USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 804 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 31 MET CE :methyl 152:sc= -0.916 (180deg=-3.36!) USER MOD Set 1.2: A 105 THR OG1 : rot -140:sc= 0 USER MOD Set 2.1: A 8 SER OG : rot -165:sc= -3.18! USER MOD Set 2.2: A 27 MET CE :methyl 144:sc= -0.339 (180deg=-1.46) USER MOD Single : A 1 MET CE :methyl 173:sc=-0.00474 (180deg=-0.0397) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 80:sc= -0.603 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 56:sc= 0.983 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -156:sc= -0.101 (180deg=-0.287) USER MOD Single : A 35 ASN : amide:sc= -0.421 K(o=-0.42,f=-3.3!) USER MOD Single : A 38 SER OG : rot 24:sc= 0.279 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -1.45 K(o=-1.4,f=-5!) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 64 ASN : amide:sc= -3.84! C(o=-3.8!,f=-6.3!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot -150:sc= 0 USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 ASN : amide:sc= -0.38 K(o=-0.38,f=-3.6!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 15:sc= -0.877 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0214 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.0735 USER MOD Single : A 96 SER OG : rot 22:sc= 0.174 USER MOD Single : A 100 ASN : amide:sc= -2.29 K(o=-2.3,f=-5.6!) USER MOD Single : A 102 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0344) USER MOD Single : A 108 ASN : amide:sc= -0.272 K(o=-0.27,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.835 0.657 -4.189 1.00 0.00 N ATOM 2 CA MET A 1 7.693 0.576 -5.144 1.00 0.00 C ATOM 3 C MET A 1 6.385 0.429 -4.364 1.00 0.00 C ATOM 4 O MET A 1 6.149 -0.570 -3.713 1.00 0.00 O ATOM 5 CB MET A 1 7.878 -0.637 -6.059 1.00 0.00 C ATOM 6 CG MET A 1 8.349 -0.169 -7.437 1.00 0.00 C ATOM 7 SD MET A 1 9.832 -1.091 -7.912 1.00 0.00 S ATOM 8 CE MET A 1 8.989 -2.556 -8.558 1.00 0.00 C ATOM 0 H1 MET A 1 9.724 0.757 -4.719 1.00 0.00 H new ATOM 0 H2 MET A 1 8.709 1.480 -3.566 1.00 0.00 H new ATOM 0 H3 MET A 1 8.870 -0.210 -3.615 1.00 0.00 H new ATOM 0 HA MET A 1 7.658 1.484 -5.746 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.606 -1.324 -5.628 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.940 -1.184 -6.150 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.561 -0.322 -8.174 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.563 0.900 -7.417 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.717 -3.218 -9.026 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.494 -3.081 -7.741 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.247 -2.253 -9.297 1.00 0.00 H new ATOM 20 N LYS A 2 5.533 1.414 -4.424 1.00 0.00 N ATOM 21 CA LYS A 2 4.240 1.329 -3.688 1.00 0.00 C ATOM 22 C LYS A 2 3.178 0.710 -4.599 1.00 0.00 C ATOM 23 O LYS A 2 2.893 1.216 -5.667 1.00 0.00 O ATOM 24 CB LYS A 2 3.798 2.731 -3.263 1.00 0.00 C ATOM 25 CG LYS A 2 5.030 3.592 -2.974 1.00 0.00 C ATOM 26 CD LYS A 2 4.793 4.416 -1.706 1.00 0.00 C ATOM 27 CE LYS A 2 5.602 5.712 -1.780 1.00 0.00 C ATOM 28 NZ LYS A 2 6.799 5.602 -0.899 1.00 0.00 N ATOM 0 H LYS A 2 5.676 2.275 -4.951 1.00 0.00 H new ATOM 0 HA LYS A 2 4.366 0.708 -2.801 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.199 3.189 -4.050 1.00 0.00 H new ATOM 0 HB3 LYS A 2 3.167 2.671 -2.376 1.00 0.00 H new ATOM 0 HG2 LYS A 2 5.908 2.958 -2.850 1.00 0.00 H new ATOM 0 HG3 LYS A 2 5.231 4.253 -3.817 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.732 4.643 -1.600 1.00 0.00 H new ATOM 0 HD3 LYS A 2 5.086 3.842 -0.827 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.910 5.903 -2.808 1.00 0.00 H new ATOM 0 HE3 LYS A 2 4.986 6.556 -1.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 7.349 6.483 -0.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 6.494 5.440 0.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 7.390 4.806 -1.214 1.00 0.00 H new ATOM 42 N ILE A 3 2.595 -0.384 -4.190 1.00 0.00 N ATOM 43 CA ILE A 3 1.556 -1.037 -5.035 1.00 0.00 C ATOM 44 C ILE A 3 0.163 -0.676 -4.517 1.00 0.00 C ATOM 45 O ILE A 3 -0.240 -1.088 -3.446 1.00 0.00 O ATOM 46 CB ILE A 3 1.745 -2.556 -4.983 1.00 0.00 C ATOM 47 CG1 ILE A 3 3.159 -2.906 -5.449 1.00 0.00 C ATOM 48 CG2 ILE A 3 0.724 -3.233 -5.901 1.00 0.00 C ATOM 49 CD1 ILE A 3 3.804 -3.866 -4.449 1.00 0.00 C ATOM 0 H ILE A 3 2.794 -0.854 -3.307 1.00 0.00 H new ATOM 0 HA ILE A 3 1.655 -0.690 -6.063 1.00 0.00 H new ATOM 0 HB ILE A 3 1.599 -2.905 -3.961 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.124 -3.364 -6.438 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.759 -2.000 -5.538 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.860 -4.314 -5.862 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.284 -2.982 -5.571 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.868 -2.885 -6.924 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.812 -4.115 -4.782 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.852 -3.392 -3.469 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.208 -4.777 -4.383 1.00 0.00 H new ATOM 61 N ALA A 4 -0.578 0.091 -5.269 1.00 0.00 N ATOM 62 CA ALA A 4 -1.946 0.478 -4.824 1.00 0.00 C ATOM 63 C ALA A 4 -2.983 -0.335 -5.603 1.00 0.00 C ATOM 64 O ALA A 4 -3.140 -0.176 -6.797 1.00 0.00 O ATOM 65 CB ALA A 4 -2.166 1.969 -5.086 1.00 0.00 C ATOM 0 H ALA A 4 -0.294 0.467 -6.174 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.052 0.278 -3.758 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.167 2.252 -4.760 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.427 2.549 -4.533 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.061 2.170 -6.152 1.00 0.00 H new ATOM 71 N ILE A 5 -3.690 -1.207 -4.938 1.00 0.00 N ATOM 72 CA ILE A 5 -4.714 -2.030 -5.641 1.00 0.00 C ATOM 73 C ILE A 5 -6.047 -1.278 -5.664 1.00 0.00 C ATOM 74 O ILE A 5 -6.626 -0.991 -4.635 1.00 0.00 O ATOM 75 CB ILE A 5 -4.890 -3.361 -4.905 1.00 0.00 C ATOM 76 CG1 ILE A 5 -3.513 -3.927 -4.543 1.00 0.00 C ATOM 77 CG2 ILE A 5 -5.626 -4.352 -5.808 1.00 0.00 C ATOM 78 CD1 ILE A 5 -2.751 -4.273 -5.824 1.00 0.00 C ATOM 0 H ILE A 5 -3.603 -1.385 -3.937 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.388 -2.220 -6.664 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.470 -3.200 -3.996 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -2.951 -3.199 -3.958 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -3.625 -4.816 -3.922 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -5.751 -5.299 -5.283 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -6.605 -3.950 -6.068 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.047 -4.515 -6.717 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -1.771 -4.676 -5.567 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -3.311 -5.016 -6.391 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -2.627 -3.374 -6.428 1.00 0.00 H new ATOM 90 N ALA A 6 -6.536 -0.954 -6.830 1.00 0.00 N ATOM 91 CA ALA A 6 -7.830 -0.219 -6.920 1.00 0.00 C ATOM 92 C ALA A 6 -8.951 -1.080 -6.336 1.00 0.00 C ATOM 93 O ALA A 6 -8.874 -2.293 -6.325 1.00 0.00 O ATOM 94 CB ALA A 6 -8.139 0.093 -8.385 1.00 0.00 C ATOM 0 H ALA A 6 -6.095 -1.167 -7.725 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.757 0.711 -6.357 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.085 0.630 -8.451 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.342 0.709 -8.802 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.210 -0.838 -8.948 1.00 0.00 H new ATOM 100 N SER A 7 -9.995 -0.464 -5.852 1.00 0.00 N ATOM 101 CA SER A 7 -11.122 -1.247 -5.271 1.00 0.00 C ATOM 102 C SER A 7 -10.620 -2.052 -4.071 1.00 0.00 C ATOM 103 O SER A 7 -10.659 -1.597 -2.945 1.00 0.00 O ATOM 104 CB SER A 7 -11.678 -2.201 -6.328 1.00 0.00 C ATOM 105 OG SER A 7 -12.319 -3.295 -5.683 1.00 0.00 O ATOM 0 H SER A 7 -10.116 0.549 -5.834 1.00 0.00 H new ATOM 0 HA SER A 7 -11.908 -0.565 -4.947 1.00 0.00 H new ATOM 0 HB2 SER A 7 -12.386 -1.677 -6.971 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.873 -2.562 -6.968 1.00 0.00 H new ATOM 0 HG SER A 7 -13.215 -3.024 -5.392 1.00 0.00 H new ATOM 111 N SER A 8 -10.149 -3.246 -4.301 1.00 0.00 N ATOM 112 CA SER A 8 -9.646 -4.079 -3.173 1.00 0.00 C ATOM 113 C SER A 8 -10.762 -4.272 -2.145 1.00 0.00 C ATOM 114 O SER A 8 -10.513 -4.547 -0.988 1.00 0.00 O ATOM 115 CB SER A 8 -8.460 -3.376 -2.513 1.00 0.00 C ATOM 116 OG SER A 8 -7.426 -4.322 -2.275 1.00 0.00 O ATOM 0 H SER A 8 -10.091 -3.681 -5.222 1.00 0.00 H new ATOM 0 HA SER A 8 -9.329 -5.051 -3.550 1.00 0.00 H new ATOM 0 HB2 SER A 8 -8.095 -2.574 -3.155 1.00 0.00 H new ATOM 0 HB3 SER A 8 -8.771 -2.916 -1.575 1.00 0.00 H new ATOM 0 HG SER A 8 -6.771 -3.941 -1.654 1.00 0.00 H new ATOM 122 N GLY A 9 -11.992 -4.130 -2.557 1.00 0.00 N ATOM 123 CA GLY A 9 -13.124 -4.307 -1.603 1.00 0.00 C ATOM 124 C GLY A 9 -12.855 -3.493 -0.337 1.00 0.00 C ATOM 125 O GLY A 9 -13.029 -2.291 -0.311 1.00 0.00 O ATOM 0 H GLY A 9 -12.262 -3.899 -3.513 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -14.057 -3.984 -2.065 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -13.241 -5.361 -1.352 1.00 0.00 H new ATOM 129 N THR A 10 -12.433 -4.138 0.716 1.00 0.00 N ATOM 130 CA THR A 10 -12.155 -3.400 1.980 1.00 0.00 C ATOM 131 C THR A 10 -11.152 -4.191 2.822 1.00 0.00 C ATOM 132 O THR A 10 -10.189 -3.650 3.328 1.00 0.00 O ATOM 133 CB THR A 10 -13.458 -3.230 2.765 1.00 0.00 C ATOM 134 OG1 THR A 10 -14.396 -4.205 2.336 1.00 0.00 O ATOM 135 CG2 THR A 10 -14.025 -1.832 2.522 1.00 0.00 C ATOM 0 H THR A 10 -12.269 -5.144 0.755 1.00 0.00 H new ATOM 0 HA THR A 10 -11.739 -2.420 1.746 1.00 0.00 H new ATOM 0 HB THR A 10 -13.261 -3.358 3.829 1.00 0.00 H new ATOM 0 HG1 THR A 10 -15.231 -4.099 2.838 1.00 0.00 H new ATOM 0 HG21 THR A 10 -14.953 -1.713 3.082 1.00 0.00 H new ATOM 0 HG22 THR A 10 -13.304 -1.084 2.852 1.00 0.00 H new ATOM 0 HG23 THR A 10 -14.224 -1.700 1.458 1.00 0.00 H new ATOM 143 N ASP A 11 -11.369 -5.468 2.976 1.00 0.00 N ATOM 144 CA ASP A 11 -10.427 -6.291 3.786 1.00 0.00 C ATOM 145 C ASP A 11 -10.515 -7.752 3.341 1.00 0.00 C ATOM 146 O ASP A 11 -9.552 -8.328 2.874 1.00 0.00 O ATOM 147 CB ASP A 11 -10.800 -6.185 5.265 1.00 0.00 C ATOM 148 CG ASP A 11 -9.530 -6.233 6.116 1.00 0.00 C ATOM 149 OD1 ASP A 11 -8.933 -7.294 6.195 1.00 0.00 O ATOM 150 OD2 ASP A 11 -9.174 -5.208 6.675 1.00 0.00 O ATOM 0 H ASP A 11 -12.157 -5.977 2.576 1.00 0.00 H new ATOM 0 HA ASP A 11 -9.410 -5.928 3.641 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -11.339 -5.256 5.449 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -11.467 -7.001 5.542 1.00 0.00 H new ATOM 155 N LEU A 12 -11.661 -8.359 3.486 1.00 0.00 N ATOM 156 CA LEU A 12 -11.807 -9.784 3.074 1.00 0.00 C ATOM 157 C LEU A 12 -12.659 -9.865 1.806 1.00 0.00 C ATOM 158 O LEU A 12 -12.687 -10.873 1.129 1.00 0.00 O