USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 732 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 NoAdj-H: A 38 HIS HE2 : A 38 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD NoAdj-H: A 70 HIS HE2 : A 70 HIS NE2 : A 102 ZNZN :(H bumps) USER MOD Set 1.1: A 44 GLN : amide:sc= 1.99 K(o=3.1,f=-2.2) USER MOD Set 1.2: A 67 LYS NZ :NH3+ 152:sc= 1.08 (180deg=0) USER MOD Set 2.1: A 40 SER OG : rot -63:sc= 1.45 USER MOD Set 2.2: A 43 CYS SG : rot 180:sc= 1.23 USER MOD Set 3.1: A 12 LYS NZ :NH3+ -174:sc= 1.87 (180deg=0) USER MOD Set 3.2: A 89 GLN : amide:sc= 0.938 K(o=3.6,f=-6.8!) USER MOD Set 3.3: A 92 ASN : amide:sc= 0.838 K(o=3.6,f=-2.6) USER MOD Single : A 1 MET CE :methyl 172:sc= 0 (180deg=-0.0845) USER MOD Single : A 1 MET N :NH3+ 167:sc= 0.857 (180deg=0.542) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 42:sc= 0.00803 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.0269 X(o=-0.027,f=-0.047) USER MOD Single : A 26 THR OG1 : rot -40:sc= 0.343 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.00867 USER MOD Single : A 35 LYS NZ :NH3+ -159:sc= 1.54 (180deg=1.08) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -0.125 K(o=-0.12,f=-0.65) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot -46:sc= 0.149 USER MOD Single : A 65 ASN : amide:sc=-0.00697 X(o=-0.007,f=-0.007) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 HIS : no HE2:sc= 0.597 K(o=0.6,f=-3.7!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.064 X(o=-0.064,f=-0.066) USER MOD Single : A 82 ASN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A 85 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 86 ASN : amide:sc= 0.568 K(o=0.57,f=-0.19) USER MOD Single : A 90 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -11.255 27.015 -3.642 1.00 0.00 N ATOM 2 CA MET A 1 -12.663 27.326 -3.916 1.00 0.00 C ATOM 3 C MET A 1 -13.469 26.107 -4.419 1.00 0.00 C ATOM 4 O MET A 1 -14.688 26.197 -4.595 1.00 0.00 O ATOM 5 CB MET A 1 -12.762 28.493 -4.920 1.00 0.00 C ATOM 6 CG MET A 1 -12.269 29.845 -4.372 1.00 0.00 C ATOM 7 SD MET A 1 -10.477 30.068 -4.136 1.00 0.00 S ATOM 8 CE MET A 1 -9.899 30.028 -5.857 1.00 0.00 C ATOM 0 H1 MET A 1 -10.721 27.899 -3.523 1.00 0.00 H new ATOM 0 H2 MET A 1 -11.187 26.450 -2.771 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.858 26.475 -4.437 1.00 0.00 H new ATOM 0 HA MET A 1 -13.112 27.619 -2.967 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.183 28.242 -5.809 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.800 28.599 -5.235 1.00 0.00 H new ATOM 0 HG2 MET A 1 -12.617 30.626 -5.048 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.756 30.014 -3.412 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.842 30.293 -5.892 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.036 29.026 -6.264 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.472 30.741 -6.450 1.00 0.00 H new ATOM 18 N ALA A 2 -12.806 24.966 -4.638 1.00 0.00 N ATOM 19 CA ALA A 2 -13.390 23.706 -5.106 1.00 0.00 C ATOM 20 C ALA A 2 -12.613 22.477 -4.580 1.00 0.00 C ATOM 21 O ALA A 2 -11.490 22.599 -4.077 1.00 0.00 O ATOM 22 CB ALA A 2 -13.412 23.728 -6.643 1.00 0.00 C ATOM 0 H ALA A 2 -11.800 24.894 -4.486 1.00 0.00 H new ATOM 0 HA ALA A 2 -14.404 23.615 -4.717 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -13.843 22.798 -7.014 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.014 24.570 -6.986 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -12.395 23.832 -7.020 1.00 0.00 H new ATOM 28 N VAL A 3 -13.208 21.286 -4.720 1.00 0.00 N ATOM 29 CA VAL A 3 -12.650 19.982 -4.301 1.00 0.00 C ATOM 30 C VAL A 3 -12.950 18.881 -5.331 1.00 0.00 C ATOM 31 O VAL A 3 -13.838 19.032 -6.176 1.00 0.00 O ATOM 32 CB VAL A 3 -13.168 19.554 -2.906 1.00 0.00 C ATOM 33 CG1 VAL A 3 -12.671 20.489 -1.797 1.00 0.00 C ATOM 34 CG2 VAL A 3 -14.699 19.469 -2.820 1.00 0.00 C ATOM 0 H VAL A 3 -14.130 21.194 -5.146 1.00 0.00 H new ATOM 0 HA VAL A 3 -11.570 20.114 -4.239 1.00 0.00 H new ATOM 0 HB VAL A 3 -12.761 18.554 -2.759 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -13.058 20.151 -0.836 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -11.581 20.478 -1.773 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -13.020 21.503 -1.993 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -14.991 19.164 -1.815 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -15.131 20.445 -3.043 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -15.064 18.738 -3.541 1.00 0.00 H new ATOM 44 N SER A 4 -12.221 17.762 -5.249 1.00 0.00 N ATOM 45 CA SER A 4 -12.348 16.595 -6.143 1.00 0.00 C ATOM 46 C SER A 4 -12.121 15.271 -5.393 1.00 0.00 C ATOM 47 O SER A 4 -11.559 15.254 -4.293 1.00 0.00 O ATOM 48 CB SER A 4 -11.328 16.689 -7.292 1.00 0.00 C ATOM 49 OG SER A 4 -11.466 17.890 -8.041 1.00 0.00 O ATOM 0 H SER A 4 -11.502 17.635 -4.537 1.00 0.00 H new ATOM 0 HA SER A 4 -13.364 16.605 -6.536 1.00 0.00 H new ATOM 0 HB2 SER A 4 -10.319 16.632 -6.884 1.00 0.00 H new ATOM 0 HB3 SER A 4 -11.452 15.833 -7.956 1.00 0.00 H new ATOM 0 HG SER A 4 -10.798 17.907 -8.758 1.00 0.00 H new ATOM 55 N VAL A 5 -12.534 14.155 -6.004 1.00 0.00 N ATOM 56 CA VAL A 5 -12.402 12.777 -5.482 1.00 0.00 C ATOM 57 C VAL A 5 -12.014 11.796 -6.598 1.00 0.00 C ATOM 58 O VAL A 5 -12.135 12.112 -7.785 1.00 0.00 O ATOM 59 CB VAL A 5 -13.699 12.299 -4.785 1.00 0.00 C ATOM 60 CG1 VAL A 5 -14.005 13.112 -3.521 1.00 0.00 C ATOM 61 CG2 VAL A 5 -14.934 12.337 -5.697 1.00 0.00 C ATOM 0 H VAL A 5 -12.990 14.181 -6.916 1.00 0.00 H new ATOM 0 HA VAL A 5 -11.605 12.796 -4.738 1.00 0.00 H new ATOM 0 HB VAL A 5 -13.500 11.261 -4.521 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -14.923 12.743 -3.064 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -13.182 13.010 -2.814 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -14.128 14.162 -3.785 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -15.806 11.989 -5.143 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -15.104 13.359 -6.037 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -14.770 11.690 -6.559 1.00 0.00 H new ATOM 71 N THR A 6 -11.551 10.597 -6.233 1.00 0.00 N ATOM 72 CA THR A 6 -11.153 9.539 -7.183 1.00 0.00 C ATOM 73 C THR A 6 -12.338 9.061 -8.048 1.00 0.00 C ATOM 74 O THR A 6 -13.370 8.669 -7.490 1.00 0.00 O ATOM 75 CB THR A 6 -10.538 8.331 -6.450 1.00 0.00 C ATOM 76 OG1 THR A 6 -11.299 7.962 -5.314 1.00 0.00 O ATOM 77 CG2 THR A 6 -9.126 8.646 -5.954 1.00 0.00 C ATOM 0 H THR A 6 -11.438 10.324 -5.257 1.00 0.00 H new ATOM 0 HA THR A 6 -10.403 9.982 -7.839 1.00 0.00 H new ATOM 0 HB THR A 6 -10.523 7.518 -7.176 1.00 0.00 H new ATOM 0 HG1 THR A 6 -12.253 8.001 -5.533 1.00 0.00 H new ATOM 0 HG21 THR A 6 -8.718 7.775 -5.441 1.00 0.00 H new ATOM 0 HG22 THR A 6 -8.490 8.898 -6.803 1.00 0.00 H new ATOM 0 HG23 THR A 6 -9.162 9.489 -5.264 1.00 0.00 H new ATOM 85 N PRO A 7 -12.232 9.075 -9.393 1.00 0.00 N ATOM 86 CA PRO A 7 -13.306 8.640 -10.290 1.00 0.00 C ATOM 87 C PRO A 7 -13.437 7.106 -10.367 1.00 0.00 C ATOM 88 O PRO A 7 -12.546 6.361 -9.949 1.00 0.00 O ATOM 89 CB PRO A 7 -12.933 9.236 -11.654 1.00 0.00 C ATOM 90 CG PRO A 7 -11.406 9.219 -11.634 1.00 0.00 C ATOM 91 CD PRO A 7 -11.081 9.521 -10.172 1.00 0.00 C ATOM 0 HA PRO A 7 -14.279 8.978 -9.933 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -13.332 8.642 -12.476 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -13.323 10.247 -11.773 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -11.009 8.253 -11.945 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -10.985 9.968 -12.305 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -10.176 9.000 -9.860 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.902 10.586 -10.026 1.00 0.00 H new ATOM 99 N ILE A 8 -14.553 6.639 -10.944 1.00 0.00 N ATOM 100 CA ILE A 8 -14.876 5.208 -11.147 1.00 0.00 C ATOM 101 C ILE A 8 -15.214 4.854 -12.610 1.00 0.00 C ATOM 102 O ILE A 8 -15.455 3.689 -12.924 1.00 0.00 O ATOM 103 CB ILE A 8 -16.009 4.750 -10.193 1.00 0.00 C ATOM 104 CG1 ILE A 8 -17.336 5.503 -10.454 1.00 0.00 C ATOM 105 CG2 ILE A 8 -15.558 4.881 -8.728 1.00 0.00 C ATOM 106 CD1 ILE A 8 -18.538 4.906 -9.713 1.00 0.00 C ATOM 0 H ILE A 8 -15.282 7.260 -11.295 1.00 0.00 H new ATOM 0 HA ILE A 8 -13.966 4.659 -10.903 1.00 0.00 H new ATOM 0 HB ILE A 8 -16.211 3.699 -10.397 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -17.217 6.545 -10.156 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -17.541 5.499 -11.524 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -16.363 4.556 -8.069 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -14.679 4.259 -8.561 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -15.312 5.921 -8.515 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -19.432 5.485 -9.944 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -18.683 3.873 -10.029 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -18.354 4.935 -8.639 1.00 0.00 H new ATOM 118 N ARG A 9 -15.228 5.842 -13.520 1.00 0.00 N ATOM 119 CA ARG A 9 -15.559 5.693 -14.953 1.00 0.00 C ATOM 120 C ARG A 9 -14.811 4.550 -15.646 1.00 0.00 C ATOM 121 O ARG A 9 -15.385 3.873 -16.494 1.00 0.00 O ATOM 122 CB ARG A 9 -15.279 7.036 -15.653 1.00 0.00 C ATOM 123 CG ARG A 9 -15.950 7.167 -17.030 1.00 0.00 C ATOM 124 CD ARG A 9 -15.499 8.473 -17.702 1.00 0.00 C ATOM 125 NE ARG A 9 -16.430 8.905 -18.765 1.00 0.00 N ATOM 126 CZ ARG A 9 -17.517 9.638 -18.594 1.00 0.00 C ATOM 127 NH1 ARG A 9 -18.237 10.021 -19.602 1.00 0.00 N ATOM 128 NH2 ARG A 9 -17.936 10.023 -17.424 1.00 0.00 N ATOM 0 H ARG A 9 -15.001 6.805 -13.271 1.00 0.00 H new ATOM 0 HA ARG A 9 -16.613 5.426 -15.027 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -15.623 7.848 -15.012 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -14.202 7.157 -15.770 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -15.687 6.315 -17.656 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -17.034 7.159 -16.919 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -15.420 9.258 -16.950 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -14.504 8.337 -18.126 1.00 0.00 H new ATOM 0 HE ARG A 9 -16.214 8.611 -19.718 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -17.969 9.757 -20.550 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -19.072 10.586 -19.447 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -17.419 9.760 -16.585 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -18.782 10.588 -17.346 1.00 0.00 H new ATOM 142 N ASP A 10 -13.552 4.336 -15.266 1.00 0.00 N ATOM 143 CA ASP A 10 -12.650 3.303 -15.794 1.00 0.00 C ATOM 144 C ASP A 10 -13.047 1.850 -15.452 1.00 0.00 C ATOM 145 O ASP A 10 -12.557 0.929 -16.105 1.00 0.00 O ATOM 146 CB ASP A 10 -11.229 3.574 -15.276 1.00 0.00 C ATOM 147 CG ASP A 10 -10.687 4.929 -15.756 1.00 0.00 C ATOM 148 OD1 ASP A 10 -10.148 5.003 -16.886 1.00 0.00 O ATOM 149 OD2 ASP A 10 -10.798 5.924 -14.999 1.00 0.00 O ATOM 0 H ASP A 10 -13.107 4.905 -14.546 1.00 0.00 H new ATOM 0 HA ASP A 10 -12.714 3.376 -16.880 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -11.230 3.550 -14.186 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -10.564 2.779 -15.611 1.00 0.00 H new ATOM 154 N THR A 11 -13.908 1.623 -14.448 1.00 0.00 N ATOM 155 CA THR A 11 -14.332 0.272 -14.014 1.00 0.00 C ATOM 156 C THR A 11 -15.835 0.104 -13.777 1.00 0.00 C ATOM 157 O THR A 11 -16.294 -1.029 -13.646 1.00 0.00 O ATOM 158 CB THR A 11 -13.589 -0.204 -12.753 1.00 0.00 C ATOM 159 OG1 THR A 11 -13.819 0.692 -11.685 1.00 0.00 O ATOM 160 CG2 THR A 11 -12.078 -0.320 -12.950 1.00 0.00 C ATOM 0 H THR A 11 -14.336 2.374 -13.907 1.00 0.00 H new ATOM 0 HA THR A 11 -14.065 -0.348 -14.870 1.00 0.00 H new ATOM 0 HB THR A 11 -13.982 -1.197 -12.533 1.00 0.00 H new ATOM 0 HG1 THR A 11 -13.343 0.379 -10.887 1.00 0.00 H new ATOM 0 HG21 THR A 11 -11.615 -0.660 -12.023 1.00 0.00 H new ATOM 0 HG22 THR A 11 -11.869 -1.036 -13.744 1.00 0.00 H new ATOM 0 HG23 THR A 11 -11.671 0.654 -13.223 1.00 0.00 H new ATOM 168 N LYS A 12 -16.632 1.182 -13.761 1.00 0.00 N ATOM 169 CA LYS A 12 -18.098 1.152 -13.565 1.00 0.00 C ATOM 170 C LYS A 12 -18.846 0.185 -14.507 1.00 0.00 C ATOM 171 O LYS A 12 -19.881 -0.364 -14.129 1.00 0.00 O ATOM 172 CB LYS A 12 -18.614 2.601 -13.657 1.00 0.00 C ATOM 173 CG LYS A 12 -20.091 2.762 -13.272 1.00 0.00 C ATOM 174 CD LYS A 12 -20.499 4.242 -13.264 1.00 0.00 C ATOM 175 CE LYS A 12 -21.960 4.375 -12.823 1.00 0.00 C ATOM 176 NZ LYS A 12 -22.417 5.787 -12.867 1.00 0.00 N ATOM 0 H LYS A 12 -16.270 2.127 -13.887 1.00 0.00 H new ATOM 0 HA LYS A 12 -18.309 0.741 -12.578 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -18.009 3.234 -13.008 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.473 2.962 -14.676 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -20.716 2.213 -13.976 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -20.263 2.328 -12.287 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -19.853 4.803 -12.589 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -20.369 4.670 -14.258 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -22.593 3.767 -13.469 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -22.072 3.987 -11.