USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 794 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0.0448 USER MOD Single : A 5 SER OG : rot 170:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.544 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -133:sc= -2.03 (180deg=-2.78!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= -1.73 X(o=-1.7,f=-1.6) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc=-0.00875 X(o=-0.0087,f=-0.093) USER MOD Single : A 36 HIS : no HE2:sc= 0.269 K(o=0.27,f=-0.93) USER MOD Single : A 37 CYS SG : rot 65:sc= -1.34 USER MOD Single : A 39 THR OG1 : rot 180:sc= -1.22 USER MOD Single : A 41 SER OG : rot -160:sc= -0.917 USER MOD Single : A 49 SER OG : rot 89:sc= 1.08 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -2.16! C(o=-2.2!,f=-1.3!) USER MOD Single : A 57 GLN : amide:sc= -0.259 K(o=-0.26,f=-0.77) USER MOD Single : A 61 MET CE :methyl -109:sc= -0.788 (180deg=-1.97!) USER MOD Single : A 63 SER OG : rot -150:sc= -0.106 USER MOD Single : A 65 SER OG : rot 180:sc= -0.867 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 12:sc= 0.246 USER MOD Single : A 73 GLN : amide:sc= -0.227 X(o=-0.23,f=-0.00032) USER MOD Single : A 79 SER OG : rot -57:sc= -0.237 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -0.443 X(o=-0.44,f=-0.024) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 94 SER OG : rot -104:sc= -0.605 USER MOD Single : A 99 TYR OH : rot 165:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 45:sc= 0.00164 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.772 -8.113 2.936 1.00 0.00 N ATOM 2 CA GLY A 1 -14.645 -7.236 4.088 1.00 0.00 C ATOM 3 C GLY A 1 -14.334 -5.802 3.655 1.00 0.00 C ATOM 4 O GLY A 1 -13.170 -5.409 3.590 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.983 -9.079 3.257 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.543 -7.775 2.326 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.881 -8.113 2.400 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.569 -7.253 4.666 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.854 -7.602 4.742 1.00 0.00 H new ATOM 8 N SER A 2 -15.394 -5.061 3.369 1.00 0.00 N ATOM 9 CA SER A 2 -15.248 -3.679 2.943 1.00 0.00 C ATOM 10 C SER A 2 -15.685 -2.737 4.067 1.00 0.00 C ATOM 11 O SER A 2 -15.371 -1.547 4.041 1.00 0.00 O ATOM 12 CB SER A 2 -16.059 -3.405 1.675 1.00 0.00 C ATOM 13 OG SER A 2 -15.833 -4.393 0.673 1.00 0.00 O ATOM 0 H SER A 2 -16.358 -5.391 3.424 1.00 0.00 H new ATOM 0 HA SER A 2 -14.197 -3.500 2.715 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.120 -3.376 1.923 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.796 -2.423 1.282 1.00 0.00 H new ATOM 0 HG SER A 2 -16.370 -4.184 -0.120 1.00 0.00 H new ATOM 19 N SER A 3 -16.402 -3.303 5.026 1.00 0.00 N ATOM 20 CA SER A 3 -16.885 -2.528 6.156 1.00 0.00 C ATOM 21 C SER A 3 -15.941 -2.698 7.349 1.00 0.00 C ATOM 22 O SER A 3 -16.037 -1.964 8.331 1.00 0.00 O ATOM 23 CB SER A 3 -18.306 -2.943 6.541 1.00 0.00 C ATOM 24 OG SER A 3 -18.657 -4.213 6.000 1.00 0.00 O ATOM 0 H SER A 3 -16.660 -4.290 5.044 1.00 0.00 H new ATOM 0 HA SER A 3 -16.908 -1.478 5.866 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.392 -2.975 7.627 1.00 0.00 H new ATOM 0 HB3 SER A 3 -19.011 -2.191 6.187 1.00 0.00 H new ATOM 0 HG SER A 3 -19.571 -4.442 6.270 1.00 0.00 H new ATOM 30 N GLY A 4 -15.051 -3.672 7.224 1.00 0.00 N ATOM 31 CA GLY A 4 -14.091 -3.948 8.279 1.00 0.00 C ATOM 32 C GLY A 4 -12.658 -3.748 7.783 1.00 0.00 C ATOM 33 O GLY A 4 -12.442 -3.213 6.696 1.00 0.00 O ATOM 0 H GLY A 4 -14.975 -4.280 6.408 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.280 -3.292 9.129 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -14.218 -4.971 8.632 1.00 0.00 H new ATOM 37 N SER A 5 -11.715 -4.189 8.602 1.00 0.00 N ATOM 38 CA SER A 5 -10.308 -4.065 8.260 1.00 0.00 C ATOM 39 C SER A 5 -9.963 -2.600 7.984 1.00 0.00 C ATOM 40 O SER A 5 -9.536 -2.256 6.883 1.00 0.00 O ATOM 41 CB SER A 5 -9.958 -4.930 7.047 1.00 0.00 C ATOM 42 OG SER A 5 -9.450 -6.205 7.430 1.00 0.00 O ATOM 0 H SER A 5 -11.897 -4.633 9.502 1.00 0.00 H new ATOM 0 HA SER A 5 -9.718 -4.417 9.106 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.846 -5.064 6.429 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.218 -4.414 6.435 1.00 0.00 H new ATOM 0 HG SER A 5 -9.390 -6.784 6.641 1.00 0.00 H new ATOM 48 N SER A 6 -10.162 -1.777 9.002 1.00 0.00 N ATOM 49 CA SER A 6 -9.878 -0.357 8.883 1.00 0.00 C ATOM 50 C SER A 6 -8.466 -0.150 8.331 1.00 0.00 C ATOM 51 O SER A 6 -7.486 -0.540 8.962 1.00 0.00 O ATOM 52 CB SER A 6 -10.029 0.350 10.231 1.00 0.00 C ATOM 53 OG SER A 6 -11.396 0.568 10.570 1.00 0.00 O ATOM 0 H SER A 6 -10.517 -2.066 9.914 1.00 0.00 H new ATOM 0 HA SER A 6 -10.599 0.079 8.192 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.554 -0.247 11.009 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.507 1.306 10.199 1.00 0.00 H new ATOM 0 HG SER A 6 -11.450 1.020 11.438 1.00 0.00 H new ATOM 59 N GLY A 7 -8.408 0.463 7.158 1.00 0.00 N ATOM 60 CA GLY A 7 -7.132 0.726 6.513 1.00 0.00 C ATOM 61 C GLY A 7 -6.982 -0.103 5.236 1.00 0.00 C ATOM 62 O GLY A 7 -7.231 0.393 4.138 1.00 0.00 O ATOM 0 H GLY A 7 -9.224 0.785 6.637 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.053 1.786 6.274 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.318 0.493 7.200 1.00 0.00 H new ATOM 66 N LEU A 8 -6.577 -1.350 5.422 1.00 0.00 N ATOM 67 CA LEU A 8 -6.391 -2.252 4.298 1.00 0.00 C ATOM 68 C LEU A 8 -7.531 -2.055 3.297 1.00 0.00 C ATOM 69 O LEU A 8 -7.297 -1.676 2.151 1.00 0.00 O ATOM 70 CB LEU A 8 -6.244 -3.694 4.787 1.00 0.00 C ATOM 71 CG LEU A 8 -4.889 -4.062 5.395 1.00 0.00 C ATOM 72 CD1 LEU A 8 -4.417 -2.985 6.375 1.00 0.00 C ATOM 73 CD2 LEU A 8 -4.936 -5.446 6.044 1.00 0.00 C ATOM 0 H LEU A 8 -6.372 -1.758 6.334 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.463 -2.021 3.774 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.017 -3.885 5.531 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.437 -4.363 3.948 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.156 -4.109 4.590 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -3.452 -3.271 6.793 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.318 -2.034 5.851 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.145 -2.882 7.180 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.960 -5.682 6.468 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.686 -5.452 6.835 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.195 -6.192 5.292 1.00 0.00 H new ATOM 85 N GLY A 9 -8.741 -2.322 3.767 1.00 0.00 N ATOM 86 CA GLY A 9 -9.918 -2.179 2.928 1.00 0.00 C ATOM 87 C GLY A 9 -9.769 -0.994 1.972 1.00 0.00 C ATOM 88 O GLY A 9 -9.591 -1.180 0.770 1.00 0.00 O ATOM 0 H GLY A 9 -8.931 -2.637 4.718 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.075 -3.094 2.357 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.800 -2.038 3.553 1.00 0.00 H new ATOM 92 N ALA A 10 -9.848 0.199 2.544 1.00 0.00 N ATOM 93 CA ALA A 10 -9.724 1.415 1.758 1.00 0.00 C ATOM 94 C ALA A 10 -8.559 1.267 0.777 1.00 0.00 C ATOM 95 O ALA A 10 -8.722 1.482 -0.423 1.00 0.00 O ATOM 96 CB ALA A 10 -9.550 2.613 2.694 1.00 0.00 C ATOM 0 H ALA A 10 -9.996 0.349 3.542 1.00 0.00 H new ATOM 0 HA ALA A 10 -10.627 1.587 1.173 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -9.457 3.525 2.104 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -10.417 2.692 3.349 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.652 2.477 3.296 1.00 0.00 H new ATOM 102 N LEU A 11 -7.409 0.902 1.325 1.00 0.00 N ATOM 103 CA LEU A 11 -6.218 0.723 0.514 1.00 0.00 C ATOM 104 C LEU A 11 -6.529 -0.235 -0.638 1.00 0.00 C ATOM 105 O LEU A 11 -6.340 0.107 -1.804 1.00 0.00 O ATOM 106 CB LEU A 11 -5.040 0.278 1.383 1.00 0.00 C ATOM 107 CG LEU A 11 -4.233 -0.913 0.861 1.00 0.00 C ATOM 108 CD1 LEU A 11 -3.511 -0.559 -0.440 1.00 0.00 C ATOM 109 CD2 LEU A 11 -3.269 -1.432 1.930 1.00 0.00 C ATOM 0 H LEU A 11 -7.277 0.726 2.321 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.915 1.670 0.068 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.364 1.124 1.505 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.419 0.028 2.374 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.927 -1.722 0.633 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.945 -1.423 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.243 -0.275 -1.196 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.830 0.273 -0.263 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.708 -2.278 1.534 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.578 -0.638 2.213 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.834 -1.750 2.806 1.00 0.00 H new ATOM 121 N TYR A 12 -7.001 -1.418 -0.270 1.00 0.00 N ATOM 122 CA TYR A 12 -7.340 -2.428 -1.257 1.00 0.00 C ATOM 123 C TYR A 12 -8.295 -1.865 -2.312 1.00 0.00 C ATOM 124 O TYR A 12 -8.024 -1.951 -3.509 1.00 0.00 O ATOM 125 CB TYR A 12 -8.048 -3.546 -0.490 1.00 0.00 C ATOM 126 CG TYR A 12 -8.576 -4.674 -1.380 1.00 0.00 C ATOM 127 CD1 TYR A 12 -7.750 -5.254 -2.321 1.00 0.00 C ATOM 128 CD2 TYR A 12 -9.878 -5.110 -1.242 1.00 0.00 C ATOM 129 CE1 TYR A 12 -8.247 -6.315 -3.159 1.00 0.00 C ATOM 130 CE2 TYR A 12 -10.375 -6.171 -2.079 1.00 0.00 C ATOM 131 CZ TYR A 12 -9.535 -6.721 -2.996 1.00 0.00 C ATOM 132 OH TYR A 12 -10.005 -7.723 -3.787 1.00 0.00 O ATOM 0 H TYR A 12 -7.156 -1.699 0.698 1.00 0.00 H new ATOM 0 HA TYR A 12 -6.445 -2.777 -1.773 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -7.356 -3.967 0.240 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -8.880 -3.118 0.069 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -6.731 -4.913 -2.429 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -10.524 -4.655 -0.506 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -7.612 -6.778 -3.900 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -11.392 -6.522 -1.981 1.00 0.00 H new ATOM 0 HH TYR A 12 -10.940 -7.909 -3.559 1.00 0.00 H new ATOM 142 N LEU A 13 -9.393 -1.302 -1.830 1.00 0.00 N ATOM 143 CA LEU A 13 -10.389 -0.725 -2.716 1.00 0.00 C ATOM 144 C LEU A 13 -9.687 0.088 -3.805 1.00 0.00 C ATOM 145 O LEU A 13 -10.137 0.116 -4.950 1.00 0.00 O ATOM 146 CB LEU A 13 -11.417 0.077 -1.916 1.00 0.00 C ATOM 147 CG LEU A 13 -12.467 -0.741 -1.161 1.00 0.00 C ATOM 148 CD1 LEU A 13 -13.287 0.149 -0.225 1.00 0.00 C ATOM 149 CD2 LEU A 13 -13.354 -1.524 -2.131 1.00 0.00 C ATOM 0 H LEU A 13 -9.615 -1.233 -0.837 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.953 -1.511 -3.218 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -10.883 0.698 -1.197 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -11.933 0.752 -2.599 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.949 -1.471 -0.539 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -14.026 -0.457 0.299 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.625 0.622 0.500 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -13.796 0.918 -0.807 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -14.091 -2.097 -1.568 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.865 -0.830 -2.798 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -12.738 -2.204 -2.719 1.00 0.00 H new ATOM 161 N SER A 14 -8.597 0.728 -3.411 1.00 0.00 N ATOM 162 CA SER A 14 -7.828 1.539 -4.340 1.00 0.00 C ATOM 163 C SER A 14 -7.073 0.639 -5.319 1.00 0.00 C ATOM 164 O SER A 14 -7.159 0.826 -6.532 1.00 0.00 O ATOM 165 CB SER A 14 -6.852 2.452 -3.596 1.00 0.00 C ATOM 166 OG SER A 14 -7.207 3.827 -3.718 1.00 0.00 O ATOM 0 H SER A 14 -8.227 0.702 -2.461 1.00 0.00 H new ATOM 0 HA SER A 14 -8.520 2.170 -4.897 1.00 0.00 H new ATOM 0 HB2 SER A 14 -6.829 2.176 -2.542 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.846 2.302 -3.987 1.00 0.00 H new ATOM 0 HG SER A 14 -6.560 4.377 -3.228 1.00 0.00 H new ATOM 172 N MET A 15 -6.349 -0.317 -4.756 1.00 0.00 N ATOM 173 CA MET A 15 -5.579 -1.247 -5.565 1.00 0.00 C ATOM 174 C MET A 15 -6.397 -1.744 -6.758 1.00 0.00 C ATOM 175 O MET A 15 -5.840 -2.066 -7.807 1.00 0.00 O ATOM 176 CB MET A 15 -5.152 -2.439 -4.706 1.00 0.00 C ATOM 177 CG MET A 15 -4.039 -2.043 -3.733 1.00 0.00 C ATOM 178 SD MET A 15 -3.713 -3.383 -2.601 1.00 0.00 S ATOM 179 CE MET A 15 -1.933 -3.455 -2.710 1.00 0.00 C ATOM 0 H MET A 15 -6.279 -0.468 -3.750 1.00 0.00 H new ATOM 0 HA MET A 15 -4.699 -0.727 -5.944 1.00 0.00 H new ATOM 0 HB2 MET A 15 -6.010 -2.816 -4.149 1.00 0.00 H new ATOM 0 HB3 MET A 15 -4.807 -3.250 -5.348 1.00 0.00 H new ATOM 0 HG2 MET A 15 -3.133 -1.794 -4.286 1.00 0.00 H new ATOM 0 HG3 MET A 15 -4.330 -1.150 -3.179 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.618 -4.490 -2.839 1.00 0.00 H new ATOM 0 HE2 MET A 15 -1.596 -2.864 -3.562 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.496 -3.054 -1.795 1.00 0.00 H new ATOM 189 N LYS A 16 -7.706 -1.792 -6.558 1.00 0.00 N ATOM 190 CA LYS A 16 -8.607 -2.245 -7.605 1.00 0.00 C ATOM 191 C LYS A 16 -8.518 -1.290 -8.797 1.00 0.00 C ATOM 192 O LYS A 16 -8.447 -1.729 -9.944 1.00 0.00 O ATOM 193 CB LYS A 16 -10.025 -2.412 -7.056 1.00 0.00 C ATOM 194 CG LYS A 16 -10.065 -3.474 -5.954 1.00 0.00 C ATOM 195 CD LYS A 16 -11.199 -4.472 -6.196 1.00 0.00 C ATOM 196 CE LYS A 16 -12.510 -3.971 -5.587 1.00 0.00 C ATOM 197 NZ LYS A 16 -13.425 -3.493 -6.648 1.00 0.00 N ATOM 0 H LYS A 16 -8.164 -1.525 -5.687 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.310 -3.231 -7.963 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.381 -1.460 -6.662 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.700 -2.695 -7.863 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.112 -4.002 -5.918 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.199 -2.993 -4.985 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.328 -4.629 -7.267 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.938 -5.437 -5.762 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.986 -4.773 -5.023 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -12.306 -3.164 -4.