ATOM 159 CB LEU A 12 -12.491 -10.570 4.193 1.00 0.00 C ATOM 160 CG LEU A 12 -11.528 -10.728 5.371 1.00 0.00 C ATOM 161 CD1 LEU A 12 -11.636 -9.507 6.287 1.00 0.00 C ATOM 162 CD2 LEU A 12 -11.892 -11.989 6.157 1.00 0.00 C ATOM 0 H LEU A 12 -12.502 -7.930 3.872 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.822 -10.207 2.879 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -13.394 -10.052 4.515 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -12.799 -11.550 3.828 1.00 0.00 H new ATOM 0 HG LEU A 12 -10.507 -10.812 4.998 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.950 -9.620 7.126 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -11.379 -8.608 5.727 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -12.656 -9.422 6.661 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -11.207 -12.104 6.997 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -12.913 -11.903 6.530 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -11.816 -12.859 5.505 1.00 0.00 H new ATOM 174 N GLY A 13 -13.359 -8.813 1.482 1.00 0.00 N ATOM 175 CA GLY A 13 -14.212 -8.834 0.260 1.00 0.00 C ATOM 176 C GLY A 13 -13.436 -8.249 -0.921 1.00 0.00 C ATOM 177 O GLY A 13 -14.012 -7.710 -1.844 1.00 0.00 O ATOM 0 H GLY A 13 -13.377 -7.940 2.010 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -14.518 -9.856 0.036 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -15.122 -8.259 0.430 1.00 0.00 H new ATOM 181 N SER A 14 -12.134 -8.349 -0.897 1.00 0.00 N ATOM 182 CA SER A 14 -11.319 -7.800 -2.020 1.00 0.00 C ATOM 183 C SER A 14 -11.365 -8.763 -3.210 1.00 0.00 C ATOM 184 O SER A 14 -10.411 -9.460 -3.492 1.00 0.00 O ATOM 185 CB SER A 14 -9.872 -7.626 -1.560 1.00 0.00 C ATOM 186 OG SER A 14 -9.333 -8.896 -1.216 1.00 0.00 O ATOM 0 H SER A 14 -11.599 -8.788 -0.148 1.00 0.00 H new ATOM 0 HA SER A 14 -11.724 -6.834 -2.322 1.00 0.00 H new ATOM 0 HB2 SER A 14 -9.279 -7.169 -2.352 1.00 0.00 H new ATOM 0 HB3 SER A 14 -9.829 -6.955 -0.702 1.00 0.00 H new ATOM 0 HG SER A 14 -9.427 -9.508 -1.976 1.00 0.00 H new ATOM 192 N GLU A 15 -12.465 -8.810 -3.914 1.00 0.00 N ATOM 193 CA GLU A 15 -12.567 -9.728 -5.085 1.00 0.00 C ATOM 194 C GLU A 15 -11.835 -9.121 -6.286 1.00 0.00 C ATOM 195 O GLU A 15 -11.880 -9.648 -7.380 1.00 0.00 O ATOM 196 CB GLU A 15 -14.041 -9.938 -5.439 1.00 0.00 C ATOM 197 CG GLU A 15 -14.146 -10.699 -6.761 1.00 0.00 C ATOM 198 CD GLU A 15 -15.557 -11.273 -6.909 1.00 0.00 C ATOM 199 OE1 GLU A 15 -16.492 -10.610 -6.492 1.00 0.00 O ATOM 200 OE2 GLU A 15 -15.678 -12.366 -7.438 1.00 0.00 O ATOM 0 H GLU A 15 -13.298 -8.251 -3.728 1.00 0.00 H new ATOM 0 HA GLU A 15 -12.111 -10.685 -4.833 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -14.540 -10.495 -4.646 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -14.547 -8.976 -5.520 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -13.924 -10.033 -7.595 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -13.410 -11.503 -6.790 1.00 0.00 H new ATOM 207 N VAL A 16 -11.169 -8.015 -6.096 1.00 0.00 N ATOM 208 CA VAL A 16 -10.447 -7.377 -7.233 1.00 0.00 C ATOM 209 C VAL A 16 -11.469 -6.839 -8.237 1.00 0.00 C ATOM 210 O VAL A 16 -11.430 -7.156 -9.409 1.00 0.00 O ATOM 211 CB VAL A 16 -9.554 -8.411 -7.919 1.00 0.00 C ATOM 212 CG1 VAL A 16 -8.414 -7.699 -8.649 1.00 0.00 C ATOM 213 CG2 VAL A 16 -8.972 -9.358 -6.868 1.00 0.00 C ATOM 0 H VAL A 16 -11.094 -7.526 -5.204 1.00 0.00 H new ATOM 0 HA VAL A 16 -9.830 -6.559 -6.862 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.144 -8.981 -8.637 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -7.778 -8.437 -9.138 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.827 -7.023 -9.398 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.823 -7.129 -7.932 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -8.335 -10.096 -7.356 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.382 -8.787 -6.151 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -9.783 -9.867 -6.347 1.00 0.00 H new ATOM 223 N SER A 17 -12.387 -6.030 -7.781 1.00 0.00 N ATOM 224 CA SER A 17 -13.416 -5.471 -8.701 1.00 0.00 C ATOM 225 C SER A 17 -12.756 -5.041 -10.012 1.00 0.00 C ATOM 226 O SER A 17 -11.561 -4.821 -10.075 1.00 0.00 O ATOM 227 CB SER A 17 -14.080 -4.260 -8.041 1.00 0.00 C ATOM 228 OG SER A 17 -15.424 -4.159 -8.491 1.00 0.00 O ATOM 0 H SER A 17 -12.468 -5.732 -6.809 1.00 0.00 H new ATOM 0 HA SER A 17 -14.168 -6.232 -8.910 1.00 0.00 H new ATOM 0 HB2 SER A 17 -14.054 -4.363 -6.956 1.00 0.00 H new ATOM 0 HB3 SER A 17 -13.532 -3.351 -8.288 1.00 0.00 H new ATOM 0 HG SER A 17 -15.853 -3.385 -8.069 1.00 0.00 H new ATOM 234 N ARG A 18 -13.523 -4.919 -11.060 1.00 0.00 N ATOM 235 CA ARG A 18 -12.940 -4.504 -12.367 1.00 0.00 C ATOM 236 C ARG A 18 -13.436 -3.101 -12.723 1.00 0.00 C ATOM 237 O ARG A 18 -13.727 -2.807 -13.866 1.00 0.00 O ATOM 238 CB ARG A 18 -13.375 -5.492 -13.453 1.00 0.00 C ATOM 239 CG ARG A 18 -12.428 -6.694 -13.461 1.00 0.00 C ATOM 240 CD ARG A 18 -13.111 -7.886 -12.789 1.00 0.00 C ATOM 241 NE ARG A 18 -14.026 -8.548 -13.763 1.00 0.00 N ATOM 242 CZ ARG A 18 -13.745 -9.738 -14.218 1.00 0.00 C ATOM 243 NH1 ARG A 18 -13.885 -10.782 -13.447 1.00 0.00 N ATOM 244 NH2 ARG A 18 -13.324 -9.885 -15.444 1.00 0.00 N ATOM 0 H ARG A 18 -14.529 -5.089 -11.068 1.00 0.00 H new ATOM 0 HA ARG A 18 -11.852 -4.497 -12.297 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.397 -5.823 -13.270 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -13.368 -5.004 -14.427 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.154 -6.948 -14.485 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -11.505 -6.447 -12.936 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -12.363 -8.596 -12.436 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -13.672 -7.553 -11.916 1.00 0.00 H new ATOM 0 HE ARG A 18 -14.872 -8.070 -14.074 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -14.214 -10.668 -12.488 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.665 -11.712 -13.803 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -13.214 -9.070 -16.047 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -13.104 -10.815 -15.800 1.00 0.00 H new ATOM 258 N PHE A 19 -13.535 -2.232 -11.754 1.00 0.00 N ATOM 259 CA PHE A 19 -14.013 -0.850 -12.039 1.00 0.00 C ATOM 260 C PHE A 19 -13.035 0.163 -11.439 1.00 0.00 C ATOM 261 O PHE A 19 -13.019 0.394 -10.247 1.00 0.00 O ATOM 262 CB PHE A 19 -15.398 -0.652 -11.415 1.00 0.00 C ATOM 263 CG PHE A 19 -16.448 -0.694 -12.499 1.00 0.00 C ATOM 264 CD1 PHE A 19 -16.268 0.040 -13.678 1.00 0.00 C ATOM 265 CD2 PHE A 19 -17.603 -1.469 -12.325 1.00 0.00 C ATOM 266 CE1 PHE A 19 -17.244 0.002 -14.684 1.00 0.00 C ATOM 267 CE2 PHE A 19 -18.579 -1.507 -13.330 1.00 0.00 C ATOM 268 CZ PHE A 19 -18.399 -0.773 -14.510 1.00 0.00 C ATOM 0 H PHE A 19 -13.306 -2.420 -10.778 1.00 0.00 H new ATOM 0 HA PHE A 19 -14.074 -0.701 -13.117 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -15.591 -1.430 -10.677 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -15.439 0.303 -10.890 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -15.377 0.636 -13.812 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.741 -2.037 -11.417 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.106 0.570 -15.592 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -19.470 -2.102 -13.195 1.00 0.00 H new ATOM 0 HZ PHE A 19 -19.150 -0.804 -15.285 1.00 0.00 H new ATOM 278 N PHE A 20 -12.217 0.769 -12.256 1.00 0.00 N ATOM 279 CA PHE A 20 -11.242 1.766 -11.733 1.00 0.00 C ATOM 280 C PHE A 20 -11.748 3.180 -12.029 1.00 0.00 C ATOM 281 O PHE A 20 -12.315 3.441 -13.072 1.00 0.00 O ATOM 282 CB PHE A 20 -9.885 1.558 -12.410 1.00 0.00 C ATOM 283 CG PHE A 20 -8.880 2.528 -11.836 1.00 0.00 C ATOM 284 CD1 PHE A 20 -8.751 2.664 -10.447 1.00 0.00 C ATOM 285 CD2 PHE A 20 -8.076 3.292 -12.692 1.00 0.00 C ATOM 286 CE1 PHE A 20 -7.819 3.564 -9.914 1.00 0.00 C ATOM 287 CE2 PHE A 20 -7.144 4.193 -12.160 1.00 0.00 C ATOM 288 CZ PHE A 20 -7.015 4.329 -10.771 1.00 0.00 C ATOM 0 H PHE A 20 -12.182 0.616 -13.264 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.134 1.637 -10.656 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -9.545 0.534 -12.259 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.977 1.708 -13.486 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.370 2.075 -9.787 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.175 3.186 -13.762 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -7.720 3.669 -8.844 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -6.525 4.783 -12.820 1.00 0.00 H new ATOM 0 HZ PHE A 20 -6.296 5.023 -10.361 1.00 0.00 H new ATOM 298 N GLY A 21 -11.550 4.094 -11.119 1.00 0.00 N ATOM 299 CA GLY A 21 -12.024 5.489 -11.347 1.00 0.00 C ATOM 300 C GLY A 21 -13.126 5.820 -10.341 1.00 0.00 C ATOM 301 O GLY A 21 -13.118 6.863 -9.717 1.00 0.00 O ATOM 0 H GLY A 21 -11.081 3.935 -10.227 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -11.195 6.189 -11.239 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -12.401 5.595 -12.364 1.00 0.00 H new ATOM 305 N ARG A 22 -14.071 4.938 -10.176 1.00 0.00 N ATOM 306 CA ARG A 22 -15.172 5.196 -9.206 1.00 0.00 C ATOM 307 C ARG A 22 -14.925 4.378 -7.938 1.00 0.00 C ATOM 308 O ARG A 22 -15.188 4.824 -6.839 1.00 0.00 O ATOM 309 CB ARG A 22 -16.506 4.780 -9.830 1.00 0.00 C ATOM 310 CG ARG A 22 -17.623 5.681 -9.297 1.00 0.00 C ATOM 311 CD ARG A 22 -18.755 5.751 -10.325 1.00 0.00 C ATOM 312 NE ARG A 22 -19.672 4.592 -10.132 1.00 0.00 N ATOM 313 CZ ARG A 22 -20.311 4.089 -11.153 1.00 0.00 C ATOM 314 NH1 ARG A 22 -19.676 3.853 -12.269 1.00 0.00 N ATOM 315 NH2 ARG A 22 -21.584 3.819 -11.058 1.00 0.00 N ATOM 0 H ARG A 22 -14.129 4.048 -10.671 1.00 0.00 H new ATOM 0 HA ARG A 22 -15.203 6.257 -8.958 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -16.451 4.855 -10.916 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -16.721 3.738 -9.593 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -18.000 5.291 -8.351 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -17.235 6.680 -9.098 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -19.304 6.686 -10.214 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -18.345 5.740 -11.335 1.00 0.00 H new ATOM 0 HE ARG A 22 -19.800 4.192 -9.202 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -18.680 4.062 -12.343 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -20.176 3.460 -13.067 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -22.080 4.001 -10.186 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -22.083 3.426 -11.856 1.00 0.00 H new ATOM 329 N ALA A 23 -14.422 3.183 -8.088 1.00 0.00 N ATOM 330 CA ALA A 23 -14.150 2.324 -6.900 1.00 0.00 C ATOM 331 C ALA A 23 -13.541 3.170 -5.775 1.00 0.00 C ATOM 332 O ALA A 23 -12.368 3.486 -5.812 1.00 0.00 O ATOM 333 CB ALA A 23 -13.165 