0.011 -2.411 1.00 0.00 O ATOM 0 H GLU A 56 -9.930 -0.665 -4.746 1.00 0.00 H new ATOM 0 HA GLU A 56 -11.346 -0.387 -2.163 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -12.331 -1.558 -4.764 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -12.928 -2.164 -3.232 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -13.113 0.573 -2.838 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.430 0.455 -4.558 1.00 0.00 H new ATOM 885 N ILE A 57 -10.960 -2.926 -1.672 1.00 0.00 N ATOM 886 CA ILE A 57 -10.366 -4.159 -1.185 1.00 0.00 C ATOM 887 C ILE A 57 -11.367 -5.303 -1.353 1.00 0.00 C ATOM 888 O ILE A 57 -12.559 -5.133 -1.100 1.00 0.00 O ATOM 889 CB ILE A 57 -9.868 -3.984 0.251 1.00 0.00 C ATOM 890 CG1 ILE A 57 -8.340 -3.929 0.299 1.00 0.00 C ATOM 891 CG2 ILE A 57 -10.431 -5.075 1.164 1.00 0.00 C ATOM 892 CD1 ILE A 57 -7.856 -2.579 0.833 1.00 0.00 C ATOM 0 H ILE A 57 -11.817 -2.648 -1.195 1.00 0.00 H new ATOM 0 HA ILE A 57 -9.485 -4.416 -1.774 1.00 0.00 H new ATOM 0 HB ILE A 57 -10.236 -3.029 0.626 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -7.964 -4.731 0.934 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.935 -4.096 -0.699 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -10.061 -4.927 2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -11.520 -5.024 1.163 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -10.114 -6.053 0.801 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -6.766 -2.567 0.857 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.214 -1.781 0.182 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.243 -2.427 1.841 1.00 0.00 H new ATOM 904 N ILE A 58 -10.847 -6.445 -1.780 1.00 0.00 N ATOM 905 CA ILE A 58 -11.680 -7.617 -1.986 1.00 0.00 C ATOM 906 C ILE A 58 -11.263 -8.713 -1.003 1.00 0.00 C ATOM 907 O ILE A 58 -12.099 -9.488 -0.540 1.00 0.00 O ATOM 908 CB ILE A 58 -11.636 -8.056 -3.451 1.00 0.00 C ATOM 909 CG1 ILE A 58 -10.196 -8.284 -3.912 1.00 0.00 C ATOM 910 CG2 ILE A 58 -12.373 -7.056 -4.345 1.00 0.00 C ATOM 911 CD1 ILE A 58 -10.006 -9.711 -4.430 1.00 0.00 C ATOM 0 H ILE A 58 -9.858 -6.583 -1.989 1.00 0.00 H new ATOM 0 HA ILE A 58 -12.724 -7.383 -1.779 1.00 0.00 H new ATOM 0 HB ILE A 58 -12.156 -9.010 -3.538 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -9.945 -7.572 -4.698 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -9.512 -8.100 -3.084 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -12.327 -7.391 -5.381 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -13.415 -6.987 -4.032 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.903 -6.076 -4.260 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -8.973 -9.847 -4.752 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -10.235 -10.420 -3.635 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -10.674 -9.884 -5.273 1.00 0.00 H new ATOM 923 N GLU A 59 -9.971 -8.742 -0.713 1.00 0.00 N ATOM 924 CA GLU A 59 -9.432 -9.730 0.207 1.00 0.00 C ATOM 925 C GLU A 59 -9.108 -11.027 -0.538 1.00 0.00 C ATOM 926 O GLU A 59 -9.790 -11.383 -1.497 1.00 0.00 O ATOM 927 CB GLU A 59 -10.401 -9.989 1.362 1.00 0.00 C ATOM 928 CG GLU A 59 -9.645 -10.372 2.636 1.00 0.00 C ATOM 929 CD GLU A 59 -10.611 -10.837 3.728 1.00 0.00 C ATOM 930 OE1 GLU A 59 -11.701 -10.231 3.818 1.00 0.00 O ATOM 931 OE2 GLU A 59 -10.238 -11.789 4.448 1.00 0.00 O ATOM 0 H GLU A 59 -9.281 -8.097 -1.099 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.508 -9.337 0.632 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.001 -9.098 1.545 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -11.091 -10.788 1.090 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.931 -11.166 2.415 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.071 -9.517 2.993 1.00 0.00 H new ATOM 938 N ARG A 60 -8.066 -11.697 -0.067 1.00 0.00 N ATOM 939 CA ARG A 60 -7.643 -12.947 -0.676 1.00 0.00 C ATOM 940 C ARG A 60 -6.963 -13.840 0.364 1.00 0.00 C ATOM 941 O ARG A 60 -5.761 -14.085 0.286 1.00 0.00 O ATOM 942 CB ARG A 60 -6.675 -12.695 -1.833 1.00 0.00 C ATOM 943 CG ARG A 60 -7.429 -12.543 -3.156 1.00 0.00 C ATOM 944 CD ARG A 60 -7.266 -13.791 -4.026 1.00 0.00 C ATOM 945 NE ARG A 60 -5.963 -13.753 -4.726 1.00 0.00 N ATOM 946 CZ ARG A 60 -5.560 -14.673 -5.614 1.00 0.00 C ATOM 947 NH1 ARG A 60 -6.357 -15.706 -5.916 1.00 0.00 N ATOM 948 NH2 ARG A 60 -4.361 -14.558 -6.200 1.00 0.00 N ATOM 0 H ARG A 60 -7.502 -11.398 0.729 1.00 0.00 H new ATOM 0 HA ARG A 60 -8.532 -13.446 -1.063 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -6.094 -11.794 -1.636 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -5.968 -13.521 -1.906 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.487 -12.369 -2.958 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -7.057 -11.670 -3.693 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -7.330 -14.686 -3.408 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -8.077 -13.847 -4.752 1.00 0.00 H new ATOM 0 HE ARG A 60 -5.332 -12.979 -4.520 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -7.270 -15.793 -5.470 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -6.051 -16.406 -6.592 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -3.755 -13.771 -5.971 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.054 -15.258 -6.876 1.00 0.00 H new ATOM 962 N PRO A 61 -7.785 -14.316 1.338 1.00 0.00 N ATOM 963 CA PRO A 61 -7.275 -15.177 2.391 1.00 0.00 C ATOM 964 C PRO A 61 -7.020 -16.592 1.868 1.00 0.00 C ATOM 965 O PRO A 61 -6.434 -17.419 2.564 1.00 0.00 O ATOM 966 CB PRO A 61 -8.332 -15.129 3.483 1.00 0.00 C ATOM 967 CG PRO A 61 -9.599 -14.621 2.816 1.00 0.00 C ATOM 968 CD PRO A 61 -9.214 -14.047 1.462 1.00 0.00 C ATOM 0 HA PRO A 61 -6.309 -14.847 2.774 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -8.489 -16.116 3.918 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -8.026 -14.468 4.294 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -10.319 -15.431 2.697 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -10.076 -13.859 3.432 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -9.777 -14.519 0.657 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.422 -12.978 1.412 1.00 0.00 H new ATOM 976 N SER A 62 -7.474 -16.826 0.645 1.00 0.00 N ATOM 977 CA SER A 62 -7.302 -18.127 0.020 1.00 0.00 C ATOM 978 C SER A 62 -7.828 -19.226 0.945 1.00 0.00 C ATOM 979 O SER A 62 -8.421 -18.937 1.983 1.00 0.00 O ATOM 980 CB SER A 62 -5.833 -18.382 -0.326 1.00 0.00 C ATOM 981 OG SER A 62 -5.681 -19.459 -1.247 1.00 0.00 O ATOM 0 H SER A 62 -7.960 -16.137 0.071 1.00 0.00 H new ATOM 0 HA SER A 62 -7.873 -18.139 -0.908 1.00 0.00 H new ATOM 0 HB2 SER A 62 -5.398 -17.477 -0.751 1.00 0.00 H new ATOM 0 HB3 SER A 62 -5.279 -18.604 0.586 1.00 0.00 H new ATOM 0 HG SER A 62 -4.730 -19.589 -1.444 1.00 0.00 H new ATOM 987 N LYS A 63 -7.592 -20.464 0.535 1.00 0.00 N ATOM 988 CA LYS A 63 -8.035 -21.607 1.314 1.00 0.00 C ATOM 989 C LYS A 63 -7.046 -21.856 2.454 1.00 0.00 C ATOM 990 O LYS A 63 -6.060 -22.571 2.281 1.00 0.00 O ATOM 991 CB LYS A 63 -8.248 -22.822 0.409 1.00 0.00 C ATOM 992 CG LYS A 63 -9.699 -23.305 0.472 1.00 0.00 C ATOM 993 CD LYS A 63 -9.787 -24.811 0.217 1.00 0.00 C ATOM 994 CE LYS A 63 -9.973 -25.104 -1.274 1.00 0.00 C ATOM 995 NZ LYS A 63 -9.584 -26.499 -1.580 1.00 0.00 N ATOM 0 H LYS A 63 -7.100 -20.700 -0.327 1.00 0.00 H new ATOM 0 HA LYS A 63 -9.004 -21.404 1.770 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -7.991 -22.564 -0.618 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -7.579 -23.628 0.712 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.121 -23.073 1.450 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.296 -22.772 -0.268 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.881 -25.298 0.577 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -10.620 -25.231 0.781 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -11.013 -24.940 -1.556 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -9.370 -24.414 -1.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -9.716 -26.681 -2.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -8.585 -26.644 -1.