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -14.310 -3.156 -6.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -12.975 -2.713 -7.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -13.634 -4.273 -7.304 1.00 0.00 H new ATOM 211 N ASP A 17 -8.523 -0.003 -8.485 1.00 0.00 N ATOM 212 CA ASP A 17 -8.444 1.018 -9.516 1.00 0.00 C ATOM 213 C ASP A 17 -7.205 0.769 -10.379 1.00 0.00 C ATOM 214 O ASP A 17 -6.078 0.870 -9.897 1.00 0.00 O ATOM 215 CB ASP A 17 -8.320 2.413 -8.902 1.00 0.00 C ATOM 216 CG ASP A 17 -9.073 3.517 -9.648 1.00 0.00 C ATOM 217 OD1 ASP A 17 -8.885 3.599 -10.881 1.00 0.00 O ATOM 218 OD2 ASP A 17 -9.819 4.254 -8.968 1.00 0.00 O ATOM 0 H ASP A 17 -8.581 0.357 -7.532 1.00 0.00 H new ATOM 0 HA ASP A 17 -9.355 0.967 -10.112 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -8.684 2.375 -7.875 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -7.264 2.681 -8.856 1.00 0.00 H new ATOM 223 N PRO A 18 -7.462 0.441 -11.673 1.00 0.00 N ATOM 224 CA PRO A 18 -6.381 0.177 -12.608 1.00 0.00 C ATOM 225 C PRO A 18 -5.698 1.478 -13.037 1.00 0.00 C ATOM 226 O PRO A 18 -4.734 1.454 -13.800 1.00 0.00 O ATOM 227 CB PRO A 18 -7.033 -0.562 -13.765 1.00 0.00 C ATOM 228 CG PRO A 18 -8.522 -0.277 -13.656 1.00 0.00 C ATOM 229 CD PRO A 18 -8.784 0.312 -12.279 1.00 0.00 C ATOM 0 HA PRO A 18 -5.583 -0.422 -12.170 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -6.638 -0.217 -14.721 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -6.835 -1.632 -13.706 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.836 0.418 -14.435 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.097 -1.192 -13.795 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -9.283 1.278 -12.350 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -9.429 -0.337 -11.687 1.00 0.00 H new ATOM 237 N GLU A 19 -6.226 2.582 -12.529 1.00 0.00 N ATOM 238 CA GLU A 19 -5.680 3.889 -12.850 1.00 0.00 C ATOM 239 C GLU A 19 -5.166 4.575 -11.583 1.00 0.00 C ATOM 240 O GLU A 19 -4.009 4.991 -11.524 1.00 0.00 O ATOM 241 CB GLU A 19 -6.719 4.758 -13.561 1.00 0.00 C ATOM 242 CG GLU A 19 -6.657 4.558 -15.077 1.00 0.00 C ATOM 243 CD GLU A 19 -7.100 5.822 -15.816 1.00 0.00 C ATOM 244 OE1 GLU A 19 -8.030 6.482 -15.304 1.00 0.00 O ATOM 245 OE2 GLU A 19 -6.498 6.101 -16.875 1.00 0.00 O ATOM 0 H GLU A 19 -7.027 2.598 -11.897 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.841 3.753 -13.532 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.716 4.509 -13.198 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -6.546 5.807 -13.322 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -5.640 4.298 -15.372 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -7.296 3.722 -15.363 1.00 0.00 H new ATOM 252 N LYS A 20 -6.050 4.674 -10.602 1.00 0.00 N ATOM 253 CA LYS A 20 -5.700 5.303 -9.339 1.00 0.00 C ATOM 254 C LYS A 20 -5.252 4.229 -8.346 1.00 0.00 C ATOM 255 O LYS A 20 -5.143 4.491 -7.149 1.00 0.00 O ATOM 256 CB LYS A 20 -6.857 6.166 -8.832 1.00 0.00 C ATOM 257 CG LYS A 20 -7.079 7.375 -9.742 1.00 0.00 C ATOM 258 CD LYS A 20 -6.276 8.583 -9.255 1.00 0.00 C ATOM 259 CE LYS A 20 -6.430 9.765 -10.214 1.00 0.00 C ATOM 260 NZ LYS A 20 -7.389 10.752 -9.670 1.00 0.00 N ATOM 0 H LYS A 20 -7.008 4.329 -10.656 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.860 5.984 -9.472 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.768 5.569 -8.786 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.646 6.504 -7.817 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.785 7.126 -10.762 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.140 7.625 -9.768 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.613 8.871 -8.259 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -5.223 8.314 -9.169 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.462 10.240 -10.374 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -6.775 9.410 -11.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.482 11.548 -10.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.316 10.300 -9.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.044 11.103 -8.754 1.00 0.00 H new ATOM 274 N GLY A 21 -5.004 3.041 -8.879 1.00 0.00 N ATOM 275 CA GLY A 21 -4.570 1.926 -8.055 1.00 0.00 C ATOM 276 C GLY A 21 -3.451 1.140 -8.740 1.00 0.00 C ATOM 277 O GLY A 21 -2.728 1.682 -9.575 1.00 0.00 O ATOM 0 H GLY A 21 -5.096 2.827 -9.872 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -4.221 2.296 -7.091 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.414 1.266 -7.857 1.00 0.00 H new ATOM 281 N ILE A 22 -3.343 -0.125 -8.363 1.00 0.00 N ATOM 282 CA ILE A 22 -2.324 -0.992 -8.931 1.00 0.00 C ATOM 283 C ILE A 22 -2.677 -1.299 -10.387 1.00 0.00 C ATOM 284 O ILE A 22 -3.840 -1.220 -10.778 1.00 0.00 O ATOM 285 CB ILE A 22 -2.139 -2.240 -8.066 1.00 0.00 C ATOM 286 CG1 ILE A 22 -0.754 -2.257 -7.416 1.00 0.00 C ATOM 287 CG2 ILE A 22 -2.409 -3.511 -8.873 1.00 0.00 C ATOM 288 CD1 ILE A 22 -0.654 -3.366 -6.367 1.00 0.00 C ATOM 0 H ILE A 22 -3.945 -0.571 -7.671 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.356 -0.491 -8.936 1.00 0.00 H new ATOM 0 HB ILE A 22 -2.872 -2.208 -7.260 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.009 -2.405 -8.181 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -0.555 -1.292 -6.950 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.271 -4.384 -8.235 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -3.433 -3.494 -9.247 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -1.716 -3.563 -9.713 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.340 -3.356 -5.921 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.402 -3.202 -5.591 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.829 -4.332 -6.841 1.00 0.00 H new ATOM 300 N LYS A 23 -1.650 -1.644 -11.151 1.00 0.00 N ATOM 301 CA LYS A 23 -1.837 -1.964 -12.556 1.00 0.00 C ATOM 302 C LYS A 23 -2.143 -3.457 -12.699 1.00 0.00 C ATOM 303 O LYS A 23 -2.282 -4.163 -11.701 1.00 0.00 O ATOM 304 CB LYS A 23 -0.631 -1.503 -13.376 1.00 0.00 C ATOM 305 CG LYS A 23 -0.851 -0.093 -13.929 1.00 0.00 C ATOM 306 CD LYS A 23 -0.573 -0.045 -15.433 1.00 0.00 C ATOM 307 CE LYS A 23 -0.694 1.383 -15.968 1.00 0.00 C ATOM 308 NZ LYS A 23 -1.826 1.489 -16.914 1.00 0.00 N ATOM 0 H LYS A 23 -0.686 -1.709 -10.823 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.693 -1.423 -12.959 1.00 0.00 H new ATOM 0 HB2 LYS A 23 0.264 -1.518 -12.754 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.459 -2.197 -14.198 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -1.876 0.222 -13.735 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -0.198 0.610 -13.412 1.00 0.00 H new ATOM 0 HD2 LYS A 23 0.427 -0.429 -15.634 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -1.275 -0.694 -15.957 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -0.839 2.077 -15.140 1.00 0.00 H new ATOM 0 HE3 LYS A 23 0.232 1.670 -16.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -1.893 2.465 -17.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -1.672 0.841 -17.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -2.710 1.235 -16.428 1.00 0.00 H new ATOM 322 N GLU A 24 -2.239 -3.892 -13.946 1.00 0.00 N ATOM 323 CA GLU A 24 -2.526 -5.287 -14.232 1.00 0.00 C ATOM 324 C GLU A 24 -1.874 -5.704 -15.552 1.00 0.00 C ATOM 325 O GLU A 24 -2.338 -5.322 -16.625 1.00 0.00 O ATOM 326 CB GLU A 24 -4.034 -5.543 -14.261 1.00 0.00 C ATOM 327 CG GLU A 24 -4.675 -5.196 -12.916 1.00 0.00 C ATOM 328 CD GLU A 24 -6.023 -5.901 -12.752 1.00 0.00 C ATOM 329 OE1 GLU A 24 -6.929 -5.587 -13.553 1.00 0.00 O ATOM 330 OE2 GLU A 24 -6.116 -6.739 -11.829 1.00 0.00 O ATOM 0 H GLU A 24 -2.123 -3.303 -14.770 1.00 0.00 H new ATOM 0 HA GLU A 24 -2.103 -5.895 -13.432 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -4.492 -4.948 -15.051 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -4.224 -6.589 -14.499 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.007 -5.487 -12.105 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.814 -4.117 -12.843 1.00 0.00 H new ATOM 337 N LEU A 25 -0.808 -6.481 -15.429 1.00 0.00 N ATOM 338 CA LEU A 25 -0.088 -6.954 -16.599 1.00 0.00 C ATOM 339 C LEU A 25 -0.217 -8.475 -16.692 1.00 0.00 C ATOM 340 O LEU A 25 -0.725 -9.116 -15.774 1.00 0.00 O ATOM 341 CB LEU A 25 1.360 -6.460 -16.572 1.00 0.00 C ATOM 342 CG LEU A 25 1.574 -5.035 -16.056 1.00 0.00 C ATOM 343 CD1 LEU A 25 2.626 -5.006 -14.946 1.00 0.00 C ATOM 344 CD2 LEU A 25 1.923 -4.084 -17.202 1.00 0.00 C ATOM 0 H LEU A 25 -0.426 -6.795 -14.537 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.525 -6.541 -17.508 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.944 -7.141 -15.952 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.763 -6.524 -17.583 1.00 0.00 H new ATOM 0 HG LEU A 25 0.638 -4.685 -15.621 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.759 -3.982 -14.597 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.297 -5.632 -14.117 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.573 -5.383 -15.332 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.070 -3.078 -16.808 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.839 -4.421 -17.688 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.109 -4.074 -17.927 1.00 0.00 H new ATOM 356 N ASN A 26 0.252 -9.010 -17.810 1.00 0.00 N ATOM 357 CA ASN A 26 0.195 -10.444 -18.036 1.00 0.00 C ATOM 358 C ASN A 26 1.612 -11.020 -17.987 1.00 0.00 C ATOM 359 O ASN A 26 2.374 -10.885 -18.943 1.00 0.00 O ATOM 360 CB ASN A 26 -0.398 -10.763 -19.410 1.00 0.00 C ATOM 361 CG ASN A 26 0.268 -9.924 -20.502 1.00 0.00 C ATOM 362 OD1 ASN A 26 -0.039 -8.760 -20.701 1.00 0.00 O ATOM 363 ND2 ASN A 26 1.195 -10.578 -21.197 1.00 0.00 N ATOM 0 H ASN A 26 0.673 -8.475 -18.570 1.00 0.00 H new ATOM 0 HA ASN A 26 -0.435 -10.882 -17.262 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -0.267 -11.823 -19.630 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -1.471 -10.570 -19.401 1.00 0.00 H new ATOM 0 HD21 ASN A 26 1.697 -10.105 -21.948 1.00 0.00 H new ATOM 0 HD22 ASN A 26 1.403 -11.552 -20.978 1.00 0.00 H new ATOM 370 N LEU A 27 1.922 -11.650 -16.863 1.00 0.00 N ATOM 371 CA LEU A 27 3.234 -12.247 -16.677 1.00 0.00 C ATOM 372 C LEU A 27 3.162 -13.738 -17.011 1.00 0.00 C ATOM 373 O LEU A 27 2.077 -14.315 -17.065 1.00 0.00 O ATOM 374 CB LEU A 27 3.760 -11.956 -15.270 1.00 0.00 C ATOM 375 CG LEU A 27 3.827 -10.480 -14.871 1.00 0.00 C ATOM 376 CD1 LEU A 27 3.743 -10.319 -13.352 