1.222 -7.293 1.00 0.00 C ATOM 0 H ALA A 23 -14.187 2.763 -8.987 1.00 0.00 H new ATOM 0 HA ALA A 23 -15.083 1.881 -6.552 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -12.962 0.590 -6.428 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -13.595 0.617 -8.091 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.235 1.672 -7.640 1.00 0.00 H new ATOM 339 N PRO A 24 -14.358 3.511 -4.808 1.00 0.00 N ATOM 340 CA PRO A 24 -13.928 4.317 -3.650 1.00 0.00 C ATOM 341 C PRO A 24 -13.233 3.432 -2.609 1.00 0.00 C ATOM 342 O PRO A 24 -13.611 3.405 -1.454 1.00 0.00 O ATOM 343 CB PRO A 24 -15.242 4.866 -3.091 1.00 0.00 C ATOM 344 CG PRO A 24 -16.358 3.910 -3.578 1.00 0.00 C ATOM 345 CD PRO A 24 -15.786 3.136 -4.780 1.00 0.00 C ATOM 0 HA PRO A 24 -13.216 5.098 -3.915 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -15.214 4.907 -2.002 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -15.420 5.882 -3.444 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -16.655 3.226 -2.783 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -17.248 4.469 -3.866 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -15.913 2.060 -4.657 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -16.288 3.413 -5.707 1.00 0.00 H new ATOM 353 N TYR A 25 -12.222 2.707 -3.005 1.00 0.00 N ATOM 354 CA TYR A 25 -11.511 1.828 -2.037 1.00 0.00 C ATOM 355 C TYR A 25 -10.075 1.613 -2.514 1.00 0.00 C ATOM 356 O TYR A 25 -9.697 0.527 -2.908 1.00 0.00 O ATOM 357 CB TYR A 25 -12.226 0.478 -1.949 1.00 0.00 C ATOM 358 CG TYR A 25 -13.521 0.641 -1.191 1.00 0.00 C ATOM 359 CD1 TYR A 25 -13.511 0.701 0.209 1.00 0.00 C ATOM 360 CD2 TYR A 25 -14.733 0.733 -1.887 1.00 0.00 C ATOM 361 CE1 TYR A 25 -14.714 0.852 0.913 1.00 0.00 C ATOM 362 CE2 TYR A 25 -15.936 0.884 -1.184 1.00 0.00 C ATOM 363 CZ TYR A 25 -15.926 0.943 0.216 1.00 0.00 C ATOM 364 OH TYR A 25 -17.110 1.092 0.909 1.00 0.00 O ATOM 0 H TYR A 25 -11.859 2.686 -3.958 1.00 0.00 H new ATOM 0 HA TYR A 25 -11.505 2.298 -1.053 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -12.424 0.094 -2.950 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -11.589 -0.251 -1.448 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.576 0.631 0.746 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -14.741 0.688 -2.966 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -14.706 0.898 1.992 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -16.870 0.955 -1.721 1.00 0.00 H new ATOM 0 HH TYR A 25 -17.856 1.140 0.275 1.00 0.00 H new ATOM 374 N PHE A 26 -9.272 2.638 -2.484 1.00 0.00 N ATOM 375 CA PHE A 26 -7.862 2.491 -2.938 1.00 0.00 C ATOM 376 C PHE A 26 -7.037 1.841 -1.826 1.00 0.00 C ATOM 377 O PHE A 26 -6.796 2.430 -0.791 1.00 0.00 O ATOM 378 CB PHE A 26 -7.285 3.870 -3.265 1.00 0.00 C ATOM 379 CG PHE A 26 -6.375 3.760 -4.465 1.00 0.00 C ATOM 380 CD1 PHE A 26 -6.831 3.141 -5.637 1.00 0.00 C ATOM 381 CD2 PHE A 26 -5.073 4.277 -4.407 1.00 0.00 C ATOM 382 CE1 PHE A 26 -5.986 3.038 -6.750 1.00 0.00 C ATOM 383 CE2 PHE A 26 -4.228 4.174 -5.520 1.00 0.00 C ATOM 384 CZ PHE A 26 -4.685 3.555 -6.691 1.00 0.00 C ATOM 0 H PHE A 26 -9.531 3.572 -2.165 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.828 1.865 -3.829 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.091 4.575 -3.469 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -6.732 4.257 -2.409 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.834 2.743 -5.682 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -4.721 4.755 -3.504 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.337 2.560 -7.653 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.225 4.572 -5.475 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.034 3.476 -7.549 1.00 0.00 H new ATOM 394 N MET A 27 -6.604 0.627 -2.032 1.00 0.00 N ATOM 395 CA MET A 27 -5.797 -0.067 -0.989 1.00 0.00 C ATOM 396 C MET A 27 -4.315 0.249 -1.194 1.00 0.00 C ATOM 397 O MET A 27 -3.665 -0.308 -2.056 1.00 0.00 O ATOM 398 CB MET A 27 -6.019 -1.578 -1.098 1.00 0.00 C ATOM 399 CG MET A 27 -5.804 -2.227 0.270 1.00 0.00 C ATOM 400 SD MET A 27 -5.788 -4.027 0.086 1.00 0.00 S ATOM 401 CE MET A 27 -7.469 -4.329 0.681 1.00 0.00 C ATOM 0 H MET A 27 -6.775 0.085 -2.879 1.00 0.00 H new ATOM 0 HA MET A 27 -6.105 0.276 -0.001 1.00 0.00 H new ATOM 0 HB2 MET A 27 -7.028 -1.783 -1.455 1.00 0.00 H new ATOM 0 HB3 MET A 27 -5.331 -2.005 -1.827 1.00 0.00 H new ATOM 0 HG2 MET A 27 -4.863 -1.886 0.702 1.00 0.00 H new ATOM 0 HG3 MET A 27 -6.597 -1.928 0.955 1.00 0.00 H new ATOM 0 HE1 MET A 27 -7.912 -5.150 0.118 1.00 0.00 H new ATOM 0 HE2 MET A 27 -7.439 -4.589 1.739 1.00 0.00 H new ATOM 0 HE3 MET A 27 -8.070 -3.430 0.546 1.00 0.00 H new ATOM 411 N ILE A 28 -3.775 1.138 -0.406 1.00 0.00 N ATOM 412 CA ILE A 28 -2.335 1.490 -0.552 1.00 0.00 C ATOM 413 C ILE A 28 -1.484 0.470 0.207 1.00 0.00 C ATOM 414 O ILE A 28 -1.550 0.373 1.417 1.00 0.00 O ATOM 415 CB ILE A 28 -2.093 2.887 0.021 1.00 0.00 C ATOM 416 CG1 ILE A 28 -0.610 3.241 -0.104 1.00 0.00 C ATOM 417 CG2 ILE A 28 -2.501 2.912 1.496 1.00 0.00 C ATOM 418 CD1 ILE A 28 -0.187 3.156 -1.572 1.00 0.00 C ATOM 0 H ILE A 28 -4.270 1.636 0.334 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.060 1.479 -1.607 1.00 0.00 H new ATOM 0 HB ILE A 28 -2.687 3.614 -0.533 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.431 4.246 0.279 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.010 2.559 0.498 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.328 3.908 1.904 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.558 2.661 1.585 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -1.907 2.185 2.050 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.870 3.408 -1.661 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.351 2.143 -1.940 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -0.778 3.856 -2.162 1.00 0.00 H new ATOM 430 N VAL A 29 -0.689 -0.295 -0.489 1.00 0.00 N ATOM 431 CA VAL A 29 0.159 -1.308 0.201 1.00 0.00 C ATOM 432 C VAL A 29 1.622 -1.114 -0.201 1.00 0.00 C ATOM 433 O VAL A 29 1.954 -1.047 -1.368 1.00 0.00 O ATOM 434 CB VAL A 29 -0.298 -2.713 -0.197 1.00 0.00 C ATOM 435 CG1 VAL A 29 0.737 -3.739 0.266 1.00 0.00 C ATOM 436 CG2 VAL A 29 -1.645 -3.015 0.464 1.00 0.00 C ATOM 0 H VAL A 29 -0.590 -0.263 -1.504 1.00 0.00 H new ATOM 0 HA VAL A 29 0.062 -1.186 1.280 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.402 -2.767 -1.281 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.410 -4.739 -0.018 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.697 -3.524 -0.203 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.842 -3.686 1.350 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.973 -4.016 0.182 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.539 -2.960 1.547 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.384 -2.285 0.134 1.00 0.00 H new ATOM 446 N GLU A 30 2.501 -1.025 0.760 1.00 0.00 N ATOM 447 CA GLU A 30 3.943 -0.839 0.438 1.00 0.00 C ATOM 448 C GLU A 30 4.714 -2.108 0.810 1.00 0.00 C ATOM 449 O GLU A 30 4.820 -2.463 1.967 1.00 0.00 O ATOM 450 CB GLU A 30 4.494 0.344 1.238 1.00 0.00 C ATOM 451 CG GLU A 30 5.556 1.071 0.409 1.00 0.00 C ATOM 452 CD GLU A 30 6.361 2.005 1.316 1.00 0.00 C ATOM 453 OE1 GLU A 30 5.871 3.082 1.609 1.00 0.00 O ATOM 454 OE2 GLU A 30 7.455 1.626 1.701 1.00 0.00 O ATOM 0 H GLU A 30 2.282 -1.073 1.755 1.00 0.00 H new ATOM 0 HA GLU A 30 4.057 -0.642 -0.628 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.687 1.030 1.496 1.00 0.00 H new ATOM 0 HB3 GLU A 30 4.926 -0.007 2.175 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.219 0.348 -0.067 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.082 1.642 -0.389 1.00 0.00 H new ATOM 461 N MET A 31 5.249 -2.797 -0.161 1.00 0.00 N ATOM 462 CA MET A 31 6.008 -4.043 0.144 1.00 0.00 C ATOM 463 C MET A 31 7.489 -3.833 -0.176 1.00 0.00 C ATOM 464 O MET A 31 7.844 -3.335 -1.225 1.00 0.00 O ATOM 465 CB MET A 31 5.461 -5.194 -0.705 1.00 0.00 C ATOM 466 CG MET A 31 6.379 -6.409 -0.569 1.00 0.00 C ATOM 467 SD MET A 31 5.395 -7.860 -0.119 1.00 0.00 S ATOM 468 CE MET A 31 4.054 -7.598 -1.304 1.00 0.00 C ATOM 0 H MET A 31 5.194 -2.552 -1.150 1.00 0.00 H new ATOM 0 HA MET A 31 5.897 -4.285 1.201 1.00 0.00 H new ATOM 0 HB2 MET A 31 4.452 -5.450 -0.383 1.00 0.00 H new ATOM 0 HB3 MET A 31 5.395 -4.890 -1.750 1.00 0.00 H new ATOM 0 HG2 MET A 31 6.904 -6.589 -1.507 1.00 0.00 H new ATOM 0 HG3 MET A 31 7.138 -6.221 0.190 1.00 0.00 H new ATOM 0 HE1 MET A 31 3.609 -8.557 -1.568 1.00 0.00 H new ATOM 0 HE2 MET A 31 3.294 -6.956 -0.858 1.00 0.00 H new ATOM 0 HE3 MET A 31 4.449 -7.122 -2.201 1.00 0.00 H new ATOM 478 N LYS A 32 8.357 -4.210 0.723 1.00 0.00 N ATOM 479 CA LYS A 32 9.815 -4.035 0.473 1.00 0.00 C ATOM 480 C LYS A 32 10.353 -5.262 -0.266 1.00 0.00 C ATOM 481 O LYS A 32 10.934 -5.157 -1.327 1.00 0.00 O ATOM 482 CB LYS A 32 10.546 -3.888 1.808 1.00 0.00 C ATOM 483 CG LYS A 32 9.905 -2.759 2.618 1.00 0.00 C ATOM 484 CD LYS A 32 10.570 -1.431 2.254 1.00 0.00 C ATOM 485 CE LYS A 32 11.870 -1.277 3.043 1.00 0.00 C ATOM 486 NZ LYS A 32 12.892 -0.605 2.191 1.00 0.00 N ATOM 0 H LYS A 32 8.119 -4.632 1.620 1.00 0.00 H new ATOM 0 HA LYS A 32 9.977 -3.143 -0.132 1.00 0.00 H new ATOM 0 HB2 LYS A 32 10.498 -4.823 2.366 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.601 -3.673 1.636 1.00 0.00 H new ATOM 0 HG2 LYS A 32 8.836 -2.711 2.412 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.016 -2.954 3.685 1.00 0.00 H new ATOM 0 HD2 LYS A 32 10.776 -1.397 1.184 1.00 0.00 H new ATOM 0 HD3 LYS A 32 9.897 -0.603 2.476 1.00 0.00 H new ATOM 0 HE2 LYS A 32 11.693 -0.693 3.946 1.00 0.00 H new ATOM 0 HE3 LYS A 32 12.232 -2.254 3.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 13.777 -0.500 2.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 13.068 -1.179 1.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 12.545 0.334 1.908 1.00 0.00 H new ATOM 500 N LYS A 33 10.162 -6.427 0.291 1.00 0.00 N ATOM 501 CA LYS A 33 10.659 -7.664 -0.375 1.00 0.00 C ATOM 502 C LYS A 33 9.762 -8.840 0.014 1.00 0.00 C ATOM 503 O LYS A 33 10.172 -9.739 0.720 1.00 0.00 O ATOM 504 CB LYS A 33 12.094 -7.943 0.078 1.00 0.00 C ATOM 505 CG LYS A 33 12.149 -7.985 1.607 1.00 0.00 C ATOM 506 CD LYS A 33 12.973 -6.805 2.123 1.00 0.00 C ATOM 507 CE LYS A 33 14.338 -6.794 1.433 1.00 0.00 C ATOM 508 NZ LYS A 33 14.496 -5.530 0.661 1.00 0.00 N ATOM 0 H LYS A 33 9.683 -6.575 1.179 1.00 0.00 H new ATOM 0 HA LYS A 33 10.640 -7.533 -1.457 1.00 0.00 H new ATOM 0 HB2 LYS A 33 12.439 -8.891 -0.335 1.00 0.00 H new ATOM 0 HB3 LYS A 33 12.762 -7.169 -0.299 1.00 0.00 H new ATOM 0 HG2 LYS A 33 11.140 -7.945 2.018 1.00 0.00 H new ATOM 0 HG3 LYS A 33 12.592 -8.924 1.939 1.00 0.00 H new ATOM 0 HD2 LYS A 33 12.448 -5.869 1.929 1.00 0.00 H new ATOM 0 HD3 LYS A 33 13.100 -6.881 3.203 1.00 0.00 H new ATOM 0 HE2 LYS A 33 15.132 -6.881 2.174 1.00 0.00 H new ATOM 0 HE3 LYS A 33 14.427 -7.652 0.