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -23.375 5.855 -12.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -21.767 6.380 -12.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -22.430 6.117 -13.853 1.00 0.00 H new ATOM 190 N TRP A 13 -18.308 -0.061 -15.707 1.00 0.00 N ATOM 191 CA TRP A 13 -18.856 -0.989 -16.716 1.00 0.00 C ATOM 192 C TRP A 13 -18.218 -2.397 -16.687 1.00 0.00 C ATOM 193 O TRP A 13 -18.675 -3.300 -17.391 1.00 0.00 O ATOM 194 CB TRP A 13 -18.729 -0.329 -18.098 1.00 0.00 C ATOM 195 CG TRP A 13 -17.546 -0.677 -18.952 1.00 0.00 C ATOM 196 CD1 TRP A 13 -17.496 -1.731 -19.795 1.00 0.00 C ATOM 197 CD2 TRP A 13 -16.285 0.033 -19.145 1.00 0.00 C ATOM 198 NE1 TRP A 13 -16.334 -1.691 -20.537 1.00 0.00 N ATOM 199 CE2 TRP A 13 -15.551 -0.616 -20.187 1.00 0.00 C ATOM 200 CE3 TRP A 13 -15.688 1.166 -18.557 1.00 0.00 C ATOM 201 CZ2 TRP A 13 -14.311 -0.147 -20.644 1.00 0.00 C ATOM 202 CZ3 TRP A 13 -14.453 1.655 -19.020 1.00 0.00 C ATOM 203 CH2 TRP A 13 -13.762 1.007 -20.058 1.00 0.00 C ATOM 0 H TRP A 13 -17.449 0.394 -16.018 1.00 0.00 H new ATOM 0 HA TRP A 13 -19.905 -1.167 -16.478 1.00 0.00 H new ATOM 0 HB2 TRP A 13 -19.629 -0.570 -18.664 1.00 0.00 H new ATOM 0 HB3 TRP A 13 -18.725 0.751 -17.950 1.00 0.00 H new ATOM 0 HD1 TRP A 13 -18.256 -2.494 -19.876 1.00 0.00 H new ATOM 0 HE1 TRP A 13 -16.087 -2.372 -21.255 1.00 0.00 H new ATOM 0 HE3 TRP A 13 -16.186 1.666 -17.739 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 -13.786 -0.664 -21.434 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 -14.030 2.541 -18.571 1.00 0.00 H new ATOM 0 HH2 TRP A 13 -12.815 1.393 -20.404 1.00 0.00 H new ATOM 214 N LEU A 14 -17.169 -2.586 -15.879 1.00 0.00 N ATOM 215 CA LEU A 14 -16.363 -3.810 -15.770 1.00 0.00 C ATOM 216 C LEU A 14 -16.724 -4.736 -14.599 1.00 0.00 C ATOM 217 O LEU A 14 -16.235 -5.865 -14.563 1.00 0.00 O ATOM 218 CB LEU A 14 -14.881 -3.393 -15.670 1.00 0.00 C ATOM 219 CG LEU A 14 -14.339 -2.629 -16.894 1.00 0.00 C ATOM 220 CD1 LEU A 14 -12.846 -2.379 -16.731 1.00 0.00 C ATOM 221 CD2 LEU A 14 -14.522 -3.365 -18.222 1.00 0.00 C ATOM 0 H LEU A 14 -16.841 -1.852 -15.251 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.573 -4.402 -16.661 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -14.753 -2.770 -14.785 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -14.276 -4.287 -15.521 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.917 -1.706 -16.931 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.471 -1.839 -17.600 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.672 -1.787 -15.833 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -12.325 -3.332 -16.644 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -14.115 -2.760 -19.032 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -13.999 -4.320 -18.184 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -15.583 -3.540 -18.398 1.00 0.00 H new ATOM 233 N THR A 15 -17.540 -4.294 -13.638 1.00 0.00 N ATOM 234 CA THR A 15 -17.948 -5.098 -12.467 1.00 0.00 C ATOM 235 C THR A 15 -19.028 -6.126 -12.854 1.00 0.00 C ATOM 236 O THR A 15 -20.224 -5.953 -12.605 1.00 0.00 O ATOM 237 CB THR A 15 -18.371 -4.215 -11.281 1.00 0.00 C ATOM 238 OG1 THR A 15 -17.479 -3.132 -11.126 1.00 0.00 O ATOM 239 CG2 THR A 15 -18.375 -4.971 -9.954 1.00 0.00 C ATOM 0 H THR A 15 -17.944 -3.358 -13.645 1.00 0.00 H new ATOM 0 HA THR A 15 -17.077 -5.659 -12.128 1.00 0.00 H new ATOM 0 HB THR A 15 -19.381 -3.878 -11.513 1.00 0.00 H new ATOM 0 HG1 THR A 15 -17.764 -2.580 -10.368 1.00 0.00 H new ATOM 0 HG21 THR A 15 -18.681 -4.298 -9.153 1.00 0.00 H new ATOM 0 HG22 THR A 15 -19.073 -5.806 -10.013 1.00 0.00 H new ATOM 0 HG23 THR A 15 -17.374 -5.349 -9.748 1.00 0.00 H new ATOM 247 N LEU A 16 -18.591 -7.190 -13.525 1.00 0.00 N ATOM 248 CA LEU A 16 -19.377 -8.303 -14.063 1.00 0.00 C ATOM 249 C LEU A 16 -19.825 -9.292 -12.967 1.00 0.00 C ATOM 250 O LEU A 16 -19.081 -9.571 -12.028 1.00 0.00 O ATOM 251 CB LEU A 16 -18.466 -8.981 -15.106 1.00 0.00 C ATOM 252 CG LEU A 16 -19.151 -9.878 -16.148 1.00 0.00 C ATOM 253 CD1 LEU A 16 -20.342 -9.215 -16.847 1.00 0.00 C ATOM 254 CD2 LEU A 16 -18.123 -10.202 -17.233 1.00 0.00 C ATOM 0 H LEU A 16 -17.597 -7.307 -13.724 1.00 0.00 H new ATOM 0 HA LEU A 16 -20.306 -7.947 -14.508 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -17.919 -8.202 -15.636 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -17.729 -9.582 -14.573 1.00 0.00 H new ATOM 0 HG LEU A 16 -19.522 -10.755 -15.617 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -20.773 -9.909 -17.568 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -21.095 -8.947 -16.106 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -20.006 -8.317 -17.365 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -18.581 -10.839 -17.989 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -17.780 -9.277 -17.697 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -17.274 -10.721 -16.787 1.00 0.00 H new ATOM 266 N GLU A 17 -21.032 -9.853 -13.071 1.00 0.00 N ATOM 267 CA GLU A 17 -21.524 -10.848 -12.101 1.00 0.00 C ATOM 268 C GLU A 17 -20.755 -12.175 -12.188 1.00 0.00 C ATOM 269 O GLU A 17 -20.345 -12.587 -13.276 1.00 0.00 O ATOM 270 CB GLU A 17 -23.005 -11.170 -12.340 1.00 0.00 C ATOM 271 CG GLU A 17 -23.949 -10.011 -12.028 1.00 0.00 C ATOM 272 CD GLU A 17 -25.419 -10.430 -12.222 1.00 0.00 C ATOM 273 OE1 GLU A 17 -26.116 -9.836 -13.078 1.00 0.00 O ATOM 274 OE2 GLU A 17 -25.892 -11.353 -11.514 1.00 0.00 O ATOM 0 H GLU A 17 -21.692 -9.638 -13.818 1.00 0.00 H new ATOM 0 HA GLU A 17 -21.376 -10.398 -11.119 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -23.139 -11.465 -13.381 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -23.284 -12.027 -11.727 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -23.794 -9.677 -11.002 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -23.719 -9.165 -12.676 1.00 0.00 H new ATOM 281 N VAL A 18 -20.620 -12.879 -11.058 1.00 0.00 N ATOM 282 CA VAL A 18 -20.037 -14.234 -11.022 1.00 0.00 C ATOM 283 C VAL A 18 -21.100 -15.281 -11.387 1.00 0.00 C ATOM 284 O VAL A 18 -22.290 -15.088 -11.112 1.00 0.00 O ATOM 285 CB VAL A 18 -19.418 -14.586 -9.654 1.00 0.00 C ATOM 286 CG1 VAL A 18 -18.351 -13.565 -9.250 1.00 0.00 C ATOM 287 CG2 VAL A 18 -20.432 -14.704 -8.510 1.00 0.00 C ATOM 0 H VAL A 18 -20.909 -12.531 -10.144 1.00 0.00 H new ATOM 0 HA VAL A 18 -19.231 -14.244 -11.756 1.00 0.00 H new ATOM 0 HB VAL A 18 -18.977 -15.572 -9.802 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -17.933 -13.840 -8.282 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -17.558 -13.553 -9.997 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -18.802 -12.575 -9.183 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -19.911 -14.954 -7.586 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -20.954 -13.755 -8.387 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -21.153 -15.487 -8.743 1.00 0.00 H new ATOM 297 N CYS A 19 -20.691 -16.400 -11.989 1.00 0.00 N ATOM 298 CA CYS A 19 -21.602 -17.487 -12.348 1.00 0.00 C ATOM 299 C CYS A 19 -22.172 -18.178 -11.100 1.00 0.00 C ATOM 300 O CYS A 19 -21.448 -18.642 -10.212 1.00 0.00 O ATOM 301 CB CYS A 19 -20.877 -18.432 -13.301 1.00 0.00 C ATOM 302 SG CYS A 19 -21.929 -19.800 -13.890 1.00 0.00 S ATOM 0 H CYS A 19 -19.719 -16.577 -12.241 1.00 0.00 H new ATOM 0 HA CYS A 19 -22.476 -17.095 -12.868 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -20.514 -17.866 -14.159 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -20.002 -18.845 -12.798 1.00 0.00 H new ATOM 307 N ARG A 20 -23.503 -18.202 -11.018 1.00 0.00 N ATOM 308 CA ARG A 20 -24.266 -18.729 -9.881 1.00 0.00 C ATOM 309 C ARG A 20 -24.076 -20.230 -9.667 1.00 0.00 C ATOM 310 O ARG A 20 -24.157 -20.687 -8.526 1.00 0.00 O ATOM 311 CB ARG A 20 -25.759 -18.413 -10.049 1.00 0.00 C ATOM 312 CG ARG A 20 -26.120 -16.910 -10.062 1.00 0.00 C ATOM 313 CD ARG A 20 -25.848 -16.194 -11.400 1.00 0.00 C ATOM 314 NE ARG A 20 -26.403 -14.826 -11.439 1.00 0.00 N ATOM 315 CZ ARG A 20 -27.619 -14.460 -11.801 1.00 0.00 C ATOM 316 NH1 ARG A 20 -28.554 -15.322 -12.095 1.00 0.00 N ATOM 317 NH2 ARG A 20 -27.923 -13.199 -11.871 1.00 0.00 N ATOM 0 H ARG A 20 -24.100 -17.844 -11.763 1.00 0.00 H new ATOM 0 HA ARG A 20 -23.875 -18.231 -8.994 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -26.105 -18.861 -10.980 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -26.308 -18.895 -9.240 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -27.176 -16.802 -9.816 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -25.556 -16.408 -9.276 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -24.772 -16.150 -11.571 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -26.277 -16.779 -12.214 1.00 0.00 H new ATOM 0 HE ARG A 20 -25.773 -14.076 -11.153 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -28.358 -16.322 -12.050 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -29.480 -14.996 -12.370 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -27.223 -12.492 -11.646 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -28.862 -12.916 -12.151 1.00 0.00 H new ATOM 331 N GLU A 21 -23.797 -20.986 -10.724 1.00 0.00 N ATOM 332 CA GLU A 21 -23.549 -22.426 -10.636 1.00 0.00 C ATOM 333 C GLU A 21 -22.087 -22.688 -10.240 1.00 0.00 C ATOM 334 O GLU A 21 -21.800 -23.552 -9.407 1.00 0.00 O ATOM 335 CB GLU A 21 -23.863 -23.094 -11.982 1.00 0.00 C ATOM 336 CG GLU A 21 -25.304 -22.891 -12.482 1.00 0.00 C ATOM 337 CD GLU A 21 -26.350 -23.523 -11.542 1.00 0.00 C ATOM 338 OE1 GLU A 21 -26.701 -24.713 -11.728 1.00 0.00 O ATOM 339 OE2 GLU A 21 -26.852 -22.827 -10.626 1.00 0.00 O ATOM 0 H GLU A 21 -23.736 -20.617 -11.673 1.00 0.00 H new ATOM 0 HA GLU A 21 -24.199 -22.852 -9.871 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -23.175 -22.707 -12.733 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -23.671 -24.163 -11.895 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -25.505 -21.824 -12.578 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -25.405 -23.325 -13.477 1.00 0.00 H new ATOM 346 N PHE A 22 -21.154 -21.893 -10.773 1.00 0.00 N ATOM 347 CA PHE A 22 -19.732 -21.928 -10.425 1.00 0.00 C ATOM 348 C PHE A 22 -19.519 -21.596 -8.939 1.00 0.00 C ATOM 349 O PHE A 22 -18.635 -22.170 -8.300 1.00 0.00 O ATOM 350 CB PHE A 22 -19.002 -20.936 -11.331 1.00 0.00 C ATOM 351 CG PHE A 22 -17.494 -20.872 -11.193 1.00 0.00 C ATOM 352 CD1 PHE A 22 -16.692 -21.844 -11.818 1.00 0.00 C ATOM 353 CD2 PHE A 22 -16.887 -19.802 -10.508 1.00 0.00 C ATOM 354 CE1 PHE A 22 -15.289 -21.755 -11.749 1.00 0.00 C ATOM 355 CE2 PHE A 22 -15.484 -19.719 -10.429 1.00 0.00 C ATOM 356 CZ PHE A 22 -14.687 -20.695 -11.051 1.00 0.00 C ATOM 0 H PHE A 22 -21.374 -21.189 -11.477 1.00 0.00 H new ATOM 0 HA PHE A 22 -19.332 -22.930 -10.579 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -19.239 -21.182 -12.366 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -19.404 -19.941 -11.140 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -17.154 -22.661 -12.352 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -17.499 -19.044 -10.042 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -14.676 -22.501 -12.232 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -15.020 -18.906 -9.891 1.00 0.00 H new ATOM 0 HZ PHE A 22 -13.611 -20.630 -10.992 1.00 0.00 H new ATOM 366 N GLN A 23 -20.375 -20.741 -8.356 1.00 0.00 N ATOM 367 CA GLN A 23 -20.349 -20.402 -6.922 1.00 0.00 C ATOM 368 C GLN A 23 -20.592 -21.617 -5.999 1.00 0.00 C ATOM 369 O GLN A 23 -20.273 -21.559 -4.809 1.00 0.00 O ATOM 370 CB GLN A 23 -21.377 -19.294 -6.617 1.00 0.00 C ATOM 371 CG GLN A 23 -20.902 -17.887 -7.007 1.00 0.00 C ATOM 372 CD GLN A 23 -19.819 -17.354 -6.071 1.00 0.00 C ATOM 373 OE1 GLN A 23 -18.627 -17.506 -6.300 1.00 0.00 O ATOM 374 NE2 GLN A 23 -20.184 -16.711 -4.980 1.00 0.00 N ATOM 0 H GLN A 23 -21.112 -20.260 -8.871 1.00 0.00 H new ATOM 0 HA GLN A 23 -19.341 -20.045 -6.709 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -22.304 -19.515 -7.147 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -21.608 -19.308 -5.552 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -20.518 -17.906 -8.027 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -21.752 -17.205 -6.999 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -21.174 -16.576 -4.775 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -19.477 -16.348 -4.341 1.00 0.00 H new ATOM 383 N ARG A 24 -21.129 -22.723 -6.541 1.00 0.00 N ATOM 384 CA ARG A 24 -21.395 -23.998 -5.845 1.00 0.00 C ATOM 385 C ARG A 24 -20.658 -25.176 -6.511 1.00 0.00 C ATOM 386 O ARG A 24 -20.959 -26.337 -6.230 1.00 0.00 O ATOM 387 CB ARG A 24 -22.918 -24.245 -5.736 1.00 0.00 C ATOM 388 CG ARG A 24 -23.670 -23.240 -4.846 1.00 0.00 C ATOM 389 CD ARG A 24 -24.178 -22.008 -5.605 1.00 0.00 C ATOM 390 NE ARG A 24 -24.859 -21.064 -4.700 1.00 0.00 N ATOM 391 CZ ARG A 24 -25.391 -19.902 -5.033 1.00 0.00 C ATOM 392 NH1 ARG A 24 -25.369 -19.457 -6.257 1.00 0.00 N ATOM 393 NH2 ARG A 24 -25.957 -19.155 -4.130 1.00 0.00 N ATOM 0 H ARG A 24 -21.403 -22.756 -7.523 1.00 0.00 H new ATOM 0 HA ARG A 24 -20.998 -23.924 -4.832 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -23.349 -24.217 -6.737 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -23.082 -25.249 -5.346 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -24.517 -23.743 -4.379 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -23.010 -22.914 -4.042 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -23.341 -21.508 -6.093 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -24.865 -22.321 -6.392 1.00 0.00 H new ATOM 0 HE ARG A 24 -24.926 -21.335 -3.719 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -24.931 -20.011 -6.993 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -25.790 -18.555 -6.479 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -25.991 -19.466 -3.159 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -26.366 -18.258 -4.393 1.00 0.00 H new ATOM 407 N GLY A 25 -19.691 -24.888 -7.391 1.00 0.00 N ATOM 408 CA GLY A 25 -18.887 -25.879 -8.119 1.00 0.00 C ATOM 409 C GLY A 25 -19.710 -26.844 -8.983 1.00 0.00 C ATOM 410 O GLY A 25 -19.376 -28.028 -9.059 1.00 0.00 O ATOM 0 H GLY A 25 -19.438 -23.928 -7.624 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -18.175 -25.355 -8.757 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -18.306 -26.457 -7.401 1.00 0.00 H new ATOM 414 N THR A 26 -20.798 -26.360 -9.597 1.00 0.00 N ATOM 415 CA THR A 26 -21.737 -27.178 -10.391 1.00 0.00 C ATOM 416 C THR A 26 -22.031 -26.626 -11.802 1.00 0.00 C ATOM 417 O THR A 26 -22.989 -27.062 -12.448 1.00 0.00 O ATOM 418 CB THR A 26 -22.997 -27.476 -9.552 1.00 0.00 C ATOM 419 OG1 THR A 26 -23.779 -28.507 -10.120 1.00 0.00 O ATOM 420 CG2 THR A 26 -23.895 -26.262 -9.305 1.00 0.00 C ATOM 0 H THR A 26 -21.058 -25.375 -9.558 1.00 0.00 H new ATOM 0 HA THR A 26 -21.247 -28.126 -10.612 1.00 0.00 H new ATOM 0 HB THR A 26 -22.599 -27.792 -8.588 1.00 0.00 H new ATOM 0 HG1 THR A 26 -23.802 -28.401 -11.094 1.00 0.00 H new ATOM 0 HG21 THR A 26 -24.756 -26.562 -8.708 1.00 0.00 H new ATOM 0 HG22 THR A 26 -23.332 -25.496 -8.771 1.00 0.00 H new ATOM 0 HG23 THR A 26 -24.237 -25.862 -10.260 1.00 0.00 H new ATOM 428 N CYS A 27 -21.199 -25.704 -12.312 1.00 0.00 N ATOM 429 CA CYS A 27 -21.304 -25.202 -13.691 1.00 0.00 C ATOM 430 C CYS A 27 -20.961 -26.323 -14.717 1.00 0.00 C ATOM 431 O CYS A 27 -20.545 -27.430 -14.347 1.00 0.00 O ATOM 432 CB CYS A 27 -20.449 -23.926 -13.849 1.00 0.00 C ATOM 433 SG CYS A 27 -20.937 -23.023 -15.359 1.00 0.00 S ATOM 0 H CYS A 27 -20.435 -25.286 -11.780 1.00 0.00 H new ATOM 0 HA CYS A 27 -22.334 -24.916 -13.906 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -20.575 -23.285 -12.976 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -19.393 -24.191 -13.900 1.00 0.00 H new ATOM 438 N SER A 28 -21.132 -26.052 -16.013 1.00 0.00 N ATOM 439 CA SER A 28 -20.936 -27.010 -17.120 1.00 0.00 C ATOM 440 C SER A 28 -20.179 -26.460 -18.341 1.00 0.00 C ATOM 441 O SER A 28 -20.106 -27.127 -19.379 1.00 0.00 O ATOM 442 CB SER A 28 -22.301 -27.580 -17.538 1.00 0.00 C ATOM 443 OG SER A 28 -23.162 -26.562 -18.032 1.00 0.00 O ATOM 0 H SER A 28 -21.421 -25.130 -16.339 1.00 0.00 H new ATOM 0 HA SER A 28 -20.285 -27.793 -16.731 1.00 0.00 H new ATOM 0 HB2 SER A 28 -22.159 -28.342 -18.305 1.00 0.00 H new ATOM 0 HB3 SER A 28 -22.768 -28.071 -16.684 1.00 0.00 H new ATOM 0 HG SER A 28 -24.021 -26.957 -18.291 1.00 0.00 H new ATOM 449 N ARG A 29 -19.599 -25.256 -18.237 1.00 0.00 N ATOM 450 CA ARG A 29 -18.862 -24.555 -19.305 1.00 0.00 C ATOM 451 C ARG A 29 -17.519 -23.997 -18.811 1.00 0.00 C ATOM 452 O ARG A 29 -17.392 -23.683 -17.624 1.00 0.00 O ATOM 453 CB ARG A 29 -19.723 -23.367 -19.757 1.00 0.00 C ATOM 454 CG ARG A 29 -21.004 -23.775 -20.504 1.00 0.00 C ATOM 455 CD ARG A 29 -21.927 -22.564 -20.684 1.00 0.00 C ATOM 456 NE ARG A 29 -22.385 -22.045 -19.380 1.00 0.00 N ATOM 457 CZ ARG A 29 -23.313 -22.539 -18.586 1.00 0.00 C ATOM 458 NH1 ARG A 29 -23.388 -22.099 -17.371 1.00 0.00 N ATOM 459 NH2 ARG A 29 -24.159 -23.459 -18.964 1.00 0.00 N ATOM 0 H ARG A 29 -19.630 -24.719 -17.371 1.00 0.00 H new ATOM 0 HA ARG A 29 -18.663 -25.263 -20.109 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -19.996 -22.776 -18.883 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -19.126 -22.723 -20.403 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -20.747 -24.192 -21.478 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -21.523 -24.556 -19.949 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -21.400 -21.779 -21.226 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -22.788 -22.846 -21.289 1.00 0.00 H new ATOM 0 HE ARG A 29 -21.924 -21.196 -19.052 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -22.737 -21.384 -17.046 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -24.098 -22.467 -16.738 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -24.120 -23.829 -19.914 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -24.859 -23.808 -18.309 1.00 0.00 H new ATOM 473 N PRO A 30 -16.524 -23.826 -19.703 1.00 0.00 N ATOM 474 CA PRO A 30 -15.273 -23.167 -19.348 1.00 0.00 C ATOM 475 C PRO A 30 -15.522 -21.653 -19.210 1.00 0.00 C ATOM 476 O PRO A 30 -16.499 -21.115 -19.744 1.00 0.00 O ATOM 477 CB PRO A 30 -14.319 -23.482 -20.503 1.00 0.00 C ATOM 478 CG PRO A 30 -15.254 -23.574 -21.708 1.00 0.00 C ATOM 479 CD PRO A 30 -16.535 -24.166 -21.120 1.00 0.00 C ATOM 0 HA PRO A 30 -14.859 -23.507 -18.399 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -13.570 -22.700 -20.632 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -13.780 -24.415 -20.338 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -15.432 -22.595 -22.154 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -14.840 -24.210 -22.490 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -17.416 -23.755 -21.613 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -16.566 -25.246 -21.261 1.00 0.00 H new ATOM 487 N ASP A 31 -14.611 -20.943 -18.540 1.00 0.00 N ATOM 488 CA ASP A 31 -14.680 -19.482 -18.364 1.00 0.00 C ATOM 489 C ASP A 31 -14.822 -18.715 -19.694 1.00 0.00 C ATOM 490 O ASP A 31 -15.415 -17.637 -19.739 1.00 0.00 O ATOM 491 CB ASP A 31 -13.447 -18.990 -17.592 1.00 0.00 C ATOM 492 CG ASP A 31 -12.128 -19.176 -18.363 1.00 0.00 C ATOM 493 OD1 ASP A 31 -11.611 -18.183 -18.926 1.00 0.00 O ATOM 494 OD2 ASP A 31 -11.603 -20.315 -18.396 1.00 0.00 O ATOM 0 H ASP A 31 -13.795 -21.366 -18.098 1.00 0.00 H new ATOM 0 HA ASP A 31 -15.584 -19.274 -17.792 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -13.574 -17.934 -17.354 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -13.384 -19.525 -16.644 1.00 0.00 H new ATOM 499 N THR A 32 -14.301 -19.290 -20.779 1.00 0.00 N ATOM 500 CA THR A 32 -14.342 -18.750 -22.145 1.00 0.00 C ATOM 501 C THR A 32 -15.718 -18.800 -22.823 1.00 0.00 C ATOM 502 O THR A 32 -15.942 -18.042 -23.771 1.00 0.00 O ATOM 503 CB THR A 32 -13.330 -19.470 -23.053 1.00 0.00 C ATOM 504 OG1 THR A 32 -13.485 -20.870 -22.951 1.00 0.00 O ATOM 505 CG2 THR A 32 -11.887 -19.136 -22.673 1.00 0.00 C ATOM 0 H THR A 32 -13.816 -20.186 -20.731 1.00 0.00 H new ATOM 0 HA THR A 32 -14.086 -17.698 -22.021 1.00 0.00 H new ATOM 0 HB THR A 32 -13.527 -19.130 -24.070 1.00 0.00 H new ATOM 0 HG1 THR A 32 -12.836 -21.314 -23.535 1.00 0.00 H new ATOM 0 HG21 THR A 32 -11.204 -19.664 -23.338 1.00 0.00 H new ATOM 0 HG22 THR A 32 -11.726 -18.062 -22.766 1.00 0.00 H new ATOM 0 HG23 THR A 32 -11.701 -19.443 -21.644 1.00 0.00 H new ATOM 513 N GLU A 33 -16.649 -19.648 -22.362 1.00 0.00 N ATOM 514 CA GLU A 33 -17.990 -19.814 -22.958 1.00 0.00 C ATOM 515 C GLU A 33 -19.145 -19.380 -22.045 1.00 0.00 C ATOM 516 O GLU A 33 -20.192 -18.970 -22.553 1.00 0.00 O ATOM 517 CB GLU A 33 -18.229 -21.293 -23.350 1.00 0.00 C ATOM 518 CG GLU A 33 -18.765 -21.484 -24.778 1.00 0.00 C ATOM 519 CD GLU A 33 -20.082 -20.731 -25.052 1.00 0.00 C ATOM 520 OE1 GLU A 33 -20.039 -19.691 -25.753 1.00 0.00 O ATOM 521 OE2 GLU A 33 -21.161 -21.165 -24.576 1.00 0.00 O ATOM 0 H GLU A 33 -16.493 -20.249 -21.552 1.00 0.00 H new ATOM 0 HA GLU A 33 -17.991 -19.159 -23.829 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -17.292 -21.841 -23.249 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -18.934 -21.735 -22.646 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -18.010 -21.147 -25.488 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -18.921 -22.548 -24.959 1.00 0.00 H new ATOM 528 N CYS A 34 -18.999 -19.499 -20.722 1.00 0.00 N ATOM 529 CA CYS A 34 -20.084 -19.196 -19.793 1.00 0.00 C ATOM 530 C CYS A 34 -20.621 -17.746 -19.877 1.00 0.00 C ATOM 531 O CYS A 34 -19.978 -16.819 -20.383 1.00 0.00 O ATOM 532 CB CYS A 34 -19.690 -19.640 -18.385 1.00 0.00 C ATOM 533 SG CYS A 34 -21.202 -20.006 -17.443 1.00 0.00 S ATOM 0 H CYS A 34 -18.136 -19.804 -20.272 1.00 0.00 H new ATOM 0 HA CYS A 34 -20.953 -19.778 -20.100 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -19.052 -20.522 -18.432 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -19.116 -18.857 -17.889 1.00 0.00 H new ATOM 538 N LYS A 35 -21.858 -17.584 -19.401 1.00 0.00 N ATOM 539 CA LYS A 35 -22.679 -16.363 -19.476 1.00 0.00 C ATOM 540 C LYS A 35 -22.463 -15.360 -18.330 1.00 0.00 C ATOM 541 O LYS A 35 -23.058 -14.282 -18.343 1.00 0.00 O ATOM 542 CB LYS A 35 -24.160 -16.772 -19.637 1.00 0.00 C ATOM 543 CG LYS A 35 -24.416 -17.864 -20.704 1.00 0.00 C ATOM 544 CD LYS A 35 -23.923 -17.496 -22.118 1.00 0.00 C ATOM 545 CE LYS A 35 -23.984 -18.673 -23.104 1.00 0.00 C ATOM 546 NZ LYS A 35 -22.887 -19.651 -22.875 1.00 0.00 N ATOM 0 H LYS A 35 -22.346 -18.343 -18.925 1.00 0.00 H new ATOM 0 HA LYS A 35 -22.349 -15.804 -20.352 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -24.531 -17.128 -18.676 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -24.741 -15.887 -19.895 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -23.926 -18.785 -20.389 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -25.485 -18.070 -20.747 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -24.527 -16.675 -22.504 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -22.896 -17.135 -22.056 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -24.945 -19.178 -23.007 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -23.925 -18.294 -24.