1.00 0.00 C ATOM 377 CD2 LEU A 27 5.075 -9.812 -15.450 1.00 0.00 C ATOM 0 H LEU A 27 1.287 -11.760 -16.072 1.00 0.00 H new ATOM 0 HA LEU A 27 3.957 -11.801 -17.361 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.127 -12.478 -14.552 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.760 -12.381 -15.182 1.00 0.00 H new ATOM 0 HG LEU A 27 2.963 -9.971 -15.297 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.793 -9.261 -13.095 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.802 -10.736 -12.993 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.575 -10.846 -12.884 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.098 -8.764 -15.152 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.965 -10.316 -15.074 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.052 -9.879 -16.538 1.00 0.00 H new ATOM 389 N GLU A 28 4.333 -14.320 -17.227 1.00 0.00 N ATOM 390 CA GLU A 28 4.417 -15.733 -17.554 1.00 0.00 C ATOM 391 C GLU A 28 5.420 -16.432 -16.635 1.00 0.00 C ATOM 392 O GLU A 28 6.148 -15.776 -15.891 1.00 0.00 O ATOM 393 CB GLU A 28 4.788 -15.934 -19.025 1.00 0.00 C ATOM 394 CG GLU A 28 3.851 -16.941 -19.694 1.00 0.00 C ATOM 395 CD GLU A 28 4.559 -17.677 -20.833 1.00 0.00 C ATOM 396 OE1 GLU A 28 5.513 -18.422 -20.521 1.00 0.00 O ATOM 397 OE2 GLU A 28 4.131 -17.477 -21.991 1.00 0.00 O ATOM 0 H GLU A 28 5.231 -13.838 -17.182 1.00 0.00 H new ATOM 0 HA GLU A 28 3.436 -16.181 -17.396 1.00 0.00 H new ATOM 0 HB2 GLU A 28 4.737 -14.980 -19.550 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.817 -16.285 -19.100 1.00 0.00 H new ATOM 0 HG2 GLU A 28 3.498 -17.661 -18.955 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.973 -16.424 -20.081 1.00 0.00 H new ATOM 404 N LYS A 29 5.427 -17.754 -16.716 1.00 0.00 N ATOM 405 CA LYS A 29 6.330 -18.550 -15.900 1.00 0.00 C ATOM 406 C LYS A 29 6.302 -20.001 -16.384 1.00 0.00 C ATOM 407 O LYS A 29 5.289 -20.685 -16.249 1.00 0.00 O ATOM 408 CB LYS A 29 5.992 -18.389 -14.416 1.00 0.00 C ATOM 409 CG LYS A 29 6.754 -19.409 -13.567 1.00 0.00 C ATOM 410 CD LYS A 29 7.532 -18.717 -12.446 1.00 0.00 C ATOM 411 CE LYS A 29 8.023 -19.732 -11.412 1.00 0.00 C ATOM 412 NZ LYS A 29 9.397 -20.178 -11.735 1.00 0.00 N ATOM 0 H LYS A 29 4.822 -18.295 -17.334 1.00 0.00 H new ATOM 0 HA LYS A 29 7.355 -18.197 -16.010 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.242 -17.379 -14.090 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.920 -18.516 -14.268 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.054 -20.127 -13.139 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.442 -19.972 -14.198 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.383 -18.180 -12.866 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.896 -17.977 -11.961 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.004 -19.286 -10.418 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.352 -20.590 -11.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.715 -20.867 -11.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.406 -20.623 -12.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.037 -19.358 -11.734 1.00 0.00 H new ATOM 426 N ASP A 30 7.428 -20.428 -16.936 1.00 0.00 N ATOM 427 CA ASP A 30 7.546 -21.786 -17.440 1.00 0.00 C ATOM 428 C ASP A 30 6.731 -21.919 -18.729 1.00 0.00 C ATOM 429 O ASP A 30 7.296 -22.061 -19.812 1.00 0.00 O ATOM 430 CB ASP A 30 7.001 -22.798 -16.430 1.00 0.00 C ATOM 431 CG ASP A 30 7.962 -23.932 -16.068 1.00 0.00 C ATOM 432 OD1 ASP A 30 9.115 -23.873 -16.548 1.00 0.00 O ATOM 433 OD2 ASP A 30 7.523 -24.831 -15.320 1.00 0.00 O ATOM 0 H ASP A 30 8.267 -19.858 -17.045 1.00 0.00 H new ATOM 0 HA ASP A 30 8.602 -21.989 -17.619 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.729 -22.267 -15.518 1.00 0.00 H new ATOM 0 HB3 ASP A 30 6.085 -23.232 -16.831 1.00 0.00 H new ATOM 438 N LYS A 31 5.417 -21.869 -18.569 1.00 0.00 N ATOM 439 CA LYS A 31 4.520 -21.983 -19.706 1.00 0.00 C ATOM 440 C LYS A 31 3.079 -21.778 -19.235 1.00 0.00 C ATOM 441 O LYS A 31 2.221 -22.631 -19.458 1.00 0.00 O ATOM 442 CB LYS A 31 4.745 -23.308 -20.436 1.00 0.00 C ATOM 443 CG LYS A 31 5.340 -23.074 -21.826 1.00 0.00 C ATOM 444 CD LYS A 31 4.921 -24.181 -22.796 1.00 0.00 C ATOM 445 CE LYS A 31 4.560 -23.602 -24.165 1.00 0.00 C ATOM 446 NZ LYS A 31 3.091 -23.475 -24.303 1.00 0.00 N ATOM 0 H LYS A 31 4.952 -21.751 -17.669 1.00 0.00 H new ATOM 0 HA LYS A 31 4.732 -21.203 -20.437 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.414 -23.940 -19.852 1.00 0.00 H new ATOM 0 HB3 LYS A 31 3.799 -23.843 -20.527 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.011 -22.107 -22.208 1.00 0.00 H new ATOM 0 HG3 LYS A 31 6.427 -23.037 -21.758 1.00 0.00 H new ATOM 0 HD2 LYS A 31 5.732 -24.901 -22.904 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.067 -24.722 -22.389 1.00 0.00 H new ATOM 0 HE2 LYS A 31 5.029 -22.626 -24.289 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.951 -24.245 -24.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.863 -23.080 -25.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.651 -24.412 -24.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.726 -22.843 -23.562 1.00 0.00 H new ATOM 460 N LYS A 32 2.856 -20.641 -18.592 1.00 0.00 N ATOM 461 CA LYS A 32 1.534 -20.312 -18.088 1.00 0.00 C ATOM 462 C LYS A 32 1.398 -18.793 -17.975 1.00 0.00 C ATOM 463 O LYS A 32 2.173 -18.148 -17.270 1.00 0.00 O ATOM 464 CB LYS A 32 1.261 -21.053 -16.777 1.00 0.00 C ATOM 465 CG LYS A 32 2.456 -20.948 -15.828 1.00 0.00 C ATOM 466 CD LYS A 32 3.169 -22.295 -15.693 1.00 0.00 C ATOM 467 CE LYS A 32 2.281 -23.316 -14.980 1.00 0.00 C ATOM 468 NZ LYS A 32 2.937 -24.642 -14.949 1.00 0.00 N ATOM 0 H LYS A 32 3.570 -19.936 -18.409 1.00 0.00 H new ATOM 0 HA LYS A 32 0.767 -20.649 -18.785 1.00 0.00 H new ATOM 0 HB2 LYS A 32 0.374 -20.637 -16.298 1.00 0.00 H new ATOM 0 HB3 LYS A 32 1.049 -22.102 -16.985 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.155 -20.198 -16.199 1.00 0.00 H new ATOM 0 HG3 LYS A 32 2.118 -20.611 -14.848 1.00 0.00 H new ATOM 0 HD2 LYS A 32 3.438 -22.669 -16.681 1.00 0.00 H new ATOM 0 HD3 LYS A 32 4.098 -22.165 -15.138 1.00 0.00 H new ATOM 0 HE2 LYS A 32 2.076 -22.981 -13.963 1.00 0.00 H new ATOM 0 HE3 LYS A 32 1.321 -23.391 -15.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.320 -25.323 -14.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 3.110 -24.966 -15.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 3.842 -24.570 -14.442 1.00 0.00 H new ATOM 482 N VAL A 33 0.408 -18.265 -18.679 1.00 0.00 N ATOM 483 CA VAL A 33 0.161 -16.833 -18.666 1.00 0.00 C ATOM 484 C VAL A 33 -0.748 -16.487 -17.485 1.00 0.00 C ATOM 485 O VAL A 33 -1.657 -17.246 -17.154 1.00 0.00 O ATOM 486 CB VAL A 33 -0.413 -16.389 -20.013 1.00 0.00 C ATOM 487 CG1 VAL A 33 -0.810 -14.911 -19.980 1.00 0.00 C ATOM 488 CG2 VAL A 33 0.574 -16.666 -21.149 1.00 0.00 C ATOM 0 H VAL A 33 -0.233 -18.803 -19.262 1.00 0.00 H new ATOM 0 HA VAL A 33 1.094 -16.286 -18.529 1.00 0.00 H new ATOM 0 HB VAL A 33 -1.313 -16.974 -20.202 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.215 -14.621 -20.950 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.565 -14.754 -19.210 1.00 0.00 H new ATOM 0 HG13 VAL A 33 0.067 -14.304 -19.757 1.00 0.00 H new ATOM 0 HG21 VAL A 33 0.141 -16.341 -22.095 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.500 -16.120 -20.968 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.785 -17.734 -21.195 1.00 0.00 H new ATOM 498 N PHE A 34 -0.471 -15.340 -16.883 1.00 0.00 N ATOM 499 CA PHE A 34 -1.252 -14.884 -15.746 1.00 0.00 C ATOM 500 C PHE A 34 -1.772 -13.463 -15.972 1.00 0.00 C ATOM 501 O PHE A 34 -1.030 -12.494 -15.817 1.00 0.00 O ATOM 502 CB PHE A 34 -0.320 -14.885 -14.533 1.00 0.00 C ATOM 503 CG PHE A 34 0.192 -16.273 -14.143 1.00 0.00 C ATOM 504 CD1 PHE A 34 1.134 -16.890 -14.907 1.00 0.00 C ATOM 505 CD2 PHE A 34 -0.294 -16.891 -13.034 1.00 0.00 C ATOM 506 CE1 PHE A 34 1.609 -18.178 -14.546 1.00 0.00 C ATOM 507 CE2 PHE A 34 0.181 -18.180 -12.672 1.00 0.00 C ATOM 508 CZ PHE A 34 1.123 -18.796 -13.436 1.00 0.00 C ATOM 0 H PHE A 34 0.284 -14.713 -17.161 1.00 0.00 H new ATOM 0 HA PHE A 34 -2.111 -15.538 -15.600 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.533 -14.240 -14.743 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -0.846 -14.451 -13.683 1.00 0.00 H new ATOM 0 HD1 PHE A 34 1.520 -16.400 -15.788 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -1.042 -16.402 -12.428 1.00 0.00 H new ATOM 0 HE1 PHE A 34 2.356 -18.667 -15.153 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -0.205 -18.671 -11.791 1.00 0.00 H new ATOM 0 HZ PHE A 34 1.485 -19.776 -13.161 1.00 0.00 H new ATOM 518 N ASN A 35 -3.044 -13.384 -16.337 1.00 0.00 N ATOM 519 CA ASN A 35 -3.672 -12.097 -16.586 1.00 0.00 C ATOM 520 C ASN A 35 -4.228 -11.543 -15.273 1.00 0.00 C ATOM 521 O ASN A 35 -4.496 -12.298 -14.341 1.00 0.00 O ATOM 522 CB ASN A 35 -4.834 -12.234 -17.572 1.00 0.00 C ATOM 523 CG ASN A 35 -4.380 -11.926 -19.001 1.00 0.00 C ATOM 524 OD1 ASN A 35 -4.079 -10.798 -19.354 1.00 0.00 O ATOM 525 ND2 ASN A 35 -4.349 -12.989 -19.799 1.00 0.00 N ATOM 0 H ASN A 35 -3.656 -14.190 -16.466 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.919 -11.429 -17.006 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.238 -13.245 -17.525 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -5.639 -11.556 -17.288 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -4.060 -12.888 -20.772 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -4.614 -13.905 -19.438 1.00 0.00 H new ATOM 532 N HIS A 36 -4.385 -10.228 -15.243 1.00 0.00 N ATOM 533 CA HIS A 36 -4.904 -9.563 -14.060 1.00 0.00 C ATOM 534 C HIS A 36 -4.141 -10.044 -12.824 1.00 0.00 C ATOM 535 O HIS A 36 -4.746 -10.485 -11.848 1.00 0.00 O ATOM 536 CB HIS A 36 -6.416 -9.770 -13.940 1.00 0.00 C ATOM 537 CG HIS A 36 -7.198 -9.292 -15.141 1.00 0.00 C ATOM 538 ND1 HIS A 36 -7.323 -7.954 -15.470 1.00 0.00 N ATOM 539 CD2 HIS A 36 -7.892 -9.988 -16.086 1.00 0.00 C ATOM 540 CE1 HIS A 36 -8.062 -7.861 -16.566 1.00 0.00 C ATOM 541 NE2 HIS A 36 -8.414 -9.122 -16.946 1.00 0.00 N ATOM 0 H HIS A 36 -4.162 -9.605 -16.019 1.00 0.00 H new ATOM 0 HA HIS A 36 -4.748 -8.488 -14.145 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -6.616 -10.830 -13.787 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -6.775 -9.247 -13.054 1.00 0.00 H new ATOM 0 HD1 HIS A 36 -6.916 -7.172 -14.956 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -7.999 -11.062 -16.128 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -8.337 -6.946 -17.070 1.00 0.00 H new ATOM 549 N CYS A 37 -2.822 -9.943 -12.906 1.00 0.00 N ATOM 550 CA CYS A 37 -1.969 -10.361 -11.807 1.00 0.00 C ATOM 551 C CYS A 37 -1.052 -9.194 -11.439 1.00 0.00 C ATOM 552 O CYS A 37 -0.899 -8.251 -12.214 1.00 0.00 O ATOM 553 CB CYS A 37 -1.176 -11.622 -12.156 1.00 0.00 C ATOM 554 SG CYS A 37 -2.203 -13.109 -11.864 1.00 0.00 S ATOM 0 H CYS A 37 -2.323 -9.577 -13.717 1.00 0.00 H new ATOM 0 HA CYS A 37 -2.583 -10.623 -10.946 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -0.861 -11.586 -13.199 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.270 -11.671 -11.551 1.00 0.00 H new ATOM 0 HG CYS A 37 -3.213 -13.107 -12.683 1.00 0.00 H new ATOM 560 N LEU A 38 -0.466 -9.294 -10.255 1.00 0.00 N ATOM 561 CA LEU A 38 0.432 -8.258 -9.774 1.00 0.00 C ATOM 562 C LEU A 38 1.821 -8.858 -9.547 1.00 0.00 C ATOM 563 O LEU A 38 2.205 -9.815 -10.217 1.00 0.00 O ATOM 564 CB LEU A 38 -0.153 -7.574 -8.536 1.00 0.00 C ATOM 565 CG LEU A 38 -1.680 -7.546 -8.444 1.00 0.00 C ATOM 566 CD1 LEU A 38 -2.137 -6.927 -7.122 1.00 0.00 C ATOM 567 CD2 LEU A 38 -2.289 -6.833 -9.652 1.00 0.00 C ATOM 0 H LEU A 38 -0.596 -10.077 -9.614 1.00 0.00 H new ATOM 0 HA LEU A 38 0.542 -7.472 -10.521 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.235 -8.076 -7.650 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.212 -6.547 -8.506 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.043 -8.574 -8.461 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.226 -6.919 -7.081 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.747 -7.515 -6.291 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.764 -5.905 -7.050 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.375 -6.827 -9.562 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.923 -5.807 -9.692 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.004 -7.356 -10.565 1.00 0.00 H new ATOM 579 N THR A 39 2.537 -8.270 -8.599 1.00 0.00 N ATOM 580 CA THR A 39 3.875 -8.735 -8.275 1.00 0.00 C ATOM 581 C THR A 39 4.213 -8.412 -6.818 1.00 0.00 C ATOM 582 O THR A 39 3.953 -7.307 -6.347 1.00 0.00 O ATOM 583 CB THR A 39 4.848 -8.110 -9.277 1.00 0.00 C ATOM 584 OG1 THR A 39 4.355 -6.786 -9.461 1.00 0.00 O ATOM 585 CG2 THR A 39 4.743 -8.742 -10.667 1.00 0.00 C ATOM 0 H THR A 39 2.216 -7.476 -8.045 1.00 0.00 H new ATOM 0 HA THR A 39 3.949 -9.819 -8.361 1.00 0.00 H new ATOM 0 HB THR A 39 5.867 -8.215 -8.906 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.929 -6.308 -10.096 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.454 -8.262 -11.339 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.967 -9.807 -10.601 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.732 -8.608 -11.052 1.00 0.00 H new ATOM 593 N GLY A 40 4.788 -9.399 -6.146 1.00 0.00 N ATOM 594 CA GLY A 40 5.165 -9.234 -4.752 1.00 0.00 C ATOM 595 C GLY A 40 5.839 -7.880 -4.523 1.00 0.00 C ATOM 596 O GLY A 40 5.438 -7.124 -3.639 1.00 0.00 O ATOM 0 H GLY A 40 5.002 -10.315 -6.541 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.280 -9.315 -4.120 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.842 -10.036 -4.457 1.00 0.00 H new ATOM 600 N SER A 41 6.853 -7.615 -5.334 1.00 0.00 N ATOM 601 CA SER A 41 7.587 -6.366 -5.231 1.00 0.00 C ATOM 602 C SER A 41 6.744 -5.215 -5.784 1.00 0.00 C ATOM 603 O SER A 41 6.644 -4.159 -5.162 1.00 0.00 O ATOM 604 CB SER A 41 8.923 -6.449 -5.972 1.00 0.00 C ATOM 605 OG SER A 41 9.331 -5.181 -6.480 1.00 0.00 O ATOM 0 H SER A 41 7.183 -8.245 -6.065 1.00 0.00 H new ATOM 0 HA SER A 41 7.797 -6.180 -4.178 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.688 -6.833 -5.298 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.838 -7.159 -6.795 1.00 0.00 H new ATOM 0 HG SER A 41 9.990 -5.311 -7.194 1.00 0.00 H new ATOM 611 N GLY A 42 6.157 -5.460 -6.946 1.00 0.00 N ATOM 612 CA GLY A 42 5.325 -4.458 -7.590 1.00 0.00 C ATOM 613 C GLY A 42 4.259 -3.930 -6.628 1.00 0.00 C ATOM 614 O GLY A 42 4.073 -2.720 -6.505 1.00 0.00 O ATOM 0 H GLY A 42 6.241 -6.338 -7.458 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.947 -3.633 -7.938 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.845 -4.889 -8.469 1.00 0.00 H new ATOM 618 N VAL A 43 3.587 -4.863 -5.970 1.00 0.00 N ATOM 619 CA VAL A 43 2.544 -4.507 -5.023 1.00 0.00 C ATOM 620 C VAL A 43 3.065 -3.417 -4.084 1.00 0.00 C ATOM 621 O VAL A 43 2.335 -2.489 -3.738 1.00 0.00 O ATOM 622 CB VAL A 43 2.063 -5.755 -4.281 1.00 0.00 C ATOM 623 CG1 VAL A 43 1.210 -5.378 -3.068 1.00 0.00 C ATOM 624 CG2 VAL A 43 1.296 -6.689 -5.220 1.00 0.00 C ATOM 0 H VAL A 43 3.745 -5.865 -6.074 1.00 0.00 H new ATOM 0 HA VAL A 43 1.677 -4.101 -5.544 1.00 0.00 H new ATOM 0 HB VAL A 43 2.942 -6.289 -3.920 1.00 0.00 H new ATOM 0 HG11 VAL A 43 0.881 -6.284 -2.559 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.801 -4.770 -2.382 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.340 -4.811 -3.397 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.965 -7.569 -4.668 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.429 -6.167 -5.624 1.00 0.00 H new ATOM 0 HG23 VAL A 43 1.947 -6.998 -6.038 1.00 0.00 H new ATOM 634 N ILE A 44 4.324 -3.566 -3.697 1.00 0.00 N ATOM 635 CA ILE A 44 4.951 -2.606 -2.805 1.00 0.00 C ATOM 636 C ILE A 44 5.362 -1.367 -3.603 1.00 0.00 C ATOM 637 O ILE A 44 5.404 -0.262 -3.063 1.00 0.00 O ATOM 638 CB ILE A 44 6.107 -3.258 -2.043 1.00 0.00 C ATOM 639 CG1 ILE A 44 5.700 -4.628 -1.497 1.00 0.00 C ATOM 640 CG2 ILE A 44 6.628 -2.333 -0.941 1.00 0.00 C ATOM 641 CD1 ILE A 44 6.930 -5.491 -1.208 1.00 0.00 C ATOM 0 H ILE A 44 4.926 -4.337 -3.985 1.00 0.00 H new ATOM 0 HA ILE A 44 4.244 -2.275 -2.044 1.00 0.00 H new ATOM 0 HB ILE A 44 6.928 -3.421 -2.741 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.118 -4.501 -0.584 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.057 -5.134 -2.217 1.00 0.00 H new ATOM 0 HG21 ILE A 44 7.449 -2.820 -0.415 1.00 0.00 H new ATOM 0 HG22 ILE A 44 6.983 -1.403 -1.384 1.00 0.00 H new ATOM 0 HG23 ILE A 44 5.824 -2.116 -0.238 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.612 -6.459 -0.821 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.497 -5.636 -2.128 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.558 -4.993 -0.469 1.00 0.00 H new ATOM 653 N ASP A 45 5.655 -1.592 -4.875 1.00 0.00 N ATOM 654 CA ASP A 45 6.061 -0.508 -5.753 1.00 0.00 C ATOM 655 C ASP A 45 4.942 0.534 -5.821 1.00 0.00 C ATOM 656 O ASP A 45 5.205 1.735 -5.798 1.00 0.00 O ATOM 657 CB ASP A 45 6.320 -1.016 -7.173 1.00 0.00 C ATOM 658 CG ASP A 45 7.159 -0.084 -8.050 1.00 0.00 C ATOM 659 OD1 ASP A 45 6.733 1.080 -8.211 1.00 0.00 O ATOM 660 OD2 ASP A 45 8.207 -0.557 -8.539 1.00 0.00 O ATOM 0 H ASP A 45 5.619 -2.510 -5.319 1.00 0.00 H new ATOM 0 HA ASP A 45 6.978 -0.075 -5.352 1.00 0.00 H new ATOM 0 HB2 ASP A 45 6.822 -1.982 -7.111 1.00 0.00 H new ATOM 0 HB3 ASP A 45 5.361 -1.186 -7.663 1.00 0.00 H new ATOM 665 N TRP A 46 3.717 0.036 -5.902 1.00 0.00 N ATOM 666 CA TRP A 46 2.557 0.908 -5.973 1.00 0.00 C ATOM 667 C TRP A 46 2.436 1.643 -4.637 1.00 0.00 C ATOM 668 O TRP A 46 2.018 2.799 -4.596 1.00 0.00 O ATOM 669 CB TRP A 46 1.299 0.119 -6.338 1.00 0.00 C ATOM 670 CG TRP A 46 0.015 0.952 -6.323 1.00 0.00 C ATOM 671 CD1 TRP A 46 -0.471 1.735 -7.295 1.00 0.00 C ATOM 672 CD2 TRP A 46 -0.931 1.053 -5.238 1.00 0.00 C ATOM 673 NE1 TRP A 46 -1.657 2.331 -6.918 1.00 0.00 N ATOM 674 CE2 TRP A 46 -1.946 1.903 -5.628 1.00 0.00 C ATOM 675 CE3 TRP A 46 -0.930 0.446 -3.970 1.00 0.00 C ATOM 676 CZ2 TRP A 46 -3.035 2.224 -4.808 1.00 0.00 C ATOM 677 CZ3 TRP A 46 -2.025 0.777 -3.163 1.00 0.00 C ATOM 678 CH2 TRP A 46 -3.055 1.631 -3.540 1.00 0.00 C ATOM 0 H TRP A 46 3.502 -0.961 -5.920 1.00 0.00 H new ATOM 0 HA TRP A 46 2.677 1.646 -6.766 1.00 0.00 H new ATOM 0 HB2 TRP A 46 1.428 -0.312 -7.331 1.00 0.00 H new ATOM 0 HB3 TRP A 46 1.189 -0.712 -5.641 1.00 0.00 H new ATOM 0 HD1 TRP A 46 0.005 1.881 -8.253 1.00 0.00 H new ATOM 0 HE1 TRP A 46 -2.218 2.969 -7.483 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -0.147 -0.223 -3.644 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 -3.817 2.893 -5.136 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -2.073 0.338 -2.178 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -3.867 1.836 -2.858 1.00 0.00 H new ATOM 689 N LEU A 47 2.809 0.942 -3.576 1.00 0.00 N ATOM 690 CA LEU A 47 2.747 1.513 -2.242 1.00 0.00 C ATOM 691 C LEU A 47 3.734 2.679 -2.144 1.00 0.00 C ATOM 692 O LEU A 47 3.349 3.795 -1.799 1.00 0.00 O ATOM 693 CB LEU A 47 2.969 0.430 -1.184 1.00 0.00 C ATOM 694 CG LEU A 47 1.886 -0.647 -1.090 1.00 0.00 C ATOM 695 CD1 LEU A 47 2.436 -1.922 -0.448 1.00 0.00 C ATOM 696 CD2 LEU A 47 0.653 -0.121 -0.354 1.00 0.00 C ATOM 0 H LEU A 47 3.155 -0.017 -3.614 1.00 0.00 H new ATOM 0 HA LEU A 47 1.754 1.918 -2.047 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.922 -0.058 -1.387 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.059 0.913 -0.211 1.00 0.00 H new ATOM 0 HG LEU A 47 1.572 -0.905 -2.101 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.646 -2.671 -0.393 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.260 -2.306 -1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.794 -1.698 0.557 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.101 -0.906 -0.301 1.00 0.00 H new ATOM 0 HD22 LEU A 47 0.933 0.182 0.655 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.247 0.737 -0.891 1.00 0.00 H new ATOM 708 N VAL A 48 4.987 2.380 -2.454 1.00 0.00 N ATOM 709 CA VAL A 48 6.031 3.389 -2.406 1.00 0.00 C ATOM 710 C VAL A 48 5.769 4.439 -3.487 1.00 0.00 C ATOM 711 O VAL A 48 5.932 5.635 -3.248 1.00 0.00 O ATOM 712 CB VAL A 48 7.404 2.727 -2.536 1.00 0.00 C ATOM 713 CG1 VAL A 48 8.507 3.777 -2.689 1.00 0.00 C ATOM 714 CG2 VAL A 48 7.684 1.807 -1.346 1.00 0.00 C ATOM 0 H VAL A 48 5.303 1.453 -2.739 1.00 0.00 H new ATOM 0 HA VAL A 48 6.022 3.903 -1.445 1.00 0.00 H new ATOM 0 HB VAL A 48 7.397 2.115 -3.438 1.00 0.00 H new ATOM 0 HG11 VAL A 48 9.473 3.280 -2.779 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.321 4.373 -3.582 1.00 0.00 H new ATOM 0 HG13 VAL A 48 8.514 4.427 -1.814 1.00 0.00 H new ATOM 0 HG21 VAL A 48 8.666 1.349 -1.463 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.662 2.388 -0.424 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.923 1.028 -1.302 1.00 0.00 H new ATOM 724 N SER A 49 5.367 3.955 -4.653 1.00 0.00 N ATOM 725 CA SER A 49 5.082 4.838 -5.772 1.00 0.00 C ATOM 726 C SER A 49 4.173 5.982 -5.316 1.00 0.00 C ATOM 727 O SER A 49 4.458 7.148 -5.582 1.00 0.00 O ATOM 728 CB SER A 49 4.432 4.072 -6.926 1.00 0.00 C ATOM 729 OG SER A 49 5.402 3.516 -7.810 1.00 0.00 O ATOM 0 H SER A 49 5.232 2.963 -4.847 1.00 0.00 H new ATOM 0 HA SER A 49 6.025 5.251 -6.131 1.00 0.00 H new ATOM 0 HB2 SER A 49 3.807 3.274 -6.525 1.00 0.00 H new ATOM 0 HB3 SER A 49 3.776 4.742 -7.482 1.00 0.00 H new ATOM 0 HG SER A 49 5.651 2.620 -7.500 1.00 0.00 H new ATOM 735 N ASN A 50 3.098 5.608 -4.639 1.00 0.00 N ATOM 736 CA ASN A 50 2.147 6.588 -4.144 1.00 0.00 C ATOM 737 C ASN A 50 2.658 7.168 -2.824 1.00 0.00 C ATOM 738 O ASN A 50 2.217 8.234 -2.398 1.00 0.00 O ATOM 739 CB ASN A 50 0.782 5.948 -3.882 1.00 0.00 C ATOM 740 CG ASN A 50 -0.138 6.101 -5.095 1.00 0.00 C ATOM 741 OD1 ASN A 50 -0.849 7.081 -5.247 1.00 0.00 O ATOM 742 ND2 ASN A 50 -0.084 5.082 -5.948 1.00 0.00 N ATOM 0 H ASN A 50 2.864 4.639 -4.421 1.00 0.00 H new ATOM 0 HA ASN A 50 2.042 7.366 -4.900 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.911 4.891 -3.650 1.00 0.00 H new ATOM 0 HB3 ASN A 50 0.320 6.412 -3.010 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.660 5.091 -6.790 1.00 0.00 H new ATOM 0 HD22 ASN A 50 0.533 4.292 -5.760 1.00 0.00 H new ATOM 749 N LYS A 51 3.581 6.439 -2.212 1.00 0.00 N ATOM 750 CA LYS A 51 4.157 6.868 -0.949 1.00 0.00 C ATOM 751 C LYS A 51 3.223 6.466 0.194 1.00 0.00 C ATOM 752 O LYS A 51 2.814 7.309 0.992 1.00 0.00 O ATOM 753 CB LYS A 51 4.476 8.364 -0.986 1.00 0.00 C ATOM 754 CG LYS A 51 5.180 8.743 -2.290 1.00 0.00 C ATOM 755 CD LYS A 51 6.700 8.657 -2.138 1.00 0.00 C ATOM 756 CE LYS A 51 7.360 8.237 -3.452 1.00 0.00 C ATOM 757 NZ LYS A 51 8.419 9.199 -3.832 1.00 0.00 N ATOM 0 H LYS A 51 3.944 5.554 -2.568 1.00 0.00 H new ATOM 0 HA LYS A 51 5.109 6.367 -0.774 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.555 8.938 -0.886 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.109 8.626 -0.138 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.853 8.079 -3.090 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.897 9.755 -2.580 1.00 0.00 H new ATOM 0 HD2 LYS A 51 7.093 9.624 -1.823 1.00 0.00 H new ATOM 0 HD3 LYS A 51 6.951 7.940 -1.356 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.787 7.239 -3.349 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.610 8.182 -4.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 8.856 8.898 -4.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 8.003 10.145 -3.