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 15.187 -5.674 -0.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 13.580 -5.256 0.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 14.832 -4.776 1.294 1.00 0.00 H new ATOM 522 N GLY A 34 8.537 -8.838 -0.439 1.00 0.00 N ATOM 523 CA GLY A 34 7.613 -9.954 -0.091 1.00 0.00 C ATOM 524 C GLY A 34 7.133 -9.786 1.352 1.00 0.00 C ATOM 525 O GLY A 34 6.494 -10.657 1.910 1.00 0.00 O ATOM 0 H GLY A 34 8.137 -8.112 -1.034 1.00 0.00 H new ATOM 0 HA2 GLY A 34 6.761 -9.961 -0.771 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.121 -10.911 -0.208 1.00 0.00 H new ATOM 529 N ASN A 35 7.435 -8.673 1.963 1.00 0.00 N ATOM 530 CA ASN A 35 6.997 -8.448 3.370 1.00 0.00 C ATOM 531 C ASN A 35 6.327 -7.078 3.483 1.00 0.00 C ATOM 532 O ASN A 35 6.984 -6.062 3.596 1.00 0.00 O ATOM 533 CB ASN A 35 8.214 -8.500 4.296 1.00 0.00 C ATOM 534 CG ASN A 35 7.963 -9.510 5.417 1.00 0.00 C ATOM 535 OD1 ASN A 35 6.863 -10.000 5.574 1.00 0.00 O ATOM 536 ND2 ASN A 35 8.945 -9.842 6.209 1.00 0.00 N ATOM 0 H ASN A 35 7.967 -7.908 1.548 1.00 0.00 H new ATOM 0 HA ASN A 35 6.287 -9.223 3.659 1.00 0.00 H new ATOM 0 HB2 ASN A 35 9.102 -8.782 3.731 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.405 -7.513 4.718 1.00 0.00 H new ATOM 0 HD21 ASN A 35 8.789 -10.514 6.961 1.00 0.00 H new ATOM 0 HD22 ASN A 35 9.869 -9.430 6.076 1.00 0.00 H new ATOM 543 N ILE A 36 5.023 -7.041 3.452 1.00 0.00 N ATOM 544 CA ILE A 36 4.310 -5.736 3.555 1.00 0.00 C ATOM 545 C ILE A 36 4.713 -5.030 4.852 1.00 0.00 C ATOM 546 O ILE A 36 4.632 -5.590 5.927 1.00 0.00 O ATOM 547 CB ILE A 36 2.799 -5.980 3.559 1.00 0.00 C ATOM 548 CG1 ILE A 36 2.403 -6.747 2.295 1.00 0.00 C ATOM 549 CG2 ILE A 36 2.065 -4.638 3.590 1.00 0.00 C ATOM 550 CD1 ILE A 36 1.730 -8.064 2.686 1.00 0.00 C ATOM 0 H ILE A 36 4.420 -7.859 3.360 1.00 0.00 H new ATOM 0 HA ILE A 36 4.578 -5.110 2.704 1.00 0.00 H new ATOM 0 HB ILE A 36 2.528 -6.563 4.439 1.00 0.00 H new ATOM 0 HG12 ILE A 36 1.725 -6.146 1.690 1.00 0.00 H new ATOM 0 HG13 ILE A 36 3.285 -6.944 1.685 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.989 -4.812 3.593 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.346 -4.090 4.489 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.336 -4.055 2.710 1.00 0.00 H new ATOM 0 HD11 ILE A 36 1.448 -8.610 1.786 1.00 0.00 H new ATOM 0 HD12 ILE A 36 2.423 -8.666 3.274 1.00 0.00 H new ATOM 0 HD13 ILE A 36 0.839 -7.855 3.278 1.00 0.00 H new ATOM 562 N GLU A 37 5.140 -3.800 4.760 1.00 0.00 N ATOM 563 CA GLU A 37 5.541 -3.055 5.987 1.00 0.00 C ATOM 564 C GLU A 37 4.417 -2.096 6.390 1.00 0.00 C ATOM 565 O GLU A 37 4.502 -1.409 7.389 1.00 0.00 O ATOM 566 CB GLU A 37 6.816 -2.257 5.708 1.00 0.00 C ATOM 567 CG GLU A 37 6.577 -1.297 4.541 1.00 0.00 C ATOM 568 CD GLU A 37 7.132 0.085 4.894 1.00 0.00 C ATOM 569 OE1 GLU A 37 6.520 0.757 5.709 1.00 0.00 O ATOM 570 OE2 GLU A 37 8.157 0.448 4.343 1.00 0.00 O ATOM 0 H GLU A 37 5.228 -3.279 3.888 1.00 0.00 H new ATOM 0 HA GLU A 37 5.726 -3.761 6.796 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.109 -1.699 6.597 1.00 0.00 H new ATOM 0 HB3 GLU A 37 7.637 -2.935 5.472 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.060 -1.675 3.640 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.511 -1.228 4.326 1.00 0.00 H new ATOM 577 N SER A 38 3.365 -2.044 5.619 1.00 0.00 N ATOM 578 CA SER A 38 2.236 -1.132 5.954 1.00 0.00 C ATOM 579 C SER A 38 1.180 -1.212 4.850 1.00 0.00 C ATOM 580 O SER A 38 1.472 -1.025 3.686 1.00 0.00 O ATOM 581 CB SER A 38 2.753 0.304 6.063 1.00 0.00 C ATOM 582 OG SER A 38 3.356 0.681 4.831 1.00 0.00 O ATOM 0 H SER A 38 3.239 -2.595 4.770 1.00 0.00 H new ATOM 0 HA SER A 38 1.795 -1.430 6.905 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.933 0.981 6.302 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.477 0.382 6.874 1.00 0.00 H new ATOM 0 HG SER A 38 2.994 0.129 4.107 1.00 0.00 H new ATOM 588 N SER A 39 -0.044 -1.495 5.203 1.00 0.00 N ATOM 589 CA SER A 39 -1.112 -1.591 4.168 1.00 0.00 C ATOM 590 C SER A 39 -2.375 -0.888 4.666 1.00 0.00 C ATOM 591 O SER A 39 -3.070 -1.379 5.534 1.00 0.00 O ATOM 592 CB SER A 39 -1.422 -3.063 3.893 1.00 0.00 C ATOM 593 OG SER A 39 -1.067 -3.838 5.031 1.00 0.00 O ATOM 0 H SER A 39 -0.350 -1.664 6.161 1.00 0.00 H new ATOM 0 HA SER A 39 -0.771 -1.112 3.250 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.482 -3.188 3.670 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.869 -3.406 3.018 1.00 0.00 H new ATOM 0 HG SER A 39 -1.266 -4.782 4.859 1.00 0.00 H new ATOM 599 N GLU A 40 -2.679 0.260 4.123 1.00 0.00 N ATOM 600 CA GLU A 40 -3.899 0.993 4.565 1.00 0.00 C ATOM 601 C GLU A 40 -4.916 1.025 3.422 1.00 0.00 C ATOM 602 O GLU A 40 -4.588 0.774 2.279 1.00 0.00 O ATOM 603 CB GLU A 40 -3.523 2.426 4.950 1.00 0.00 C ATOM 604 CG GLU A 40 -3.455 2.542 6.474 1.00 0.00 C ATOM 605 CD GLU A 40 -2.172 3.271 6.875 1.00 0.00 C ATOM 606 OE1 GLU A 40 -1.918 4.329 6.322 1.00 0.00 O ATOM 607 OE2 GLU A 40 -1.466 2.760 7.729 1.00 0.00 O ATOM 0 H GLU A 40 -2.136 0.721 3.393 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.334 0.487 5.427 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.561 2.692 4.511 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.259 3.126 4.554 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.325 3.083 6.847 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.479 1.550 6.926 1.00 0.00 H new ATOM 614 N VAL A 41 -6.149 1.329 3.723 1.00 0.00 N ATOM 615 CA VAL A 41 -7.187 1.375 2.655 1.00 0.00 C ATOM 616 C VAL A 41 -8.033 2.639 2.821 1.00 0.00 C ATOM 617 O VAL A 41 -8.689 2.831 3.826 1.00 0.00 O ATOM 618 CB VAL A 41 -8.084 0.142 2.766 1.00 0.00 C ATOM 619 CG1 VAL A 41 -8.933 0.241 4.035 1.00 0.00 C ATOM 620 CG2 VAL A 41 -9.003 0.068 1.544 1.00 0.00 C ATOM 0 H VAL A 41 -6.482 1.547 4.662 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.705 1.387 1.678 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.465 -0.754 2.811 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -9.573 -0.638 4.114 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.280 0.295 4.906 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -9.552 1.137 3.990 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -9.643 -0.811 1.623 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -9.622 0.964 1.499 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.400 -0.002 0.639 1.00 0.00 H new ATOM 630 N ILE A 42 -8.027 3.502 1.842 1.00 0.00 N ATOM 631 CA ILE A 42 -8.831 4.752 1.946 1.00 0.00 C ATOM 632 C ILE A 42 -9.733 4.885 0.717 1.00 0.00 C ATOM 633 O ILE A 42 -9.300 4.705 -0.404 1.00 0.00 O ATOM 634 CB ILE A 42 -7.894 5.959 2.023 1.00 0.00 C ATOM 635 CG1 ILE A 42 -7.105 6.072 0.716 1.00 0.00 C ATOM 636 CG2 ILE A 42 -6.922 5.779 3.190 1.00 0.00 C ATOM 637 CD1 ILE A 42 -6.123 7.240 0.811 1.00 0.00 C ATOM 0 H ILE A 42 -7.500 3.395 0.975 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.446 4.712 2.845 1.00 0.00 H new ATOM 0 HB ILE A 42 -8.480 6.865 2.176 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.566 5.145 0.523 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -7.787 6.224 -0.121 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -6.255 6.639 3.244 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -7.483 5.696 4.121 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -6.335 4.873 3.038 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -5.562 7.320 -0.120 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.673 8.165 0.983 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -5.433 7.069 1.637 1.00 0.00 H new ATOM 649 N GLU A 43 -10.983 5.202 0.918 1.00 0.00 N ATOM 650 CA GLU A 43 -11.909 5.349 -0.240 1.00 0.00 C ATOM 651 C GLU A 43 -11.608 6.661 -0.967 1.00 0.00 C ATOM 652 O GLU A 43 -11.229 7.644 -0.361 1.00 0.00 O ATOM 653 CB GLU A 43 -13.355 5.367 0.262 1.00 0.00 C ATOM 654 CG GLU A 43 -13.636 4.092 1.060 1.00 0.00 C ATOM 655 CD GLU A 43 -14.105 4.466 2.467 1.00 0.00 C ATOM 656 OE1 GLU A 43 -14.829 5.439 2.590 1.00 0.00 O ATOM 657 OE2 GLU A 43 -13.731 3.772 3.399 1.00 0.00 O ATOM 0 H GLU A 43 -11.402 5.365 1.833 1.00 0.00 H new ATOM 0 HA GLU A 43 -11.772 4.512 -0.924 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.523 6.244 0.887 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.043 5.440 -0.581 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -14.398 3.496 0.557 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -12.736 3.479 1.116 1.00 0.00 H new ATOM 664 N ASN A 44 -11.774 6.686 -2.260 1.00 0.00 N ATOM 665 CA ASN A 44 -11.496 7.936 -3.021 1.00 0.00 C ATOM 666 C ASN A 44 -12.137 9.124 -2.296 1.00 0.00 C ATOM 667 O ASN A 44 -13.109 8.962 -1.586 1.00 0.00 O ATOM 668 CB ASN A 44 -12.082 7.818 -4.430 1.00 0.00 C ATOM 669 CG ASN A 44 -11.514 6.576 -5.117 1.00 0.00 C ATOM 670 OD1 ASN A 44 -10.737 5.846 -4.532 1.00 0.00 O ATOM 671 ND2 ASN A 44 -11.870 6.302 -6.342 1.00 0.00 N ATOM 0 H ASN A 44 -12.090 5.896 -2.822 1.00 0.00 H new ATOM 0 HA ASN A 44 -10.419 8.090 -3.090 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -13.169 7.753 -4.379 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -11.843 8.709 -5.011 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -11.497 5.476 -6.809 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -12.522 6.914 -6.833 1.00 0.00 H new ATOM 769 N GLY A 54 -14.291 9.960 -12.291 1.00 0.00 N ATOM 770 CA GLY A 54 -13.650 8.960 -11.392 1.00 0.00 C ATOM 771 C GLY A 54 -12.161 8.846 -11.730 1.00 0.00 C ATOM 772 O GLY A 54 -11.328 8.687 -10.859 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.775 9.259 -10.351 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -14.134 7.990 -11.506 1.00 0.00 H new ATOM 776 N ILE A 55 -11.820 8.929 -12.986 1.00 0.00 N ATOM 777 CA ILE A 55 -10.386 8.826 -13.375 1.00 0.00 C ATOM 778 C ILE A 55 -9.622 10.037 -12.834 1.00 0.00 C ATOM 779 O ILE A 55 -8.408 10.053 -12.801 1.00 0.00 O ATOM 780 CB ILE A 55 -10.271 8.793 -14.900 1.00 0.00 C ATOM 781 CG1 ILE A 55 -11.115 7.639 -15.449 1.00 0.00 C ATOM 782 CG2 ILE A 55 -8.809 8.589 -15.297 1.00 0.00 C ATOM 783 CD1 ILE A 55 -10.574 6.311 -14.914 1.00 0.00 C ATOM 0 H ILE A 55 -12.472 9.064 -13.759 1.00 0.00 H new ATOM 0 HA ILE A 55 -9.963 7.912 -12.958 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.631 9.736 -15.313 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.157 7.764 -15.155 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.089 7.642 -16.539 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -8.727 8.565 -16.384 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.208 9.410 -14.905 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.448 7.646 -14.885 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.175 5.490 -15.305 