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -10.177 -27.153 -1.031 1.00 0.00 H new ATOM 1009 N LYS A 64 -7.343 -21.252 3.596 1.00 0.00 N ATOM 1010 CA LYS A 64 -6.491 -21.399 4.764 1.00 0.00 C ATOM 1011 C LYS A 64 -5.071 -20.951 4.414 1.00 0.00 C ATOM 1012 O LYS A 64 -4.346 -21.661 3.718 1.00 0.00 O ATOM 1013 CB LYS A 64 -6.570 -22.827 5.308 1.00 0.00 C ATOM 1014 CG LYS A 64 -7.829 -23.022 6.156 1.00 0.00 C ATOM 1015 CD LYS A 64 -9.034 -23.364 5.277 1.00 0.00 C ATOM 1016 CE LYS A 64 -10.305 -22.696 5.805 1.00 0.00 C ATOM 1017 NZ LYS A 64 -11.089 -22.120 4.690 1.00 0.00 N ATOM 0 H LYS A 64 -8.162 -20.660 3.737 1.00 0.00 H new ATOM 0 HA LYS A 64 -6.838 -20.755 5.572 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -6.572 -23.536 4.480 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -5.686 -23.041 5.909 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -7.664 -23.820 6.880 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -8.034 -22.114 6.723 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -8.846 -23.039 4.254 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -9.172 -24.445 5.248 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -10.910 -23.426 6.344 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -10.043 -21.912 6.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -11.948 -21.671 5.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -10.515 -21.409 4.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -11.355 -22.875 4.026 1.00 0.00 H new ATOM 1031 N ASP A 65 -4.715 -19.776 4.913 1.00 0.00 N ATOM 1032 CA ASP A 65 -3.394 -19.226 4.662 1.00 0.00 C ATOM 1033 C ASP A 65 -3.301 -17.831 5.283 1.00 0.00 C ATOM 1034 O ASP A 65 -3.111 -16.843 4.575 1.00 0.00 O ATOM 1035 CB ASP A 65 -3.129 -19.094 3.161 1.00 0.00 C ATOM 1036 CG ASP A 65 -1.657 -19.187 2.754 1.00 0.00 C ATOM 1037 OD1 ASP A 65 -0.890 -19.792 3.533 1.00 0.00 O ATOM 1038 OD2 ASP A 65 -1.332 -18.651 1.672 1.00 0.00 O ATOM 0 H ASP A 65 -5.319 -19.190 5.490 1.00 0.00 H new ATOM 0 HA ASP A 65 -2.659 -19.901 5.100 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.685 -19.873 2.639 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -3.525 -18.137 2.820 1.00 0.00 H new ATOM 1043 N GLY A 66 -3.440 -17.794 6.600 1.00 0.00 N ATOM 1044 CA GLY A 66 -3.374 -16.537 7.325 1.00 0.00 C ATOM 1045 C GLY A 66 -4.468 -15.575 6.856 1.00 0.00 C ATOM 1046 O GLY A 66 -5.636 -15.743 7.201 1.00 0.00 O ATOM 0 H GLY A 66 -3.598 -18.615 7.184 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.482 -16.723 8.393 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -2.395 -16.080 7.179 1.00 0.00 H new ATOM 1050 N PHE A 67 -4.050 -14.589 6.076 1.00 0.00 N ATOM 1051 CA PHE A 67 -4.979 -13.601 5.556 1.00 0.00 C ATOM 1052 C PHE A 67 -4.270 -12.618 4.622 1.00 0.00 C ATOM 1053 O PHE A 67 -3.306 -11.965 5.020 1.00 0.00 O ATOM 1054 CB PHE A 67 -5.536 -12.834 6.757 1.00 0.00 C ATOM 1055 CG PHE A 67 -6.656 -11.853 6.405 1.00 0.00 C ATOM 1056 CD1 PHE A 67 -6.390 -10.767 5.630 1.00 0.00 C ATOM 1057 CD2 PHE A 67 -7.917 -12.068 6.866 1.00 0.00 C ATOM 1058 CE1 PHE A 67 -7.430 -9.857 5.304 1.00 0.00 C ATOM 1059 CE2 PHE A 67 -8.957 -11.157 6.539 1.00 0.00 C ATOM 1060 CZ PHE A 67 -8.691 -10.071 5.765 1.00 0.00 C ATOM 0 H PHE A 67 -3.080 -14.453 5.792 1.00 0.00 H new ATOM 0 HA PHE A 67 -5.767 -14.095 4.988 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -5.910 -13.549 7.490 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.723 -12.286 7.233 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -5.389 -10.597 5.263 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -8.128 -12.931 7.480 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -7.219 -8.994 4.689 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -9.959 -11.327 6.905 1.00 0.00 H new ATOM 0 HZ PHE A 67 -9.482 -9.378 5.516 1.00 0.00 H new ATOM 1070 N CYS A 68 -4.773 -12.545 3.399 1.00 0.00 N ATOM 1071 CA CYS A 68 -4.199 -11.653 2.406 1.00 0.00 C ATOM 1072 C CYS A 68 -5.343 -10.931 1.690 1.00 0.00 C ATOM 1073 O CYS A 68 -6.507 -11.296 1.848 1.00 0.00 O ATOM 1074 CB CYS A 68 -3.296 -12.404 1.425 1.00 0.00 C ATOM 1075 SG CYS A 68 -2.061 -13.393 2.344 1.00 0.00 S ATOM 0 H CYS A 68 -5.572 -13.089 3.073 1.00 0.00 H new ATOM 0 HA CYS A 68 -3.560 -10.920 2.898 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -3.897 -13.056 0.791 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -2.791 -11.696 0.768 1.00 0.00 H new ATOM 0 HG CYS A 68 -1.301 -14.028 1.502 1.00 0.00 H new ATOM 1081 N PHE A 69 -4.972 -9.920 0.920 1.00 0.00 N ATOM 1082 CA PHE A 69 -5.952 -9.143 0.179 1.00 0.00 C ATOM 1083 C PHE A 69 -5.321 -8.497 -1.056 1.00 0.00 C ATOM 1084 O PHE A 69 -4.126 -8.655 -1.301 1.00 0.00 O ATOM 1085 CB PHE A 69 -6.451 -8.042 1.117 1.00 0.00 C ATOM 1086 CG PHE A 69 -5.372 -7.040 1.530 1.00 0.00 C ATOM 1087 CD1 PHE A 69 -4.380 -7.419 2.379 1.00 0.00 C ATOM 1088 CD2 PHE A 69 -5.404 -5.769 1.047 1.00 0.00 C ATOM 1089 CE1 PHE A 69 -3.378 -6.489 2.762 1.00 0.00 C ATOM 1090 CE2 PHE A 69 -4.402 -4.838 1.430 1.00 0.00 C ATOM 1091 CZ PHE A 69 -3.410 -5.218 2.279 1.00 0.00 C ATOM 0 H PHE A 69 -4.006 -9.620 0.792 1.00 0.00 H new ATOM 0 HA PHE A 69 -6.762 -9.790 -0.157 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -7.264 -7.504 0.629 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -6.866 -8.503 2.013 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -4.354 -8.428 2.762 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -6.191 -5.468 0.372 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -2.591 -6.791 3.437 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -4.428 -3.829 1.047 1.00 0.00 H new ATOM 0 HZ PHE A 69 -2.648 -4.510 2.570 1.00 0.00 H new ATOM 1101 N LYS A 70 -6.152 -7.784 -1.801 1.00 0.00 N ATOM 1102 CA LYS A 70 -5.690 -7.114 -3.005 1.00 0.00 C ATOM 1103 C LYS A 70 -6.412 -5.772 -3.145 1.00 0.00 C ATOM 1104 O LYS A 70 -7.581 -5.650 -2.780 1.00 0.00 O ATOM 1105 CB LYS A 70 -5.849 -8.027 -4.221 1.00 0.00 C ATOM 1106 CG LYS A 70 -7.238 -7.873 -4.845 1.00 0.00 C ATOM 1107 CD LYS A 70 -7.151 -7.211 -6.221 1.00 0.00 C ATOM 1108 CE LYS A 70 -8.275 -7.699 -7.137 1.00 0.00 C ATOM 1109 NZ LYS A 70 -7.746 -8.639 -8.150 1.00 0.00 N ATOM 0 H LYS A 70 -7.143 -7.655 -1.595 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.624 -6.898 -2.935 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -5.085 -7.789 -4.961 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.693 -9.064 -3.924 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.709 -8.851 -4.937 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -7.871 -7.275 -4.189 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -7.211 -6.128 -6.112 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.185 -7.433 -6.675 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -9.047 -8.190 -6.545 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -8.744 -6.849 -7.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.522 -8.961 -8.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.025 -8.159 -8.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.319 -9.459 -7.673 1.00 0.00 H new ATOM 1123 N LEU A 71 -5.686 -4.798 -3.673 1.00 0.00 N ATOM 1124 CA LEU A 71 -6.242 -3.470 -3.866 1.00 0.00 C ATOM 1125 C LEU A 71 -6.062 -3.053 -5.327 1.00 0.00 C ATOM 1126 O LEU A 71 -4.938 -2.848 -5.784 1.00 0.00 O ATOM 1127 CB LEU A 71 -5.635 -2.484 -2.866 1.00 0.00 C ATOM 1128 CG LEU A 71 -6.190 -1.059 -2.907 1.00 0.00 C ATOM 1129 CD1 LEU A 71 -6.497 -0.549 -1.497 1.00 0.00 C ATOM 1130 CD2 LEU A 71 -5.244 -0.123 -3.661 1.00 0.00 C ATOM 0 H LEU A 71 -4.717 -4.902 -3.973 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.313 -3.473 -3.665 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.781 -2.881 -1.861 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.560 -2.439 -3.038 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.132 -1.076 -3.456 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.890 0.466 -1.555 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.236 -1.198 -1.028 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.583 -0.551 -0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.663 0.883 -3.675 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.275 -0.106 -3.162 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.119 -0.478 -4.684 1.00 0.00 H new ATOM 1142 N PHE A 72 -7.186 -2.940 -6.020 1.00 0.00 N ATOM 1143 CA PHE A 72 -7.166 -2.551 -7.420 1.00 0.00 C ATOM 1144 C PHE A 72 -8.039 -1.317 -7.659 1.00 0.00 C ATOM 1145 O PHE A 72 -8.914 -1.006 -6.853 1.00 0.00 O ATOM 1146 CB PHE A 72 -7.735 -3.726 -8.218 1.00 0.00 C ATOM 1147 CG PHE A 72 -9.230 -3.963 -7.997 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -9.650 -4.715 -6.944 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -10.138 -3.422 -8.852 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -11.038 -4.935 -6.739 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -11.526 -3.642 -8.647 1.00 0.00 C ATOM 1152 CZ PHE A 72 -11.947 -4.394 -7.594 1.00 0.00 C ATOM 0 H PHE A 72 -8.116 -3.111 -5.638 1.00 0.00 H new ATOM 0 HA PHE A 72 -6.148 -2.307 -7.724 