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 9.143 9.231 -3.086 1.00 0.00 H new ATOM 771 N LEU A 52 2.913 5.179 0.238 1.00 0.00 N ATOM 772 CA LEU A 52 2.035 4.655 1.271 1.00 0.00 C ATOM 773 C LEU A 52 2.857 4.343 2.523 1.00 0.00 C ATOM 774 O LEU A 52 2.311 4.251 3.621 1.00 0.00 O ATOM 775 CB LEU A 52 1.240 3.459 0.743 1.00 0.00 C ATOM 776 CG LEU A 52 -0.096 3.785 0.072 1.00 0.00 C ATOM 777 CD1 LEU A 52 -0.802 2.509 -0.391 1.00 0.00 C ATOM 778 CD2 LEU A 52 -0.980 4.629 0.992 1.00 0.00 C ATOM 0 H LEU A 52 3.254 4.483 -0.425 1.00 0.00 H new ATOM 0 HA LEU A 52 1.293 5.401 1.554 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.862 2.922 0.027 1.00 0.00 H new ATOM 0 HB3 LEU A 52 1.050 2.779 1.573 1.00 0.00 H new ATOM 0 HG LEU A 52 0.104 4.382 -0.817 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.749 2.768 -0.864 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.170 1.983 -1.107 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.990 1.865 0.468 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.923 4.847 0.491 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.176 4.079 1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -0.471 5.563 1.229 1.00 0.00 H new ATOM 790 N VAL A 53 4.156 4.189 2.315 1.00 0.00 N ATOM 791 CA VAL A 53 5.059 3.889 3.414 1.00 0.00 C ATOM 792 C VAL A 53 6.298 4.780 3.307 1.00 0.00 C ATOM 793 O VAL A 53 6.355 5.672 2.462 1.00 0.00 O ATOM 794 CB VAL A 53 5.395 2.396 3.423 1.00 0.00 C ATOM 795 CG1 VAL A 53 4.263 1.584 4.055 1.00 0.00 C ATOM 796 CG2 VAL A 53 5.706 1.896 2.011 1.00 0.00 C ATOM 0 H VAL A 53 4.605 4.266 1.402 1.00 0.00 H new ATOM 0 HA VAL A 53 4.583 4.107 4.370 1.00 0.00 H new ATOM 0 HB VAL A 53 6.288 2.257 4.032 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.527 0.526 4.049 1.00 0.00 H new ATOM 0 HG12 VAL A 53 4.108 1.914 5.082 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.346 1.733 3.484 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.941 0.832 2.045 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.839 2.055 1.369 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.559 2.444 1.611 1.00 0.00 H new ATOM 806 N ARG A 54 7.261 4.506 4.176 1.00 0.00 N ATOM 807 CA ARG A 54 8.496 5.272 4.190 1.00 0.00 C ATOM 808 C ARG A 54 9.554 4.588 3.323 1.00 0.00 C ATOM 809 O ARG A 54 10.426 5.251 2.762 1.00 0.00 O ATOM 810 CB ARG A 54 9.033 5.423 5.615 1.00 0.00 C ATOM 811 CG ARG A 54 8.282 6.521 6.371 1.00 0.00 C ATOM 812 CD ARG A 54 8.905 7.893 6.107 1.00 0.00 C ATOM 813 NE ARG A 54 7.968 8.962 6.521 1.00 0.00 N ATOM 814 CZ ARG A 54 7.763 9.330 7.793 1.00 0.00 C ATOM 815 NH1 ARG A 54 8.426 8.718 8.783 1.00 0.00 N ATOM 816 NH2 ARG A 54 6.894 10.310 8.074 1.00 0.00 N ATOM 0 H ARG A 54 7.211 3.765 4.875 1.00 0.00 H new ATOM 0 HA ARG A 54 8.278 6.262 3.789 1.00 0.00 H new ATOM 0 HB2 ARG A 54 8.933 4.477 6.147 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.096 5.660 5.583 1.00 0.00 H new ATOM 0 HG2 ARG A 54 7.236 6.528 6.065 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.300 6.309 7.440 1.00 0.00 H new ATOM 0 HD2 ARG A 54 9.843 7.987 6.655 1.00 0.00 H new ATOM 0 HD3 ARG A 54 9.143 7.996 5.048 1.00 0.00 H new ATOM 0 HE ARG A 54 7.446 9.449 5.792 1.00 0.00 H new ATOM 0 HH11 ARG A 54 9.087 7.972 8.569 1.00 0.00 H new ATOM 0 HH12 ARG A 54 8.270 8.998 9.751 1.00 0.00 H new ATOM 0 HH21 ARG A 54 6.389 10.775 7.320 1.00 0.00 H new ATOM 0 HH22 ARG A 54 6.737 10.591 9.042 1.00 0.00 H new ATOM 830 N ASN A 55 9.444 3.270 3.239 1.00 0.00 N ATOM 831 CA ASN A 55 10.380 2.489 2.450 1.00 0.00 C ATOM 832 C ASN A 55 9.699 1.201 1.985 1.00 0.00 C ATOM 833 O ASN A 55 8.576 0.906 2.392 1.00 0.00 O ATOM 834 CB ASN A 55 11.609 2.103 3.275 1.00 0.00 C ATOM 835 CG ASN A 55 11.849 3.108 4.404 1.00 0.00 C ATOM 836 OD1 ASN A 55 12.715 3.965 4.333 1.00 0.00 O ATOM 837 ND2 ASN A 55 11.038 2.956 5.446 1.00 0.00 N ATOM 0 H ASN A 55 8.720 2.723 3.705 1.00 0.00 H new ATOM 0 HA ASN A 55 10.693 3.096 1.601 1.00 0.00 H new ATOM 0 HB2 ASN A 55 11.472 1.106 3.694 1.00 0.00 H new ATOM 0 HB3 ASN A 55 12.486 2.060 2.629 1.00 0.00 H new ATOM 0 HD21 ASN A 55 11.119 3.578 6.251 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.334 2.218 5.441 1.00 0.00 H new ATOM 844 N ARG A 56 10.406 0.467 1.138 1.00 0.00 N ATOM 845 CA ARG A 56 9.883 -0.783 0.613 1.00 0.00 C ATOM 846 C ARG A 56 9.605 -1.763 1.755 1.00 0.00 C ATOM 847 O ARG A 56 8.595 -2.464 1.744 1.00 0.00 O ATOM 848 CB ARG A 56 10.866 -1.422 -0.370 1.00 0.00 C ATOM 849 CG ARG A 56 10.335 -1.347 -1.803 1.00 0.00 C ATOM 850 CD ARG A 56 9.366 -2.496 -2.089 1.00 0.00 C ATOM 851 NE ARG A 56 10.092 -3.629 -2.706 1.00 0.00 N ATOM 852 CZ ARG A 56 10.316 -3.750 -4.022 1.00 0.00 C ATOM 853 NH1 ARG A 56 9.871 -2.809 -4.866 1.00 0.00 N ATOM 854 NH2 ARG A 56 10.984 -4.812 -4.493 1.00 0.00 N ATOM 0 H ARG A 56 11.337 0.714 0.802 1.00 0.00 H new ATOM 0 HA ARG A 56 8.955 -0.559 0.087 1.00 0.00 H new ATOM 0 HB2 ARG A 56 11.829 -0.915 -0.308 1.00 0.00 H new ATOM 0 HB3 ARG A 56 11.036 -2.463 -0.095 1.00 0.00 H new ATOM 0 HG2 ARG A 56 9.830 -0.394 -1.958 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.167 -1.385 -2.506 1.00 0.00 H new ATOM 0 HD2 ARG A 56 8.889 -2.820 -1.164 1.00 0.00 H new ATOM 0 HD3 ARG A 56 8.572 -2.156 -2.754 1.00 0.00 H new ATOM 0 HE ARG A 56 10.444 -4.363 -2.091 1.00 0.00 H new ATOM 0 HH11 ARG A 56 9.362 -2.001 -4.507 1.00 0.00 H new ATOM 0 HH12 ARG A 56 10.041 -2.901 -5.868 1.00 0.00 H new ATOM 0 HH21 ARG A 56 11.322 -5.528 -3.850 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.154 -4.904 -5.494 1.00 0.00 H new ATOM 868 N GLN A 57 10.520 -1.780 2.713 1.00 0.00 N ATOM 869 CA GLN A 57 10.386 -2.662 3.860 1.00 0.00 C ATOM 870 C GLN A 57 8.977 -2.559 4.448 1.00 0.00 C ATOM 871 O GLN A 57 8.217 -3.525 4.422 1.00 0.00 O ATOM 872 CB GLN A 57 11.446 -2.351 4.919 1.00 0.00 C ATOM 873 CG GLN A 57 11.881 -3.623 5.650 1.00 0.00 C ATOM 874 CD GLN A 57 10.804 -4.084 6.634 1.00 0.00 C ATOM 875 OE1 GLN A 57 10.066 -5.025 6.391 1.00 0.00 O ATOM 876 NE2 GLN A 57 10.756 -3.371 7.756 1.00 0.00 N ATOM 0 H GLN A 57 11.357 -1.197 2.719 1.00 0.00 H new ATOM 0 HA GLN A 57 10.545 -3.687 3.525 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.311 -1.885 4.447 1.00 0.00 H new ATOM 0 HB3 GLN A 57 11.049 -1.633 5.636 1.00 0.00 H new ATOM 0 HG2 GLN A 57 12.080 -4.413 4.926 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.813 -3.439 6.185 1.00 0.00 H new ATOM 0 HE21 GLN A 57 11.404 -2.595 7.896 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.072 -3.600 8.477 1.00 0.00 H new ATOM 885 N GLU A 58 8.672 -1.377 4.965 1.00 0.00 N ATOM 886 CA GLU A 58 7.368 -1.135 5.558 1.00 0.00 C ATOM 887 C GLU A 58 6.276 -1.833 4.745 1.00 0.00 C ATOM 888 O GLU A 58 5.426 -2.524 5.304 1.00 0.00 O ATOM 889 CB GLU A 58 7.089 0.365 5.675 1.00 0.00 C ATOM 890 CG GLU A 58 6.943 0.783 7.140 1.00 0.00 C ATOM 891 CD GLU A 58 6.340 2.185 7.252 1.00 0.00 C ATOM 892 OE1 GLU A 58 7.074 3.145 6.935 1.00 0.00 O ATOM 893 OE2 GLU A 58 5.158 2.264 7.653 1.00 0.00 O ATOM 0 H GLU A 58 9.305 -0.578 4.985 1.00 0.00 H new ATOM 0 HA GLU A 58 7.366 -1.552 6.565 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.900 0.927 5.212 1.00 0.00 H new ATOM 0 HB3 GLU A 58 6.178 0.613 5.130 1.00 0.00 H new ATOM 0 HG2 GLU A 58 6.310 0.068 7.665 1.00 0.00 H new ATOM 0 HG3 GLU A 58 7.918 0.762 7.627 1.00 0.00 H new ATOM 900 N GLY A 59 6.335 -1.629 3.437 1.00 0.00 N ATOM 901 CA GLY A 59 5.362 -2.230 2.541 1.00 0.00 C ATOM 902 C GLY A 59 5.361 -3.754 2.675 1.00 0.00 C ATOM 903 O GLY A 59 4.302 -4.377 2.722 1.00 0.00 O ATOM 0 H GLY A 59 7.042 -1.056 2.976 1.00 0.00 H new ATOM 0 HA2 GLY A 59 4.368 -1.841 2.764 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.590 -1.952 1.512 1.00 0.00 H new ATOM 907 N LEU A 60 6.562 -4.312 2.734 1.00 0.00 N ATOM 908 CA LEU A 60 6.714 -5.751 2.862 1.00 0.00 C ATOM 909 C LEU A 60 5.810 -6.256 3.989 1.00 0.00 C ATOM 910 O LEU A 60 5.110 -7.255 3.827 1.00 0.00 O ATOM 911 CB LEU A 60 8.187 -6.121 3.043 1.00 0.00 C ATOM 912 CG LEU A 60 8.535 -7.599 2.860 1.00 0.00 C ATOM 913 CD1 LEU A 60 8.703 -8.294 4.213 1.00 0.00 C ATOM 914 CD2 LEU A 60 7.500 -8.301 1.979 1.00 0.00 C ATOM 0 H LEU A 60 7.439 -3.793 2.695 1.00 0.00 H new ATOM 0 HA LEU A 60 6.395 -6.251 1.947 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.777 -5.539 2.335 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.497 -5.816 4.042 1.00 0.00 H new ATOM 0 HG LEU A 60 9.493 -7.663 2.344 1.00 0.00 H new ATOM 0 HD11 LEU A 60 8.950 -9.344 4.055 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.505 -7.813 4.772 1.00 0.00 H new ATOM 0 HD13 LEU A 60 7.773 -8.221 4.777 1.00 0.00 H new ATOM 0 HD21 LEU A 60 7.771 -9.351 1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.517 -8.229 2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.473 -7.825 0.999 1.00 0.00 H new ATOM 926 N MET A 61 5.855 -5.543 5.105 1.00 0.00 N ATOM 927 CA MET A 61 5.049 -5.907 6.258 1.00 0.00 C ATOM 928 C MET A 61 3.559 -5.711 5.969 1.00 0.00 C ATOM 929 O MET A 61 2.766 -6.638 6.124 1.00 0.00 O ATOM 930 CB MET A 61 5.455 -5.047 7.456 1.00 0.00 C ATOM 931 CG MET A 61 6.974 -5.034 7.632 1.00 0.00 C ATOM 932 SD MET A 61 7.395 -4.434 9.260 1.00 0.00 S ATOM 933 CE MET A 61 6.882 -2.731 9.104 1.00 0.00 C ATOM 0 H MET A 61 6.437 -4.715 5.235 1.00 0.00 H new ATOM 0 HA MET A 61 5.221 -6.960 6.481 1.00 0.00 H new ATOM 0 HB2 MET A 61 5.093 -4.028 7.316 1.00 0.00 H new ATOM 0 HB3 MET A 61 4.984 -5.432 8.361 1.00 0.00 H new ATOM 0 HG2 MET A 61 7.373 -6.038 7.491 1.00 0.00 H new ATOM 0 HG3 MET A 61 7.431 -4.400 6.872 1.00 0.00 H new ATOM 0 HE1 MET A 61 7.761 -2.088 9.070 1.00 0.00 H new ATOM 0 HE2 MET A 61 6.306 -2.607 8.187 1.00 0.00 H new ATOM 0 HE3 MET A 61 6.265 -2.457 9.960 1.00 0.00 H new ATOM 943 N ILE A 62 3.224 -4.498 5.555 1.00 0.00 N ATOM 944 CA ILE A 62 1.844 -4.168 5.244 1.00 0.00 C ATOM 945 C ILE A 62 1.302 -5.172 4.224 1.00 0.00 C ATOM 946 O ILE A 62 0.247 -5.769 4.436 1.00 0.00 O ATOM 947 CB ILE A 62 1.729 -2.711 4.792 1.00 0.00 C ATOM 948 CG1 ILE A 62 2.267 -1.761 5.865 1.00 0.00 C ATOM 949 CG2 ILE A 62 0.292 -2.371 4.394 1.00 0.00 C ATOM 950 CD1 ILE A 62 1.330 -1.712 7.073 1.00 0.00 C ATOM 0 H ILE A 62 3.885 -3.732 5.428 1.00 0.00 H new ATOM 0 HA ILE A 62 1.223 -4.251 6.136 1.00 0.00 H new ATOM 0 HB ILE A 62 2.348 -2.579 3.904 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.258 -2.088 6.182 1.00 0.00 H new ATOM 0 HG13 ILE A 62 2.380 -0.761 5.447 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.239 -1.329 4.077 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.021 -3.017 3.573 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.368 -2.524 5.248 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.735 -1.030 7.820 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.347 -1.362 6.757 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.239 -2.709 7.503 1.00 0.00 H new ATOM 962 N SER A 63 2.048 -5.327 3.140 1.00 0.00 N ATOM 963 CA SER A 63 1.655 -6.248 2.087 1.00 0.00 C ATOM 964 C SER A 63 1.075 -7.525 2.699 1.00 0.00 C ATOM 965 O SER A 63 -0.002 -7.972 2.305 1.00 0.00 O ATOM 966 CB SER A 63 2.840 -6.585 1.180 1.00 0.00 C ATOM 967 OG SER A 63 3.130 -5.531 0.266 1.00 0.00 O ATOM 0 H SER A 63 2.922 -4.830 2.968 1.00 0.00 H new ATOM 0 HA SER A 63 0.891 -5.765 1.477 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.719 -6.786 1.792 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.623 -7.497 0.624 1.00 0.00 H new ATOM 0 HG SER A 63 3.512 -5.906 -0.555 1.00 0.00 H new ATOM 973 N ALA A 64 1.813 -8.076 3.650 1.00 0.00 N ATOM 974 CA ALA A 64 1.385 -9.293 4.320 1.00 0.00 C ATOM 975 C ALA A 64 -0.047 -9.114 4.827 1.00 0.00 C ATOM 976 O ALA A 64 -0.915 -9.940 4.550 1.00 0.00 O ATOM 977 CB ALA A 64 2.365 -9.627 5.447 1.00 0.00 C ATOM 0 H ALA A 64 2.705 -7.703 3.973 1.00 0.00 H new ATOM 0 HA ALA A 64 1.387 -10.134 3.626 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.044 -10.540 5.950 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.362 -9.773 5.031 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.388 -8.807 6.164 1.00 0.00 H new ATOM 983 N SER A 65 -0.250 -8.030 5.561 1.00 0.00 N ATOM 984 CA SER A 65 -1.562 -7.732 6.109 1.00 0.00 C ATOM 985 C SER A 65 -2.617 -7.787 5.002 1.00 0.00 C ATOM 986 O SER A 65 -3.718 -8.292 5.214 1.00 0.00 O ATOM 987 CB SER A 65 -1.577 -6.361 6.788 1.00 0.00 C ATOM 988 OG SER A 65 -2.424 -6.342 7.934 1.00 0.00 O ATOM 0 H SER A 65 0.473 -7.347 5.789 1.00 0.00 H new ATOM 0 HA SER A 65 -1.796 -8.484 6.863 1.00 0.00 H new ATOM 0 HB2 SER A 65 -0.563 -6.091 7.082 1.00 0.00 H new ATOM 0 HB3 SER A 65 -1.913 -5.607 6.076 1.00 0.00 H new ATOM 0 HG SER A 65 -2.405 -5.450 8.340 1.00 0.00 H new ATOM 994 N LEU A 66 -2.242 -7.261 3.845 1.00 0.00 N ATOM 995 CA LEU A 66 -3.142 -7.245 2.704 1.00 0.00 C ATOM 996 C LEU A 66 -3.440 -8.682 2.274 1.00 0.00 C ATOM 997 O LEU A 66 -4.599 -9.089 2.216 1.00 0.00 O ATOM 998 CB LEU A 66 -2.570 -6.373 1.584 1.00 0.00 C ATOM 999 CG LEU A 66 -2.672 -4.861 1.792 1.00 0.00 C ATOM 1000 CD1 LEU A 66 -1.665 -4.117 0.912 1.00 0.00 C ATOM 1001 CD2 LEU A 66 -4.104 -4.371 1.564 1.00 0.00 C ATOM 0 H LEU A 66 -1.328 -6.843 3.673 