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.539 6.186 -15.231 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.623 6.310 -13.825 1.00 0.00 H new ATOM 795 N ARG A 56 -10.325 11.051 -12.409 1.00 0.00 N ATOM 796 CA ARG A 56 -9.640 12.259 -11.870 1.00 0.00 C ATOM 797 C ARG A 56 -8.945 11.907 -10.553 1.00 0.00 C ATOM 798 O ARG A 56 -8.189 12.689 -10.010 1.00 0.00 O ATOM 799 CB ARG A 56 -10.671 13.363 -11.624 1.00 0.00 C ATOM 800 CG ARG A 56 -9.953 14.696 -11.408 1.00 0.00 C ATOM 801 CD ARG A 56 -10.695 15.803 -12.159 1.00 0.00 C ATOM 802 NE ARG A 56 -9.800 16.383 -13.200 1.00 0.00 N ATOM 803 CZ ARG A 56 -10.147 17.475 -13.824 1.00 0.00 C ATOM 804 NH1 ARG A 56 -9.841 18.639 -13.322 1.00 0.00 N ATOM 805 NH2 ARG A 56 -10.801 17.402 -14.952 1.00 0.00 N ATOM 0 H ARG A 56 -11.344 11.095 -12.412 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.899 12.608 -12.589 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -11.349 13.437 -12.474 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -11.278 13.120 -10.752 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -9.910 14.930 -10.344 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -8.924 14.629 -11.762 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -11.597 15.402 -12.622 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.012 16.580 -11.463 1.00 0.00 H new ATOM 0 HE ARG A 56 -8.916 15.926 -13.425 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.330 18.696 -12.441 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.113 19.492 -13.810 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.040 16.492 -15.345 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.073 18.255 -15.440 1.00 0.00 H new ATOM 819 N THR A 57 -9.193 10.736 -10.034 1.00 0.00 N ATOM 820 CA THR A 57 -8.546 10.335 -8.754 1.00 0.00 C ATOM 821 C THR A 57 -7.092 9.939 -9.018 1.00 0.00 C ATOM 822 O THR A 57 -6.286 9.853 -8.113 1.00 0.00 O ATOM 823 CB THR A 57 -9.298 9.143 -8.156 1.00 0.00 C ATOM 824 OG1 THR A 57 -8.814 8.889 -6.845 1.00 0.00 O ATOM 825 CG2 THR A 57 -9.079 7.909 -9.033 1.00 0.00 C ATOM 0 H THR A 57 -9.816 10.039 -10.442 1.00 0.00 H new ATOM 0 HA THR A 57 -8.573 11.171 -8.056 1.00 0.00 H new ATOM 0 HB THR A 57 -10.363 9.369 -8.111 1.00 0.00 H new ATOM 0 HG1 THR A 57 -9.296 8.127 -6.460 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.614 7.060 -8.607 1.00 0.00 H new ATOM 0 HG22 THR A 57 -9.452 8.106 -10.038 1.00 0.00 H new ATOM 0 HG23 THR A 57 -8.014 7.680 -9.080 1.00 0.00 H new ATOM 833 N ALA A 58 -6.749 9.696 -10.255 1.00 0.00 N ATOM 834 CA ALA A 58 -5.348 9.304 -10.578 1.00 0.00 C ATOM 835 C ALA A 58 -4.386 10.387 -10.082 1.00 0.00 C ATOM 836 O ALA A 58 -3.271 10.106 -9.690 1.00 0.00 O ATOM 837 CB ALA A 58 -5.200 9.144 -12.092 1.00 0.00 C ATOM 0 H ALA A 58 -7.379 9.752 -11.055 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.113 8.359 -10.088 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.175 8.857 -12.329 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.884 8.372 -12.445 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.435 10.089 -12.582 1.00 0.00 H new ATOM 843 N GLN A 59 -4.809 11.621 -10.095 1.00 0.00 N ATOM 844 CA GLN A 59 -3.916 12.717 -9.624 1.00 0.00 C ATOM 845 C GLN A 59 -3.637 12.540 -8.130 1.00 0.00 C ATOM 846 O GLN A 59 -2.500 12.516 -7.701 1.00 0.00 O ATOM 847 CB GLN A 59 -4.597 14.068 -9.859 1.00 0.00 C ATOM 848 CG GLN A 59 -3.533 15.143 -10.084 1.00 0.00 C ATOM 849 CD GLN A 59 -4.208 16.511 -10.211 1.00 0.00 C ATOM 850 OE1 GLN A 59 -5.398 16.635 -10.004 1.00 0.00 O ATOM 851 NE2 GLN A 59 -3.492 17.549 -10.546 1.00 0.00 N ATOM 0 H GLN A 59 -5.732 11.917 -10.411 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.977 12.683 -10.176 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.258 14.009 -10.724 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.217 14.329 -9.001 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -2.827 15.150 -9.254 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -2.963 14.922 -10.986 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -2.492 17.444 -10.720 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -3.932 18.465 -10.634 1.00 0.00 H new ATOM 860 N ILE A 60 -4.663 12.415 -7.334 1.00 0.00 N ATOM 861 CA ILE A 60 -4.452 12.238 -5.869 1.00 0.00 C ATOM 862 C ILE A 60 -3.694 10.934 -5.621 1.00 0.00 C ATOM 863 O ILE A 60 -3.013 10.779 -4.627 1.00 0.00 O ATOM 864 CB ILE A 60 -5.806 12.185 -5.158 1.00 0.00 C ATOM 865 CG1 ILE A 60 -6.501 13.544 -5.280 1.00 0.00 C ATOM 866 CG2 ILE A 60 -5.594 11.854 -3.680 1.00 0.00 C ATOM 867 CD1 ILE A 60 -5.651 14.615 -4.594 1.00 0.00 C ATOM 0 H ILE A 60 -5.638 12.428 -7.634 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.874 13.076 -5.481 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.427 11.416 -5.618 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.646 13.797 -6.330 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -7.490 13.501 -4.823 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.558 11.816 -3.174 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.099 10.887 -3.591 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.973 12.623 -3.220 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.145 15.583 -4.681 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -5.529 14.363 -3.541 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -4.672 14.664 -5.071 1.00 0.00 H new ATOM 879 N ILE A 61 -3.805 9.993 -6.519 1.00 0.00 N ATOM 880 CA ILE A 61 -3.088 8.700 -6.333 1.00 0.00 C ATOM 881 C ILE A 61 -1.583 8.929 -6.494 1.00 0.00 C ATOM 882 O ILE A 61 -0.779 8.365 -5.779 1.00 0.00 O ATOM 883 CB ILE A 61 -3.573 7.694 -7.382 1.00 0.00 C ATOM 884 CG1 ILE A 61 -4.967 7.194 -6.999 1.00 0.00 C ATOM 885 CG2 ILE A 61 -2.609 6.506 -7.441 1.00 0.00 C ATOM 886 CD1 ILE A 61 -5.504 6.280 -8.103 1.00 0.00 C ATOM 0 H ILE A 61 -4.360 10.064 -7.372 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.290 8.307 -5.337 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.611 8.179 -8.357 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.924 6.653 -6.054 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.640 8.039 -6.852 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.957 5.792 -8.188 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.614 6.858 -7.711 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.570 6.021 -6.466 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.497 5.924 -7.830 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.563 6.836 -9.039 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.835 5.429 -8.228 1.00 0.00 H new ATOM 898 N ALA A 62 -1.196 9.756 -7.428 1.00 0.00 N ATOM 899 CA ALA A 62 0.257 10.020 -7.632 1.00 0.00 C ATOM 900 C ALA A 62 0.773 10.923 -6.509 1.00 0.00 C ATOM 901 O ALA A 62 1.943 10.914 -6.183 1.00 0.00 O ATOM 902 CB ALA A 62 0.465 10.712 -8.981 1.00 0.00 C ATOM 0 H ALA A 62 -1.822 10.259 -8.057 1.00 0.00 H new ATOM 0 HA ALA A 62 0.804 9.077 -7.620 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.527 10.905 -9.131 1.00 0.00 H new ATOM 0 HB2 ALA A 62 0.097 10.069 -9.780 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.081 11.655 -8.994 1.00 0.00 H new ATOM 908 N ASN A 63 -0.089 11.702 -5.915 1.00 0.00 N ATOM 909 CA ASN A 63 0.356 12.601 -4.813 1.00 0.00 C ATOM 910 C ASN A 63 0.539 11.786 -3.531 1.00 0.00 C ATOM 911 O ASN A 63 0.988 12.291 -2.521 1.00 0.00 O ATOM 912 CB ASN A 63 -0.698 13.686 -4.580 1.00 0.00 C ATOM 913 CG ASN A 63 -0.021 15.057 -4.552 1.00 0.00 C ATOM 914 OD1 ASN A 63 0.604 15.460 -5.513 1.00 0.00 O ATOM 915 ND2 ASN A 63 -0.118 15.797 -3.481 1.00 0.00 N ATOM 0 H ASN A 63 -1.081 11.755 -6.145 1.00 0.00 H new ATOM 0 HA ASN A 63 1.303 13.067 -5.086 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.448 13.655 -5.370 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -1.219 13.506 -3.639 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.331 16.713 -3.451 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -0.642 15.460 -2.674 1.00 0.00 H new ATOM 922 N ASN A 64 0.196 10.527 -3.561 1.00 0.00 N ATOM 923 CA ASN A 64 0.351 9.681 -2.346 1.00 0.00 C ATOM 924 C ASN A 64 1.625 8.840 -2.467 1.00 0.00 C ATOM 925 O ASN A 64 1.939 8.045 -1.603 1.00 0.00 O ATOM 926 CB ASN A 64 -0.860 8.756 -2.214 1.00 0.00 C ATOM 927 CG ASN A 64 -2.143 9.563 -2.429 1.00 0.00 C ATOM 928 OD1 ASN A 64 -2.134 10.775 -2.336 1.00 0.00 O ATOM 929 ND2 ASN A 64 -3.253 8.939 -2.714 1.00 0.00 N ATOM 0 H ASN A 64 -0.186 10.048 -4.377 1.00 0.00 H new ATOM 0 HA ASN A 64 0.421 10.319 -1.465 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -0.797 7.950 -2.945 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.871 8.291 -1.228 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -4.113 9.468 -2.859 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -3.261 7.922 -2.792 1.00 0.00 H new ATOM 936 N GLY A 65 2.363 9.006 -3.532 1.00 0.00 N ATOM 937 CA GLY A 65 3.614 8.215 -3.702 1.00 0.00 C ATOM 938 C GLY A 65 3.305 6.920 -4.457 1.00 0.00 C ATOM 939 O GLY A 65 4.191 6.165 -4.801 1.00 0.00 O ATOM 0 H GLY A 65 2.153 9.655 -4.290 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.354 8.799 -4.249 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.046 7.986 -2.728 1.00 0.00 H new ATOM 943 N VAL A 66 2.053 6.655 -4.714 1.00 0.00 N ATOM 944 CA VAL A 66 1.685 5.409 -5.444 1.00 0.00 C ATOM 945 C VAL A 66 2.469 5.323 -6.751 1.00 0.00 C ATOM 946 O VAL A 66 2.017 5.767 -7.788 1.00 0.00 O ATOM 947 CB VAL A 66 0.187 5.421 -5.751 1.00 0.00 C ATOM 948 CG1 VAL A 66 -0.204 4.112 -6.439 1.00 0.00 C ATOM 949 CG2 VAL A 66 -0.598 5.563 -4.444 1.00 0.00 C ATOM 0 H VAL A 66 1.267 7.249 -4.449 1.00 0.00 H new ATOM 0 HA VAL A 66 1.925 4.546 -4.823 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.043 6.259 -6.409 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.272 4.121 -6.658 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.356 4.008 -7.368 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.025 3.273 -5.782 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.666 5.572 -4.660 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.367 4.724 -3.788 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.320 6.495 -3.952 1.00 0.00 H new ATOM 959 N LYS A 67 3.633 4.739 -6.714 1.00 0.00 N ATOM 960 CA LYS A 67 4.435 4.607 -7.958 1.00 0.00 C ATOM 961 C LYS A 67 3.890 3.428 -8.765 1.00 0.00 C ATOM 962 O LYS A 67 4.214 3.249 -9.923 1.00 0.00 O ATOM 963 CB LYS A 67 5.900 4.353 -7.600 1.00 0.00 C ATOM 964 CG LYS A 67 6.802 5.184 -8.514 1.00 0.00 C ATOM 965 CD LYS A 67 8.250 5.088 -8.029 1.00 0.00 C ATOM 966 CE LYS A 67 9.134 6.011 -8.869 1.00 0.00 C ATOM 967 NZ LYS A 67 9.217 7.347 -8.215 1.00 0.00 N ATOM 0 H LYS A 67 4.063 4.348 -5.876 1.00 0.00 H new ATOM 0 HA LYS A 67 4.368 5.523 -8.545 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.081 4.615 -6.558 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.133 3.294 -7.708 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.727 4.825 -9.540 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.476 6.224 -8.516 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.311 5.367 -6.977 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.603 4.060 -8.107 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.131 5.582 -8.973 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.723 6.111 -9.