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.559 -3.550 -9.279 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.191 -4.631 -7.950 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -8.929 -5.144 -6.265 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -9.804 -2.825 -9.687 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -11.372 -5.532 -5.904 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -12.247 -3.213 -9.327 1.00 0.00 H new ATOM 0 HZ PHE A 72 -13.002 -4.561 -7.437 1.00 0.00 H new ATOM 1162 N HIS A 73 -7.770 -0.648 -8.770 1.00 0.00 N ATOM 1163 CA HIS A 73 -8.520 0.545 -9.125 1.00 0.00 C ATOM 1164 C HIS A 73 -9.744 0.153 -9.956 1.00 0.00 C ATOM 1165 O HIS A 73 -9.621 -0.562 -10.949 1.00 0.00 O ATOM 1166 CB HIS A 73 -7.622 1.560 -9.835 1.00 0.00 C ATOM 1167 CG HIS A 73 -8.023 2.998 -9.610 1.00 0.00 C ATOM 1168 ND1 HIS A 73 -8.976 3.640 -10.382 1.00 0.00 N ATOM 1169 CD2 HIS A 73 -7.592 3.910 -8.692 1.00 0.00 C ATOM 1170 CE1 HIS A 73 -9.103 4.883 -9.940 1.00 0.00 C ATOM 1171 NE2 HIS A 73 -8.244 5.048 -8.893 1.00 0.00 N ATOM 0 H HIS A 73 -7.043 -0.909 -9.436 1.00 0.00 H new ATOM 0 HA HIS A 73 -8.880 1.036 -8.221 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -6.596 1.422 -9.495 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.633 1.354 -10.905 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -6.846 3.735 -7.930 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -9.769 5.634 -10.339 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -8.123 5.905 -8.354 1.00 0.00 H new ATOM 1179 N PRO A 74 -10.927 0.652 -9.507 1.00 0.00 N ATOM 1180 CA PRO A 74 -12.172 0.361 -10.197 1.00 0.00 C ATOM 1181 C PRO A 74 -12.282 1.170 -11.491 1.00 0.00 C ATOM 1182 O PRO A 74 -12.863 0.705 -12.471 1.00 0.00 O ATOM 1183 CB PRO A 74 -13.264 0.693 -9.194 1.00 0.00 C ATOM 1184 CG PRO A 74 -12.616 1.591 -8.153 1.00 0.00 C ATOM 1185 CD PRO A 74 -11.109 1.502 -8.334 1.00 0.00 C ATOM 0 HA PRO A 74 -12.245 -0.679 -10.515 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.099 1.198 -9.679 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -13.661 -0.213 -8.736 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -12.955 2.620 -8.273 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -12.899 1.277 -7.148 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -10.670 2.488 -8.487 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -10.629 1.072 -7.455 1.00 0.00 H new ATOM 1193 N LEU A 75 -11.716 2.368 -11.453 1.00 0.00 N ATOM 1194 CA LEU A 75 -11.744 3.246 -12.611 1.00 0.00 C ATOM 1195 C LEU A 75 -10.588 2.886 -13.546 1.00 0.00 C ATOM 1196 O LEU A 75 -10.366 3.559 -14.551 1.00 0.00 O ATOM 1197 CB LEU A 75 -11.746 4.711 -12.171 1.00 0.00 C ATOM 1198 CG LEU A 75 -12.556 5.033 -10.913 1.00 0.00 C ATOM 1199 CD1 LEU A 75 -12.450 6.517 -10.558 1.00 0.00 C ATOM 1200 CD2 LEU A 75 -14.010 4.583 -11.067 1.00 0.00 C ATOM 0 H LEU A 75 -11.236 2.751 -10.639 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.666 3.105 -13.175 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -10.714 5.021 -12.004 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -12.132 5.316 -12.992 1.00 0.00 H new ATOM 0 HG LEU A 75 -12.132 4.472 -10.081 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -13.035 6.719 -9.660 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -11.406 6.774 -10.377 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -12.833 7.117 -11.383 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -14.563 4.824 -10.159 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -14.462 5.098 -11.915 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -14.042 3.507 -11.237 1.00 0.00 H new ATOM 1212 N GLU A 76 -9.882 1.825 -13.182 1.00 0.00 N ATOM 1213 CA GLU A 76 -8.755 1.368 -13.976 1.00 0.00 C ATOM 1214 C GLU A 76 -7.916 2.560 -14.443 1.00 0.00 C ATOM 1215 O GLU A 76 -8.018 2.982 -15.594 1.00 0.00 O ATOM 1216 CB GLU A 76 -9.227 0.530 -15.167 1.00 0.00 C ATOM 1217 CG GLU A 76 -9.047 -0.964 -14.891 1.00 0.00 C ATOM 1218 CD GLU A 76 -9.161 -1.777 -16.182 1.00 0.00 C ATOM 1219 OE1 GLU A 76 -10.312 -2.101 -16.548 1.00 0.00 O ATOM 1220 OE2 GLU A 76 -8.096 -2.057 -16.773 1.00 0.00 O ATOM 0 H GLU A 76 -10.069 1.269 -12.348 1.00 0.00 H new ATOM 0 HA GLU A 76 -8.130 0.731 -13.350 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -10.276 0.742 -15.372 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -8.665 0.809 -16.058 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -8.074 -1.138 -14.432 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -9.800 -1.299 -14.178 1.00 0.00 H new ATOM 1227 N GLN A 77 -7.107 3.068 -13.526 1.00 0.00 N ATOM 1228 CA GLN A 77 -6.251 4.203 -13.829 1.00 0.00 C ATOM 1229 C GLN A 77 -4.795 3.874 -13.494 1.00 0.00 C ATOM 1230 O GLN A 77 -4.006 3.556 -14.383 1.00 0.00 O ATOM 1231 CB GLN A 77 -6.716 5.455 -13.082 1.00 0.00 C ATOM 1232 CG GLN A 77 -8.129 5.855 -13.511 1.00 0.00 C ATOM 1233 CD GLN A 77 -8.104 6.613 -14.840 1.00 0.00 C ATOM 1234 OE1 GLN A 77 -7.088 6.716 -15.507 1.00 0.00 O ATOM 1235 NE2 GLN A 77 -9.277 7.136 -15.186 1.00 0.00 N ATOM 0 H GLN A 77 -7.026 2.715 -12.573 1.00 0.00 H new ATOM 0 HA GLN A 77 -6.320 4.410 -14.897 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -6.697 5.270 -12.008 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.026 6.276 -13.277 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -8.749 4.964 -13.608 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -8.584 6.478 -12.741 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -10.089 7.012 -14.581 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -9.365 7.661 -16.056 1.00 0.00 H new ATOM 1244 N SER A 78 -4.482 3.961 -12.209 1.00 0.00 N ATOM 1245 CA SER A 78 -3.134 3.677 -11.746 1.00 0.00 C ATOM 1246 C SER A 78 -3.065 3.813 -10.224 1.00 0.00 C ATOM 1247 O SER A 78 -3.426 4.852 -9.673 1.00 0.00 O ATOM 1248 CB SER A 78 -2.116 4.606 -12.409 1.00 0.00 C ATOM 1249 OG SER A 78 -0.791 4.087 -12.335 1.00 0.00 O ATOM 0 H SER A 78 -5.139 4.224 -11.474 1.00 0.00 H new ATOM 0 HA SER A 78 -2.885 2.653 -12.025 1.00 0.00 H new ATOM 0 HB2 SER A 78 -2.389 4.756 -13.454 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.150 5.583 -11.927 1.00 0.00 H new ATOM 0 HG SER A 78 -0.171 4.709 -12.771 1.00 0.00 H new ATOM 1255 N ILE A 79 -2.598 2.749 -9.587 1.00 0.00 N ATOM 1256 CA ILE A 79 -2.476 2.736 -8.139 1.00 0.00 C ATOM 1257 C ILE A 79 -1.009 2.931 -7.753 1.00 0.00 C ATOM 1258 O ILE A 79 -0.525 2.315 -6.805 1.00 0.00 O ATOM 1259 CB ILE A 79 -3.101 1.466 -7.560 1.00 0.00 C ATOM 1260 CG1 ILE A 79 -2.262 0.234 -7.908 1.00 0.00 C ATOM 1261 CG2 ILE A 79 -4.555 1.314 -8.012 1.00 0.00 C ATOM 1262 CD1 ILE A 79 -2.267 -0.775 -6.758 1.00 0.00 C ATOM 0 H ILE A 79 -2.299 1.889 -10.048 1.00 0.00 H new ATOM 0 HA ILE A 79 -3.033 3.565 -7.703 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.109 1.555 -6.474 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -2.655 -0.235 -8.810 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.238 0.537 -8.127 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.975 0.403 -7.586 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.133 2.173 -7.673 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -4.594 1.257 -9.100 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.664 -1.641 -7.031 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.851 -0.310 -5.864 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.290 -1.094 -6.558 1.00 0.00 H new ATOM 1274 N TRP A 80 -0.341 3.791 -8.508 1.00 0.00 N ATOM 1275 CA TRP A 80 1.062 4.075 -8.257 1.00 0.00 C ATOM 1276 C TRP A 80 1.275 5.581 -8.415 1.00 0.00 C ATOM 1277 O TRP A 80 0.576 6.233 -9.188 1.00 0.00 O ATOM 1278 CB TRP A 80 1.962 3.244 -9.175 1.00 0.00 C ATOM 1279 CG TRP A 80 1.964 1.748 -8.857 1.00 0.00 C ATOM 1280 CD1 TRP A 80 1.310 0.768 -9.495 1.00 0.00 C ATOM 1281 CD2 TRP A 80 2.685 1.097 -7.789 1.00 0.00 C ATOM 1282 NE1 TRP A 80 1.556 -0.462 -8.919 1.00 0.00 N ATOM 1283 CE2 TRP A 80 2.418 -0.256 -7.849 1.00 0.00 C ATOM 1284 CE3 TRP A 80 3.535 1.633 -6.806 1.00 0.00 C ATOM 1285 CZ2 TRP A 80 2.961 -1.184 -6.953 1.00 0.00 C ATOM 1286 CZ3 TRP A 80 4.069 0.692 -5.917 1.00 0.00 C ATOM 1287 CH2 TRP A 80 3.810 -0.673 -5.964 1.00 0.00 C ATOM 0 H TRP A 80 -0.745 4.300 -9.294 1.00 0.00 H new ATOM 0 HA TRP A 80 1.338 3.789 -7.242 1.00 0.00 H new ATOM 0 HB2 TRP A 80 1.640 3.385 -10.207 1.00 0.00 H new ATOM 0 HB3 TRP A 80 2.982 3.621 -9.105 1.00 0.00 H new ATOM 0 HD1 TRP A 80 0.671 0.921 -10.352 1.00 0.00 H new ATOM 0 HE1 TRP A 80 1.175 -1.358 -9.223 1.00 0.00 H new ATOM 0 HE3 TRP A 80 3.759 2.688 -6.741 