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.095 -6.790 2.976 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.519 -6.631 1.450 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.081 -6.627 0.656 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.418 -4.641 2.829 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.759 -3.044 1.079 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.654 -4.437 1.165 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.864 -4.339 -0.136 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.149 -3.293 1.718 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.411 -4.605 0.544 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -4.774 -4.866 2.267 1.00 0.00 H new ATOM 1013 N LEU A 67 -2.373 -9.412 1.983 1.00 0.00 N ATOM 1014 CA LEU A 67 -2.505 -10.796 1.560 1.00 0.00 C ATOM 1015 C LEU A 67 -3.279 -11.578 2.623 1.00 0.00 C ATOM 1016 O LEU A 67 -4.308 -12.184 2.326 1.00 0.00 O ATOM 1017 CB LEU A 67 -1.133 -11.391 1.236 1.00 0.00 C ATOM 1018 CG LEU A 67 -1.079 -12.913 1.094 1.00 0.00 C ATOM 1019 CD1 LEU A 67 -1.039 -13.326 -0.379 1.00 0.00 C ATOM 1020 CD2 LEU A 67 0.094 -13.496 1.884 1.00 0.00 C ATOM 0 H LEU A 67 -1.413 -9.071 2.032 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.080 -10.859 0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.776 -10.946 0.307 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.436 -11.094 2.020 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.993 -13.328 1.520 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.001 -14.413 -0.451 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.933 -12.960 -0.884 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.155 -12.900 -0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.109 -14.579 1.766 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.028 -13.077 1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.019 -13.248 2.939 1.00 0.00 H new ATOM 1032 N SER A 68 -2.755 -11.539 3.839 1.00 0.00 N ATOM 1033 CA SER A 68 -3.384 -12.236 4.948 1.00 0.00 C ATOM 1034 C SER A 68 -4.907 -12.146 4.826 1.00 0.00 C ATOM 1035 O SER A 68 -5.572 -13.146 4.558 1.00 0.00 O ATOM 1036 CB SER A 68 -2.924 -11.665 6.290 1.00 0.00 C ATOM 1037 OG SER A 68 -2.449 -12.681 7.169 1.00 0.00 O ATOM 0 H SER A 68 -1.902 -11.035 4.081 1.00 0.00 H new ATOM 0 HA SER A 68 -3.084 -13.283 4.908 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.134 -10.934 6.121 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.752 -11.136 6.762 1.00 0.00 H new ATOM 0 HG SER A 68 -2.163 -12.275 8.014 1.00 0.00 H new ATOM 1043 N GLU A 69 -5.414 -10.940 5.030 1.00 0.00 N ATOM 1044 CA GLU A 69 -6.846 -10.706 4.947 1.00 0.00 C ATOM 1045 C GLU A 69 -7.447 -11.502 3.787 1.00 0.00 C ATOM 1046 O GLU A 69 -8.541 -12.052 3.907 1.00 0.00 O ATOM 1047 CB GLU A 69 -7.151 -9.214 4.804 1.00 0.00 C ATOM 1048 CG GLU A 69 -6.900 -8.474 6.120 1.00 0.00 C ATOM 1049 CD GLU A 69 -7.861 -8.953 7.210 1.00 0.00 C ATOM 1050 OE1 GLU A 69 -9.030 -9.219 6.858 1.00 0.00 O ATOM 1051 OE2 GLU A 69 -7.404 -9.041 8.370 1.00 0.00 O ATOM 0 H GLU A 69 -4.859 -10.114 5.253 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.305 -11.049 5.874 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.529 -8.786 4.018 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.189 -9.079 4.499 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.871 -8.635 6.441 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.023 -7.402 5.968 1.00 0.00 H new ATOM 1058 N GLY A 70 -6.706 -11.538 2.689 1.00 0.00 N ATOM 1059 CA GLY A 70 -7.152 -12.258 1.508 1.00 0.00 C ATOM 1060 C GLY A 70 -7.390 -11.299 0.339 1.00 0.00 C ATOM 1061 O GLY A 70 -8.028 -11.663 -0.647 1.00 0.00 O ATOM 0 H GLY A 70 -5.800 -11.080 2.592 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -6.406 -13.001 1.227 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.071 -12.799 1.733 1.00 0.00 H new ATOM 1065 N TYR A 71 -6.863 -10.093 0.488 1.00 0.00 N ATOM 1066 CA TYR A 71 -7.009 -9.079 -0.542 1.00 0.00 C ATOM 1067 C TYR A 71 -6.140 -9.404 -1.759 1.00 0.00 C ATOM 1068 O TYR A 71 -6.339 -8.845 -2.836 1.00 0.00 O ATOM 1069 CB TYR A 71 -6.523 -7.770 0.082 1.00 0.00 C ATOM 1070 CG TYR A 71 -7.498 -7.163 1.093 1.00 0.00 C ATOM 1071 CD1 TYR A 71 -8.818 -6.962 0.745 1.00 0.00 C ATOM 1072 CD2 TYR A 71 -7.056 -6.818 2.355 1.00 0.00 C ATOM 1073 CE1 TYR A 71 -9.735 -6.391 1.697 1.00 0.00 C ATOM 1074 CE2 TYR A 71 -7.974 -6.247 3.307 1.00 0.00 C ATOM 1075 CZ TYR A 71 -9.267 -6.062 2.931 1.00 0.00 C ATOM 1076 OH TYR A 71 -10.133 -5.523 3.831 1.00 0.00 O ATOM 0 H TYR A 71 -6.334 -9.795 1.307 1.00 0.00 H new ATOM 0 HA TYR A 71 -8.044 -9.022 -0.880 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -5.568 -7.947 0.576 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -6.342 -7.046 -0.712 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -9.163 -7.233 -0.242 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -6.023 -6.976 2.628 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -10.770 -6.228 1.437 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -7.642 -5.972 4.297 1.00 0.00 H new ATOM 0 HH TYR A 71 -11.051 -5.623 3.502 1.00 0.00 H new ATOM 1086 N LEU A 72 -5.194 -10.308 -1.545 1.00 0.00 N ATOM 1087 CA LEU A 72 -4.293 -10.714 -2.611 1.00 0.00 C ATOM 1088 C LEU A 72 -4.155 -12.237 -2.603 1.00 0.00 C ATOM 1089 O LEU A 72 -3.759 -12.823 -1.596 1.00 0.00 O ATOM 1090 CB LEU A 72 -2.958 -9.975 -2.495 1.00 0.00 C ATOM 1091 CG LEU A 72 -3.038 -8.447 -2.456 1.00 0.00 C ATOM 1092 CD1 LEU A 72 -1.776 -7.848 -1.833 1.00 0.00 C ATOM 1093 CD2 LEU A 72 -3.316 -7.878 -3.849 1.00 0.00 C ATOM 0 H LEU A 72 -5.032 -10.770 -0.650 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.702 -10.435 -3.582 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.454 -10.316 -1.591 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.331 -10.265 -3.338 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.876 -8.164 -1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.859 -6.761 -1.817 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.662 -8.218 -0.814 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.906 -8.137 -2.423 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -3.368 -6.791 -3.794 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.514 -8.169 -4.528 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -4.264 -8.268 -4.219 1.00 0.00 H new ATOM 1105 N GLN A 73 -4.489 -12.836 -3.737 1.00 0.00 N ATOM 1106 CA GLN A 73 -4.408 -14.280 -3.873 1.00 0.00 C ATOM 1107 C GLN A 73 -3.104 -14.675 -4.570 1.00 0.00 C ATOM 1108 O GLN A 73 -2.702 -14.043 -5.546 1.00 0.00 O ATOM 1109 CB GLN A 73 -5.621 -14.829 -4.627 1.00 0.00 C ATOM 1110 CG GLN A 73 -6.906 -14.620 -3.824 1.00 0.00 C ATOM 1111 CD GLN A 73 -7.089 -15.728 -2.784 1.00 0.00 C ATOM 1112 OE1 GLN A 73 -7.708 -16.750 -3.030 1.00 0.00 O ATOM 1113 NE2 GLN A 73 -6.517 -15.468 -1.612 1.00 0.00 N ATOM 0 H GLN A 73 -4.816 -12.347 -4.570 1.00 0.00 H new ATOM 0 HA GLN A 73 -4.412 -14.720 -2.876 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.707 -14.333 -5.594 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.480 -15.892 -4.825 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -6.875 -13.651 -3.326 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.762 -14.604 -4.498 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.013 -14.592 -1.473 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -6.582 -16.145 -0.852 1.00 0.00 H new ATOM 1122 N PRO A 74 -2.464 -15.745 -4.028 1.00 0.00 N ATOM 1123 CA PRO A 74 -1.214 -16.231 -4.587 1.00 0.00 C ATOM 1124 C PRO A 74 -1.457 -16.993 -5.892 1.00 0.00 C ATOM 1125 O PRO A 74 -2.472 -17.673 -6.038 1.00 0.00 O ATOM 1126 CB PRO A 74 -0.606 -17.098 -3.497 1.00 0.00 C ATOM 1127 CG PRO A 74 -1.747 -17.441 -2.553 1.00 0.00 C ATOM 1128 CD PRO A 74 -2.911 -16.517 -2.873 1.00 0.00 C ATOM 0 HA PRO A 74 -0.534 -15.425 -4.861 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -0.162 -18.000 -3.918 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.188 -16.567 -2.973 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.042 -18.483 -2.674 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -1.435 -17.317 -1.516 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -3.815 -17.083 -3.100 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.145 -15.868 -2.029 1.00 0.00 H new ATOM 1136 N ALA A 75 -0.508 -16.855 -6.806 1.00 0.00 N ATOM 1137 CA ALA A 75 -0.606 -17.522 -8.093 1.00 0.00 C ATOM 1138 C ALA A 75 0.800 -17.840 -8.606 1.00 0.00 C ATOM 1139 O ALA A 75 1.578 -16.934 -8.899 1.00 0.00 O ATOM 1140 CB ALA A 75 -1.396 -16.643 -9.065 1.00 0.00 C ATOM 0 H ALA A 75 0.333 -16.291 -6.681 1.00 0.00 H new ATOM 0 HA ALA A 75 -1.143 -18.466 -7.996 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -1.470 -17.143 -10.031 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -2.397 -16.471 -8.669 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.885 -15.688 -9.189 1.00 0.00 H new ATOM 1146 N GLY A 76 1.083 -19.132 -8.699 1.00 0.00 N ATOM 1147 CA GLY A 76 2.381 -19.581 -9.171 1.00 0.00 C ATOM 1148 C GLY A 76 3.089 -20.425 -8.110 1.00 0.00 C ATOM 1149 O GLY A 76 2.893 -21.638 -8.044 1.00 0.00 O ATOM 0 H GLY A 76 0.435 -19.881 -8.455 1.00 0.00 H new ATOM 0 HA2 GLY A 76 2.258 -20.165 -10.083 1.00 0.00 H new ATOM 0 HA3 GLY A 76 2.997 -18.719 -9.426 1.00 0.00 H new ATOM 1153 N ASP A 77 3.897 -19.751 -7.305 1.00 0.00 N ATOM 1154 CA ASP A 77 4.635 -20.424 -6.250 1.00 0.00 C ATOM 1155 C ASP A 77 5.182 -19.383 -5.272 1.00 0.00 C ATOM 1156 O ASP A 77 4.857 -18.201 -5.372 1.00 0.00 O ATOM 1157 CB ASP A 77 5.820 -21.207 -6.819 1.00 0.00 C ATOM 1158 CG ASP A 77 5.657 -22.728 -6.806 1.00 0.00 C ATOM 1159 OD1 ASP A 77 5.592 -23.282 -5.687 1.00 0.00 O ATOM 1160 OD2 ASP A 77 5.602 -23.302 -7.915 1.00 0.00 O ATOM 0 H ASP A 77 4.057 -18.745 -7.362 1.00 0.00 H new ATOM 0 HA ASP A 77 3.955 -21.113 -5.750 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.990 -20.884 -7.846 1.00 0.00 H new ATOM 0 HB3 ASP A 77 6.714 -20.948 -6.251 1.00 0.00 H new ATOM 1165 N LEU A 78 6.004 -19.860 -4.348 1.00 0.00 N ATOM 1166 CA LEU A 78 6.599 -18.984 -3.353 1.00 0.00 C ATOM 1167 C LEU A 78 5.499 -18.420 -2.453 1.00 0.00 C ATOM 1168 O LEU A 78 5.323 -18.872 -1.323 1.00 0.00 O ATOM 1169 CB LEU A 78 7.454 -17.910 -4.027 1.00 0.00 C ATOM 1170 CG LEU A 78 8.855 -18.343 -4.465 1.00 0.00 C ATOM 1171 CD1 LEU A 78 8.785 -19.526 -5.433 1.00 0.00 C ATOM 1172 CD2 LEU A 78 9.634 -17.166 -5.054 1.00 0.00 C ATOM 0 H LEU A 78 6.272 -20.841 -4.268 1.00 0.00 H new ATOM 0 HA LEU A 78 7.280 -19.544 -2.711 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.918 -17.544 -4.903 1.00 0.00 H new ATOM 0 HB3 LEU A 78 7.553 -17.069 -3.340 1.00 0.00 H new ATOM 0 HG LEU A 78 9.400 -18.680 -3.583 1.00 0.00 H new ATOM 0 HD11 LEU A 78 9.794 -19.814 -5.729 1.00 0.00 H new ATOM 0 HD12 LEU A 78 8.296 -20.368 -4.944 1.00 0.00 H new ATOM 0 HD13 LEU A 78 8.215 -19.240 -6.317 1.00 0.00 H new ATOM 0 HD21 LEU A 78 10.626 -17.501 -5.357 1.00 0.00 H new ATOM 0 HD22 LEU A 78 9.102 -16.775 -5.922 1.00 0.00 H new ATOM 0 HD23 LEU A 78 9.730 -16.381 -4.304 1.00 0.00 H new ATOM 1184 N SER A 79 4.786 -17.439 -2.988 1.00 0.00 N ATOM 1185 CA SER A 79 3.707 -16.808 -2.247 1.00 0.00 C ATOM 1186 C SER A 79 2.842 -17.874 -1.572 1.00 0.00 C ATOM 1187 O SER A 79 2.535 -17.769 -0.385 1.00 0.00 O ATOM 1188 CB SER A 79 2.851 -15.930 -3.162 1.00 0.00 C ATOM 1189 OG SER A 79 2.268 -16.678 -4.226 1.00 0.00 O ATOM 0 H SER A 79 4.935 -17.066 -3.926 1.00 0.00 H new ATOM 0 HA SER A 79 4.146 -16.168 -1.481 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.062 -15.457 -2.577 1.00 0.00 H new ATOM 0 HB3 SER A 79 3.465 -15.130 -3.575 1.00 0.00 H new ATOM 0 HG SER A 79 2.974 -17.127 -4.736 1.00 0.00 H new ATOM 1195 N LYS A 80 2.474 -18.875 -2.357 1.00 0.00 N ATOM 1196 CA LYS A 80 1.650 -19.960 -1.850 1.00 0.00 C ATOM 1197 C LYS A 80 2.419 -20.713 -0.763 1.00 0.00 C ATOM 1198 O LYS A 80 1.966 -20.799 0.377 1.00 0.00 O ATOM 1199 CB LYS A 80 1.173 -20.852 -2.998 1.00 0.00 C ATOM 1200 CG LYS A 80 -0.336 -21.089 -2.918 1.00 0.00 C ATOM 1201 CD LYS A 80 -0.768 -22.201 -3.875 1.00 0.00 C ATOM 1202 CE LYS A 80 -1.669 -21.652 -4.983 1.00 0.00 C ATOM 1203 NZ LYS A 80 -2.593 -22.701 -5.468 1.00 0.00 N ATOM 0 H LYS A 80 2.731 -18.958 -3.341 1.00 0.00 H new ATOM 0 HA LYS A 80 0.745 -19.567 -1.386 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.422 -20.387 -3.952 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.697 -21.807 -2.963 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.612 -21.355 -1.898 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.866 -20.168 -3.162 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.112 -22.669 -4.316 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.298 -22.976 -3.322 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.239 -20.802 -4.608 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.058 -21.287 -5.