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -22.739 -20.215 -23.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -22.011 -19.142 -22.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -23.143 -20.282 -22.088 1.00 0.00 H new ATOM 560 N PHE A 36 -21.576 -15.681 -17.388 1.00 0.00 N ATOM 561 CA PHE A 36 -21.145 -14.847 -16.258 1.00 0.00 C ATOM 562 C PHE A 36 -19.644 -15.095 -15.980 1.00 0.00 C ATOM 563 O PHE A 36 -19.050 -16.032 -16.524 1.00 0.00 O ATOM 564 CB PHE A 36 -21.998 -15.158 -15.021 1.00 0.00 C ATOM 565 CG PHE A 36 -23.498 -14.961 -15.149 1.00 0.00 C ATOM 566 CD1 PHE A 36 -24.038 -13.663 -15.215 1.00 0.00 C ATOM 567 CD2 PHE A 36 -24.362 -16.075 -15.150 1.00 0.00 C ATOM 568 CE1 PHE A 36 -25.431 -13.476 -15.273 1.00 0.00 C ATOM 569 CE2 PHE A 36 -25.755 -15.889 -15.214 1.00 0.00 C ATOM 570 CZ PHE A 36 -26.290 -14.590 -15.271 1.00 0.00 C ATOM 0 H PHE A 36 -21.108 -16.587 -17.391 1.00 0.00 H new ATOM 0 HA PHE A 36 -21.282 -13.794 -16.503 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -21.816 -16.194 -14.736 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -21.644 -14.535 -14.200 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -23.380 -12.807 -15.221 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -23.954 -17.074 -15.102 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -25.841 -12.478 -15.319 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -26.414 -16.745 -15.219 1.00 0.00 H new ATOM 0 HZ PHE A 36 -27.360 -14.448 -15.313 1.00 0.00 H new ATOM 580 N ALA A 37 -18.995 -14.273 -15.152 1.00 0.00 N ATOM 581 CA ALA A 37 -17.562 -14.386 -14.874 1.00 0.00 C ATOM 582 C ALA A 37 -17.194 -15.581 -13.962 1.00 0.00 C ATOM 583 O ALA A 37 -17.987 -16.006 -13.118 1.00 0.00 O ATOM 584 CB ALA A 37 -17.112 -13.054 -14.281 1.00 0.00 C ATOM 0 H ALA A 37 -19.450 -13.508 -14.654 1.00 0.00 H new ATOM 0 HA ALA A 37 -17.035 -14.596 -15.805 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -16.046 -13.096 -14.059 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -17.302 -12.254 -14.997 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -17.666 -12.858 -13.363 1.00 0.00 H new ATOM 590 N HIS A 38 -15.977 -16.118 -14.136 1.00 0.00 N ATOM 591 CA HIS A 38 -15.448 -17.291 -13.414 1.00 0.00 C ATOM 592 C HIS A 38 -14.074 -16.969 -12.774 1.00 0.00 C ATOM 593 O HIS A 38 -13.034 -17.229 -13.389 1.00 0.00 O ATOM 594 CB HIS A 38 -15.387 -18.521 -14.356 1.00 0.00 C ATOM 595 CG HIS A 38 -16.732 -19.047 -14.804 1.00 0.00 C ATOM 596 ND1 HIS A 38 -17.753 -18.316 -15.355 1.00 0.00 N ATOM 597 CD2 HIS A 38 -17.209 -20.327 -14.662 1.00 0.00 C ATOM 598 CE1 HIS A 38 -18.830 -19.100 -15.445 1.00 0.00 C ATOM 599 NE2 HIS A 38 -18.567 -20.346 -15.024 1.00 0.00 N ATOM 0 H HIS A 38 -15.309 -15.736 -14.806 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.126 -17.541 -12.598 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -14.805 -18.256 -15.238 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -14.850 -19.323 -13.849 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -17.699 -17.340 -15.646 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -16.635 -21.179 -14.327 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -19.792 -18.772 -15.811 1.00 0.00 H new ATOM 607 N PRO A 39 -14.040 -16.361 -11.566 1.00 0.00 N ATOM 608 CA PRO A 39 -12.797 -15.953 -10.894 1.00 0.00 C ATOM 609 C PRO A 39 -11.855 -17.105 -10.507 1.00 0.00 C ATOM 610 O PRO A 39 -12.288 -18.211 -10.179 1.00 0.00 O ATOM 611 CB PRO A 39 -13.239 -15.190 -9.637 1.00 0.00 C ATOM 612 CG PRO A 39 -14.658 -15.683 -9.368 1.00 0.00 C ATOM 613 CD PRO A 39 -15.196 -15.979 -10.764 1.00 0.00 C ATOM 0 HA PRO A 39 -12.208 -15.354 -11.588 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.580 -15.399 -8.794 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.218 -14.112 -9.799 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -14.662 -16.573 -8.738 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.256 -14.928 -8.858 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -15.934 -16.781 -10.736 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -15.691 -15.104 -11.185 1.00 0.00 H new ATOM 621 N SER A 40 -10.550 -16.806 -10.483 1.00 0.00 N ATOM 622 CA SER A 40 -9.482 -17.713 -10.033 1.00 0.00 C ATOM 623 C SER A 40 -9.219 -17.577 -8.524 1.00 0.00 C ATOM 624 O SER A 40 -9.858 -16.786 -7.823 1.00 0.00 O ATOM 625 CB SER A 40 -8.176 -17.406 -10.785 1.00 0.00 C ATOM 626 OG SER A 40 -7.593 -16.201 -10.305 1.00 0.00 O ATOM 0 H SER A 40 -10.195 -15.899 -10.785 1.00 0.00 H new ATOM 0 HA SER A 40 -9.813 -18.730 -10.243 1.00 0.00 H new ATOM 0 HB2 SER A 40 -7.475 -18.231 -10.659 1.00 0.00 H new ATOM 0 HB3 SER A 40 -8.377 -17.319 -11.853 1.00 0.00 H new ATOM 0 HG SER A 40 -8.197 -15.451 -10.486 1.00 0.00 H new ATOM 632 N LYS A 41 -8.209 -18.307 -8.032 1.00 0.00 N ATOM 633 CA LYS A 41 -7.703 -18.246 -6.650 1.00 0.00 C ATOM 634 C LYS A 41 -7.189 -16.849 -6.241 1.00 0.00 C ATOM 635 O LYS A 41 -7.135 -16.564 -5.043 1.00 0.00 O ATOM 636 CB LYS A 41 -6.581 -19.288 -6.500 1.00 0.00 C ATOM 637 CG LYS A 41 -7.124 -20.729 -6.508 1.00 0.00 C ATOM 638 CD LYS A 41 -6.019 -21.790 -6.399 1.00 0.00 C ATOM 639 CE LYS A 41 -5.297 -21.748 -5.044 1.00 0.00 C ATOM 640 NZ LYS A 41 -4.278 -22.825 -4.935 1.00 0.00 N ATOM 0 H LYS A 41 -7.702 -18.982 -8.605 1.00 0.00 H new ATOM 0 HA LYS A 41 -8.537 -18.462 -5.982 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -5.864 -19.167 -7.312 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -6.043 -19.109 -5.569 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.821 -20.853 -5.679 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -7.688 -20.893 -7.426 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -6.453 -22.779 -6.545 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -5.294 -21.639 -7.199 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -4.817 -20.778 -4.916 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -6.025 -21.852 -4.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -3.810 -22.767 -4.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -4.740 -23.751 -5.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -3.570 -22.711 -5.688 1.00 0.00 H new ATOM 654 N SER A 42 -6.824 -15.991 -7.203 1.00 0.00 N ATOM 655 CA SER A 42 -6.302 -14.630 -6.962 1.00 0.00 C ATOM 656 C SER A 42 -7.263 -13.496 -7.348 1.00 0.00 C ATOM 657 O SER A 42 -7.057 -12.360 -6.917 1.00 0.00 O ATOM 658 CB SER A 42 -4.967 -14.422 -7.690 1.00 0.00 C ATOM 659 OG SER A 42 -4.021 -15.402 -7.285 1.00 0.00 O ATOM 0 H SER A 42 -6.883 -16.225 -8.194 1.00 0.00 H new ATOM 0 HA SER A 42 -6.169 -14.573 -5.882 1.00 0.00 H new ATOM 0 HB2 SER A 42 -5.121 -14.480 -8.768 1.00 0.00 H new ATOM 0 HB3 SER A 42 -4.581 -13.425 -7.476 1.00 0.00 H new ATOM 0 HG SER A 42 -3.176 -15.257 -7.759 1.00 0.00 H new ATOM 665 N CYS A 43 -8.308 -13.760 -8.143 1.00 0.00 N ATOM 666 CA CYS A 43 -9.277 -12.737 -8.548 1.00 0.00 C ATOM 667 C CYS A 43 -10.079 -12.187 -7.351 1.00 0.00 C ATOM 668 O CYS A 43 -10.550 -12.944 -6.498 1.00 0.00 O ATOM 669 CB CYS A 43 -10.211 -13.310 -9.616 1.00 0.00 C ATOM 670 SG CYS A 43 -9.277 -13.651 -11.136 1.00 0.00 S ATOM 0 H CYS A 43 -8.504 -14.687 -8.522 1.00 0.00 H new ATOM 0 HA CYS A 43 -8.725 -11.895 -8.965 1.00 0.00 H new ATOM 0 HB2 CYS A 43 -10.676 -14.226 -9.251 1.00 0.00 H new ATOM 0 HB3 CYS A 43 -11.016 -12.605 -9.824 1.00 0.00 H new ATOM 0 HG CYS A 43 -10.077 -14.139 -12.037 1.00 0.00 H new ATOM 676 N GLN A 44 -10.255 -10.865 -7.300 1.00 0.00 N ATOM 677 CA GLN A 44 -11.002 -10.163 -6.252 1.00 0.00 C ATOM 678 C GLN A 44 -12.513 -10.220 -6.537 1.00 0.00 C ATOM 679 O GLN A 44 -12.965 -9.837 -7.619 1.00 0.00 O ATOM 680 CB GLN A 44 -10.471 -8.725 -6.164 1.00 0.00 C ATOM 681 CG GLN A 44 -11.038 -7.934 -4.973 1.00 0.00 C ATOM 682 CD GLN A 44 -10.278 -6.627 -4.733 1.00 0.00 C ATOM 683 OE1 GLN A 44 -9.054 -6.593 -4.643 1.00 0.00 O ATOM 684 NE2 GLN A 44 -10.948 -5.503 -4.603 1.00 0.00 N ATOM 0 H GLN A 44 -9.872 -10.235 -8.005 1.00 0.00 H new ATOM 0 HA GLN A 44 -10.857 -10.645 -5.285 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -9.384 -8.751 -6.088 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -10.713 -8.199 -7.088 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -12.090 -7.713 -5.154 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -10.991 -8.550 -4.075 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -11.966 -5.505 -4.674 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -10.450 -4.629 -4.432 1.00 0.00 H new ATOM 693 N VAL A 45 -13.286 -10.690 -5.554 1.00 0.00 N ATOM 694 CA VAL A 45 -14.752 -10.867 -5.613 1.00 0.00 C ATOM 695 C VAL A 45 -15.419 -10.013 -4.530 1.00 0.00 C ATOM 696 O VAL A 45 -14.975 -10.009 -3.380 1.00 0.00 O ATOM 697 CB VAL A 45 -15.150 -12.345 -5.394 1.00 0.00 C ATOM 698 CG1 VAL A 45 -16.641 -12.582 -5.676 1.00 0.00 C ATOM 699 CG2 VAL A 45 -14.344 -13.356 -6.224 1.00 0.00 C ATOM 0 H VAL A 45 -12.897 -10.972 -4.654 1.00 0.00 H new ATOM 0 HA VAL A 45 -15.085 -10.556 -6.603 1.00 0.00 H new ATOM 0 HB VAL A 45 -14.921 -12.519 -4.343 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -16.880 -13.633 -5.511 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -17.240 -11.964 -5.008 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -16.862 -12.318 -6.710 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -14.692 -14.366 -6.005 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -14.481 -13.147 -7.285 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -13.287 -13.274 -5.971 1.00 0.00 H new ATOM 709 N GLU A 46 -16.488 -9.301 -4.884 1.00 0.00 N ATOM 710 CA GLU A 46 -17.245 -8.412 -3.992 1.00 0.00 C ATOM 711 C GLU A 46 -18.752 -8.451 -4.309 1.00 0.00 C ATOM 712 O GLU A 46 -19.159 -8.289 -5.459 1.00 0.00 O ATOM 713 CB GLU A 46 -16.728 -6.966 -4.139 1.00 0.00 C ATOM 714 CG GLU A 46 -15.302 -6.768 -3.600 1.00 0.00 C ATOM 715 CD GLU A 46 -14.785 -5.335 -3.819 1.00 0.00 C ATOM 716 OE1 GLU A 46 -13.760 -5.169 -4.524 1.00 0.00 O ATOM 717 OE2 GLU A 46 -15.372 -4.374 -3.262 1.00 0.00 O ATOM 0 H GLU A 46 -16.867 -9.325 -5.831 1.00 0.00 H new ATOM 0 HA GLU A 46 -17.101 -8.758 -2.968 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -16.752 -6.685 -5.192 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -17.404 -6.292 -3.613 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -15.284 -6.999 -2.535 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -14.630 -7.473 -4.090 1.00 0.00 H new ATOM 724 N ASN A 47 -19.585 -8.644 -3.278 1.00 0.00 N ATOM 725 CA ASN A 47 -21.060 -8.676 -3.322 1.00 0.00 C ATOM 726 C ASN A 47 -21.702 -9.454 -4.503 1.00 0.00 C ATOM 727 O ASN A 47 -22.727 -9.039 -5.052 1.00 0.00 O ATOM 728 CB ASN A 47 -21.565 -7.224 -3.207 1.00 0.00 C ATOM 729 CG ASN A 47 -23.030 -7.115 -2.800 1.00 0.00 C ATOM 730 OD1 ASN A 47 -23.563 -7.920 -2.046 1.00 0.00 O ATOM 731 ND2 ASN A 47 -23.730 -6.106 -3.269 1.00 0.00 N ATOM 0 H ASN A 47 -19.230 -8.791 -2.333 1.00 0.00 H new ATOM 0 HA ASN A 47 -21.394 -9.274 -2.474 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -20.954 -6.693 -2.477 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -21.425 -6.723 -4.165 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -24.709 -5.998 -3.005 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -23.294 -5.431 -3.897 1.00 0.00 H new ATOM 738 N GLY A 48 -21.102 -10.576 -4.917 1.00 0.00 N ATOM 739 CA GLY A 48 -21.616 -11.406 -6.021 1.00 0.00 C ATOM 740 C GLY A 48 -21.122 -11.003 -7.418 1.00 0.00 C ATOM 741 O GLY A 48 -21.686 -11.431 -8.429 1.00 0.00 O ATOM 0 H GLY A 48 -20.245 -10.937 -4.498 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -21.335 -12.443 -5.838 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -22.705 -11.364 -6.011 1.00 0.00 H new ATOM 745 N ARG A 49 -20.081 -10.169 -7.494 1.00 0.00 N ATOM 746 CA ARG A 49 -19.469 -9.661 -8.726 1.00 0.00 C ATOM 747 C ARG A 49 -17.943 -9.644 -8.641 1.00 0.00 C ATOM 748 O ARG A 49 -17.355 -9.795 -7.572 1.00 0.00 O ATOM 749 CB ARG A 49 -19.993 -8.247 -9.036 1.00 0.00 C ATOM 750 CG ARG A 49 -21.525 -8.137 -9.074 1.00 0.00 C ATOM 751 CD ARG A 49 -21.924 -6.831 -9.761 1.00 0.00 C ATOM 752 NE ARG A 49 -23.357 -6.792 -10.105 1.00 0.00 N ATOM 753 CZ ARG A 49 -23.879 -6.473 -11.277 1.00 0.00 C ATOM 754 NH1 ARG A 49 -25.170 -6.486 -11.438 1.00 0.00 N ATOM 755 NH2 ARG A 49 -23.154 -6.139 -12.312 1.00 0.00 N ATOM 0 H ARG A 49 -19.619 -9.812 -6.657 1.00 0.00 H new ATOM 0 HA ARG A 49 -19.749 -10.339 -9.533 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -19.609 -7.557 -8.285 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -19.593 -7.926 -9.998 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -21.948 -8.987 -9.610 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -21.928 -8.166 -8.062 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -21.687 -5.992 -9.106 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -21.332 -6.705 -10.667 1.00 0.00 H new ATOM 0 HE ARG A 49 -24.013 -7.036 -9.363 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -25.778 -6.742 -10.660 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -25.574 -6.240 -12.342 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -22.137 -6.116 -12.236 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -23.605 -5.901 -13.195 1.00 0.00 H new ATOM 769 N VAL A 50 -17.314 -9.446 -9.790 1.00 0.00 N ATOM 770 CA VAL A 50 -15.861 -9.384 -10.007 1.00 0.00 C ATOM 771 C VAL A 50 -15.557 -8.273 -11.014 1.00 0.00 C ATOM 772 O VAL A 50 -16.348 -8.032 -11.924 1.00 0.00 O ATOM 773 CB VAL A 50 -15.333 -10.723 -10.552 1.00 0.00 C ATOM 774 CG1 VAL A 50 -15.256 -11.776 -9.453 1.00 0.00 C ATOM 775 CG2 VAL A 50 -16.149 -11.322 -11.704 1.00 0.00 C ATOM 0 H VAL A 50 -17.832 -9.315 -10.659 1.00 0.00 H new ATOM 0 HA VAL A 50 -15.370 -9.179 -9.056 1.00 0.00 H new ATOM 0 HB VAL A 50 -14.346 -10.470 -10.940 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -14.880 -12.710 -9.870 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -14.584 -11.433 -8.667 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -16.249 -11.939 -9.035 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -15.698 -12.263 -12.018 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -17.171 -11.503 -11.371 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -16.159 -10.626 -12.543 1.00 0.00 H new ATOM 785 N ILE A 51 -14.423 -7.583 -10.886 1.00 0.00 N ATOM 786 CA ILE A 51 -14.061 -6.483 -11.800 1.00 0.00 C ATOM 787 C ILE A 51 -13.144 -7.016 -12.910 1.00 0.00 C ATOM 788 O ILE A 51 -12.133 -7.667 -12.635 1.00 0.00 O ATOM 789 CB ILE A 51 -13.429 -5.299 -11.028 1.00 0.00 C ATOM 790 CG1 ILE A 51 -14.368 -4.860 -9.884 1.00 0.00 C ATOM 791 CG2 ILE A 51 -13.158 -4.121 -11.984 1.00 0.00 C ATOM 792 CD1 ILE A 51 -13.952 -3.615 -9.094 1.00 0.00 C ATOM 0 H ILE A 51 -13.732 -7.763 -10.157 1.00 0.00 H new ATOM 0 HA ILE A 51 -14.964 -6.093 -12.270 1.00 0.00 H new ATOM 0 HB ILE A 51 -12.479 -5.620 -10.601 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -15.357 -4.681 -10.305 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -14.464 -5.691 -9.185 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -12.714 -3.296 -11.428 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -12.473 -4.440 -12.769 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -14.096 -3.793 -12.432 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -14.692 -3.411 -8.320 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -12.980 -3.786 -8.631 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -13.887 -2.761 -9.768 1.00 0.00 H new ATOM 804 N ALA A 52 -13.495 -6.750 -14.169 1.00 0.00 N ATOM 805 CA ALA A 52 -12.696 -7.143 -15.329 1.00 0.00 C ATOM 806 C ALA A 52 -11.425 -6.274 -15.468 1.00 0.00 C ATOM 807 O ALA A 52 -11.392 -5.119 -15.036 1.00 0.00 O ATOM 808 CB ALA A 52 -13.578 -7.110 -16.581 1.00 0.00 C ATOM 0 H ALA A 52 -14.350 -6.251 -14.414 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.337 -8.163 -15.193 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -12.988 -7.402 -17.450 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -14.410 -7.803 -16.458 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -13.964 -6.101 -16.727 1.00 0.00 H new ATOM 814 N CYS A 53 -10.369 -6.838 -16.058 1.00 0.00 N ATOM 815 CA CYS A 53 -9.069 -6.192 -16.216 1.00 0.00 C ATOM 816 C CYS A 53 -9.070 -5.088 -17.292 1.00 0.00 C ATOM 817 O CYS A 53 -8.959 -5.339 -18.500 1.00 0.00 O ATOM 818 CB CYS A 53 -7.998 -7.270 -16.435 1.00 0.00 C ATOM 819 SG CYS A 53 -6.319 -6.584 -16.230 1.00 0.00 S ATOM 0 H CYS A 53 -10.397 -7.780 -16.448 1.00 0.00 H new ATOM 0 HA CYS A 53 -8.827 -5.655 -15.299 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -8.149 -8.086 -15.728 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -8.102 -7.692 -17.435 1.00 0.00 H new ATOM 824 N PHE A 54 -9.190 -3.840 -16.832 1.00 0.00 N ATOM 825 CA PHE A 54 -9.104 -2.645 -17.676 1.00 0.00 C ATOM 826 C PHE A 54 -7.719 -2.561 -18.334 1.00 0.00 C ATOM 827 O PHE A 54 -7.617 -2.211 -19.507 1.00 0.00 O ATOM 828 CB PHE A 54 -9.380 -1.374 -16.858 1.00 0.00 C ATOM 829 CG PHE A 54 -8.579 -1.247 -15.577 1.00 0.00 C ATOM 830 CD1 PHE A 54 -7.328 -0.603 -15.582 1.00 0.00 C ATOM 831 CD2 PHE A 54 -9.070 -1.815 -14.386 1.00 0.00 C ATOM 832 CE1 PHE A 54 -6.560 -0.547 -14.406 1.00 0.00 C ATOM 833 CE2 PHE A 54 -8.312 -1.744 -13.207 1.00 0.00 C ATOM 834 CZ PHE A 54 -7.053 -1.116 -13.216 1.00 0.00 C ATOM 0 H PHE A 54 -9.352 -3.628 -15.848 1.00 0.00 H new ATOM 0 HA PHE A 54 -9.864 -2.721 -18.454 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -9.175 -0.506 -17.484 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.441 -1.344 -16.609 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -6.957 -0.151 -16.490 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -10.032 -2.306 -14.380 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -5.592 -0.068 -14.415 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.695 -2.172 -12.292 1.00 0.00 H new ATOM 0 HZ PHE A 54 -6.465 -1.070 -12.311 1.00 0.00 H new ATOM 844 N ASP A 55 -6.654 -2.929 -17.611 1.00 0.00 N ATOM 845 CA ASP A 55 -5.295 -2.953 -18.150 1.00 0.00 C ATOM 846 C ASP A 55 -5.200 -3.937 -19.329 1.00 0.00 C ATOM 847 O ASP A 55 -4.596 -3.602 -20.346 1.00 0.00 O ATOM 848 CB ASP A 55 -4.276 -3.322 -17.065 1.00 0.00 C ATOM 849 CG ASP A 55 -4.012 -2.238 -16.021 1.00 0.00 C ATOM 850 OD1 ASP A 55 -3.919 -2.587 -14.820 1.00 0.00 O ATOM 851 OD2 ASP A 55 -3.786 -1.066 -16.405 1.00 0.00 O ATOM 0 H ASP A 55 -6.714 -3.218 -16.635 1.00 0.00 H new ATOM 0 HA ASP A 55 -5.059 -1.951 -18.509 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -4.624 -4.219 -16.553 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.332 -3.576 -17.548 1.00 0.00 H new ATOM 856 N SER A 56 -5.806 -5.127 -19.245 1.00 0.00 N ATOM 857 CA SER A 56 -5.808 -6.097 -20.347 1.00 0.00 C ATOM 858 C SER A 56 -6.565 -5.555 -21.572 1.00 0.00 C ATOM 859 O SER A 56 -6.070 -5.659 -22.699 1.00 0.00 O ATOM 860 CB SER A 56 -6.377 -7.437 -19.869 1.00 0.00 C ATOM 861 OG SER A 56 -6.387 -8.387 -20.922 1.00 0.00 O ATOM 0 H SER A 56 -6.307 -5.444 -18.415 1.00 0.00 H new ATOM 0 HA SER A 56 -4.779 -6.262 -20.665 1.00 0.00 H new ATOM 0 HB2 SER A 56 -5.780 -7.815 -19.039 1.00 0.00 H new ATOM 0 HB3 SER A 56 -7.390 -7.293 -19.494 1.00 0.00 H new ATOM 0 HG SER A 56 -6.753 -9.235 -20.594 1.00 0.00 H new ATOM 867 N LEU A 57 -7.722 -4.905 -21.371 1.00 0.00 N ATOM 868 CA LEU A 57 -8.503 -4.273 -22.447 1.00 0.00 C ATOM 869 C LEU A 57 -7.752 -3.114 -23.133 1.00 0.00 C ATOM 870 O LEU A 57 -7.812 -2.982 -24.357 1.00 0.00 O ATOM 871 CB LEU A 57 -9.849 -3.773 -21.885 1.00 0.00 C ATOM 872 CG LEU A 57 -10.897 -4.887 -21.713 1.00 0.00 C ATOM 873 CD1 LEU A 57 -12.041 -4.395 -20.824 1.00 0.00 C ATOM 874 CD2 LEU A 57 -11.494 -5.328 -23.054 1.00 0.00 C ATOM 0 H LEU A 57 -8.146 -4.802 -20.449 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.673 -5.032 -23.211 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -9.676 -3.297 -20.920 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -10.250 -3.008 -22.551 1.00 0.00 H new ATOM 0 HG LEU A 57 -10.386 -5.736 -21.259 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.778 -5.189 -20.707 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -11.648 -4.118 -19.846 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.512 -3.527 -21.285 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -12.228 -6.115 -22.884 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -11.978 -4.478 -23.534 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -10.700 -5.705 -23.699 1.00 0.00 H new ATOM 886 N LYS A 58 -7.038 -2.281 -22.360 1.00 0.00 N ATOM 887 CA LYS A 58 -6.255 -1.132 -22.859 1.00 0.00 C ATOM 888 C LYS A 58 -4.869 -1.511 -23.412 1.00 0.00 C ATOM 889 O LYS A 58 -4.205 -0.663 -24.011 1.00 0.00 O ATOM 890 CB LYS A 58 -6.119 -0.084 -21.735 1.00 0.00 C ATOM 891 CG LYS A 58 -7.450 0.563 -21.299 1.00 0.00 C ATOM 892 CD LYS A 58 -8.199 1.370 -22.374 1.00 0.00 C ATOM 893 CE LYS A 58 -7.354 2.521 -22.935 1.00 0.00 C ATOM 894 NZ LYS A 58 -8.115 3.327 -23.927 1.00 0.00 N ATOM 0 H LYS A 58 -6.986 -2.387 -21.347 1.00 0.00 H new ATOM 0 HA LYS A 58 -6.804 -0.719 -23.706 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.659 -0.557 -20.868 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.440 0.701 -22.068 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -8.112 -0.225 -20.939 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.250 1.222 -20.454 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -8.488 0.705 -23.188 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -9.118 1.772 -21.948 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -7.026 3.164 -22.118 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -6.456 2.119 -23.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.513 4.096 -24.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.407 2.718 -24.