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 2.737 -2.238 -7.021 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 4.728 1.052 -5.141 1.00 0.00 H new ATOM 0 HH2 TRP A 80 4.262 -1.336 -5.241 1.00 0.00 H new ATOM 1298 N ALA A 81 2.245 6.091 -7.669 1.00 0.00 N ATOM 1299 CA ALA A 81 2.559 7.509 -7.716 1.00 0.00 C ATOM 1300 C ALA A 81 3.783 7.726 -8.607 1.00 0.00 C ATOM 1301 O ALA A 81 4.689 6.894 -8.638 1.00 0.00 O ATOM 1302 CB ALA A 81 2.772 8.032 -6.294 1.00 0.00 C ATOM 0 H ALA A 81 2.824 5.547 -7.029 1.00 0.00 H new ATOM 0 HA ALA A 81 1.732 8.072 -8.149 1.00 0.00 H new ATOM 0 HB1 ALA A 81 3.008 9.096 -6.329 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.864 7.880 -5.711 1.00 0.00 H new ATOM 0 HB3 ALA A 81 3.597 7.493 -5.828 1.00 0.00 H new ATOM 1308 N VAL A 82 3.771 8.849 -9.311 1.00 0.00 N ATOM 1309 CA VAL A 82 4.869 9.186 -10.201 1.00 0.00 C ATOM 1310 C VAL A 82 6.122 9.474 -9.371 1.00 0.00 C ATOM 1311 O VAL A 82 7.220 9.055 -9.733 1.00 0.00 O ATOM 1312 CB VAL A 82 4.470 10.353 -11.105 1.00 0.00 C ATOM 1313 CG1 VAL A 82 3.155 10.060 -11.830 1.00 0.00 C ATOM 1314 CG2 VAL A 82 4.379 11.657 -10.310 1.00 0.00 C ATOM 0 H VAL A 82 3.018 9.537 -9.283 1.00 0.00 H new ATOM 0 HA VAL A 82 5.100 8.347 -10.858 1.00 0.00 H new ATOM 0 HB VAL A 82 5.248 10.474 -11.858 1.00 0.00 H new ATOM 0 HG11 VAL A 82 2.894 10.906 -12.466 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.269 9.166 -12.443 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.364 9.899 -11.098 1.00 0.00 H new ATOM 0 HG21 VAL A 82 4.094 12.471 -10.977 1.00 0.00 H new ATOM 0 HG22 VAL A 82 3.631 11.553 -9.524 1.00 0.00 H new ATOM 0 HG23 VAL A 82 5.348 11.878 -9.862 1.00 0.00 H new ATOM 1324 N LYS A 83 5.915 10.188 -8.274 1.00 0.00 N ATOM 1325 CA LYS A 83 7.014 10.537 -7.390 1.00 0.00 C ATOM 1326 C LYS A 83 6.914 9.709 -6.107 1.00 0.00 C ATOM 1327 O LYS A 83 6.149 8.748 -6.042 1.00 0.00 O ATOM 1328 CB LYS A 83 7.047 12.047 -7.147 1.00 0.00 C ATOM 1329 CG LYS A 83 5.632 12.628 -7.114 1.00 0.00 C ATOM 1330 CD LYS A 83 4.818 12.024 -5.968 1.00 0.00 C ATOM 1331 CE LYS A 83 3.543 11.359 -6.492 1.00 0.00 C ATOM 1332 NZ LYS A 83 2.397 11.668 -5.609 1.00 0.00 N ATOM 0 H LYS A 83 5.003 10.534 -7.977 1.00 0.00 H new ATOM 0 HA LYS A 83 7.969 10.291 -7.854 1.00 0.00 H new ATOM 0 HB2 LYS A 83 7.552 12.256 -6.204 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.625 12.533 -7.933 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.682 13.711 -6.998 1.00 0.00 H new ATOM 0 HG3 LYS A 83 5.132 12.432 -8.063 1.00 0.00 H new ATOM 0 HD2 LYS A 83 5.423 11.290 -5.435 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.558 12.803 -5.252 1.00 0.00 H new ATOM 0 HE2 LYS A 83 3.334 11.706 -7.504 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.685 10.280 -6.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.540 11.209 -5.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.592 11.315 -4.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.252 12.697 -5.576 1.00 0.00 H new ATOM 1346 N GLY A 84 7.697 10.113 -5.118 1.00 0.00 N ATOM 1347 CA GLY A 84 7.706 9.421 -3.840 1.00 0.00 C ATOM 1348 C GLY A 84 7.510 10.403 -2.683 1.00 0.00 C ATOM 1349 O GLY A 84 6.784 11.387 -2.815 1.00 0.00 O ATOM 0 H GLY A 84 8.330 10.911 -5.176 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.915 8.671 -3.823 1.00 0.00 H new ATOM 0 HA3 GLY A 84 8.650 8.891 -3.716 1.00 0.00 H new ATOM 1353 N PRO A 85 8.188 10.093 -1.545 1.00 0.00 N ATOM 1354 CA PRO A 85 8.096 10.937 -0.366 1.00 0.00 C ATOM 1355 C PRO A 85 8.911 12.219 -0.544 1.00 0.00 C ATOM 1356 O PRO A 85 8.482 13.295 -0.129 1.00 0.00 O ATOM 1357 CB PRO A 85 8.595 10.070 0.778 1.00 0.00 C ATOM 1358 CG PRO A 85 9.381 8.940 0.132 1.00 0.00 C ATOM 1359 CD PRO A 85 9.057 8.936 -1.353 1.00 0.00 C ATOM 0 HA PRO A 85 7.080 11.281 -0.174 1.00 0.00 H new ATOM 0 HB2 PRO A 85 9.224 10.645 1.458 1.00 0.00 H new ATOM 0 HB3 PRO A 85 7.763 9.681 1.365 1.00 0.00 H new ATOM 0 HG2 PRO A 85 10.450 9.081 0.289 1.00 0.00 H new ATOM 0 HG3 PRO A 85 9.116 7.984 0.583 1.00 0.00 H new ATOM 0 HD2 PRO A 85 9.962 9.016 -1.956 1.00 0.00 H new ATOM 0 HD3 PRO A 85 8.558 8.013 -1.647 1.00 0.00 H new ATOM 1367 N LYS A 86 10.072 12.063 -1.163 1.00 0.00 N ATOM 1368 CA LYS A 86 10.951 13.195 -1.401 1.00 0.00 C ATOM 1369 C LYS A 86 10.910 13.564 -2.885 1.00 0.00 C ATOM 1370 O LYS A 86 11.951 13.777 -3.505 1.00 0.00 O ATOM 1371 CB LYS A 86 12.359 12.900 -0.880 1.00 0.00 C ATOM 1372 CG LYS A 86 12.374 12.830 0.649 1.00 0.00 C ATOM 1373 CD LYS A 86 11.983 11.435 1.138 1.00 0.00 C ATOM 1374 CE LYS A 86 11.265 11.508 2.488 1.00 0.00 C ATOM 1375 NZ LYS A 86 11.012 10.148 3.015 1.00 0.00 N ATOM 0 H LYS A 86 10.424 11.170 -1.507 1.00 0.00 H new ATOM 0 HA LYS A 86 10.607 14.067 -0.845 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.714 11.956 -1.294 1.00 0.00 H new ATOM 0 HB3 LYS A 86 13.046 13.675 -1.219 1.00 0.00 H new ATOM 0 HG2 LYS A 86 13.368 13.083 1.018 1.00 0.00 H new ATOM 0 HG3 LYS A 86 11.684 13.569 1.057 1.00 0.00 H new ATOM 0 HD2 LYS A 86 11.336 10.956 0.403 1.00 0.00 H new ATOM 0 HD3 LYS A 86 12.875 10.815 1.229 1.00 0.00 H new ATOM 0 HE2 LYS A 86 11.869 12.073 3.198 1.00 0.00 H new ATOM 0 HE3 LYS A 86 10.322 12.042 2.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 10.018 10.070 3.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.208 9.446 2.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 11.632 9.971 3.831 1.00 0.00 H new ATOM 1389 N GLY A 87 9.696 13.628 -3.413 1.00 0.00 N ATOM 1390 CA GLY A 87 9.506 13.967 -4.813 1.00 0.00 C ATOM 1391 C GLY A 87 10.606 13.352 -5.681 1.00 0.00 C ATOM 1392 O GLY A 87 11.332 14.069 -6.369 1.00 0.00 O ATOM 0 H GLY A 87 8.835 13.451 -2.896 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.532 13.611 -5.148 1.00 0.00 H new ATOM 0 HA3 GLY A 87 9.507 15.051 -4.932 1.00 0.00 H new ATOM 1396 N GLU A 88 10.696 12.032 -5.619 1.00 0.00 N ATOM 1397 CA GLU A 88 11.695 11.313 -6.391 1.00 0.00 C ATOM 1398 C GLU A 88 11.020 10.327 -7.346 1.00 0.00 C ATOM 1399 O GLU A 88 10.071 9.642 -6.969 1.00 0.00 O ATOM 1400 CB GLU A 88 12.686 10.596 -5.472 1.00 0.00 C ATOM 1401 CG GLU A 88 13.856 11.510 -5.106 1.00 0.00 C ATOM 1402 CD GLU A 88 14.829 10.804 -4.159 1.00 0.00 C ATOM 1403 OE1 GLU A 88 14.333 10.205 -3.181 1.00 0.00 O ATOM 1404 OE2 GLU A 88 16.046 10.881 -4.435 1.00 0.00 O ATOM 0 H GLU A 88 10.093 11.441 -5.046 1.00 0.00 H new ATOM 0 HA GLU A 88 12.257 12.035 -6.984 1.00 0.00 H new ATOM 0 HB2 GLU A 88 12.176 10.271 -4.565 1.00 0.00 H new ATOM 0 HB3 GLU A 88 13.061 9.699 -5.965 1.00 0.00 H new ATOM 0 HG2 GLU A 88 14.381 11.815 -6.011 1.00 0.00 H new ATOM 0 HG3 GLU A 88 13.479 12.418 -4.635 1.00 0.00 H new ATOM 1411 N ALA A 89 11.537 10.286 -8.566 1.00 0.00 N ATOM 1412 CA ALA A 89 10.996 9.395 -9.578 1.00 0.00 C ATOM 1413 C ALA A 89 10.659 8.047 -8.937 1.00 0.00 C ATOM 1414 O ALA A 89 9.512 7.605 -8.980 1.00 0.00 O ATOM 1415 CB ALA A 89 11.997 9.260 -10.727 1.00 0.00 C ATOM 0 H ALA A 89 12.325 10.855 -8.876 1.00 0.00 H new ATOM 0 HA ALA A 89 10.074 9.802 -9.994 1.00 0.00 H new ATOM 0 HB1 ALA A 89 11.591 8.592 -11.486 1.00 0.00 H new ATOM 0 HB2 ALA A 89 12.180 10.240 -11.167 1.00 0.00 H new ATOM 0 HB3 ALA A 89 12.934 8.852 -10.347 1.00 0.00 H new ATOM 1421 N VAL A 90 11.679 7.432 -8.358 1.00 0.00 N ATOM 1422 CA VAL A 90 11.505 6.143 -7.709 1.00 0.00 C ATOM 1423 C VAL A 90 12.712 5.862 -6.811 1.00 0.00 C ATOM 1424 O VAL A 90 13.816 6.330 -7.085 1.00 0.00 O ATOM 1425 CB VAL A 90 11.275 5.055 -8.760 1.00 0.00 C ATOM 1426 CG1 VAL A 90 12.198 5.252 -9.964 1.00 0.00 C ATOM 1427 CG2 VAL A 90 11.455 3.661 -8.154 1.00 0.00 C ATOM 0 H VAL A 90 12.629 7.802 -8.324 1.00 0.00 H new ATOM 0 HA VAL A 90 10.621 6.152 -7.072 1.00 0.00 H new ATOM 0 HB VAL A 90 10.246 5.139 -9.109 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.014 4.465 -10.696 1.00 0.00 H new ATOM 0 HG12 VAL A 90 12.002 6.223 -10.418 1.00 0.00 H new ATOM 0 HG13 VAL A 90 13.237 5.208 -9.637 1.00 0.00 H new ATOM 0 HG21 VAL A 90 11.286 2.906 -8.922 1.00 0.00 H new ATOM 0 HG22 VAL A 90 12.468 3.562 -7.764 1.00 0.00 H new ATOM 0 HG23 VAL A 90 10.739 3.521 -7.344 1.00 0.00 H new ATOM 1437 N GLY A 91 12.460 5.099 -5.758 1.00 0.00 N ATOM 1438 CA GLY A 91 13.512 4.750 -4.818 1.00 0.00 C ATOM 1439 C GLY A 91 14.380 3.614 -5.363 1.00 0.00 C ATOM 1440 O GLY A 91 14.873 3.690 -6.488 1.00 0.00 O ATOM 0 H GLY A 91 11.543 4.713 -5.535 1.00 0.00 H new ATOM 0 HA2 GLY A 91 14.133 5.624 -4.621 1.00 0.00 H new ATOM 0 HA3 GLY A 91 13.071 4.451 -3.867 1.00 0.00 H new ATOM 1444 N SER A 92 14.539 2.587 -4.541 1.00 0.00 N ATOM 1445 CA SER A 92 15.339 1.437 -4.927 1.00 0.00 C ATOM 1446 C SER A 92 14.589 0.604 -5.969 1.00 0.00 C ATOM 1447 O SER A 92 13.397 0.810 -6.192 1.00 0.00 O ATOM 1448 CB SER A 92 15.688 0.576 -3.711 1.00 0.00 C ATOM 1449 OG SER A 92 17.095 0.402 -3.567 1.00 0.00 O ATOM 0 H SER A 92 14.128 2.527 -3.610 1.00 0.00 H new ATOM 0 HA SER A 92 16.271 1.799 -5.362 1.00 0.00 H new ATOM 0 HB2 SER A 92 15.286 1.040 -2.810 1.00 0.00 H new ATOM 0 HB3 SER A 92 15.210 -0.399 -3.808 1.00 0.00 H new ATOM 0 HG SER A 92 17.380 0.750 -2.696 1.00 0.00 H new ATOM 1455 N ILE A 93 15.318 -0.319 -6.578 1.00 0.00 N ATOM 1456 CA ILE A 93 14.737 -1.183 -7.591 1.00 0.00 C ATOM 1457 C ILE A 93 14.895 -2.643 -7.161 1.00 0.00 C ATOM 1458 O ILE A 93 15.993 -3.194 -7.215 1.00 0.00 O ATOM 1459 CB ILE A 93 15.338 -0.878 -8.965 1.00 0.00 C ATOM 1460 CG1 ILE A 93 15.425 0.630 -9.203 1.00 0.00 C ATOM 1461 CG2 ILE A 93 14.560 -1.589 -10.074 1.00 0.00 C ATOM 1462 CD1 ILE A 93 14.135 1.162 -9.830 1.00 0.00 C ATOM 0 H ILE A 93 16.306 -0.487 -6.389 1.00 0.00 H new ATOM 0 HA ILE A 93 13.668 -0.992 -7.687 1.00 0.00 H new ATOM 0 HB ILE A 93 16.356 -1.266 -8.986 1.00 0.00 H new ATOM 0 HG12 ILE A 93 15.612 1.141 -8.258 1.00 0.00 H new ATOM 0 HG13 ILE A 93 16.269 0.850 -9.857 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.008 -1.355 -11.040 1.00 0.00 H new ATOM 0 HG22 ILE A 93 14.594 -2.666 -9.909 1.00 0.00 H new ATOM 0 HG23 ILE A 93 13.523 -1.253 -10.064 1.00 0.00 H new ATOM 0 HD11 ILE A 93 14.224 2.237 -9.989 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.964 0.667 -10.786 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.297 0.962 -9.163 1.00 0.00 H new ATOM 1474 N THR A 94 13.781 -3.227 -6.744 1.00 0.00 N ATOM 1475 CA THR A 94 13.782 -4.612 -6.305 1.00 0.00 C ATOM 1476 C THR A 94 12.790 -5.434 -7.131 1.00 0.00 C ATOM 1477 O THR A 94 12.491 -5.089 -8.273 1.00 0.00 O ATOM 1478 CB THR A 94 13.487 -4.633 -4.804 1.00 0.00 C ATOM 1479 OG1 THR A 94 13.902 -5.930 -4.386 1.00 0.00 O ATOM 1480 CG2 THR A 94 11.987 -4.606 -4.502 1.00 0.00 C ATOM 0 H THR A 94 12.872 -2.766 -6.701 1.00 0.00 H new ATOM 0 HA THR A 94 14.755 -5.077 -6.466 1.00 0.00 H new ATOM 0 HB THR A 94 13.969 -3.779 -4.328 1.00 0.00 H new ATOM 0 HG1 THR A 94 13.747 -6.029 -3.423 1.00 0.00 H new ATOM 0 HG21 THR A 94 11.833 -4.622 -3.423 1.00 0.00 H new ATOM 0 HG22 THR A 94 11.548 -3.699 -4.918 1.00 0.00 H new ATOM 0 HG23 THR A 94 11.510 -5.478 -4.950 1.00 0.00 H new ATOM 1488 N GLN A 95 12.306 -6.506 -6.520 1.00 0.00 N ATOM 1489 CA GLN A 95 11.354 -7.380 -7.184 1.00 0.00 C ATOM 1490 C GLN A 95 10.324 -6.553 -7.956 1.00 0.00 C ATOM 1491 O GLN A 95 10.153 -5.364 -7.691 1.00 0.00 O ATOM 1492 CB GLN A 95 10.670 -8.310 -6.180 1.00 0.00 C ATOM 1493 CG GLN A 95 11.561 -9.509 -5.849 1.00 0.00 C ATOM 1494 CD GLN A 95 11.750 -9.649 -4.337 1.00 0.00 C ATOM 1495 OE1 GLN A 95 11.126 -10.466 -3.680 1.00 0.00 O ATOM 1496 NE2 GLN A 95 12.645 -8.810 -3.823 1.00 0.00 N ATOM 0 H GLN A 95 12.556 -6.789 -5.572 1.00 0.00 H new ATOM 0 HA GLN A 95 11.897 -8.004 -7.894 1.00 0.00 H new ATOM 0 HB2 GLN A 95 10.440 -7.760 -5.267 1.00 0.00 H new ATOM 0 HB3 GLN A 95 9.722 -8.659 -6.589 1.00 0.00 H new ATOM 0 HG2 GLN A 95 11.115 -10.420 -6.250 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.531 -9.390 -6.331 1.00 0.00 H new ATOM 0 HE21 GLN A 95 13.133 -8.150 -4.429 1.00 0.00 H new ATOM 0 HE22 GLN A 95 12.844 -8.826 -2.823 1.00 0.00 H new ATOM 1505 N PRO A 96 9.647 -7.233 -8.920 1.00 0.00 N ATOM 1506 CA PRO A 96 8.637 -6.574 -9.731 1.00 0.00 C ATOM 1507 C PRO A 96 7.350 -6.353 -8.934 1.00 0.00 C ATOM 1508 O PRO A 96 7.127 -7.007 -7.917 1.00 0.00 O ATOM 1509 CB PRO A 96 8.443 -7.484 -10.933 1.00 0.00 C ATOM 1510 CG PRO A 96 9.002 -8.837 -10.525 1.00 0.00 C ATOM 1511 CD PRO A 96 9.823 -8.641 -9.261 1.00 0.00 C ATOM 0 HA PRO A 96 8.938 -5.576 -10.048 1.00 0.00 H new ATOM 0 HB2 PRO A 96 7.389 -7.561 -11.199 1.00 0.00 H new ATOM 0 HB3 PRO A 96 8.964 -7.093 -11.807 1.00 0.00 H new ATOM 0 HG2 PRO A 96 8.193 -9.546 -10.349 1.00 0.00 H new ATOM 0 HG3 PRO A 96 9.621 -9.250 -11.322 1.00 0.00 H new ATOM 0 HD2 PRO A 96 9.474 -9.290 -8.458 1.00 0.00 H new ATOM 0 HD3 PRO A 96 10.873 -8.879 -9.430 1.00 0.00 H new ATOM 1519 N LEU A 97 6.538 -5.430 -9.427 1.00 0.00 N ATOM 1520 CA LEU A 97 5.279 -5.115 -8.773 1.00 0.00 C ATOM 1521 C LEU A 97 4.196 -4.911 -9.833 1.00 0.00 C ATOM 1522 O LEU A 97 4.500 -4.746 -11.014 1.00 0.00 O ATOM 1523 CB LEU A 97 5.449 -3.922 -7.830 1.00 0.00 C ATOM 1524 CG LEU A 97 6.567 -2.940 -8.186 1.00 0.00 C ATOM 1525 CD1 LEU A 97 6.137 -2.006 -9.319 1.00 0.00 C ATOM 1526 CD2 LEU A 97 7.030 -2.165 -6.950 1.00 0.00 C ATOM 0 H LEU A 97 6.727 -4.890 -10.271 1.00 0.00 H new ATOM 0 HA LEU A 97 4.958 -5.946 -8.144 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.508 -3.374 -7.797 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.632 -4.302 -6.825 1.00 0.00 H new ATOM 0 HG LEU A 97 7.422 -3.512 -8.547 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.950 -1.318 -9.552 1.00 0.00 H new ATOM 0 HD12 LEU A 97 5.895 -2.595 -10.204 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.259 -1.438 -9.009 1.00 0.00 H new ATOM 0 HD21 LEU A 97 7.825 -1.474 -7.230 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.191 -1.605 -6.537 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.404 -2.864 -6.201 1.00 0.00 H new ATOM 1538 N PRO A 98 2.920 -4.930 -9.363 1.00 0.00 N ATOM 1539 CA PRO A 98 1.789 -4.750 -10.257 1.00 0.00 C ATOM 1540 C PRO A 98 1.649 -3.285 -10.676 1.00 0.00 C ATOM 1541 O PRO A 98 2.582 -2.499 -10.517 1.00 0.00 O ATOM 1542 CB PRO A 98 0.587 -5.263 -9.481 1.00 0.00 C ATOM 1543 CG PRO A 98 1.010 -5.279 -8.021 1.00 0.00 C ATOM 1544 CD PRO A 98 2.521 -5.124 -7.971 1.00 0.00 C ATOM 0 HA PRO A 98 1.903 -5.295 -11.194 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.279 -4.617 -9.630 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.302 -6.260 -9.816 1.00 0.00 H new ATOM 0 HG2 PRO A 98 0.525 -4.470 -7.474 1.00 0.00 H new ATOM 0 HG3 PRO A 98 0.706 -6.212 -7.546 1.00 0.00 H new ATOM 0 HD2 PRO A 98 2.812 -4.274 -7.354 1.00 0.00 H new ATOM 0 HD3 PRO A 98 2.996 -6.007 -7.542 1.00 0.00 H new ATOM 1552 N SER A 99 0.477 -2.962 -11.203 1.00 0.00 N ATOM 1553 CA SER A 99 0.204 -1.606 -11.645 1.00 0.00 C ATOM 1554 C SER A 99 -1.224 -1.209 -11.264 1.00 0.00 C ATOM 1555 O SER A 99 -1.436 -0.181 -10.623 1.00 0.00 O ATOM 1556 CB SER A 99 0.408 -1.467 -13.155 1.00 0.00 C ATOM 1557 OG SER A 99 0.249 -0.121 -13.594 1.00 0.00 O ATOM 0 H SER A 99 -0.294 -3.617 -11.334 1.00 0.00 H new ATOM 0 HA SER A 99 0.906 -0.937 -11.148 1.00 0.00 H new ATOM 0 HB2 SER A 99 1.405 -1.819 -13.420 1.00 0.00 H new ATOM 0 HB3 SER A 99 -0.305 -2.105 -13.677 1.00 0.00 H new ATOM 0 HG SER A 99 0.389 -0.074 -14.563 1.00 0.00 H new ATOM 1563 N SER A 100 -2.166 -2.045 -11.675 1.00 0.00 N ATOM 1564 CA SER A 100 -3.568 -1.795 -11.384 1.00 0.00 C ATOM 1565 C SER A 100 -3.910 -2.301 -9.982 1.00 0.00 C ATOM 1566 O SER A 100 -4.505 -1.577 -9.185 1.00 0.00 O ATOM 1567 CB SER A 100 -4.473 -2.458 -12.424 1.00 0.00 C ATOM 1568 OG SER A 100 -4.391 -1.814 -13.692 1.00 0.00 O ATOM 0 H SER A 100 -1.986 -2.896 -12.207 1.00 0.00 H new ATOM 0 HA SER A 100 -3.740 -0.719 -11.426 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.194 -3.506 -12.531 1.00 0.00 H new ATOM 0 HB3 SER A 100 -5.505 -2.437 -12.073 1.00 0.00 H new ATOM 0 HG SER A 100 -4.982 -2.268 -14.328 1.00 0.00 H new ATOM 1574 N TYR A 101 -3.520 -3.540 -9.723 1.00 0.00 N ATOM 1575 CA TYR A 101 -3.778 -4.152 -8.431 1.00 0.00 C ATOM 1576 C TYR A 101 -2.515 -4.162 -7.567 1.00 0.00 C ATOM 1577 O TYR A 101 -1.460 -3.699 -7.998 1.00 0.00 O ATOM 1578 CB TYR A 101 -4.194 -5.595 -8.722 1.00 0.00 C ATOM 1579 CG TYR A 101 -3.018 -6.549 -8.939 1.00 0.00 C ATOM 1580 CD1 TYR A 101 -2.420 -7.165 -7.858 1.00 0.00 C ATOM 1581 CD2 TYR A 101 -2.556 -6.795 -10.216 1.00 0.00 C ATOM 1582 CE1 TYR A 101 -1.314 -8.063 -8.062 1.00 0.00 C ATOM 1583 CE2 TYR A 101 -1.449 -7.694 -10.420 1.00 0.00 C ATOM 1584 CZ TYR A 101 -0.883 -8.284 -9.333 1.00 0.00 C ATOM 1585 OH TYR A 101 0.162 -9.132 -9.526 1.00 0.00 O ATOM 0 H TYR A 101 -3.027 -4.137 -10.387 1.00 0.00 H new ATOM 0 HA TYR A 101 -4.545 -3.597 -7.891 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -4.799 -5.962 -7.893 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -4.828 -5.608 -9.609 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -2.782 -6.973 -6.859 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -3.024 -6.314 -11.062 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -0.837 -8.550 -7.225 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -1.077 -7.895 -11.414 1.00 0.00 H new ATOM 0 HH TYR A 101 0.360 -9.195 -10.484 1.00 0.00 H new ATOM 1595 N LEU A 102 -2.665 -4.695 -6.363 1.00 0.00 N ATOM 1596 CA LEU A 102 -1.549 -4.772 -5.435 1.00 0.00 C ATOM 1597 C LEU A 102 -1.876 -5.783 -4.334 1.00 0.00 C ATOM 1598 O LEU A 102 -2.761 -5.548 -3.513 1.00 0.00 O ATOM 1599 CB LEU A 102 -1.195 -3.380 -4.906 1.00 0.00 C ATOM 1600 CG LEU A 102 0.132 -2.795 -5.394 1.00 0.00 C ATOM 1601 CD1 LEU A 102 0.293 -1.345 -4.935 1.00 0.00 C ATOM 1602 CD2 LEU A 102 1.310 -3.669 -4.958 1.00 0.00 C ATOM 0 H LEU A 102 -3.542 -5.077 -6.009 1.00 0.00 H new ATOM 0 HA LEU A 102 -0.655 -5.132 -5.944 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.995 -2.694 -5.182 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -1.172 -3.422 -3.817 1.00 0.00 H new ATOM 0 HG LEU A 102 0.123 -2.788 -6.484 1.00 0.00 H new ATOM 0 HD11 LEU A 102 1.244 -0.953 -5.295 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -0.523 -0.744 -5.336 1.00 0.00 H new ATOM 0 HD13 LEU A 102 0.272 -1.304 -3.846 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.241 -3.231 -5.318 1.00 0.00 H new ATOM 0 HD22 LEU A 102 1.334 -3.730 -3.870 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.195 -4.669 -5.375 1.00 0.00 H new ATOM 1614 N ILE A 103 -1.144 -6.887 -4.353 1.00 0.00 N ATOM 1615 CA ILE A 103 -1.345 -7.935 -3.367 1.00 0.00 C ATOM 1616 C ILE A 103 -0.455 -7.664 -2.153 1.00 0.00 C ATOM 1617 O ILE A 103 0.718 -7.325 -2.302 1.00 0.00 O ATOM 1618 CB ILE A 103 -1.125 -9.313 -3.996 1.00 0.00 C ATOM 1619 CG1 ILE A 103 -2.014 -9.502 -5.226 1.00 0.00 C ATOM 1620 CG2 ILE A 103 -1.327 -10.425 -2.965 1.00 0.00 C ATOM 1621 CD1 ILE A 103 -3.361 -10.117 -4.840 1.00 0.00 C ATOM 0 H ILE A 103 -0.411 -7.079 -5.036 1.00 0.00 H new ATOM 0 HA ILE A 103 -2.376 -7.933 -3.014 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.091 -9.373 -4.335 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -2.176 -8.541 -5.714 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -1.510 -10.145 -5.948 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.165 -11.394 -3.438 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -0.617 -10.297 -2.148 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -2.343 -10.378 -2.574 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -3.974 -10.241 -5.733 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -3.197 -11.089 -4.375 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -3.873 -9.460 -4.137 1.00 0.00 H new ATOM 1633 N ILE A 104 -1.046 -7.825 -0.978 1.00 0.00 N ATOM 1634 CA ILE A 104 -0.321 -7.602 0.262 1.00 0.00 C ATOM 1635 C ILE A 104 -0.629 -8.737 1.239 1.00 0.00 C ATOM 1636 O ILE A 104 -1.600 -9.471 1.058 1.00 0.00 O ATOM 1637 CB ILE A 104 -0.628 -6.210 0.819 1.00 0.00 C ATOM 1638 CG1 ILE A 104 -0.196 -5.119 -0.163 1.00 0.00 C ATOM 1639 CG2 ILE A 104 0.003 -6.021 2.200 1.00 0.00 C ATOM 1640 CD1 ILE A 104 -1.293 -4.064 -0.327 1.00 0.00 C ATOM 0 H ILE A 104 -2.019 -8.107 -0.858 1.00 0.00 H new ATOM 0 HA ILE A 104 0.754 -7.618 0.083 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.707 -6.122 0.943 1.00 0.00 H new ATOM 0 HG12 ILE A 104 0.719 -4.645 0.193 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.032 -5.565 -1.131 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.230 -5.024 2.573 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.395 -6.768 2.887 1.00 0.00 H new ATOM 0 HG23 ILE A 104 1.084 -6.137 2.125 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.961 -3.300 -1.030 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -2.199 -4.537 -0.706 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -1.501 -3.603 0.638 1.00 0.00 H new ATOM 1652 N ARG A 105 0.215 -8.847 2.254 1.00 0.00 N ATOM 1653 CA ARG A 105 0.045 -9.881 3.261 1.00 0.00 C ATOM 1654 C ARG A 105 0.299 -9.310 4.657 1.00 0.00 C ATOM 1655 O ARG A 105 1.235 -8.537 4.855 1.00 0.00 O ATOM 1656 CB ARG A 105 1.000 -11.051 3.015 1.00 0.00 C ATOM 1657 CG ARG A 105 0.974 -12.036 4.186 1.00 0.00 C ATOM 1658 CD ARG A 105 1.909 -13.219 3.929 1.00 0.00 C ATOM 1659 NE ARG A 105 1.230 -14.487 4.277 1.00 0.00 N ATOM 1660 CZ ARG A 105 1.578 -15.684 3.788 1.00 0.00 C ATOM 1661 NH1 ARG A 105 2.601 -15.785 2.927 1.00 0.00 N ATOM 1662 NH2 ARG A 105 0.905 -16.782 4.159 1.00 0.00 N ATOM 0 H ARG A 105 1.019 -8.237 2.401 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.981 -10.243 3.194 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.721 -11.566 2.096 1.00 0.00 H new ATOM 0 HB3 ARG A 105 2.013 -10.675 2.874 1.00 0.00 H new ATOM 0 HG2 ARG A 105 1.271 -11.525 5.102 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -0.043 -12.398 4.339 1.00 0.00 H new ATOM 0 HD2 ARG A 105 2.210 -13.234 2.882 1.00 0.00 H new ATOM 0 HD3 ARG A 105 2.818 -13.110 4.520 1.00 0.00 H new ATOM 0 HE ARG A 105 0.448 -14.447 4.930 1.00 0.00 H new ATOM 0 HH11 ARG A 105 3.114 -14.950 2.645 1.00 0.00 H new ATOM 0 HH12 ARG A 105 2.866 -16.697 2.555 1.00 0.00 H new ATOM 0 HH21 ARG A 105 0.127 -16.706 4.814 1.00 0.00 H new ATOM 0 HH22 ARG A 105 1.171 -17.693 3.786 1.00 0.00 H new ATOM 1676 N ALA A 106 -0.553 -9.711 5.589 1.00 0.00 N ATOM 1677 CA ALA A 106 -0.433 -9.248 6.961 1.00 0.00 C ATOM 1678 C ALA A 106 0.044 -10.403 7.845 1.00 0.00 C ATOM 1679 O ALA A 106 0.258 -11.513 7.360 1.00 0.00 O ATOM 1680 CB ALA A 106 -1.773 -8.674 7.426 1.00 0.00 C ATOM 0 H ALA A 106 -1.329 -10.351 5.421 1.00 0.00 H new ATOM 0 HA ALA A 106 0.306 -8.450 7.033 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -1.683 -8.327 8.455 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -2.053 -7.838 6.784 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -2.539 -9.447 7.370 1.00 0.00 H new ATOM 1686 N THR A 107 0.195 -10.102 9.126 1.00 0.00 N ATOM 1687 CA THR A 107 0.643 -11.102 10.082 1.00 0.00 C ATOM 1688 C THR A 107 -0.508 -12.040 10.450 1.00 0.00 C ATOM 1689 O THR A 107 -0.464 -13.231 10.147 1.00 0.00 O ATOM 1690 CB THR A 107 1.240 -10.371 11.286 1.00 0.00 C ATOM 1691 OG1 THR A 107 2.606 -10.174 10.930 1.00 0.00 O ATOM 1692 CG2 THR A 107 1.303 -11.253 12.534 1.00 0.00 C ATOM 0 H THR A 107 0.015 -9.181 9.525 1.00 0.00 H new ATOM 0 HA THR A 107 1.417 -11.740 9.655 1.00 0.00 H new ATOM 0 HB THR A 107 0.648 -9.481 11.500 1.00 0.00 H new ATOM 0 HG1 THR A 107 3.069 -9.704 11.655 1.00 0.00 H new ATOM 0 HG21 THR A 107 1.734 -10.686 13.359 1.00 0.00 H new ATOM 0 HG22 THR A 107 0.297 -11.576 12.803 1.00 0.00 H new ATOM 0 HG23 THR A 107 1.922 -12.127 12.331 1.00 0.00 H new ATOM 1700 N SER A 108 -1.512 -11.467 11.099 1.00 0.00 N ATOM 1701 CA SER A 108 -2.673 -12.238 11.511 1.00 0.00 C ATOM 1702 C SER A 108 -3.932 -11.685 10.842 1.00 0.00 C ATOM 1703 O SER A 108 -3.931 -10.562 10.340 1.00 0.00 O ATOM 1704 CB SER A 108 -2.830 -12.223 13.033 1.00 0.00 C ATOM 1705 OG SER A 108 -2.796 -10.900 13.561 1.00 0.00 O ATOM 0 H SER A 108 -1.545 -10.479 11.349 1.00 0.00 H new ATOM 0 HA SER A 108 -2.527 -13.272 11.197 1.00 0.00 H new ATOM 0 HB2 SER A 108 -3.773 -12.697 13.305 1.00 0.00 H new ATOM 0 HB3 SER A 108 -2.034 -12.814 13.485 1.00 0.00 H new ATOM 0 HG SER A 108 -2.901 -10.934 14.535 1.00 0.00 H new ATOM 1711 N GLU A 109 -4.977 -12.499 10.857 1.00 0.00 N ATOM 1712 CA GLU A 109 -6.241 -12.106 10.257 1.00 0.00 C ATOM 1713 C GLU A 109 -6.628 -10.697 10.710 1.00 0.00 C ATOM 1714 O GLU A 109 -7.075 -9.882 9.904 1.00 0.00 O ATOM 1715 CB GLU A 109 -7.344 -13.112 10.593 1.00 0.00 C ATOM 1716 CG GLU A 109 -8.703 -12.625 10.087 1.00 0.00 C ATOM 1717 CD GLU A 109 -9.750 -12.663 11.203 1.00 0.00 C ATOM 1718 OE1 GLU A 109 -9.608 -11.850 12.142 1.00 0.00 O ATOM 1719 OE2 GLU A 109 -10.667 -13.504 11.092 1.00 0.00 O ATOM 0 H GLU A 109 -4.975 -13.429 11.275 1.00 0.00 H new ATOM 0 HA GLU A 109 -6.120 -12.098 9.174 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -7.110 -14.077 10.144 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -7.387 -13.264 11.672 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -8.610 -11.608 9.705 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -9.030 -13.249 9.255 1.00 0.00 H new ATOM 1726 N SER A 110 -6.442 -10.452 11.999 1.00 0.00 N ATOM 1727 CA SER A 110 -6.765 -9.155 12.569 1.00 0.00 C ATOM 1728 C SER A 110 -5.981 -8.057 11.848 1.00 0.00 C ATOM 1729 O SER A 110 -6.570 -7.188 11.207 1.00 0.00 O ATOM 1730 CB SER A 110 -6.467 -9.123 14.069 1.00 0.00 C ATOM 1731 OG SER A 110 -7.651 -9.251 14.852 1.00 0.00 O ATOM 0 H SER A 110 -6.072 -11.130 12.665 1.00 0.00 H new ATOM 0 HA SER A 110 -7.832 -8.978 12.435 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.778 -9.930 14.319 1.00 0.00 H new ATOM 0 HB3 SER A 110 -5.966 -8.188 14.319 1.00 0.00 