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.197 -22.311 -6.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -2.044 -23.500 -5.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -3.188 -23.030 -4.681 1.00 0.00 H new ATOM 1217 N ASN A 81 3.569 -21.241 -1.155 1.00 0.00 N ATOM 1218 CA ASN A 81 4.406 -21.985 -0.229 1.00 0.00 C ATOM 1219 C ASN A 81 4.577 -21.176 1.059 1.00 0.00 C ATOM 1220 O ASN A 81 4.666 -21.745 2.146 1.00 0.00 O ATOM 1221 CB ASN A 81 5.795 -22.234 -0.819 1.00 0.00 C ATOM 1222 CG ASN A 81 5.824 -23.537 -1.621 1.00 0.00 C ATOM 1223 OD1 ASN A 81 5.884 -24.628 -1.080 1.00 0.00 O ATOM 1224 ND2 ASN A 81 5.779 -23.361 -2.939 1.00 0.00 N ATOM 0 H ASN A 81 3.941 -21.168 -2.102 1.00 0.00 H new ATOM 0 HA ASN A 81 3.922 -22.942 -0.031 1.00 0.00 H new ATOM 0 HB2 ASN A 81 6.076 -21.400 -1.463 1.00 0.00 H new ATOM 0 HB3 ASN A 81 6.532 -22.280 -0.017 1.00 0.00 H new ATOM 0 HD21 ASN A 81 5.794 -24.168 -3.562 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.729 -22.419 -3.326 1.00 0.00 H new ATOM 1231 N ALA A 82 4.618 -19.862 0.893 1.00 0.00 N ATOM 1232 CA ALA A 82 4.777 -18.970 2.029 1.00 0.00 C ATOM 1233 C ALA A 82 3.502 -18.994 2.874 1.00 0.00 C ATOM 1234 O ALA A 82 3.543 -19.331 4.056 1.00 0.00 O ATOM 1235 CB ALA A 82 5.120 -17.565 1.530 1.00 0.00 C ATOM 0 H ALA A 82 4.544 -19.394 -0.010 1.00 0.00 H new ATOM 0 HA ALA A 82 5.599 -19.300 2.664 1.00 0.00 H new ATOM 0 HB1 ALA A 82 5.239 -16.895 2.382 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.049 -17.598 0.961 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.316 -17.199 0.891 1.00 0.00 H new ATOM 1241 N ALA A 83 2.400 -18.633 2.234 1.00 0.00 N ATOM 1242 CA ALA A 83 1.115 -18.609 2.912 1.00 0.00 C ATOM 1243 C ALA A 83 0.906 -19.935 3.646 1.00 0.00 C ATOM 1244 O ALA A 83 0.167 -19.996 4.628 1.00 0.00 O ATOM 1245 CB ALA A 83 0.007 -18.324 1.897 1.00 0.00 C ATOM 0 H ALA A 83 2.370 -18.355 1.253 1.00 0.00 H new ATOM 0 HA ALA A 83 1.088 -17.812 3.656 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.957 -18.306 2.406 1.00 0.00 H new ATOM 0 HB2 ALA A 83 0.186 -17.358 1.425 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.001 -19.104 1.136 1.00 0.00 H new ATOM 1251 N ASP A 84 1.569 -20.965 3.142 1.00 0.00 N ATOM 1252 CA ASP A 84 1.465 -22.286 3.737 1.00 0.00 C ATOM 1253 C ASP A 84 1.842 -22.205 5.218 1.00 0.00 C ATOM 1254 O ASP A 84 1.015 -22.471 6.088 1.00 0.00 O ATOM 1255 CB ASP A 84 2.419 -23.272 3.060 1.00 0.00 C ATOM 1256 CG ASP A 84 1.878 -24.696 2.909 1.00 0.00 C ATOM 1257 OD1 ASP A 84 0.642 -24.821 2.770 1.00 0.00 O ATOM 1258 OD2 ASP A 84 2.712 -25.626 2.937 1.00 0.00 O ATOM 0 H ASP A 84 2.181 -20.911 2.328 1.00 0.00 H new ATOM 0 HA ASP A 84 0.439 -22.632 3.611 1.00 0.00 H new ATOM 0 HB2 ASP A 84 2.672 -22.889 2.071 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.345 -23.310 3.634 1.00 0.00 H new ATOM 1263 N GLY A 85 3.092 -21.836 5.458 1.00 0.00 N ATOM 1264 CA GLY A 85 3.589 -21.716 6.818 1.00 0.00 C ATOM 1265 C GLY A 85 5.114 -21.603 6.836 1.00 0.00 C ATOM 1266 O GLY A 85 5.785 -22.326 7.571 1.00 0.00 O ATOM 0 H GLY A 85 3.775 -21.616 4.733 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.150 -20.839 7.293 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.278 -22.583 7.401 1.00 0.00 H new ATOM 1270 N ILE A 86 5.618 -20.690 6.019 1.00 0.00 N ATOM 1271 CA ILE A 86 7.052 -20.473 5.932 1.00 0.00 C ATOM 1272 C ILE A 86 7.555 -19.880 7.250 1.00 0.00 C ATOM 1273 O ILE A 86 8.168 -20.579 8.055 1.00 0.00 O ATOM 1274 CB ILE A 86 7.392 -19.623 4.706 1.00 0.00 C ATOM 1275 CG1 ILE A 86 7.548 -20.496 3.460 1.00 0.00 C ATOM 1276 CG2 ILE A 86 8.631 -18.762 4.963 1.00 0.00 C ATOM 1277 CD1 ILE A 86 8.778 -21.399 3.573 1.00 0.00 C ATOM 0 H ILE A 86 5.059 -20.092 5.411 1.00 0.00 H new ATOM 0 HA ILE A 86 7.572 -21.420 5.789 1.00 0.00 H new ATOM 0 HB ILE A 86 6.561 -18.943 4.520 1.00 0.00 H new ATOM 0 HG12 ILE A 86 6.655 -21.107 3.326 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.637 -19.863 2.577 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.851 -18.168 4.076 1.00 0.00 H new ATOM 0 HG22 ILE A 86 8.444 -18.099 5.807 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.481 -19.406 5.189 1.00 0.00 H new ATOM 0 HD11 ILE A 86 8.865 -22.009 2.674 1.00 0.00 H new ATOM 0 HD12 ILE A 86 9.672 -20.785 3.683 1.00 0.00 H new ATOM 0 HD13 ILE A 86 8.675 -22.048 4.443 1.00 0.00 H new ATOM 1289 N ALA A 87 7.275 -18.598 7.430 1.00 0.00 N ATOM 1290 CA ALA A 87 7.691 -17.903 8.637 1.00 0.00 C ATOM 1291 C ALA A 87 6.548 -17.013 9.128 1.00 0.00 C ATOM 1292 O ALA A 87 5.378 -17.368 8.992 1.00 0.00 O ATOM 1293 CB ALA A 87 8.968 -17.109 8.355 1.00 0.00 C ATOM 0 H ALA A 87 6.765 -18.022 6.760 1.00 0.00 H new ATOM 0 HA ALA A 87 7.918 -18.615 9.430 1.00 0.00 H new ATOM 0 HB1 ALA A 87 9.280 -16.588 9.260 1.00 0.00 H new ATOM 0 HB2 ALA A 87 9.758 -17.790 8.038 1.00 0.00 H new ATOM 0 HB3 ALA A 87 8.778 -16.382 7.565 1.00 0.00 H new ATOM 1299 N GLU A 88 6.926 -15.873 9.687 1.00 0.00 N ATOM 1300 CA GLU A 88 5.947 -14.930 10.199 1.00 0.00 C ATOM 1301 C GLU A 88 5.576 -13.911 9.119 1.00 0.00 C ATOM 1302 O GLU A 88 4.886 -12.931 9.395 1.00 0.00 O ATOM 1303 CB GLU A 88 6.464 -14.231 11.457 1.00 0.00 C ATOM 1304 CG GLU A 88 5.434 -14.300 12.586 1.00 0.00 C ATOM 1305 CD GLU A 88 5.589 -13.116 13.544 1.00 0.00 C ATOM 1306 OE1 GLU A 88 5.369 -11.977 13.079 1.00 0.00 O ATOM 1307 OE2 GLU A 88 5.925 -13.378 14.719 1.00 0.00 O ATOM 0 H GLU A 88 7.897 -15.581 9.797 1.00 0.00 H new ATOM 0 HA GLU A 88 5.049 -15.483 10.474 1.00 0.00 H new ATOM 0 HB2 GLU A 88 7.395 -14.698 11.780 1.00 0.00 H new ATOM 0 HB3 GLU A 88 6.692 -13.189 11.231 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.428 -14.303 12.166 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.553 -15.234 13.135 1.00 0.00 H new ATOM 1314 N ASN A 89 6.052 -14.177 7.911 1.00 0.00 N ATOM 1315 CA ASN A 89 5.780 -13.296 6.789 1.00 0.00 C ATOM 1316 C ASN A 89 5.349 -14.132 5.582 1.00 0.00 C ATOM 1317 O ASN A 89 6.172 -14.802 4.960 1.00 0.00 O ATOM 1318 CB ASN A 89 7.029 -12.505 6.394 1.00 0.00 C ATOM 1319 CG ASN A 89 7.329 -11.408 7.417 1.00 0.00 C ATOM 1320 OD1 ASN A 89 7.787 -11.660 8.519 1.00 0.00 O ATOM 1321 ND2 ASN A 89 7.046 -10.180 6.992 1.00 0.00 N ATOM 0 H ASN A 89 6.624 -14.991 7.685 1.00 0.00 H new ATOM 0 HA ASN A 89 4.994 -12.603 7.088 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.882 -13.179 6.318 1.00 0.00 H new ATOM 0 HB3 ASN A 89 6.886 -12.060 5.409 1.00 0.00 H new ATOM 0 HD21 ASN A 89 7.211 -9.379 7.601 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.664 -10.039 6.057 1.00 0.00 H new ATOM 1328 N PRO A 90 4.024 -14.065 5.280 1.00 0.00 N ATOM 1329 CA PRO A 90 3.474 -14.808 4.159 1.00 0.00 C ATOM 1330 C PRO A 90 3.846 -14.150 2.829 1.00 0.00 C ATOM 1331 O PRO A 90 4.016 -14.833 1.820 1.00 0.00 O ATOM 1332 CB PRO A 90 1.975 -14.841 4.407 1.00 0.00 C ATOM 1333 CG PRO A 90 1.692 -13.726 5.401 1.00 0.00 C ATOM 1334 CD PRO A 90 3.020 -13.283 5.995 1.00 0.00 C ATOM 0 HA PRO A 90 3.875 -15.819 4.087 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.422 -14.687 3.480 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.666 -15.807 4.806 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.197 -12.890 4.906 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.020 -14.075 6.185 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.179 -12.213 5.857 1.00 0.00 H new ATOM 0 HD3 PRO A 90 3.058 -13.475 7.067 1.00 0.00 H new ATOM 1342 N PHE A 91 3.962 -12.831 2.871 1.00 0.00 N ATOM 1343 CA PHE A 91 4.311 -12.072 1.681 1.00 0.00 C ATOM 1344 C PHE A 91 5.810 -12.168 1.390 1.00 0.00 C ATOM 1345 O PHE A 91 6.610 -12.384 2.299 1.00 0.00 O ATOM 1346 CB PHE A 91 3.950 -10.612 1.960 1.00 0.00 C ATOM 1347 CG PHE A 91 3.519 -9.830 0.718 1.00 0.00 C ATOM 1348 CD1 PHE A 91 2.234 -9.908 0.277 1.00 0.00 C ATOM 1349 CD2 PHE A 91 4.419 -9.056 0.055 1.00 0.00 C ATOM 1350 CE1 PHE A 91 1.834 -9.182 -0.876 1.00 0.00 C ATOM 1351 CE2 PHE A 91 4.019 -8.330 -1.098 1.00 0.00 C ATOM 1352 CZ PHE A 91 2.735 -8.408 -1.539 1.00 0.00 C ATOM 0 H PHE A 91 3.821 -12.268 3.710 1.00 0.00 H new ATOM 0 HA PHE A 91 3.775 -12.466 0.818 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.145 -10.581 2.694 1.00 0.00 H new ATOM 0 HB3 PHE A 91 4.810 -10.115 2.409 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.519 -10.522 0.804 1.00 0.00 H new ATOM 0 HD2 PHE A 91 5.439 -8.993 0.405 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.814 -9.244 -1.227 1.00 0.00 H new ATOM 0 HE2 PHE A 91 4.735 -7.716 -1.625 1.00 0.00 H new ATOM 0 HZ PHE A 91 2.431 -7.855 -2.416 1.00 0.00 H new ATOM 1362 N LEU A 92 6.145 -12.003 0.119 1.00 0.00 N ATOM 1363 CA LEU A 92 7.534 -12.068 -0.303 1.00 0.00 C ATOM 1364 C LEU A 92 7.830 -10.902 -1.248 1.00 0.00 C ATOM 1365 O LEU A 92 7.299 -10.845 -2.356 1.00 0.00 O ATOM 1366 CB LEU A 92 7.848 -13.440 -0.903 1.00 0.00 C ATOM 1367 CG LEU A 92 7.702 -14.634 0.043 1.00 0.00 C ATOM 1368 CD1 LEU A 92 7.516 -15.935 -0.742 1.00 0.00 C ATOM 1369 CD2 LEU A 92 8.883 -14.713 1.012 1.00 0.00 C ATOM 0 H LEU A 92 5.479 -11.824 -0.632 1.00 0.00 H new ATOM 0 HA LEU A 92 8.198 -11.961 0.555 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.193 -13.598 -1.760 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.870 -13.424 -1.281 1.00 0.00 H new ATOM 0 HG LEU A 92 6.803 -14.488 0.642 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.415 -16.768 -0.047 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.619 -15.864 -1.357 1.00 0.00 H new ATOM 0 HD13 LEU A 92 8.382 -16.100 -1.383 1.00 0.00 H new ATOM 0 HD21 LEU A 92 8.755 -15.570 1.673 1.00 0.00 H new ATOM 0 HD22 LEU A 92 9.809 -14.825 0.448 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.928 -13.800 1.606 1.00 0.00 H new ATOM 1381 N ASP A 93 8.678 -10.000 -0.776 1.00 0.00 N ATOM 1382 CA ASP A 93 9.051 -8.838 -1.565 1.00 0.00 C ATOM 1383 C ASP A 93 9.992 -9.273 -2.691 1.00 0.00 C ATOM 1384 O ASP A 93 11.170 -8.918 -2.692 1.00 0.00 O ATOM 1385 CB ASP A 93 9.785 -7.803 -0.709 1.00 0.00 C ATOM 1386 CG ASP A 93 10.493 -6.699 -1.495 1.00 0.00 C ATOM 1387 OD1 ASP A 93 9.916 -6.271 -2.519 1.00 0.00 O ATOM 1388 OD2 ASP A 93 11.595 -6.306 -1.055 1.00 0.00 O ATOM 0 H ASP A 93 9.118 -10.050 0.143 1.00 0.00 H new ATOM 0 HA ASP A 93 8.139 -8.394 -1.964 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.068 -7.342 -0.029 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.521 -8.319 -0.093 1.00 0.00 H new ATOM 1393 N SER A 94 9.437 -10.034 -3.622 1.00 0.00 N ATOM 1394 CA SER A 94 10.211 -10.521 -4.751 1.00 0.00 C ATOM 1395 C SER A 94 9.426 -10.323 -6.048 1.00 0.00 C ATOM 1396 O SER A 94 8.198 -10.402 -6.054 1.00 0.00 O ATOM 1397 CB SER A 94 10.578 -11.995 -4.572 1.00 0.00 C ATOM 1398 OG SER A 94 11.834 -12.309 -5.168 1.00 0.00 O ATOM 0 H SER A 94 8.460 -10.326 -3.618 1.00 0.00 H new ATOM 0 HA SER A 94 11.137 -9.948 -4.804 1.00 0.00 H new ATOM 0 HB2 SER A 94 10.611 -12.234 -3.509 1.00 0.00 H new ATOM 0 HB3 SER A 94 9.801 -12.618 -5.014 1.00 0.00 H new ATOM 0 HG SER A 94 11.686 -12.789 -6.009 1.00 0.00 H new ATOM 1404 N PRO A 95 10.186 -10.061 -7.146 1.00 0.00 N ATOM 1405 CA PRO A 95 9.574 -9.851 -8.447 1.00 0.00 C ATOM 1406 C PRO A 95 9.098 -11.174 -9.049 1.00 0.00 C ATOM 1407 O PRO A 95 8.373 -11.183 -10.043 1.00 0.00 O ATOM 1408 CB PRO A 95 10.647 -9.171 -9.281 1.00 0.00 C ATOM 1409 CG PRO A 95 11.963 -9.444 -8.570 1.00 0.00 C ATOM 1410 CD PRO A 95 11.642 -9.959 -7.177 1.00 0.00 C ATOM 