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.818 7.976 -8.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.264 7.755 -8.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.627 7.244 -7.265 1.00 0.00 H new ATOM 981 N ALA A 68 3.053 2.626 -8.159 1.00 0.00 N ATOM 982 CA ALA A 68 2.476 1.461 -8.884 1.00 0.00 C ATOM 983 C ALA A 68 0.952 1.495 -8.754 1.00 0.00 C ATOM 984 O ALA A 68 0.416 1.674 -7.679 1.00 0.00 O ATOM 985 CB ALA A 68 3.013 0.163 -8.276 1.00 0.00 C ATOM 0 H ALA A 68 2.745 2.730 -7.192 1.00 0.00 H new ATOM 0 HA ALA A 68 2.756 1.508 -9.936 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.590 -0.690 -8.807 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.099 0.143 -8.363 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.732 0.111 -7.224 1.00 0.00 H new ATOM 991 N VAL A 69 0.247 1.333 -9.841 1.00 0.00 N ATOM 992 CA VAL A 69 -1.241 1.366 -9.768 1.00 0.00 C ATOM 993 C VAL A 69 -1.822 0.140 -10.475 1.00 0.00 C ATOM 994 O VAL A 69 -1.843 0.061 -11.687 1.00 0.00 O ATOM 995 CB VAL A 69 -1.755 2.636 -10.447 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.163 2.952 -9.939 1.00 0.00 C ATOM 997 CG2 VAL A 69 -0.823 3.804 -10.117 1.00 0.00 C ATOM 0 H VAL A 69 0.635 1.180 -10.772 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.550 1.358 -8.723 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.782 2.484 -11.526 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.530 3.857 -10.423 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.829 2.121 -10.172 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.135 3.103 -8.860 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.189 4.710 -10.601 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -0.796 3.955 -9.038 1.00 0.00 H new ATOM 0 HG23 VAL A 69 0.181 3.581 -10.477 1.00 0.00 H new ATOM 1007 N ILE A 70 -2.302 -0.815 -9.725 1.00 0.00 N ATOM 1008 CA ILE A 70 -2.890 -2.031 -10.350 1.00 0.00 C ATOM 1009 C ILE A 70 -4.392 -1.814 -10.546 1.00 0.00 C ATOM 1010 O ILE A 70 -5.123 -1.588 -9.602 1.00 0.00 O ATOM 1011 CB ILE A 70 -2.661 -3.237 -9.438 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -1.157 -3.473 -9.277 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -3.308 -4.479 -10.056 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -0.922 -4.788 -8.532 1.00 0.00 C ATOM 0 H ILE A 70 -2.312 -0.804 -8.705 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.416 -2.216 -11.314 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.108 -3.044 -8.463 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.677 -3.506 -10.255 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -0.705 -2.646 -8.728 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.144 -5.337 -9.404 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -4.379 -4.312 -10.172 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.863 -4.674 -11.032 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.149 -4.955 -8.418 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.388 -4.737 -7.548 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.359 -5.610 -9.098 1.00 0.00 H new ATOM 1026 N ALA A 71 -4.859 -1.872 -11.762 1.00 0.00 N ATOM 1027 CA ALA A 71 -6.312 -1.657 -12.008 1.00 0.00 C ATOM 1028 C ALA A 71 -6.761 -2.470 -13.222 1.00 0.00 C ATOM 1029 O ALA A 71 -5.973 -3.126 -13.876 1.00 0.00 O ATOM 1030 CB ALA A 71 -6.568 -0.172 -12.272 1.00 0.00 C ATOM 0 H ALA A 71 -4.299 -2.058 -12.594 1.00 0.00 H new ATOM 0 HA ALA A 71 -6.875 -1.979 -11.132 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.631 -0.012 -12.452 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -6.255 0.411 -11.405 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.000 0.145 -13.147 1.00 0.00 H new ATOM 1036 N SER A 72 -8.027 -2.427 -13.524 1.00 0.00 N ATOM 1037 CA SER A 72 -8.548 -3.188 -14.694 1.00 0.00 C ATOM 1038 C SER A 72 -9.436 -2.269 -15.535 1.00 0.00 C ATOM 1039 O SER A 72 -10.427 -2.690 -16.096 1.00 0.00 O ATOM 1040 CB SER A 72 -9.369 -4.380 -14.201 1.00 0.00 C ATOM 1041 OG SER A 72 -8.931 -5.558 -14.865 1.00 0.00 O ATOM 0 H SER A 72 -8.728 -1.895 -13.008 1.00 0.00 H new ATOM 0 HA SER A 72 -7.716 -3.548 -15.299 1.00 0.00 H new ATOM 0 HB2 SER A 72 -9.256 -4.493 -13.123 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.428 -4.212 -14.395 1.00 0.00 H new ATOM 0 HG SER A 72 -9.454 -6.325 -14.550 1.00 0.00 H new ATOM 1047 N SER A 73 -9.091 -1.013 -15.620 1.00 0.00 N ATOM 1048 CA SER A 73 -9.916 -0.065 -16.420 1.00 0.00 C ATOM 1049 C SER A 73 -10.280 -0.711 -17.761 1.00 0.00 C ATOM 1050 O SER A 73 -9.433 -1.287 -18.416 1.00 0.00 O ATOM 1051 CB SER A 73 -9.118 1.216 -16.672 1.00 0.00 C ATOM 1052 OG SER A 73 -9.893 2.339 -16.277 1.00 0.00 O ATOM 0 H SER A 73 -8.273 -0.603 -15.170 1.00 0.00 H new ATOM 0 HA SER A 73 -10.828 0.175 -15.873 1.00 0.00 H new ATOM 0 HB2 SER A 73 -8.183 1.191 -16.113 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.857 1.293 -17.727 1.00 0.00 H new ATOM 0 HG SER A 73 -9.652 3.113 -16.828 1.00 0.00 H new ATOM 1058 N PRO A 74 -11.531 -0.597 -18.135 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.032 -1.162 -19.399 1.00 0.00 C ATOM 1060 C PRO A 74 -11.650 -0.259 -20.574 1.00 0.00 C ATOM 1061 O PRO A 74 -11.637 -0.680 -21.715 1.00 0.00 O ATOM 1062 CB PRO A 74 -13.550 -1.189 -19.202 1.00 0.00 C ATOM 1063 CG PRO A 74 -13.868 -0.138 -18.111 1.00 0.00 C ATOM 1064 CD PRO A 74 -12.558 0.103 -17.337 1.00 0.00 C ATOM 0 HA PRO A 74 -11.619 -2.145 -19.625 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.067 -0.952 -20.132 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -13.884 -2.180 -18.896 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -14.230 0.788 -18.559 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -14.652 -0.497 -17.444 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.337 1.167 -17.249 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -12.615 -0.295 -16.324 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.338 0.980 -20.305 1.00 0.00 N ATOM 1073 CA GLY A 75 -10.956 1.909 -21.408 1.00 0.00 C ATOM 1074 C GLY A 75 -9.487 2.314 -21.251 1.00 0.00 C ATOM 1075 O GLY A 75 -8.984 2.402 -20.148 1.00 0.00 O ATOM 0 H GLY A 75 -11.331 1.389 -19.371 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -11.110 1.427 -22.373 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.592 2.794 -21.389 1.00 0.00 H new ATOM 1079 N PRO A 76 -8.844 2.549 -22.367 1.00 0.00 N ATOM 1080 CA PRO A 76 -7.424 2.951 -22.398 1.00 0.00 C ATOM 1081 C PRO A 76 -7.275 4.440 -22.067 1.00 0.00 C ATOM 1082 O PRO A 76 -6.210 5.010 -22.201 1.00 0.00 O ATOM 1083 CB PRO A 76 -7.009 2.673 -23.845 1.00 0.00 C ATOM 1084 CG PRO A 76 -8.311 2.680 -24.683 1.00 0.00 C ATOM 1085 CD PRO A 76 -9.470 2.434 -23.699 1.00 0.00 C ATOM 0 HA PRO A 76 -6.813 2.418 -21.669 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -6.313 3.432 -24.202 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.501 1.712 -23.925 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -8.435 3.633 -25.197 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -8.283 1.905 -25.449 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.266 3.167 -23.830 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -9.916 1.450 -23.846 1.00 0.00 H new ATOM 1093 N ASN A 77 -8.332 5.077 -21.638 1.00 0.00 N ATOM 1094 CA ASN A 77 -8.244 6.526 -21.304 1.00 0.00 C ATOM 1095 C ASN A 77 -7.503 6.706 -19.978 1.00 0.00 C ATOM 1096 O ASN A 77 -6.673 7.581 -19.834 1.00 0.00 O ATOM 1097 CB ASN A 77 -9.656 7.104 -21.179 1.00 0.00 C ATOM 1098 CG ASN A 77 -9.870 8.169 -22.256 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -10.083 7.850 -23.409 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -9.820 9.431 -21.928 1.00 0.00 N ATOM 0 H ASN A 77 -9.251 4.656 -21.505 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.702 7.047 -22.094 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -10.396 6.311 -21.285 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -9.796 7.539 -20.190 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -9.960 10.149 -22.639 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -9.641 9.700 -20.960 1.00 0.00 H new ATOM 1107 N ALA A 78 -7.796 5.885 -19.006 1.00 0.00 N ATOM 1108 CA ALA A 78 -7.109 6.012 -17.690 1.00 0.00 C ATOM 1109 C ALA A 78 -5.637 5.622 -17.840 1.00 0.00 C ATOM 1110 O ALA A 78 -4.748 6.342 -17.430 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.783 5.088 -16.674 1.00 0.00 C ATOM 0 H ALA A 78 -8.481 5.132 -19.067 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.175 7.043 -17.344 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.282 5.179 -15.710 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.831 5.369 -16.566 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.717 4.057 -17.021 1.00 0.00 H new ATOM 1117 N PHE A 79 -5.373 4.484 -18.421 1.00 0.00 N ATOM 1118 CA PHE A 79 -3.959 4.045 -18.595 1.00 0.00 C ATOM 1119 C PHE A 79 -3.135 5.188 -19.193 1.00 0.00 C ATOM 1120 O PHE A 79 -1.993 5.396 -18.835 1.00 0.00 O ATOM 1121 CB PHE A 79 -3.912 2.837 -19.532 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.860 1.772 -19.031 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -5.145 1.673 -17.663 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -5.453 0.882 -19.937 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -6.025 0.684 -17.200 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -6.331 -0.106 -19.474 1.00 0.00 C ATOM 1127 CZ PHE A 79 -6.617 -0.205 -18.106 1.00 0.00 C ATOM 0 H PHE A 79 -6.075 3.839 -18.783 1.00 0.00 H new ATOM 0 HA PHE A 79 -3.544 3.770 -17.625 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.187 3.137 -20.543 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.898 2.441 -19.582 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.687 2.358 -16.965 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.233 0.958 -20.992 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -6.246 0.608 -16.146 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -6.788 -0.792 -20.172 1.00 0.00 H new ATOM 0 HZ PHE A 79 -7.294 -0.967 -17.750 1.00 0.00 H new ATOM 1137 N GLU A 80 -3.703 5.929 -20.105 1.00 0.00 N ATOM 1138 CA GLU A 80 -2.949 7.054 -20.726 1.00 0.00 C ATOM 1139 C GLU A 80 -2.659 8.125 -19.672 1.00 0.00 C ATOM 