H new ATOM 0 HG SER A 110 -7.418 -9.228 15.804 1.00 0.00 H new ATOM 1737 N ASP A 111 -4.665 -8.131 11.978 1.00 0.00 N ATOM 1738 CA ASP A 111 -3.794 -7.154 11.348 1.00 0.00 C ATOM 1739 C ASP A 111 -4.284 -6.884 9.924 1.00 0.00 C ATOM 1740 O ASP A 111 -4.740 -5.783 9.618 1.00 0.00 O ATOM 1741 CB ASP A 111 -2.356 -7.670 11.263 1.00 0.00 C ATOM 1742 CG ASP A 111 -1.579 -7.639 12.581 1.00 0.00 C ATOM 1743 OD1 ASP A 111 -2.249 -7.666 13.635 1.00 0.00 O ATOM 1744 OD2 ASP A 111 -0.333 -7.588 12.503 1.00 0.00 O ATOM 0 H ASP A 111 -4.180 -8.853 12.511 1.00 0.00 H new ATOM 0 HA ASP A 111 -3.816 -6.246 11.950 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.375 -8.695 10.894 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.816 -7.076 10.526 1.00 0.00 H new ATOM 1749 N GLY A 112 -4.174 -7.908 9.090 1.00 0.00 N ATOM 1750 CA GLY A 112 -4.600 -7.796 7.706 1.00 0.00 C ATOM 1751 C GLY A 112 -6.006 -7.198 7.612 1.00 0.00 C ATOM 1752 O GLY A 112 -6.248 -6.295 6.813 1.00 0.00 O ATOM 0 H GLY A 112 -3.796 -8.820 9.347 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -3.897 -7.171 7.155 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -4.587 -8.780 7.237 1.00 0.00 H new ATOM 1756 N ARG A 113 -6.896 -7.726 8.439 1.00 0.00 N ATOM 1757 CA ARG A 113 -8.270 -7.256 8.459 1.00 0.00 C ATOM 1758 C ARG A 113 -8.311 -5.744 8.692 1.00 0.00 C ATOM 1759 O ARG A 113 -9.125 -5.042 8.095 1.00 0.00 O ATOM 1760 CB ARG A 113 -9.076 -7.956 9.555 1.00 0.00 C ATOM 1761 CG ARG A 113 -9.590 -9.315 9.075 1.00 0.00 C ATOM 1762 CD ARG A 113 -10.860 -9.155 8.237 1.00 0.00 C ATOM 1763 NE ARG A 113 -11.620 -10.425 8.223 1.00 0.00 N ATOM 1764 CZ ARG A 113 -12.858 -10.554 7.727 1.00 0.00 C ATOM 1765 NH1 ARG A 113 -13.484 -9.491 7.202 1.00 0.00 N ATOM 1766 NH2 ARG A 113 -13.472 -11.745 7.757 1.00 0.00 N ATOM 0 H ARG A 113 -6.692 -8.475 9.100 1.00 0.00 H new ATOM 0 HA ARG A 113 -8.714 -7.490 7.492 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -8.453 -8.091 10.439 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.917 -7.329 9.850 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -8.820 -9.811 8.484 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -9.795 -9.955 9.934 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -11.478 -8.356 8.647 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.600 -8.866 7.219 1.00 0.00 H new ATOM 0 HE ARG A 113 -11.173 -11.254 8.615 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.018 -8.584 7.180 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -14.426 -9.589 6.824 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -12.997 -12.554 8.158 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -14.414 -11.843 7.379 1.00 0.00 H new ATOM 1780 N CYS A 114 -7.422 -5.288 9.563 1.00 0.00 N ATOM 1781 CA CYS A 114 -7.346 -3.873 9.882 1.00 0.00 C ATOM 1782 C CYS A 114 -6.713 -3.145 8.694 1.00 0.00 C ATOM 1783 O CYS A 114 -7.146 -2.053 8.328 1.00 0.00 O ATOM 1784 CB CYS A 114 -6.573 -3.626 11.179 1.00 0.00 C ATOM 1785 SG CYS A 114 -7.634 -2.744 12.382 1.00 0.00 S ATOM 0 H CYS A 114 -6.749 -5.874 10.057 1.00 0.00 H new ATOM 0 HA CYS A 114 -8.349 -3.483 10.054 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -6.242 -4.575 11.601 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -5.678 -3.039 10.972 1.00 0.00 H new ATOM 0 HG CYS A 114 -6.969 -2.541 13.480 1.00 0.00 H new ATOM 1791 N TRP A 115 -5.699 -3.780 8.124 1.00 0.00 N ATOM 1792 CA TRP A 115 -5.003 -3.207 6.985 1.00 0.00 C ATOM 1793 C TRP A 115 -6.013 -3.040 5.848 1.00 0.00 C ATOM 1794 O TRP A 115 -6.316 -1.919 5.442 1.00 0.00 O ATOM 1795 CB TRP A 115 -3.797 -4.063 6.592 1.00 0.00 C ATOM 1796 CG TRP A 115 -2.508 -3.700 7.332 1.00 0.00 C ATOM 1797 CD1 TRP A 115 -1.970 -4.306 8.399 1.00 0.00 C ATOM 1798 CD2 TRP A 115 -1.611 -2.614 7.014 1.00 0.00 C ATOM 1799 NE1 TRP A 115 -0.797 -3.694 8.790 1.00 0.00 N ATOM 1800 CE2 TRP A 115 -0.572 -2.632 7.922 1.00 0.00 C ATOM 1801 CE3 TRP A 115 -1.677 -1.649 5.994 1.00 0.00 C ATOM 1802 CZ2 TRP A 115 0.481 -1.709 7.900 1.00 0.00 C ATOM 1803 CZ3 TRP A 115 -0.618 -0.734 5.986 1.00 0.00 C ATOM 1804 CH2 TRP A 115 0.436 -0.738 6.892 1.00 0.00 C ATOM 0 H TRP A 115 -5.343 -4.686 8.430 1.00 0.00 H new ATOM 0 HA TRP A 115 -4.596 -2.227 7.235 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -4.030 -5.110 6.783 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -3.628 -3.964 5.520 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -2.400 -5.166 8.891 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -0.204 -3.970 9.572 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -2.481 -1.616 5.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 1.284 -1.744 8.621 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -0.620 0.029 5.222 1.00 0.00 H new ATOM 0 HH2 TRP A 115 1.217 0.005 6.819 1.00 0.00 H new ATOM 1815 N MET A 116 -6.507 -4.171 5.367 1.00 0.00 N ATOM 1816 CA MET A 116 -7.477 -4.164 4.286 1.00 0.00 C ATOM 1817 C MET A 116 -8.677 -3.279 4.631 1.00 0.00 C ATOM 1818 O MET A 116 -9.386 -2.814 3.740 1.00 0.00 O ATOM 1819 CB MET A 116 -7.956 -5.592 4.019 1.00 0.00 C ATOM 1820 CG MET A 116 -8.949 -6.046 5.090 1.00 0.00 C ATOM 1821 SD MET A 116 -10.598 -6.106 4.408 1.00 0.00 S ATOM 1822 CE MET A 116 -10.382 -7.392 3.188 1.00 0.00 C ATOM 0 H MET A 116 -6.253 -5.099 5.706 1.00 0.00 H new ATOM 0 HA MET A 116 -6.996 -3.761 3.395 1.00 0.00 H new ATOM 0 HB2 MET A 116 -8.426 -5.644 3.037 1.00 0.00 H new ATOM 0 HB3 MET A 116 -7.102 -6.268 4.000 1.00 0.00 H new ATOM 0 HG2 MET A 116 -8.666 -7.029 5.466 1.00 0.00 H new ATOM 0 HG3 MET A 116 -8.922 -5.360 5.937 1.00 0.00 H new ATOM 0 HE1 MET A 116 -11.213 -7.368 2.483 1.00 0.00 H new ATOM 0 HE2 MET A 116 -9.446 -7.232 2.652 1.00 0.00 H new ATOM 0 HE3 MET A 116 -10.355 -8.363 3.683 1.00 0.00 H new ATOM 1832 N ASP A 117 -8.867 -3.074 5.926 1.00 0.00 N ATOM 1833 CA ASP A 117 -9.969 -2.254 6.400 1.00 0.00 C ATOM 1834 C ASP A 117 -9.577 -0.778 6.307 1.00 0.00 C ATOM 1835 O ASP A 117 -10.190 -0.015 5.562 1.00 0.00 O ATOM 1836 CB ASP A 117 -10.298 -2.565 7.861 1.00 0.00 C ATOM 1837 CG ASP A 117 -11.368 -3.638 8.069 1.00 0.00 C ATOM 1838 OD1 ASP A 117 -11.576 -4.424 7.119 1.00 0.00 O ATOM 1839 OD2 ASP A 117 -11.954 -3.649 9.173 1.00 0.00 O ATOM 0 H ASP A 117 -8.276 -3.462 6.662 1.00 0.00 H new ATOM 0 HA ASP A 117 -10.840 -2.469 5.781 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -9.384 -2.882 8.364 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -10.627 -1.646 8.347 1.00 0.00 H new ATOM 1844 N ALA A 118 -8.557 -0.420 7.074 1.00 0.00 N ATOM 1845 CA ALA A 118 -8.076 0.951 7.087 1.00 0.00 C ATOM 1846 C ALA A 118 -7.942 1.454 5.648 1.00 0.00 C ATOM 1847 O ALA A 118 -8.462 2.516 5.308 1.00 0.00 O ATOM 1848 CB ALA A 118 -6.754 1.020 7.854 1.00 0.00 C ATOM 0 H ALA A 118 -8.051 -1.056 7.691 1.00 0.00 H new ATOM 0 HA ALA A 118 -8.785 1.602 7.599 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -6.392 2.048 7.864 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.909 0.680 8.878 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.017 0.381 7.367 1.00 0.00 H new ATOM 1854 N LEU A 119 -7.243 0.668 4.843 1.00 0.00 N ATOM 1855 CA LEU A 119 -7.034 1.021 3.449 1.00 0.00 C ATOM 1856 C LEU A 119 -8.330 1.598 2.874 1.00 0.00 C ATOM 1857 O LEU A 119 -8.384 2.772 2.512 1.00 0.00 O ATOM 1858 CB LEU A 119 -6.496 -0.179 2.667 1.00 0.00 C ATOM 1859 CG LEU A 119 -4.973 -0.284 2.565 1.00 0.00 C ATOM 1860 CD1 LEU A 119 -4.548 -1.688 2.132 1.00 0.00 C ATOM 1861 CD2 LEU A 119 -4.410 0.796 1.638 1.00 0.00 C ATOM 0 H LEU A 119 -6.814 -0.212 5.129 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.273 1.796 3.362 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -6.873 -1.090 3.133 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.906 -0.144 1.658 1.00 0.00 H new ATOM 0 HG LEU A 119 -4.552 -0.111 3.555 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.461 -1.735 2.067 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.900 -2.416 2.863 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.980 -1.914 1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -3.326 0.699 1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.836 0.678 0.642 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.667 1.781 2.028 1.00 0.00 H new ATOM 1873 N GLU A 120 -9.342 0.745 2.808 1.00 0.00 N ATOM 1874 CA GLU A 120 -10.633 1.155 2.283 1.00 0.00 C ATOM 1875 C GLU A 120 -11.031 2.516 2.857 1.00 0.00 C ATOM 1876 O GLU A 120 -11.552 3.369 2.139 1.00 0.00 O ATOM 1877 CB GLU A 120 -11.704 0.102 2.576 1.00 0.00 C ATOM 1878 CG GLU A 120 -11.397 -1.209 1.849 1.00 0.00 C ATOM 1879 CD