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -8.958 3.731 -23.472 1.00 0.00 H new ATOM 908 N GLY A 59 -4.424 -2.756 -23.224 1.00 0.00 N ATOM 909 CA GLY A 59 -3.119 -3.254 -23.690 1.00 0.00 C ATOM 910 C GLY A 59 -1.947 -2.842 -22.786 1.00 0.00 C ATOM 911 O GLY A 59 -0.861 -2.524 -23.280 1.00 0.00 O ATOM 0 H GLY A 59 -4.970 -3.464 -22.733 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.155 -4.342 -23.751 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.937 -2.884 -24.699 1.00 0.00 H new ATOM 915 N ARG A 60 -2.177 -2.817 -21.466 1.00 0.00 N ATOM 916 CA ARG A 60 -1.241 -2.396 -20.406 1.00 0.00 C ATOM 917 C ARG A 60 -0.872 -3.515 -19.418 1.00 0.00 C ATOM 918 O ARG A 60 0.190 -3.434 -18.797 1.00 0.00 O ATOM 919 CB ARG A 60 -1.882 -1.185 -19.689 1.00 0.00 C ATOM 920 CG ARG A 60 -0.975 -0.510 -18.649 1.00 0.00 C ATOM 921 CD ARG A 60 -1.592 0.812 -18.172 1.00 0.00 C ATOM 922 NE ARG A 60 -0.782 1.435 -17.109 1.00 0.00 N ATOM 923 CZ ARG A 60 -0.917 1.284 -15.802 1.00 0.00 C ATOM 924 NH1 ARG A 60 -0.113 1.909 -14.990 1.00 0.00 N ATOM 925 NH2 ARG A 60 -1.829 0.526 -15.262 1.00 0.00 N ATOM 0 H ARG A 60 -3.076 -3.108 -21.083 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.289 -2.125 -20.862 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -2.169 -0.446 -20.437 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -2.798 -1.513 -19.197 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -0.828 -1.177 -17.799 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.008 -0.324 -19.082 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -1.679 1.499 -19.014 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -2.601 0.631 -17.803 1.00 0.00 H new ATOM 0 HE ARG A 60 -0.032 2.053 -17.417 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.619 2.514 -15.362 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -0.216 1.794 -13.982 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -2.483 0.014 -15.854 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -1.889 0.445 -14.247 1.00 0.00 H new ATOM 939 N CYS A 61 -1.713 -4.543 -19.261 1.00 0.00 N ATOM 940 CA CYS A 61 -1.473 -5.637 -18.311 1.00 0.00 C ATOM 941 C CYS A 61 -0.264 -6.513 -18.703 1.00 0.00 C ATOM 942 O CYS A 61 -0.042 -6.828 -19.878 1.00 0.00 O ATOM 943 CB CYS A 61 -2.760 -6.461 -18.128 1.00 0.00 C ATOM 944 SG CYS A 61 -2.712 -7.406 -16.567 1.00 0.00 S ATOM 0 H CYS A 61 -2.580 -4.641 -19.789 1.00 0.00 H new ATOM 0 HA CYS A 61 -1.207 -5.197 -17.350 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -3.625 -5.797 -18.130 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -2.881 -7.145 -18.968 1.00 0.00 H new ATOM 949 N SER A 62 0.513 -6.903 -17.690 1.00 0.00 N ATOM 950 CA SER A 62 1.712 -7.753 -17.785 1.00 0.00 C ATOM 951 C SER A 62 1.966 -8.542 -16.479 1.00 0.00 C ATOM 952 O SER A 62 3.060 -9.070 -16.256 1.00 0.00 O ATOM 953 CB SER A 62 2.919 -6.872 -18.150 1.00 0.00 C ATOM 954 OG SER A 62 4.012 -7.644 -18.625 1.00 0.00 O ATOM 0 H SER A 62 0.316 -6.622 -16.729 1.00 0.00 H new ATOM 0 HA SER A 62 1.555 -8.497 -18.566 1.00 0.00 H new ATOM 0 HB2 SER A 62 2.625 -6.151 -18.913 1.00 0.00 H new ATOM 0 HB3 SER A 62 3.230 -6.302 -17.275 1.00 0.00 H new ATOM 0 HG SER A 62 4.152 -8.412 -18.032 1.00 0.00 H new ATOM 960 N ARG A 63 0.961 -8.608 -15.593 1.00 0.00 N ATOM 961 CA ARG A 63 1.005 -9.286 -14.285 1.00 0.00 C ATOM 962 C ARG A 63 0.970 -10.817 -14.401 1.00 0.00 C ATOM 963 O ARG A 63 0.555 -11.380 -15.415 1.00 0.00 O ATOM 964 CB ARG A 63 -0.194 -8.797 -13.446 1.00 0.00 C ATOM 965 CG ARG A 63 -0.062 -7.333 -12.994 1.00 0.00 C ATOM 966 CD ARG A 63 -1.288 -6.885 -12.183 1.00 0.00 C ATOM 967 NE ARG A 63 -2.477 -6.689 -13.031 1.00 0.00 N ATOM 968 CZ ARG A 63 -2.977 -5.566 -13.507 1.00 0.00 C ATOM 969 NH1 ARG A 63 -4.039 -5.592 -14.233 1.00 0.00 N ATOM 970 NH2 ARG A 63 -2.471 -4.385 -13.281 1.00 0.00 N ATOM 0 H ARG A 63 0.057 -8.173 -15.774 1.00 0.00 H new ATOM 0 HA ARG A 63 1.952 -9.035 -13.807 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.107 -8.909 -14.030 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.298 -9.434 -12.567 1.00 0.00 H new ATOM 0 HG2 ARG A 63 0.838 -7.217 -12.390 1.00 0.00 H new ATOM 0 HG3 ARG A 63 0.054 -6.690 -13.867 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -1.508 -7.631 -11.419 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -1.057 -5.955 -11.664 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.982 -7.538 -13.284 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.494 -6.481 -14.440 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -4.426 -4.723 -14.602 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -1.636 -4.290 -12.703 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -2.911 -3.557 -13.682 1.00 0.00 H new ATOM 984 N GLU A 64 1.365 -11.484 -13.316 1.00 0.00 N ATOM 985 CA GLU A 64 1.361 -12.955 -13.163 1.00 0.00 C ATOM 986 C GLU A 64 0.480 -13.425 -11.983 1.00 0.00 C ATOM 987 O GLU A 64 0.368 -14.620 -11.709 1.00 0.00 O ATOM 988 CB GLU A 64 2.806 -13.474 -13.029 1.00 0.00 C ATOM 989 CG GLU A 64 3.662 -13.191 -14.272 1.00 0.00 C ATOM 990 CD GLU A 64 5.059 -13.825 -14.135 1.00 0.00 C ATOM 991 OE1 GLU A 64 5.975 -13.177 -13.570 1.00 0.00 O ATOM 992 OE2 GLU A 64 5.259 -14.976 -14.596 1.00 0.00 O ATOM 0 H GLU A 64 1.711 -11.005 -12.484 1.00 0.00 H new ATOM 0 HA GLU A 64 0.915 -13.381 -14.062 1.00 0.00 H new ATOM 0 HB2 GLU A 64 3.273 -13.011 -12.160 1.00 0.00 H new ATOM 0 HB3 GLU A 64 2.785 -14.548 -12.846 1.00 0.00 H new ATOM 0 HG2 GLU A 64 3.165 -13.586 -15.158 1.00 0.00 H new ATOM 0 HG3 GLU A 64 3.759 -12.115 -14.414 1.00 0.00 H new ATOM 999 N ASN A 65 -0.160 -12.473 -11.295 1.00 0.00 N ATOM 1000 CA ASN A 65 -1.043 -12.646 -10.135 1.00 0.00 C ATOM 1001 C ASN A 65 -2.219 -11.635 -10.183 1.00 0.00 C ATOM 1002 O ASN A 65 -2.721 -11.196 -9.144 1.00 0.00 O ATOM 1003 CB ASN A 65 -0.180 -12.474 -8.869 1.00 0.00 C ATOM 1004 CG ASN A 65 0.767 -13.639 -8.623 1.00 0.00 C ATOM 1005 OD1 ASN A 65 0.357 -14.752 -8.322 1.00 0.00 O ATOM 1006 ND2 ASN A 65 2.062 -13.423 -8.714 1.00 0.00 N ATOM 0 H ASN A 65 -0.068 -11.490 -11.553 1.00 0.00 H new ATOM 0 HA ASN A 65 -1.497 -13.637 -10.135 1.00 0.00 H new ATOM 0 HB2 ASN A 65 0.400 -11.555 -8.955 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -0.834 -12.358 -8.005 1.00 0.00 H new ATOM 0 HD21 ASN A 65 2.719 -14.182 -8.534 1.00 0.00 H new ATOM 0 HD22 ASN A 65 2.408 -12.497 -8.965 1.00 0.00 H new ATOM 1013 N CYS A 66 -2.631 -11.230 -11.393 1.00 0.00 N ATOM 1014 CA CYS A 66 -3.681 -10.251 -11.661 1.00 0.00 C ATOM 1015 C CYS A 66 -4.989 -10.593 -10.918 1.00 0.00 C ATOM 1016 O CYS A 66 -5.519 -11.707 -11.018 1.00 0.00 O ATOM 1017 CB CYS A 66 -3.853 -10.177 -13.189 1.00 0.00 C ATOM 1018 SG CYS A 66 -4.697 -8.657 -13.709 1.00 0.00 S ATOM 0 H CYS A 66 -2.217 -11.598 -12.250 1.00 0.00 H new ATOM 0 HA CYS A 66 -3.401 -9.269 -11.280 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -2.874 -10.229 -13.666 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -4.421 -11.042 -13.532 1.00 0.00 H new ATOM 1023 N LYS A 67 -5.491 -9.624 -10.143 1.00 0.00 N ATOM 1024 CA LYS A 67 -6.713 -9.754 -9.325 1.00 0.00 C ATOM 1025 C LYS A 67 -7.996 -9.455 -10.102 1.00 0.00 C ATOM 1026 O LYS A 67 -9.082 -9.482 -9.520 1.00 0.00 O ATOM 1027 CB LYS A 67 -6.659 -8.831 -8.098 1.00 0.00 C ATOM 1028 CG LYS A 67 -5.319 -8.886 -7.355 1.00 0.00 C ATOM 1029 CD LYS A 67 -5.434 -8.289 -5.946 1.00 0.00 C ATOM 1030 CE LYS A 67 -5.733 -6.781 -5.977 1.00 0.00 C ATOM 1031 NZ LYS A 67 -6.206 -6.280 -4.661 1.00 0.00 N ATOM 0 H LYS A 67 -5.053 -8.706 -10.062 1.00 0.00 H new ATOM 0 HA LYS A 67 -6.741 -10.798 -9.014 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -6.849 -7.806 -8.415 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -7.459 -9.105 -7.410 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -4.981 -9.920 -7.287 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -4.564 -8.341 -7.922 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.224 -8.803 -5.399 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -4.505 -8.462 -5.403 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -4.834 -6.239 -6.269 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.489 -6.577 -6.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -5.952 -5.277 -4.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -7.239 -6.383 -4.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -5.758 -6.829 -3.899 1.00 0.00 H new ATOM 1045 N TYR A 68 -7.874 -9.149 -11.387 1.00 0.00 N ATOM 1046 CA TYR A 68 -8.985 -8.745 -12.243 1.00 0.00 C ATOM 1047 C TYR A 68 -9.239 -9.771 -13.355 1.00 0.00 C ATOM 1048 O TYR A 68 -8.332 -10.462 -13.827 1.00 0.00 O ATOM 1049 CB TYR A 68 -8.694 -7.336 -12.772 1.00 0.00 C ATOM 1050 CG TYR A 68 -8.545 -6.276 -11.688 1.00 0.00 C ATOM 1051 CD1 TYR A 68 -7.294 -6.053 -11.072 1.00 0.00 C ATOM 1052 CD2 TYR A 68 -9.666 -5.523 -11.283 1.00 0.00 C ATOM 1053 CE1 TYR A 68 -7.163 -5.079 -10.063 1.00 0.00 C ATOM 1054 CE2 TYR A 68 -9.539 -4.547 -10.276 1.00 0.00 C ATOM 1055 CZ TYR A 68 -8.286 -4.320 -9.664 1.00 0.00 C ATOM 1056 OH TYR A 68 -8.171 -3.373 -8.692 1.00 0.00 O ATOM 0 H TYR A 68 -6.979 -9.175 -11.876 1.00 0.00 H new ATOM 0 HA TYR A 68 -9.913 -8.714 -11.672 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -7.779 -7.365 -13.363 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.499 -7.040 -13.445 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -6.434 -6.632 -11.376 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -10.626 -5.695 -11.747 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -6.204 -4.912 -9.594 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -10.400 -3.971 -9.971 1.00 0.00 H new ATOM 0 HH TYR A 68 -9.042 -2.947 -8.545 1.00 0.00 H new ATOM 1066 N LEU A 69 -10.506 -9.910 -13.748 1.00 0.00 N ATOM 1067 CA LEU A 69 -10.941 -10.898 -14.738 1.00 0.00 C ATOM 1068 C LEU A 69 -10.519 -10.508 -16.158 1.00 0.00 C ATOM 1069 O LEU A 69 -11.049 -9.546 -16.711 1.00 0.00 O ATOM 1070 CB LEU A 69 -12.475 -11.075 -14.658 1.00 0.00 C ATOM 1071 CG LEU A 69 -12.959 -12.156 -13.681 1.00 0.00 C ATOM 1072 CD1 LEU A 69 -12.665 -13.562 -14.203 1.00 0.00 C ATOM 1073 CD2 LEU A 69 -12.350 -12.011 -12.291 1.00 0.00 C ATOM 0 H LEU A 69 -11.266 -9.335 -13.385 1.00 0.00 H new ATOM 0 HA LEU A 69 -10.453 -11.845 -14.506 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.920 -10.122 -14.370 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -12.849 -11.314 -15.653 1.00 0.00 H new ATOM 0 HG LEU A 69 -14.037 -12.013 -13.602 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -13.022 -14.299 -13.484 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.172 -13.710 -15.156 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.590 -13.681 -14.341 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -12.728 -12.802 -11.644 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.265 -12.086 -12.360 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -12.621 -11.041 -11.875 1.00 0.00 H new ATOM 1085 N HIS A 70 -9.610 -11.268 -16.770 1.00 0.00 N ATOM 1086 CA HIS A 70 -9.225 -11.059 -18.171 1.00 0.00 C ATOM 1087 C HIS A 70 -10.438 -11.446 -19.049 1.00 0.00 C ATOM 1088 O HIS A 70 -10.839 -12.615 -19.028 1.00 0.00 O ATOM 1089 CB HIS A 70 -7.966 -11.865 -18.518 1.00 0.00 C ATOM 1090 CG HIS A 70 -6.676 -11.222 -18.054 1.00 0.00 C ATOM 1091 ND1 HIS A 70 -5.440 -11.366 -18.648 1.00 0.00 N ATOM 1092 CD2 HIS A 70 -6.532 -10.273 -17.072 1.00 0.00 C ATOM 1093 CE1 HIS A 70 -4.591 -10.499 -18.065 1.00 0.00 C ATOM 1094 NE2 HIS A 70 -5.216 -9.801 -17.104 1.00 0.00 N ATOM 0 H HIS A 70 -9.122 -12.040 -16.316 1.00 0.00 H new ATOM 0 HA HIS A 70 -8.968 -10.016 -18.354 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -8.047 -12.856 -18.072 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -7.923 -12.004 -19.598 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -5.209 -12.017 -19.399 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -7.304 -9.947 -16.391 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.551 -10.381 -18.333 1.00 0.00 H new ATOM 1102 N PRO A 71 -11.070 -10.494 -19.768 1.00 0.00 N ATOM 1103 CA PRO A 71 -12.303 -10.702 -20.531 1.00 0.00 C ATOM 1104 C PRO A 71 -12.360 -11.937 -21.454 1.00 0.00 C ATOM 1105 O PRO A 71 -11.651 -11.970 -22.466 1.00 0.00 O ATOM 1106 CB PRO A 71 -12.500 -9.412 -21.327 1.00 0.00 C ATOM 1107 CG PRO A 71 -11.915 -8.366 -20.397 1.00 0.00 C ATOM 1108 CD PRO A 71 -10.690 -9.087 -19.849 1.00 0.00 C ATOM 0 HA PRO A 71 -13.103 -10.921 -19.823 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -11.980 -9.441 -22.284 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -13.552 -9.223 -21.541 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.648 -7.451 -20.926 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.612 -8.085 -19.607 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -9.829 -8.950 -20.503 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -10.411 -8.699 -18.869 1.00 0.00 H new ATOM 1116 N PRO A 72 -13.207 -12.945 -21.161 1.00 0.00 N ATOM 1117 CA PRO A 72 -13.367 -14.103 -22.037 1.00 0.00 C ATOM 1118 C PRO A 72 -14.231 -13.769 -23.276 1.00 0.00 C ATOM 1119 O PRO A 72 -15.086 -12.880 -23.201 1.00 0.00 O ATOM 1120 CB PRO A 72 -14.044 -15.163 -21.172 1.00 0.00 C ATOM 1121 CG PRO A 72 -14.854 -14.362 -20.164 1.00 0.00 C ATOM 1122 CD PRO A 72 -14.067 -13.062 -19.988 1.00 0.00 C ATOM 0 HA PRO A 72 -12.408 -14.441 -22.430 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.683 -15.815 -21.768 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -13.311 -15.801 -20.677 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -15.863 -14.169 -20.529 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.953 -14.897 -19.220 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -14.739 -12.207 -19.911 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.476 -13.086 -19.073 1.00 0.00 H new ATOM 1130 N PRO A 73 -14.057 -14.478 -24.412 1.00 0.00 N ATOM 1131 CA PRO A 73 -14.791 -14.257 -25.665 1.00 0.00 C ATOM 1132 C PRO A 73 -16.302 -13.992 -25.547 1.00 0.00 C ATOM 1133 O PRO A 73 -16.787 -13.017 -26.126 1.00 0.00 O ATOM 1134 CB PRO A 73 -14.501 -15.491 -26.526 1.00 0.00 C ATOM 1135 CG PRO A 73 -13.094 -15.887 -26.090 1.00 0.00 C ATOM 1136 CD PRO A 73 -13.080 -15.545 -24.601 1.00 0.00 C ATOM 0 HA PRO A 73 -14.441 -13.322 -26.104 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -15.220 -16.289 -26.343 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -14.544 -15.260 -27.590 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -12.903 -16.946 -26.262 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -12.332 -15.333 -26.638 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -13.337 -16.417 -24.000 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -12.088 -15.222 -24.286 1.00 0.00 H new ATOM 1144 N HIS A 74 -17.055 -14.816 -24.802 1.00 0.00 N ATOM 1145 CA HIS A 74 -18.514 -14.632 -24.653 1.00 0.00 C ATOM 1146 C HIS A 74 -18.899 -13.353 -23.883 1.00 0.00 C ATOM 1147 O HIS A 74 -19.952 -12.769 -24.142 1.00 0.00 O ATOM 1148 CB HIS A 74 -19.159 -15.891 -24.029 1.00 0.00 C ATOM 1149 CG HIS A 74 -20.576 -16.129 -24.511 1.00 0.00 C ATOM 1150 ND1 HIS A 74 -20.985 -17.159 -25.341 1.00 0.00 N ATOM 1151 CD2 HIS A 74 -21.665 -15.326 -24.298 1.00 0.00 C ATOM 1152 CE1 HIS A 74 -22.277 -16.959 -25.664 1.00 0.00 C ATOM 1153 NE2 HIS A 74 -22.714 -15.850 -25.034 1.00 0.00 N ATOM 0 H HIS A 74 -16.682 -15.617 -24.292 1.00 0.00 H new ATOM 0 HA HIS A 74 -18.915 -14.495 -25.657 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -18.548 -16.762 -24.268 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -19.162 -15.791 -22.944 1.00 0.00 H new ATOM 0 HD1 HIS A 74 -20.406 -17.938 -25.655 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -21.699 -14.447 -23.672 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -22.866 -17.584 -26.319 1.00 0.00 H new ATOM 1162 N LEU A 75 -18.058 -12.893 -22.950 1.00 0.00 N ATOM 1163 CA LEU A 75 -18.326 -11.709 -22.118 1.00 0.00 C ATOM 1164 C LEU A 75 -17.745 -10.407 -22.680 1.00 0.00 C ATOM 1165 O LEU A 75 -18.265 -9.345 -22.346 1.00 0.00 O ATOM 1166 CB LEU A 75 -17.849 -11.954 -20.677 1.00 0.00 C ATOM 1167 CG LEU A 75 -18.533 -13.151 -19.979 1.00 0.00 C ATOM 1168 CD1 LEU A 75 -17.929 -13.443 -18.602 1.00 0.00 C ATOM 1169 CD2 LEU A 75 -20.034 -12.920 -19.800 1.00 0.00 C ATOM 0 H LEU A 75 -17.162 -13.335 -22.747 1.00 0.00 H new ATOM 0 HA LEU A 75 -19.407 -11.567 -22.124 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -16.772 -12.120 -20.686 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -18.028 -11.054 -20.089 1.00 0.00 H new ATOM 0 HG LEU A 75 -18.365 -14.005 -20.635 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -18.443 -14.292 -18.152 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -16.870 -13.676 -18.711 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -18.044 -12.568 -17.962 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -20.479 -13.784 -19.306 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -20.195 -12.031 -19.191 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -20.500 -12.781 -20.776 1.00 0.00 H new ATOM 1181 N LYS A 76 -16.733 -10.444 -23.560 1.00 0.00 N ATOM 1182 CA LYS A 76 -16.194 -9.231 -24.214 1.00 0.00 C ATOM 1183 C LYS A 76 -17.301 -8.420 -24.901 1.00 0.00 C ATOM 1184 O LYS A 76 -17.313 -7.194 -24.795 1.00 0.00 O ATOM 1185 CB LYS A 76 -15.075 -9.603 -25.200 1.00 0.00 C ATOM 1186 CG LYS A 76 -13.747 -9.828 -24.459 1.00 0.00 C ATOM 1187 CD LYS A 76 -12.648 -10.431 -25.349 1.00 0.00 C ATOM 1188 CE LYS A 76 -12.290 -9.523 -26.534 1.00 0.00 C ATOM 1189 NZ LYS A 76 -11.173 -10.086 -27.338 1.00 0.00 N ATOM 0 H LYS A 76 -16.265 -11.306 -23.840 1.00 0.00 H new ATOM 0 HA LYS A 76 -15.766 -8.593 -23.440 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -15.350 -10.506 -25.745 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -14.955 -8.809 -25.937 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -13.398 -8.877 -24.057 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -13.920 -10.489 -23.610 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.756 -10.609 -24.749 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -12.979 -11.400 -25.724 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -13.166 -9.391 -27.169 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -12.012 -8.536 -26.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.958 -9.447 -28.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.330 -10.189 -26.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -11.448 -11.017 -27.710 1.00 0.00 H new ATOM 1203 N THR A 77 -18.264 -9.102 -25.529 1.00 0.00 N ATOM 1204 CA THR A 77 -19.448 -8.498 -26.166 1.00 0.00 C ATOM 1205 C THR A 77 -20.331 -7.776 -25.143 1.00 0.00 C ATOM 1206 O THR A 77 -20.765 -6.650 -25.375 1.00 0.00 O ATOM 1207 CB THR A 77 -20.283 -9.577 -26.878 1.00 0.00 C ATOM 1208 OG1 THR A 77 -19.459 -10.321 -27.753 1.00 0.00 O ATOM 1209 CG2 THR A 77 -21.416 -8.980 -27.712 1.00 0.00 C ATOM 0 H THR A 77 -18.245 -10.118 -25.613 1.00 0.00 H new ATOM 0 HA THR A 77 -19.088 -7.769 -26.892 1.00 0.00 H new ATOM 0 HB THR A 77 -20.710 -10.206 -26.097 1.00 0.00 H new ATOM 0 HG1 THR A 77 -19.995 -11.008 -28.202 1.00 0.00 H new ATOM 0 HG21 THR A 77 -21.975 -9.782 -28.194 1.00 0.00 H new ATOM 0 HG22 THR A 77 -22.083 -8.411 -27.065 1.00 0.00 H new ATOM 0 HG23 THR A 77 -20.999 -8.321 -28.473 1.00 0.00 H new ATOM 1217 N GLN A 78 -20.568 -8.396 -23.982 1.00 0.00 N ATOM 1218 CA GLN A 78 -21.364 -7.812 -22.897 1.00 0.00 C ATOM 1219 C GLN A 78 -20.662 -6.582 -22.302 1.00 0.00 C ATOM 1220 O GLN A 78 -21.295 -5.550 -22.070 1.00 0.00 O ATOM 1221 CB GLN A 78 -21.623 -8.875 -21.811 1.00 0.00 C ATOM 1222 CG GLN A 78 -22.382 -10.119 -22.314 1.00 0.00 C ATOM 1223 CD GLN A 78 -23.733 -9.798 -22.955 1.00 0.00 C ATOM 1224 OE1 GLN A 78 -24.505 -8.972 -22.486 1.00 0.00 O ATOM 1225 NE2 GLN A 78 -24.074 -10.430 -24.060 1.00 0.00 N ATOM 0 H GLN A 78 -20.209 -9.326 -23.767 1.00 0.00 H new ATOM 0 HA GLN A 78 -22.321 -7.482 -23.302 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -20.668 -9.191 -21.392 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -22.192 -8.419 -21.000 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -21.761 -10.644 -23.040 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -22.539 -10.800 -21.478 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -23.445 -11.122 -24.467 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -24.967 -10.227 -24.509 1.00 0.00 H new ATOM 1234 N LEU A 79 -19.346 -6.670 -22.088 1.00 0.00 N ATOM 1235 CA LEU A 79 -18.528 -5.571 -21.575 1.00 0.00 C ATOM 1236 C LEU A 79 -18.538 -4.367 -22.529 1.00 0.00 C ATOM 1237 O LEU A 79 -18.830 -3.260 -22.089 1.00 0.00 O ATOM 1238 CB LEU A 79 -17.098 -6.072 -21.305 1.00 0.00 C ATOM 1239 CG LEU A 79 -16.997 -7.066 -20.131 1.00 0.00 C ATOM 1240 CD1 LEU A 79 -15.609 -7.694 -20.113 1.00 0.00 C ATOM 1241 CD2 LEU A 79 -17.235 -6.388 -18.780 1.00 0.00 C ATOM 0 H LEU A 79 -18.813 -7.520 -22.270 1.00 0.00 H new ATOM 0 HA LEU A 79 -18.957 -5.225 -20.635 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -16.714 -6.549 -22.207 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -16.456 -5.215 -21.100 1.00 0.00 H new ATOM 0 HG LEU A 79 -17.768 -7.821 -20.280 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -15.538 -8.397 -19.283 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.436 -8.222 -21.051 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.858 -6.913 -19.993 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -17.154 -7.127 -17.983 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -16.490 -5.607 -18.628 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -18.231 -5.946 -18.765 1.00 0.00 H new ATOM 1253 N GLU A 80 -18.276 -4.541 -23.829 1.00 0.00 N ATOM 1254 CA GLU A 80 -18.302 -3.406 -24.772 1.00 0.00 C ATOM 1255 C GLU A 80 -19.689 -2.740 -24.895 1.00 0.00 C ATOM 1256 O GLU A 80 -19.781 -1.534 -25.141 1.00 0.00 O ATOM 1257 CB GLU A 80 -17.706 -3.778 -26.138 1.00 0.00 C ATOM 1258 CG GLU A 80 -18.537 -4.746 -26.988 1.00 0.00 C ATOM 1259 CD GLU A 80 -17.976 -4.831 -28.418 1.00 0.00 C ATOM 1260 OE1 GLU A 80 -17.310 -5.833 -28.774 1.00 0.00 O ATOM 1261 OE2 GLU A 80 -18.217 -3.871 -29.192 1.00 0.00 O ATOM 0 H GLU A 80 -18.046 -5.440 -24.252 1.00 0.00 H new ATOM 0 HA GLU A 80 -17.654 -2.644 -24.338 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -17.554 -2.862 -26.709 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -16.722 -4.219 -25.976 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -18.533 -5.735 -26.531 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -19.575 -4.413 -27.018 1.00 0.00 H new ATOM 1268 N ILE A 81 -20.773 -3.493 -24.686 1.00 0.00 N ATOM 1269 CA ILE A 81 -22.147 -2.961 -24.665 1.00 0.00 C ATOM 1270 C ILE A 81 -22.353 -2.104 -23.405 1.00 0.00 C ATOM 1271 O ILE A 81 -22.889 -0.996 -23.497 1.00 0.00 O ATOM 1272 CB ILE A 81 -23.176 -4.110 -24.804 1.00 0.00 C ATOM 1273 CG1 ILE A 81 -23.155 -4.608 -26.268 1.00 0.00 C ATOM 1274 CG2 ILE A 81 -24.600 -3.672 -24.411 1.00 0.00 C ATOM 1275 CD1 ILE A 81 -23.936 -5.907 -26.504 1.00 0.00 C ATOM 0 H ILE A 81 -20.725 -4.499 -24.525 1.00 0.00 H new ATOM 0 HA ILE A 81 -22.308 -2.307 -25.522 1.00 0.00 H new ATOM 0 HB ILE A 81 -22.896 -4.911 -24.120 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -23.566 -3.829 -26.910 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -22.120 -4.760 -26.573 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -25.284 -4.513 -24.526 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -24.605 -3.339 -23.373 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -24.920 -2.854 -25.056 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -23.870 -6.185 -27.556 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -23.513 -6.703 -25.891 