0 HA PRO A 95 8.677 -9.233 -8.395 1.00 0.00 H new ATOM 0 HB2 PRO A 95 10.662 -9.567 -10.296 1.00 0.00 H new ATOM 0 HB3 PRO A 95 10.460 -8.100 -9.360 1.00 0.00 H new ATOM 0 HG2 PRO A 95 12.550 -10.178 -9.122 1.00 0.00 H new ATOM 0 HG3 PRO A 95 12.561 -8.535 -8.512 1.00 0.00 H new ATOM 0 HD2 PRO A 95 12.111 -10.926 -6.995 1.00 0.00 H new ATOM 0 HD3 PRO A 95 12.008 -9.278 -6.409 1.00 0.00 H new ATOM 1418 N ASP A 96 9.524 -12.260 -8.422 1.00 0.00 N ATOM 1419 CA ASP A 96 9.150 -13.587 -8.883 1.00 0.00 C ATOM 1420 C ASP A 96 7.736 -13.911 -8.398 1.00 0.00 C ATOM 1421 O ASP A 96 6.905 -14.389 -9.170 1.00 0.00 O ATOM 1422 CB ASP A 96 10.097 -14.651 -8.325 1.00 0.00 C ATOM 1423 CG ASP A 96 11.555 -14.515 -8.767 1.00 0.00 C ATOM 1424 OD1 ASP A 96 11.856 -14.988 -9.885 1.00 0.00 O ATOM 1425 OD2 ASP A 96 12.336 -13.941 -7.978 1.00 0.00 O ATOM 0 H ASP A 96 10.125 -12.249 -7.598 1.00 0.00 H new ATOM 0 HA ASP A 96 9.202 -13.593 -9.972 1.00 0.00 H new ATOM 0 HB2 ASP A 96 10.058 -14.615 -7.236 1.00 0.00 H new ATOM 0 HB3 ASP A 96 9.732 -15.633 -8.625 1.00 0.00 H new ATOM 1430 N ALA A 97 7.505 -13.638 -7.122 1.00 0.00 N ATOM 1431 CA ALA A 97 6.205 -13.895 -6.525 1.00 0.00 C ATOM 1432 C ALA A 97 5.147 -13.045 -7.232 1.00 0.00 C ATOM 1433 O ALA A 97 5.415 -11.908 -7.618 1.00 0.00 O ATOM 1434 CB ALA A 97 6.269 -13.614 -5.023 1.00 0.00 C ATOM 0 H ALA A 97 8.196 -13.241 -6.485 1.00 0.00 H new ATOM 0 HA ALA A 97 5.925 -14.941 -6.650 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.294 -13.807 -4.575 1.00 0.00 H new ATOM 0 HB2 ALA A 97 7.014 -14.263 -4.563 1.00 0.00 H new ATOM 0 HB3 ALA A 97 6.544 -12.572 -4.859 1.00 0.00 H new ATOM 1440 N PHE A 98 3.968 -13.630 -7.381 1.00 0.00 N ATOM 1441 CA PHE A 98 2.868 -12.941 -8.035 1.00 0.00 C ATOM 1442 C PHE A 98 1.575 -13.084 -7.230 1.00 0.00 C ATOM 1443 O PHE A 98 1.371 -14.089 -6.550 1.00 0.00 O ATOM 1444 CB PHE A 98 2.679 -13.599 -9.403 1.00 0.00 C ATOM 1445 CG PHE A 98 3.968 -13.726 -10.217 1.00 0.00 C ATOM 1446 CD1 PHE A 98 4.775 -12.644 -10.385 1.00 0.00 C ATOM 1447 CD2 PHE A 98 4.307 -14.920 -10.772 1.00 0.00 C ATOM 1448 CE1 PHE A 98 5.972 -12.762 -11.141 1.00 0.00 C ATOM 1449 CE2 PHE A 98 5.504 -15.038 -11.527 1.00 0.00 C ATOM 1450 CZ PHE A 98 6.311 -13.956 -11.696 1.00 0.00 C ATOM 0 H PHE A 98 3.750 -14.573 -7.060 1.00 0.00 H new ATOM 0 HA PHE A 98 3.094 -11.878 -8.122 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.252 -14.592 -9.261 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.955 -13.020 -9.976 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.506 -11.696 -9.944 1.00 0.00 H new ATOM 0 HD2 PHE A 98 3.666 -15.779 -10.639 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.613 -11.903 -11.275 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.774 -15.987 -11.967 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.221 -14.045 -12.271 1.00 0.00 H new ATOM 1460 N TYR A 99 0.735 -12.065 -7.333 1.00 0.00 N ATOM 1461 CA TYR A 99 -0.532 -12.064 -6.623 1.00 0.00 C ATOM 1462 C TYR A 99 -1.645 -11.471 -7.489 1.00 0.00 C ATOM 1463 O TYR A 99 -1.373 -10.809 -8.489 1.00 0.00 O ATOM 1464 CB TYR A 99 -0.328 -11.174 -5.396 1.00 0.00 C ATOM 1465 CG TYR A 99 0.764 -11.667 -4.444 1.00 0.00 C ATOM 1466 CD1 TYR A 99 0.460 -12.593 -3.467 1.00 0.00 C ATOM 1467 CD2 TYR A 99 2.052 -11.186 -4.563 1.00 0.00 C ATOM 1468 CE1 TYR A 99 1.488 -13.058 -2.571 1.00 0.00 C ATOM 1469 CE2 TYR A 99 3.079 -11.651 -3.667 1.00 0.00 C ATOM 1470 CZ TYR A 99 2.746 -12.563 -2.715 1.00 0.00 C ATOM 1471 OH TYR A 99 3.717 -13.002 -1.869 1.00 0.00 O ATOM 0 H TYR A 99 0.907 -11.234 -7.898 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.824 -13.080 -6.358 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -0.078 -10.166 -5.728 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -1.268 -11.105 -4.849 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.548 -12.969 -3.374 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.290 -10.461 -5.328 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.264 -13.783 -1.803 1.00 0.00 H new ATOM 0 HE2 TYR A 99 4.091 -11.284 -3.749 1.00 0.00 H new ATOM 0 HH TYR A 99 4.597 -12.760 -2.227 1.00 0.00 H new ATOM 1481 N TYR A 100 -2.876 -11.730 -7.073 1.00 0.00 N ATOM 1482 CA TYR A 100 -4.032 -11.230 -7.798 1.00 0.00 C ATOM 1483 C TYR A 100 -5.255 -11.136 -6.883 1.00 0.00 C ATOM 1484 O TYR A 100 -5.387 -11.911 -5.937 1.00 0.00 O ATOM 1485 CB TYR A 100 -4.312 -12.252 -8.901 1.00 0.00 C ATOM 1486 CG TYR A 100 -4.945 -13.551 -8.400 1.00 0.00 C ATOM 1487 CD1 TYR A 100 -4.151 -14.536 -7.847 1.00 0.00 C ATOM 1488 CD2 TYR A 100 -6.308 -13.739 -8.500 1.00 0.00 C ATOM 1489 CE1 TYR A 100 -4.747 -15.760 -7.375 1.00 0.00 C ATOM 1490 CE2 TYR A 100 -6.903 -14.962 -8.027 1.00 0.00 C ATOM 1491 CZ TYR A 100 -6.093 -15.912 -7.488 1.00 0.00 C ATOM 1492 OH TYR A 100 -6.655 -17.068 -7.042 1.00 0.00 O ATOM 0 H TYR A 100 -3.098 -12.280 -6.243 1.00 0.00 H new ATOM 0 HA TYR A 100 -3.836 -10.233 -8.192 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.972 -11.800 -9.641 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.377 -12.488 -9.409 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -3.084 -14.389 -7.768 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -6.929 -12.969 -8.933 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -4.138 -16.539 -6.941 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.969 -15.121 -8.099 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.624 -17.037 -7.185 1.00 0.00 H new ATOM 1502 N PHE A 101 -6.118 -10.181 -7.198 1.00 0.00 N ATOM 1503 CA PHE A 101 -7.326 -9.977 -6.416 1.00 0.00 C ATOM 1504 C PHE A 101 -8.324 -11.115 -6.640 1.00 0.00 C ATOM 1505 O PHE A 101 -8.453 -11.621 -7.754 1.00 0.00 O ATOM 1506 CB PHE A 101 -7.951 -8.665 -6.894 1.00 0.00 C ATOM 1507 CG PHE A 101 -6.983 -7.479 -6.896 1.00 0.00 C ATOM 1508 CD1 PHE A 101 -6.211 -7.229 -5.805 1.00 0.00 C ATOM 1509 CD2 PHE A 101 -6.896 -6.675 -7.989 1.00 0.00 C ATOM 1510 CE1 PHE A 101 -5.313 -6.129 -5.807 1.00 0.00 C ATOM 1511 CE2 PHE A 101 -5.998 -5.575 -7.992 1.00 0.00 C ATOM 1512 CZ PHE A 101 -5.226 -5.325 -6.901 1.00 0.00 C ATOM 0 H PHE A 101 -6.005 -9.540 -7.984 1.00 0.00 H new ATOM 0 HA PHE A 101 -7.081 -9.949 -5.354 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.339 -8.806 -7.903 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.801 -8.426 -6.256 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -6.281 -7.867 -4.937 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -7.510 -6.873 -8.855 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -4.699 -5.931 -4.941 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.928 -4.937 -8.861 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.544 -4.488 -6.903 1.00 0.00 H new ATOM 1522 N PRO A 102 -9.022 -11.493 -5.536 1.00 0.00 N ATOM 1523 CA PRO A 102 -10.004 -12.561 -5.602 1.00 0.00 C ATOM 1524 C PRO A 102 -11.285 -12.087 -6.292 1.00 0.00 C ATOM 1525 O PRO A 102 -12.312 -11.900 -5.642 1.00 0.00 O ATOM 1526 CB PRO A 102 -10.228 -12.979 -4.158 1.00 0.00 C ATOM 1527 CG PRO A 102 -9.719 -11.827 -3.307 1.00 0.00 C ATOM 1528 CD PRO A 102 -8.895 -10.915 -4.202 1.00 0.00 C ATOM 0 HA PRO A 102 -9.665 -13.407 -6.200 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -11.284 -13.170 -3.966 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -9.691 -13.900 -3.930 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -10.553 -11.279 -2.868 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -9.113 -12.201 -2.482 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -9.269 -9.892 -4.176 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -7.854 -10.882 -3.882 1.00 0.00 H new ATOM 1536 N ASP A 103 -11.182 -11.907 -7.601 1.00 0.00 N ATOM 1537 CA ASP A 103 -12.319 -11.458 -8.386 1.00 0.00 C ATOM 1538 C ASP A 103 -11.928 -11.419 -9.865 1.00 0.00 C ATOM 1539 O ASP A 103 -12.718 -11.796 -10.729 1.00 0.00 O ATOM 1540 CB ASP A 103 -12.752 -10.050 -7.974 1.00 0.00 C ATOM 1541 CG ASP A 103 -14.084 -9.584 -8.565 1.00 0.00 C ATOM 1542 OD1 ASP A 103 -14.164 -9.529 -9.811 1.00 0.00 O ATOM 1543 OD2 ASP A 103 -14.993 -9.293 -7.757 1.00 0.00 O ATOM 0 H ASP A 103 -10.329 -12.064 -8.137 1.00 0.00 H new ATOM 0 HA ASP A 103 -13.142 -12.152 -8.215 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -12.821 -10.011 -6.887 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -11.974 -9.346 -8.270 1.00 0.00 H new ATOM 1548 N SER A 104 -10.710 -10.959 -10.110 1.00 0.00 N ATOM 1549 CA SER A 104 -10.205 -10.866 -11.469 1.00 0.00 C ATOM 1550 C SER A 104 -9.310 -12.067 -11.779 1.00 0.00 C ATOM 1551 O SER A 104 -9.733 -13.003 -12.455 1.00 0.00 O ATOM 1552 CB SER A 104 -9.435 -9.561 -11.682 1.00 0.00 C ATOM 1553 OG SER A 104 -10.170 -8.629 -12.470 1.00 0.00 O ATOM 0 H SER A 104 -10.058 -10.647 -9.390 1.00 0.00 H new ATOM 0 HA SER A 104 -11.056 -10.870 -12.151 1.00 0.00 H new ATOM 0 HB2 SER A 104 -9.204 -9.115 -10.715 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.484 -9.777 -12.169 1.00 0.00 H new ATOM 0 HG SER A 104 -9.645 -7.809 -12.581 1.00 0.00 H new ATOM 1559 N GLY A 105 -8.089 -12.002 -11.268 1.00 0.00 N ATOM 1560 CA GLY A 105 -7.131 -13.073 -11.482 1.00 0.00 C ATOM 1561 C GLY A 105 -7.059 -13.459 -12.961 1.00 0.00 C ATOM 1562 O GLY A 105 -7.636 -12.782 -13.811 1.00 0.00 O ATOM 0 H GLY A 105 -7.742 -11.225 -10.707 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.146 -12.759 -11.136 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.414 -13.943 -10.889 1.00 0.00 H new ATOM 1566 N PRO A 106 -6.328 -14.574 -13.229 1.00 0.00 N ATOM 1567 CA PRO A 106 -6.174 -15.057 -14.591 1.00 0.00 C ATOM 1568 C PRO A 106 -7.455 -15.737 -15.079 1.00 0.00 C ATOM 1569 O PRO A 106 -7.698 -16.904 -14.773 1.00 0.00 O ATOM 1570 CB PRO A 106 -4.983 -16.000 -14.541 1.00 0.00 C ATOM 1571 CG PRO A 106 -4.804 -16.369 -13.077 1.00 0.00 C ATOM 1572 CD PRO A 106 -5.632 -15.400 -12.248 1.00 0.00 C ATOM 0 HA PRO A 106 -5.999 -14.253 -15.306 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -5.162 -16.887 -15.148 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -4.088 -15.519 -14.935 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -5.126 -17.395 -12.900 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -3.753 -16.312 -12.795 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -6.336 -15.930 -11.606 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -5.000 -14.795 -11.598 1.00 0.00 H new ATOM 1580 N SER A 107 -8.240 -14.979 -15.830 1.00 0.00 N ATOM 1581 CA SER A 107 -9.490 -15.494 -16.364 1.00 0.00 C ATOM 1582 C SER A 107 -9.208 -16.603 -17.379 1.00 0.00 C ATOM 1583 O SER A 107 -8.454 -16.401 -18.331 1.00 0.00 O ATOM 1584 CB SER A 107 -10.314 -14.379 -17.011 1.00 0.00 C ATOM 1585 OG SER A 107 -11.591 -14.233 -16.396 1.00 0.00 O ATOM 0 H SER A 107 -8.035 -14.012 -16.082 1.00 0.00 H new ATOM 0 HA SER A 107 -10.071 -15.905 -15.538 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.768 -13.438 -16.941 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.445 -14.594 -18.072 1.00 0.00 H new ATOM 0 HG SER A 107 -12.085 -13.510 -16.836 1.00 0.00 H new ATOM 1591 N SER A 108 -9.827 -17.750 -17.143 1.00 0.00 N ATOM 1592 CA SER A 108 -9.652 -18.891 -18.025 1.00 0.00 C ATOM 1593 C SER A 108 -10.169 -18.554 -19.425 1.00 0.00 C ATOM 1594 O SER A 108 -11.277 -18.040 -19.575 1.00 0.00 O ATOM 1595 CB SER A 108 -10.370 -20.126 -17.478 1.00 0.00 C ATOM 1596 OG SER A 108 -11.705 -19.832 -17.074 1.00 0.00 O ATOM 0 H SER A 108 -10.451 -17.914 -16.353 1.00 0.00 H new ATOM 0 HA SER A 108 -8.588 -19.119 -18.082 1.00 0.00 H new ATOM 0 HB2 SER A 108 -10.385 -20.904 -18.241 1.00 0.00 H new ATOM 0 HB3 SER A 108 -9.813 -20.523 -16.629 1.00 0.00 H new ATOM 0 HG SER A 108 -12.140 -19.281 -17.758 1.00 0.00 H new ATOM 1602 N GLY A 109 -9.342 -18.856 -20.415 1.00 0.00 N ATOM 1603 CA GLY A 109 -9.702 -18.592 -21.798 1.00 0.00 C ATOM 1604 C GLY A 109 -8.622 -17.764 -22.497 1.00 0.00 C ATOM 1605 O GLY A 109 -7.849 -18.292 -23.295 1.00 0.00 O ATOM 0 H GLY A 109 -8.424 -19.281 -20.287 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -9.842 -19.534 -22.327 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -10.653 -18.061 -21.835 1.00 0.00 H new TER 1609 GLY A 109