GLU A 120 -12.250 -2.353 2.399 1.00 0.00 C ATOM 1880 OE1 GLU A 120 -13.436 -2.415 2.010 1.00 0.00 O ATOM 1881 OE2 GLU A 120 -11.697 -3.141 3.197 1.00 0.00 O ATOM 0 H GLU A 120 -9.294 -0.228 3.109 1.00 0.00 H new ATOM 0 HA GLU A 120 -10.550 1.249 1.200 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -11.758 -0.078 3.650 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -12.680 0.475 2.265 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -11.586 -1.090 0.782 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -10.340 -1.452 1.961 1.00 0.00 H new ATOM 1888 N LEU A 121 -10.771 2.678 4.146 1.00 0.00 N ATOM 1889 CA LEU A 121 -11.095 3.921 4.825 1.00 0.00 C ATOM 1890 C LEU A 121 -10.201 5.040 4.287 1.00 0.00 C ATOM 1891 O LEU A 121 -10.693 6.088 3.873 1.00 0.00 O ATOM 1892 CB LEU A 121 -11.010 3.742 6.342 1.00 0.00 C ATOM 1893 CG LEU A 121 -11.725 2.516 6.914 1.00 0.00 C ATOM 1894 CD1 LEU A 121 -11.360 2.305 8.385 1.00 0.00 C ATOM 1895 CD2 LEU A 121 -13.237 2.618 6.707 1.00 0.00 C ATOM 0 H LEU A 121 -10.339 1.969 4.738 1.00 0.00 H new ATOM 0 HA LEU A 121 -12.126 4.209 4.619 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -9.958 3.689 6.623 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -11.422 4.633 6.817 1.00 0.00 H new ATOM 0 HG LEU A 121 -11.384 1.636 6.369 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -11.882 1.427 8.767 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -10.284 2.155 8.475 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -11.654 3.182 8.962 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -13.722 1.734 7.122 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -13.614 3.509 7.210 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -13.455 2.684 5.641 1.00 0.00 H new ATOM 1907 N ALA A 122 -8.902 4.778 4.309 1.00 0.00 N ATOM 1908 CA ALA A 122 -7.935 5.750 3.829 1.00 0.00 C ATOM 1909 C ALA A 122 -8.473 6.415 2.560 1.00 0.00 C ATOM 1910 O ALA A 122 -8.769 7.609 2.559 1.00 0.00 O ATOM 1911 CB ALA A 122 -6.589 5.060 3.599 1.00 0.00 C ATOM 0 H ALA A 122 -8.497 3.907 4.652 1.00 0.00 H new ATOM 0 HA ALA A 122 -7.778 6.533 4.571 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -5.863 5.789 3.239 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -6.236 4.629 4.536 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -6.707 4.269 2.858 1.00 0.00 H new ATOM 1917 N LEU A 123 -8.583 5.613 1.511 1.00 0.00 N ATOM 1918 CA LEU A 123 -9.081 6.108 0.239 1.00 0.00 C ATOM 1919 C LEU A 123 -10.441 6.776 0.454 1.00 0.00 C ATOM 1920 O LEU A 123 -10.776 7.743 -0.228 1.00 0.00 O ATOM 1921 CB LEU A 123 -9.103 4.987 -0.801 1.00 0.00 C ATOM 1922 CG LEU A 123 -9.742 3.670 -0.354 1.00 0.00 C ATOM 1923 CD1 LEU A 123 -11.145 3.514 -0.943 1.00 0.00 C ATOM 1924 CD2 LEU A 123 -8.842 2.481 -0.695 1.00 0.00 C ATOM 0 H LEU A 123 -8.336 4.623 1.516 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.412 6.869 -0.162 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.636 5.346 -1.682 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.077 4.784 -1.109 1.00 0.00 H new ATOM 0 HG LEU A 123 -9.849 3.693 0.731 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -11.577 2.570 -0.610 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.774 4.339 -0.608 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.086 3.522 -2.031 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.319 1.558 -0.367 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -8.681 2.443 -1.772 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.883 2.594 -0.189 1.00 0.00 H new ATOM 1936 N LYS A 124 -11.188 6.232 1.403 1.00 0.00 N ATOM 1937 CA LYS A 124 -12.504 6.763 1.716 1.00 0.00 C ATOM 1938 C LYS A 124 -12.364 7.888 2.744 1.00 0.00 C ATOM 1939 O LYS A 124 -13.351 8.309 3.346 1.00 0.00 O ATOM 1940 CB LYS A 124 -13.443 5.639 2.157 1.00 0.00 C ATOM 1941 CG LYS A 124 -13.991 4.876 0.949 1.00 0.00 C ATOM 1942 CD LYS A 124 -15.499 5.093 0.801 1.00 0.00 C ATOM 1943 CE LYS A 124 -16.159 3.896 0.115 1.00 0.00 C ATOM 1944 NZ LYS A 124 -17.325 4.336 -0.684 1.00 0.00 N ATOM 0 H LYS A 124 -10.907 5.429 1.966 1.00 0.00 H new ATOM 0 HA LYS A 124 -12.961 7.199 0.828 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -12.910 4.952 2.814 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -14.269 6.056 2.734 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -13.482 5.207 0.044 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -13.782 3.812 1.061 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -15.946 5.246 1.783 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -15.685 5.997 0.221 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -15.437 3.395 -0.530 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -16.476 3.170 0.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -17.762 3.512 -1.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -18.020 4.794 -0.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -17.013 5.012 -1.410 1.00 0.00 H new ATOM 1958 N SER A 125 -11.131 8.342 2.913 1.00 0.00 N ATOM 1959 CA SER A 125 -10.850 9.409 3.858 1.00 0.00 C ATOM 1960 C SER A 125 -11.207 8.960 5.276 1.00 0.00 C ATOM 1961 O SER A 125 -12.367 8.675 5.568 1.00 0.00 O ATOM 1962 CB SER A 125 -11.618 10.682 3.495 1.00 0.00 C ATOM 1963 OG SER A 125 -12.951 10.663 3.999 1.00 0.00 O ATOM 0 H SER A 125 -10.315 7.990 2.411 1.00 0.00 H new ATOM 0 HA SER A 125 -9.784 9.634 3.813 1.00 0.00 H new ATOM 0 HB2 SER A 125 -11.092 11.549 3.894 1.00 0.00 H new ATOM 0 HB3 SER A 125 -11.642 10.795 2.411 1.00 0.00 H new ATOM 0 HG SER A 125 -13.188 9.750 4.264 1.00 0.00 H new ATOM 1969 N GLY A 126 -10.187 8.911 6.121 1.00 0.00 N ATOM 1970 CA GLY A 126 -10.378 8.501 7.502 1.00 0.00 C ATOM 1971 C GLY A 126 -10.900 9.663 8.351 1.00 0.00 C ATOM 1972 O GLY A 126 -11.271 10.708 7.819 1.00 0.00 O ATOM 0 H GLY A 126 -9.226 9.148 5.876 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -11.082 7.670 7.544 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -9.434 8.141 7.912 1.00 0.00 H new ATOM 1976 N PRO A 127 -10.911 9.434 9.692 1.00 0.00 N ATOM 1977 CA PRO A 127 -11.380 10.449 10.620 1.00 0.00 C ATOM 1978 C PRO A 127 -10.345 11.564 10.784 1.00 0.00 C ATOM 1979 O PRO A 127 -9.173 11.294 11.043 1.00 0.00 O ATOM 1980 CB PRO A 127 -11.657 9.701 11.914 1.00 0.00 C ATOM 1981 CG PRO A 127 -10.897 8.389 11.807 1.00 0.00 C ATOM 1982 CD PRO A 127 -10.479 8.209 10.357 1.00 0.00 C ATOM 0 HA PRO A 127 -12.278 10.957 10.268 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -11.323 10.277 12.777 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -12.725 9.525 12.042 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -10.023 8.400 12.458 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -11.524 7.558 12.130 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -9.401 8.070 10.270 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -10.950 7.331 9.915 1.00 0.00 H new ATOM 1990 N SER A 128 -10.815 12.792 10.625 1.00 0.00 N ATOM 1991 CA SER A 128 -9.945 13.949 10.752 1.00 0.00 C ATOM 1992 C SER A 128 -10.726 15.131 11.330 1.00 0.00 C ATOM 1993 O SER A 128 -10.400 15.628 12.407 1.00 0.00 O ATOM 1994 CB SER A 128 -9.331 14.327 9.403 1.00 0.00 C ATOM 1995 OG SER A 128 -8.225 15.213 9.549 1.00 0.00 O ATOM 0 H SER A 128 -11.787 13.011 10.409 1.00 0.00 H new ATOM 0 HA SER A 128 -9.132 13.692 11.431 1.00 0.00 H new ATOM 0 HB2 SER A 128 -9.006 13.424 8.887 1.00 0.00 H new ATOM 0 HB3 SER A 128 -10.091 14.796 8.778 1.00 0.00 H new ATOM 0 HG SER A 128 -7.860 15.429 8.666 1.00 0.00 H new ATOM 2001 N SER A 129 -11.742 15.547 10.588 1.00 0.00 N ATOM 2002 CA SER A 129 -12.572 16.661 11.013 1.00 0.00 C ATOM 2003 C SER A 129 -13.958 16.156 11.419 1.00 0.00 C ATOM 2004 O SER A 129 -14.314 15.014 11.135 1.00 0.00 O ATOM 2005 CB SER A 129 -12.693 17.711 9.907 1.00 0.00 C ATOM 2006 OG SER A 129 -11.912 18.870 10.183 1.00 0.00 O ATOM 0 H SER A 129 -12.009 15.132 9.695 1.00 0.00 H new ATOM 0 HA SER A 129 -12.097 17.132 11.874 1.00 0.00 H new ATOM 0 HB2 SER A 129 -12.375 17.277 8.959 1.00 0.00 H new ATOM 0 HB3 SER A 129 -13.738 17.997 9.792 1.00 0.00 H new ATOM 0 HG SER A 129 -12.015 19.515 9.453 1.00 0.00 H new ATOM 2012 N GLY A 130 -14.701 17.032 12.079 1.00 0.00 N ATOM 2013 CA GLY A 130 -16.040 16.689 12.528 1.00 0.00 C ATOM 2014 C GLY A 130 -16.980 17.891 12.417 1.00 0.00 C ATOM 2015 O GLY A 130 -16.531 19.019 12.223 1.00 0.00 O ATOM 0 H GLY A 130 -14.402 17.978 12.314 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -16.427 15.863 11.931 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -16.004 16.345 13.562 1.00 0.00 H new TER 2019 GLY A 130