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -24.981 -5.757 -26.233 1.00 0.00 H new ATOM 1287 N ASN A 82 -21.885 -2.557 -22.234 1.00 0.00 N ATOM 1288 CA ASN A 82 -21.954 -1.755 -21.002 1.00 0.00 C ATOM 1289 C ASN A 82 -21.056 -0.506 -21.106 1.00 0.00 C ATOM 1290 O ASN A 82 -21.441 0.561 -20.630 1.00 0.00 O ATOM 1291 CB ASN A 82 -21.623 -2.602 -19.757 1.00 0.00 C ATOM 1292 CG ASN A 82 -22.776 -3.501 -19.340 1.00 0.00 C ATOM 1293 OD1 ASN A 82 -23.584 -3.148 -18.492 1.00 0.00 O ATOM 1294 ND2 ASN A 82 -22.916 -4.671 -19.916 1.00 0.00 N ATOM 0 H ASN A 82 -21.455 -3.474 -22.113 1.00 0.00 H new ATOM 0 HA ASN A 82 -22.981 -1.409 -20.884 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -20.745 -3.214 -19.961 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -21.365 -1.941 -18.930 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -23.694 -5.278 -19.656 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -22.247 -4.974 -20.624 1.00 0.00 H new ATOM 1301 N GLY A 83 -19.894 -0.605 -21.764 1.00 0.00 N ATOM 1302 CA GLY A 83 -18.969 0.513 -21.991 1.00 0.00 C ATOM 1303 C GLY A 83 -19.622 1.652 -22.780 1.00 0.00 C ATOM 1304 O GLY A 83 -19.564 2.811 -22.359 1.00 0.00 O ATOM 0 H GLY A 83 -19.563 -1.484 -22.162 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -18.618 0.893 -21.031 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -18.093 0.154 -22.532 1.00 0.00 H new ATOM 1308 N ARG A 84 -20.335 1.325 -23.871 1.00 0.00 N ATOM 1309 CA ARG A 84 -21.121 2.291 -24.674 1.00 0.00 C ATOM 1310 C ARG A 84 -22.243 2.978 -23.881 1.00 0.00 C ATOM 1311 O ARG A 84 -22.721 4.032 -24.292 1.00 0.00 O ATOM 1312 CB ARG A 84 -21.725 1.594 -25.905 1.00 0.00 C ATOM 1313 CG ARG A 84 -20.686 1.289 -26.990 1.00 0.00 C ATOM 1314 CD ARG A 84 -21.384 0.615 -28.177 1.00 0.00 C ATOM 1315 NE ARG A 84 -20.433 0.164 -29.210 1.00 0.00 N ATOM 1316 CZ ARG A 84 -19.769 -0.977 -29.208 1.00 0.00 C ATOM 1317 NH1 ARG A 84 -19.089 -1.385 -30.236 1.00 0.00 N ATOM 1318 NH2 ARG A 84 -19.746 -1.778 -28.187 1.00 0.00 N ATOM 0 H ARG A 84 -20.386 0.371 -24.229 1.00 0.00 H new ATOM 0 HA ARG A 84 -20.421 3.069 -24.979 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -22.200 0.664 -25.593 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -22.507 2.226 -26.326 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -20.199 2.209 -27.313 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -19.907 0.638 -26.593 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -21.959 -0.239 -27.819 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -22.094 1.313 -28.621 1.00 0.00 H new ATOM 0 HE ARG A 84 -20.274 0.791 -29.998 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -19.055 -0.818 -31.083 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -18.589 -2.273 -30.197 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -20.256 -1.536 -27.337 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -19.218 -2.649 -28.234 1.00 0.00 H new ATOM 1332 N ASN A 85 -22.638 2.408 -22.741 1.00 0.00 N ATOM 1333 CA ASN A 85 -23.663 2.922 -21.827 1.00 0.00 C ATOM 1334 C ASN A 85 -23.053 3.552 -20.548 1.00 0.00 C ATOM 1335 O ASN A 85 -23.777 3.857 -19.598 1.00 0.00 O ATOM 1336 CB ASN A 85 -24.666 1.787 -21.540 1.00 0.00 C ATOM 1337 CG ASN A 85 -25.584 1.530 -22.725 1.00 0.00 C ATOM 1338 OD1 ASN A 85 -26.604 2.183 -22.897 1.00 0.00 O ATOM 1339 ND2 ASN A 85 -25.262 0.592 -23.587 1.00 0.00 N ATOM 0 H ASN A 85 -22.232 1.532 -22.413 1.00 0.00 H new ATOM 0 HA ASN A 85 -24.199 3.747 -22.297 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -24.122 0.874 -21.297 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -25.264 2.043 -20.666 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -25.861 0.413 -24.393 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -24.413 0.043 -23.450 1.00 0.00 H new ATOM 1346 N ASN A 86 -21.729 3.765 -20.524 1.00 0.00 N ATOM 1347 CA ASN A 86 -20.971 4.341 -19.405 1.00 0.00 C ATOM 1348 C ASN A 86 -20.090 5.524 -19.838 1.00 0.00 C ATOM 1349 O ASN A 86 -20.136 6.589 -19.221 1.00 0.00 O ATOM 1350 CB ASN A 86 -20.114 3.216 -18.799 1.00 0.00 C ATOM 1351 CG ASN A 86 -19.120 3.728 -17.770 1.00 0.00 C ATOM 1352 OD1 ASN A 86 -19.480 4.226 -16.717 1.00 0.00 O ATOM 1353 ND2 ASN A 86 -17.843 3.640 -18.061 1.00 0.00 N ATOM 0 H ASN A 86 -21.133 3.530 -21.318 1.00 0.00 H new ATOM 0 HA ASN A 86 -21.667 4.742 -18.669 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -20.767 2.478 -18.332 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -19.575 2.705 -19.597 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -17.145 3.989 -17.404 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -17.549 3.222 -18.944 1.00 0.00 H new ATOM 1360 N LEU A 87 -19.314 5.365 -20.917 1.00 0.00 N ATOM 1361 CA LEU A 87 -18.422 6.405 -21.459 1.00 0.00 C ATOM 1362 C LEU A 87 -19.167 7.677 -21.923 1.00 0.00 C ATOM 1363 O LEU A 87 -18.555 8.734 -22.078 1.00 0.00 O ATOM 1364 CB LEU A 87 -17.581 5.793 -22.597 1.00 0.00 C ATOM 1365 CG LEU A 87 -16.651 4.639 -22.166 1.00 0.00 C ATOM 1366 CD1 LEU A 87 -15.984 4.029 -23.398 1.00 0.00 C ATOM 1367 CD2 LEU A 87 -15.556 5.096 -21.198 1.00 0.00 C ATOM 0 H LEU A 87 -19.286 4.496 -21.450 1.00 0.00 H new ATOM 0 HA LEU A 87 -17.770 6.741 -20.653 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -18.255 5.428 -23.372 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -16.976 6.580 -23.046 1.00 0.00 H new ATOM 0 HG LEU A 87 -17.273 3.906 -21.652 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -15.328 3.215 -23.091 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -16.749 3.644 -24.073 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -15.399 4.793 -23.911 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -14.931 4.245 -20.928 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -14.942 5.859 -21.677 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -16.014 5.510 -20.300 1.00 0.00 H new ATOM 1379 N ILE A 88 -20.486 7.578 -22.104 1.00 0.00 N ATOM 1380 CA ILE A 88 -21.421 8.648 -22.494 1.00 0.00 C ATOM 1381 C ILE A 88 -21.921 9.524 -21.324 1.00 0.00 C ATOM 1382 O ILE A 88 -22.494 10.587 -21.565 1.00 0.00 O ATOM 1383 CB ILE A 88 -22.651 8.012 -23.191 1.00 0.00 C ATOM 1384 CG1 ILE A 88 -23.334 6.949 -22.290 1.00 0.00 C ATOM 1385 CG2 ILE A 88 -22.234 7.422 -24.550 1.00 0.00 C ATOM 1386 CD1 ILE A 88 -24.702 6.474 -22.781 1.00 0.00 C ATOM 0 H ILE A 88 -20.967 6.688 -21.974 1.00 0.00 H new ATOM 0 HA ILE A 88 -20.862 9.308 -23.157 1.00 0.00 H new ATOM 0 HB ILE A 88 -23.391 8.793 -23.366 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -22.674 6.086 -22.207 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -23.447 7.362 -21.287 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -23.102 6.976 -25.035 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -21.831 8.213 -25.182 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -21.472 6.658 -24.396 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -25.100 5.733 -22.088 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -25.384 7.323 -22.836 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -24.599 6.027 -23.770 1.00 0.00 H new ATOM 1398 N GLN A 89 -21.760 9.088 -20.067 1.00 0.00 N ATOM 1399 CA GLN A 89 -22.285 9.782 -18.881 1.00 0.00 C ATOM 1400 C GLN A 89 -21.584 11.127 -18.607 1.00 0.00 C ATOM 1401 O GLN A 89 -20.418 11.154 -18.209 1.00 0.00 O ATOM 1402 CB GLN A 89 -22.231 8.818 -17.680 1.00 0.00 C ATOM 1403 CG GLN A 89 -22.838 9.446 -16.415 1.00 0.00 C ATOM 1404 CD GLN A 89 -23.272 8.439 -15.350 1.00 0.00 C ATOM 1405 OE1 GLN A 89 -22.805 7.311 -15.250 1.00 0.00 O ATOM 1406 NE2 GLN A 89 -24.173 8.832 -14.474 1.00 0.00 N ATOM 0 H GLN A 89 -21.254 8.231 -19.841 1.00 0.00 H new ATOM 0 HA GLN A 89 -23.323 10.058 -19.066 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -22.769 7.902 -17.925 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -21.196 8.537 -17.486 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -22.108 10.126 -15.977 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -23.701 10.046 -16.702 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -24.574 9.767 -14.540 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -24.470 8.201 -13.730 1.00 0.00 H new ATOM 1415 N GLN A 90 -22.277 12.250 -18.825 1.00 0.00 N ATOM 1416 CA GLN A 90 -21.728 13.605 -18.630 1.00 0.00 C ATOM 1417 C GLN A 90 -21.467 13.948 -17.145 1.00 0.00 C ATOM 1418 O GLN A 90 -20.515 14.668 -16.839 1.00 0.00 O ATOM 1419 CB GLN A 90 -22.671 14.622 -19.310 1.00 0.00 C ATOM 1420 CG GLN A 90 -21.970 15.877 -19.864 1.00 0.00 C ATOM 1421 CD GLN A 90 -21.609 16.932 -18.815 1.00 0.00 C ATOM 1422 OE1 GLN A 90 -22.448 17.426 -18.074 1.00 0.00 O ATOM 1423 NE2 GLN A 90 -20.363 17.350 -18.733 1.00 0.00 N ATOM 0 H GLN A 90 -23.245 12.248 -19.145 1.00 0.00 H new ATOM 0 HA GLN A 90 -20.745 13.651 -19.099 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -23.193 14.123 -20.127 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -23.428 14.933 -18.590 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -21.059 15.569 -20.377 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -22.617 16.336 -20.612 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -19.650 16.950 -19.343 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -20.111 18.074 -18.060 1.00 0.00 H new ATOM 1432 N LYS A 91 -22.280 13.407 -16.222 1.00 0.00 N ATOM 1433 CA LYS A 91 -22.177 13.584 -14.756 1.00 0.00 C ATOM 1434 C LYS A 91 -22.500 12.270 -14.038 1.00 0.00 C ATOM 1435 O LYS A 91 -23.570 11.697 -14.253 1.00 0.00 O ATOM 1436 CB LYS A 91 -23.141 14.687 -14.271 1.00 0.00 C ATOM 1437 CG LYS A 91 -22.810 16.076 -14.837 1.00 0.00 C ATOM 1438 CD LYS A 91 -23.739 17.154 -14.266 1.00 0.00 C ATOM 1439 CE LYS A 91 -23.406 18.511 -14.897 1.00 0.00 C ATOM 1440 NZ LYS A 91 -24.294 19.587 -14.387 1.00 0.00 N ATOM 0 H LYS A 91 -23.062 12.808 -16.484 1.00 0.00 H new ATOM 0 HA LYS A 91 -21.155 13.881 -14.522 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -24.159 14.420 -14.554 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -23.114 14.730 -13.182 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -21.775 16.327 -14.605 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -22.898 16.057 -15.923 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -24.779 16.895 -14.466 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -23.626 17.208 -13.183 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -22.367 18.766 -14.686 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -23.503 18.442 -15.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -24.039 20.490 -14.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -25.283 19.356 -14.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -24.183 19.670 -13.356 1.00 0.00 H new ATOM 1454 N ASN A 92 -21.582 11.779 -13.201 1.00 0.00 N ATOM 1455 CA ASN A 92 -21.734 10.525 -12.452 1.00 0.00 C ATOM 1456 C ASN A 92 -22.935 10.556 -11.482 1.00 0.00 C ATOM 1457 O ASN A 92 -22.979 11.364 -10.544 1.00 0.00 O ATOM 1458 CB ASN A 92 -20.408 10.196 -11.737 1.00 0.00 C ATOM 1459 CG ASN A 92 -20.433 8.837 -11.050 1.00 0.00 C ATOM 1460 OD1 ASN A 92 -21.087 7.898 -11.488 1.00 0.00 O ATOM 1461 ND2 ASN A 92 -19.734 8.683 -9.950 1.00 0.00 N ATOM 0 H ASN A 92 -20.695 12.249 -13.020 1.00 0.00 H new ATOM 0 HA ASN A 92 -21.959 9.725 -13.157 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -19.594 10.217 -12.462 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -20.197 10.969 -10.998 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -19.737 7.786 -9.465 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -19.187 9.461 -9.580 1.00 0.00 H new TER 1468 ASN A 92 HETATM 1469 ZN ZN A 101 -20.565 -20.794 -15.416 1.00 0.00 ZN HETATM 1470 ZN ZN A 102 -4.740 -8.177 -15.919 1.00 0.00 ZN