1140 O GLU A 80 -1.551 8.606 -19.552 1.00 0.00 O ATOM 1141 CB GLU A 80 -3.780 7.663 -21.858 1.00 0.00 C ATOM 1142 CG GLU A 80 -2.850 8.351 -22.861 1.00 0.00 C ATOM 1143 CD GLU A 80 -3.078 7.767 -24.257 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -4.141 7.210 -24.477 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -2.187 7.887 -25.080 1.00 0.00 O ATOM 0 H GLU A 80 -4.656 5.804 -20.447 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.007 6.679 -21.127 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.359 6.886 -22.357 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.493 8.382 -21.454 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -3.038 9.425 -22.870 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -1.811 8.212 -22.563 1.00 0.00 H new ATOM 1152 N VAL A 81 -3.646 8.503 -18.907 1.00 0.00 N ATOM 1153 CA VAL A 81 -3.422 9.545 -17.864 1.00 0.00 C ATOM 1154 C VAL A 81 -2.235 9.141 -16.986 1.00 0.00 C ATOM 1155 O VAL A 81 -1.322 9.913 -16.765 1.00 0.00 O ATOM 1156 CB VAL A 81 -4.677 9.677 -17.000 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -4.409 10.655 -15.854 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -5.830 10.204 -17.857 1.00 0.00 C ATOM 0 H VAL A 81 -4.596 8.136 -18.958 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.209 10.501 -18.343 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.940 8.702 -16.591 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -5.304 10.749 -15.239 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -3.586 10.283 -15.243 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.146 11.631 -16.262 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -6.726 10.299 -17.243 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.564 11.179 -18.264 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -6.022 9.510 -18.675 1.00 0.00 H new ATOM 1168 N LEU A 82 -2.241 7.939 -16.481 1.00 0.00 N ATOM 1169 CA LEU A 82 -1.114 7.489 -15.616 1.00 0.00 C ATOM 1170 C LEU A 82 0.204 7.633 -16.377 1.00 0.00 C ATOM 1171 O LEU A 82 1.243 7.879 -15.795 1.00 0.00 O ATOM 1172 CB LEU A 82 -1.323 6.024 -15.228 1.00 0.00 C ATOM 1173 CG LEU A 82 -2.141 5.950 -13.938 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -3.033 4.709 -13.970 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -1.193 5.867 -12.739 1.00 0.00 C ATOM 0 H LEU A 82 -2.977 7.249 -16.630 1.00 0.00 H new ATOM 0 HA LEU A 82 -1.080 8.102 -14.715 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.839 5.495 -16.029 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.360 5.532 -15.089 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.763 6.841 -13.850 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.616 4.656 -13.051 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.707 4.768 -14.824 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.413 3.817 -14.058 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -1.774 5.814 -11.818 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -0.572 4.976 -12.827 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -0.557 6.752 -12.716 1.00 0.00 H new ATOM 1187 N ASN A 83 0.175 7.484 -17.672 1.00 0.00 N ATOM 1188 CA ASN A 83 1.429 7.616 -18.465 1.00 0.00 C ATOM 1189 C ASN A 83 1.983 9.033 -18.303 1.00 0.00 C ATOM 1190 O ASN A 83 3.138 9.225 -17.980 1.00 0.00 O ATOM 1191 CB ASN A 83 1.134 7.348 -19.942 1.00 0.00 C ATOM 1192 CG ASN A 83 1.643 5.957 -20.321 1.00 0.00 C ATOM 1193 OD1 ASN A 83 2.404 5.355 -19.590 1.00 0.00 O ATOM 1194 ND2 ASN A 83 1.251 5.416 -21.442 1.00 0.00 N ATOM 0 H ASN A 83 -0.663 7.277 -18.216 1.00 0.00 H new ATOM 0 HA ASN A 83 2.163 6.893 -18.108 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.062 7.418 -20.128 1.00 0.00 H new ATOM 0 HB3 ASN A 83 1.615 8.104 -20.563 1.00 0.00 H new ATOM 0 HD21 ASN A 83 1.584 4.488 -21.704 1.00 0.00 H new ATOM 0 HD22 ASN A 83 0.612 5.921 -22.056 1.00 0.00 H new ATOM 1201 N GLU A 84 1.166 10.028 -18.519 1.00 0.00 N ATOM 1202 CA GLU A 84 1.646 11.431 -18.373 1.00 0.00 C ATOM 1203 C GLU A 84 2.066 11.671 -16.921 1.00 0.00 C ATOM 1204 O GLU A 84 2.912 12.496 -16.637 1.00 0.00 O ATOM 1205 CB GLU A 84 0.519 12.399 -18.747 1.00 0.00 C ATOM 1206 CG GLU A 84 0.888 13.815 -18.298 1.00 0.00 C ATOM 1207 CD GLU A 84 0.490 14.817 -19.383 1.00 0.00 C ATOM 1208 OE1 GLU A 84 1.199 14.901 -20.373 1.00 0.00 O ATOM 1209 OE2 GLU A 84 -0.516 15.483 -19.206 1.00 0.00 O ATOM 0 H GLU A 84 0.188 9.930 -18.790 1.00 0.00 H new ATOM 0 HA GLU A 84 2.498 11.597 -19.033 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.352 12.380 -19.824 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.413 12.088 -18.275 1.00 0.00 H new ATOM 0 HG2 GLU A 84 0.381 14.055 -17.363 1.00 0.00 H new ATOM 0 HG3 GLU A 84 1.959 13.879 -18.105 1.00 0.00 H new ATOM 1216 N LEU A 85 1.480 10.958 -15.997 1.00 0.00 N ATOM 1217 CA LEU A 85 1.846 11.145 -14.566 1.00 0.00 C ATOM 1218 C LEU A 85 3.238 10.563 -14.314 1.00 0.00 C ATOM 1219 O LEU A 85 3.998 11.068 -13.512 1.00 0.00 O ATOM 1220 CB LEU A 85 0.826 10.425 -13.681 1.00 0.00 C ATOM 1221 CG LEU A 85 -0.295 11.392 -13.299 1.00 0.00 C ATOM 1222 CD1 LEU A 85 -1.500 10.599 -12.788 1.00 0.00 C ATOM 1223 CD2 LEU A 85 0.199 12.334 -12.199 1.00 0.00 C ATOM 0 H LEU A 85 0.763 10.254 -16.173 1.00 0.00 H new ATOM 0 HA LEU A 85 1.849 12.209 -14.328 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.414 9.565 -14.209 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.313 10.044 -12.783 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.587 11.974 -14.173 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.300 11.288 -12.515 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.851 9.926 -13.571 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.208 10.017 -11.914 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.599 13.024 -11.925 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.490 11.752 -11.325 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.058 12.898 -12.562 1.00 0.00 H new ATOM 1235 N GLY A 86 3.578 9.501 -14.992 1.00 0.00 N ATOM 1236 CA GLY A 86 4.919 8.885 -14.791 1.00 0.00 C ATOM 1237 C GLY A 86 4.793 7.686 -13.848 1.00 0.00 C ATOM 1238 O GLY A 86 5.757 7.248 -13.252 1.00 0.00 O ATOM 0 H GLY A 86 2.984 9.033 -15.677 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.332 8.567 -15.748 1.00 0.00 H new ATOM 0 HA3 GLY A 86 5.609 9.618 -14.374 1.00 0.00 H new ATOM 1242 N ILE A 87 3.610 7.154 -13.707 1.00 0.00 N ATOM 1243 CA ILE A 87 3.422 5.985 -12.801 1.00 0.00 C ATOM 1244 C ILE A 87 3.285 4.708 -13.632 1.00 0.00 C ATOM 1245 O ILE A 87 3.028 4.753 -14.819 1.00 0.00 O ATOM 1246 CB ILE A 87 2.156 6.187 -11.967 1.00 0.00 C ATOM 1247 CG1 ILE A 87 2.163 7.591 -11.362 1.00 0.00 C ATOM 1248 CG2 ILE A 87 2.114 5.149 -10.845 1.00 0.00 C ATOM 1249 CD1 ILE A 87 0.871 7.812 -10.573 1.00 0.00 C ATOM 0 H ILE A 87 2.766 7.478 -14.179 1.00 0.00 H new ATOM 0 HA ILE A 87 4.285 5.896 -12.141 1.00 0.00 H new ATOM 0 HB ILE A 87 1.279 6.070 -12.604 1.00 0.00 H new ATOM 0 HG12 ILE A 87 3.027 7.713 -10.708 1.00 0.00 H new ATOM 0 HG13 ILE A 87 2.253 8.338 -12.151 1.00 0.00 H new ATOM 0 HG21 ILE A 87 1.212 5.292 -10.250 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.109 4.148 -11.276 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.991 5.266 -10.208 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.875 8.813 -10.141 1.00 0.00 H new ATOM 0 HD12 ILE A 87 0.015 7.708 -11.240 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.801 7.073 -9.775 1.00 0.00 H new ATOM 1261 N LYS A 88 3.453 3.568 -13.018 1.00 0.00 N ATOM 1262 CA LYS A 88 3.329 2.290 -13.775 1.00 0.00 C ATOM 1263 C LYS A 88 1.885 1.791 -13.690 1.00 0.00 C ATOM 1264 O LYS A 88 1.208 1.988 -12.701 1.00 0.00 O ATOM 1265 CB LYS A 88 4.267 1.243 -13.170 1.00 0.00 C ATOM 1266 CG LYS A 88 5.708 1.544 -13.585 1.00 0.00 C ATOM 1267 CD LYS A 88 6.544 1.854 -12.342 1.00 0.00 C ATOM 1268 CE LYS A 88 7.894 2.438 -12.766 1.00 0.00 C ATOM 1269 NZ LYS A 88 8.904 2.177 -11.701 1.00 0.00 N ATOM 0 H LYS A 88 3.670 3.467 -12.027 1.00 0.00 H new ATOM 0 HA LYS A 88 3.598 2.456 -14.818 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.182 1.249 -12.083 1.00 0.00 H new ATOM 0 HB3 LYS A 88 3.982 0.246 -13.507 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.130 0.691 -14.116 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.731 2.390 -14.272 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.015 2.560 -11.702 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.696 0.947 -11.758 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.217 1.991 -13.706 1.00 0.00 H new ATOM 0 HE3 LYS A 88 7.801 3.510 -12.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 9.822 2.573 -11.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 8.596 2.624 -10.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.000 1.151 -11.557 1.00 0.00 H new ATOM 1283 N ILE A 89 1.405 1.144 -14.719 1.00 0.00 N ATOM 1284 CA ILE A 89 0.006 0.637 -14.689 1.00 0.00 C ATOM 1285 C ILE A 89 0.017 -0.881 -14.871 1.00 0.00 C ATOM 1286 O ILE A 89 0.666 -1.402 -15.757 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.801 1.282 -15.820 1.00 0.00 C ATOM 1288 CG1 ILE A 89 -0.463 2.774 -15.917 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -2.294 1.123 -15.532 1.00 0.00 C ATOM 1290 CD1 ILE A 89 -0.555 3.223 -17.376 1.00 0.00 C ATOM 0 H ILE A 89 1.921 0.946 -15.576 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.452 0.889 -13.733 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.551 0.793 -16.762 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.151 3.355 -15.302 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.540 2.957 -15.532 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.870 1.581 -16.336 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -2.541 0.063 -15.467 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.536 1.611 -14.588 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -0.315 4.284 -17.446 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.151 2.651 -17.978 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.567 3.055 -17.745 1.00 0.00 H new ATOM 1302 N TYR A 90 -0.693 -1.592 -14.038 1.00 0.00 N ATOM 1303 CA TYR A 90 -0.722 -3.078 -14.158 1.00 0.00 C ATOM 1304 C TYR A 90 -2.157 -3.543 -14.414 1.00 0.00 C ATOM 1305 O TYR A 90 -3.105 -2.825 -14.167 1.00 0.00 O ATOM 1306 CB TYR A 90 -0.204 -3.699 -12.861 1.00 0.00 C ATOM 1307 CG TYR A 90 1.015 -2.941 -12.399 1.00 0.00 C ATOM 1308 CD1 TYR A 90 2.270 -3.227 -12.954 1.00 0.00 C ATOM 1309 CD2 TYR A 90 0.892 -1.947 -11.419 1.00 0.00 C ATOM 1310 CE1 TYR A 90 3.401 -2.519 -12.528 1.00 0.00 C ATOM 1311 CE2 TYR A 90 2.024 -1.240 -10.994 1.00 0.00 C ATOM 1312 CZ TYR A 90 3.279 -1.525 -11.548 1.00 0.00 C ATOM 1313 OH TYR A 90 4.393 -0.827 -11.129 1.00 0.00 O ATOM 0 H TYR A 90 -1.255 -1.208 -13.278 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.090 -3.390 -14.989 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.978 -3.668 -12.094 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.045 -4.748 -13.020 1.00 0.00 H new ATOM 0 HD1 TYR A 90 2.365 -3.993 -13.710 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -0.075 -1.726 -10.992 1.00 0.00 H new ATOM 0 HE1 TYR A 90 4.368 -2.739 -12.955 1.00 0.00 H new ATOM 0 HE2 TYR A 90 1.929 -0.474 -10.238 1.00 0.00 H new ATOM 0 HH TYR A 90 5.126 -0.969 -11.764 1.00 0.00 H new ATOM 1323 N ARG A 91 -2.324 -4.739 -14.910 1.00 0.00 N ATOM 1324 CA ARG A 91 -3.699 -5.247 -15.183 1.00 0.00 C ATOM 1325 C ARG A 91 -4.147 -6.159 -14.038 1.00 0.00 C ATOM 1326 O ARG A 91 -3.397 -6.984 -13.558 1.00 0.00 O ATOM 1327 CB ARG A 91 -3.697 -6.039 -16.493 1.00 0.00 C ATOM 1328 CG ARG A 91 -4.546 -5.310 -17.534 1.00 0.00 C ATOM 1329 CD ARG A 91 -4.048 -5.661 -18.937 1.00 0.00 C ATOM 1330 NE ARG A 91 -5.067 -6.498 -19.631 1.00 0.00 N ATOM 1331 CZ ARG A 91 -5.966 -5.936 -20.392 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -5.616 -5.386 -21.522 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -7.218 -5.922 -20.021 1.00 0.00 N ATOM 0 H ARG A 91 -1.569 -5.386 -15.138 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.387 -4.405 -15.265 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.676 -6.155 -16.858 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.091 -7.041 -16.324 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -5.593 -5.593 -17.427 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.489 -4.233 -17.375 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.861 -4.751 -19.506 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.102 -6.198 -18.875 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.062 -7.511 -19.511 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.638 -5.395 -21.812 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -6.320 -4.947 -22.115 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.493 -6.350 -19.137 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -7.921 -5.483 -20.615 1.00 0.00 H new ATOM 1347 N ALA A 92 -5.368 -6.017 -13.599 1.00 0.00 N ATOM 1348 CA ALA A 92 -5.866 -6.876 -12.488 1.00 0.00 C ATOM 1349 C ALA A 92 -6.257 -8.248 -13.041 1.00 0.00 C ATOM 1350 O ALA A 92 -6.988 -8.355 -14.005 1.00 0.00 O ATOM 1351 CB ALA A 92 -7.090 -6.220 -11.846 1.00 0.00 C ATOM 0 H ALA A 92 -6.042 -5.343 -13.962 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.082 -6.994 -11.740 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.455 -6.848 -11.033 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.814 -5.241 -11.453 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.874 -6.103 -12.594 1.00 0.00 H new ATOM 1357 N THR A 93 -5.771 -9.300 -12.439 1.00 0.00 N ATOM 1358 CA THR A 93 -6.115 -10.665 -12.932 1.00 0.00 C ATOM 1359 C THR A 93 -7.624 -10.887 -12.808 1.00 0.00 C ATOM 1360 O THR A 93 -8.251 -11.457 -13.678 1.00 0.00 O ATOM 1361 CB THR A 93 -5.375 -11.717 -12.100 1.00 0.00 C ATOM 1362 OG1 THR A 93 -4.383 -11.084 -11.304 1.00 0.00 O ATOM 1363 CG2 THR A 93 -4.711 -12.733 -13.031 1.00 0.00 C ATOM 0 H THR A 93 -5.152 -9.274 -11.629 1.00 0.00 H new ATOM 0 HA THR A 93 -5.817 -10.756 -13.977 1.00 0.00 H new ATOM 0 HB THR A 93 -6.086 -12.230 -11.452 1.00 0.00 H new ATOM 0 HG1 THR A 93 -3.912 -11.758 -10.771 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.185 -13.481 -12.438 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.473 -13.222 -13.638 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.002 -12.221 -13.681 1.00 0.00 H new ATOM 1371 N GLY A 94 -8.213 -10.437 -11.734 1.00 0.00 N ATOM 1372 CA GLY A 94 -9.682 -10.621 -11.557 1.00 0.00 C ATOM 1373 C GLY A 94 -9.948 -11.761 -10.570 1.00 0.00 C ATOM 1374 O GLY A 94 -11.009 -12.350 -10.561 1.00 0.00 O ATOM 0 H GLY A 94 -7.741 -9.950 -10.972 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -10.132 -9.698 -11.190 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -10.148 -10.843 -12.517 1.00 0.00 H new ATOM 1378 N THR A 95 -8.994 -12.076 -9.736 1.00 0.00 N ATOM 1379 CA THR A 95 -9.200 -13.176 -8.752 1.00 0.00 C ATOM 1380 C THR A 95 -9.360 -12.581 -7.350 1.00 0.00 C ATOM 1381 O THR A 95 -10.459 -12.375 -6.874 1.00 0.00 O ATOM 1382 CB THR A 95 -7.991 -14.114 -8.772 1.00 0.00 C ATOM 1383 OG1 THR A 95 -6.945 -13.520 -9.528 1.00 0.00 O ATOM 1384 CG2 THR A 95 -8.388 -15.448 -9.407 1.00 0.00 C ATOM 0 H THR A 95 -8.083 -11.620 -9.694 1.00 0.00 H new ATOM 0 HA THR A 95 -10.097 -13.736 -9.016 1.00 0.00 H new ATOM 0 HB THR A 95 -7.649 -14.288 -7.752 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.169 -14.119 -9.540 1.00 0.00 H new ATOM 0 HG21 THR A 95 -7.526 -16.115 -9.421 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.190 -15.903 -8.826 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.731 -15.277 -10.427 1.00 0.00 H new ATOM 1392 N SER A 96 -8.271 -12.302 -6.688 1.00 0.00 N ATOM 1393 CA SER A 96 -8.356 -11.717 -5.320 1.00 0.00 C ATOM 1394 C SER A 96 -7.177 -10.766 -5.102 1.00 0.00 C ATOM 1395 O SER A 96 -6.057 -11.058 -5.475 1.00 0.00 O ATOM 1396 CB SER A 96 -8.306 -12.838 -4.280 1.00 0.00 C ATOM 1397 OG SER A 96 -9.616 -13.354 -4.084 1.00 0.00 O ATOM 0 H SER A 96 -7.324 -12.454 -7.036 1.00 0.00 H new ATOM 0 HA SER A 96 -9.292 -11.169 -5.216 1.00 0.00 H new ATOM 0 HB2 SER A 96 -7.637 -13.631 -4.614 1.00 0.00 H new ATOM 0 HB3 SER A 96 -7.907 -12.459 -3.339 1.00 0.00 H new ATOM 0 HG SER A 96 -10.170 -13.145 -4.865 1.00 0.00 H new ATOM 1403 N VAL A 97 -7.418 -9.632 -4.507 1.00 0.00 N ATOM 1404 CA VAL A 97 -6.310 -8.664 -4.272 1.00 0.00 C ATOM 1405 C VAL A 97 -5.286 -9.278 -3.315 1.00 0.00 C ATOM 1406 O VAL A 97 -4.107 -8.994 -3.388 1.00 0.00 O ATOM 1407 CB VAL A 97 -6.875 -7.381 -3.661 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -5.732 -6.412 -3.357 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -7.844 -6.731 -4.649 1.00 0.00 C ATOM 0 H VAL A 97 -8.334 -9.333 -4.173 1.00 0.00 H new ATOM 0 HA VAL A 97 -5.825 -8.432 -5.220 1.00 0.00 H new ATOM 0 HB VAL A 97 -7.402 -7.621 -2.737 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -6.136 -5.498 -2.922 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -5.040 -6.875 -2.653 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -5.204 -6.172 -4.280 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.247 -5.816 -4.215 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -7.316 -6.492 -5.572 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.660 -7.421 -4.865 1.00 0.00 H new ATOM 1419 N GLU A 98 -5.725 -10.116 -2.416 1.00 0.00 N ATOM 1420 CA GLU A 98 -4.772 -10.743 -1.456 1.00 0.00 C ATOM 1421 C GLU A 98 -3.673 -11.474 -2.232 1.00 0.00 C ATOM 1422 O GLU A 98 -2.505 -11.376 -1.914 1.00 0.00 O ATOM 1423 CB GLU A 98 -5.520 -11.740 -0.569 1.00 0.00 C ATOM 1424 CG GLU A 98 -5.125 -11.520 0.892 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.119 -12.861 1.629 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -6.191 -13.397 1.851 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -4.041 -13.329 1.958 1.00 0.00 O ATOM 0 H GLU A 98 -6.700 -10.393 -2.305 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.324 -9.969 -0.833 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.596 -11.613 -0.689 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.283 -12.760 -0.871 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.139 -11.059 0.947 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -5.825 -10.834 1.369 1.00 0.00 H new ATOM 1434 N GLU A 99 -4.039 -12.207 -3.248 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.015 -12.943 -4.042 1.00 0.00 C ATOM 1436 C GLU A 99 -2.267 -11.961 -4.944 1.00 0.00 C ATOM 1437 O GLU A 99 -1.082 -12.097 -5.178 1.00 0.00 O ATOM 1438 CB GLU A 99 -3.705 -14.001 -4.907 1.00 0.00 C ATOM 1439 CG GLU A 99 -4.381 -15.039 -4.007 1.00 0.00 C ATOM 1440 CD GLU A 99 -3.361 -16.104 -3.600 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -2.634 -15.868 -2.649 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -3.324 -17.138 -4.246 1.00 0.00 O ATOM 0 H GLU A 99 -5.002 -12.328 -3.562 1.00 0.00 H new ATOM 0 HA GLU A 99 -2.310 -13.427 -3.366 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.444 -13.530 -5.555 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.976 -14.487 -5.556 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.791 -14.555 -3.120 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -5.216 -15.502 -4.532 1.00 0.00 H new ATOM 1449 N ASN A 100 -2.949 -10.972 -5.456 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.277 -9.982 -6.345 1.00 0.00 C ATOM 1451 C ASN A 100 -1.060 -9.389 -5.629 1.00 0.00 C ATOM 1452 O ASN A 100 -0.035 -9.139 -6.231 1.00 0.00 O ATOM 1453 CB ASN A 100 -3.259 -8.863 -6.693 1.00 0.00 C ATOM 1454 CG ASN A 100 -4.488 -9.459 -7.383 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -4.598 -10.661 -7.521 1.00 0.00 O ATOM 1456 ND2 ASN A 100 -5.422 -8.664 -7.826 1.00 0.00 N ATOM 0 H ASN A 100 -3.943 -10.807 -5.297 1.00 0.00 H new ATOM 0 HA ASN A 100 -1.951 -10.479 -7.259 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -3.558 -8.333 -5.789 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -2.780 -8.134 -7.346 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -6.245 -9.051 -8.288 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.330 -7.655 -7.710 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.167 -9.160 -4.348 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.017 -8.581 -3.597 1.00 0.00 C ATOM 1465 C LEU A 101 1.256 -9.370 -3.916 1.00 0.00 C ATOM 1466 O LEU A 101 2.262 -8.811 -4.306 1.00 0.00 O ATOM 1467 CB LEU A 101 -0.302 -8.655 -2.096 1.00 0.00 C ATOM 1468 CG LEU A 101 -0.307 -7.244 -1.504 1.00 0.00 C ATOM 1469 CD1 LEU A 101 -1.633 -6.555 -1.834 1.00 0.00 C ATOM 1470 CD2 LEU A 101 -0.144 -7.329 0.015 1.00 0.00 C ATOM 0 H LEU A 101 -2.000 -9.349 -3.790 1.00 0.00 H new ATOM 0 HA LEU A 101 0.121 -7.541 -3.891 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.264 -9.137 -1.922 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.454 -9.265 -1.602 1.00 0.00 H new ATOM 0 HG LEU A 101 0.517 -6.670 -1.929 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -1.636 -5.550 -1.412 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -1.752 -6.495 -2.916 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -2.457 -7.129 -1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.147 -6.324 0.438 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -0.968 -7.904 0.438 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.800 -7.820 0.253 1.00 0.00 H new ATOM 1482 N LYS A 102 1.222 -10.665 -3.750 1.00 0.00 N ATOM 1483 CA LYS A 102 2.433 -11.487 -4.041 1.00 0.00 C ATOM 1484 C LYS A 102 2.690 -11.509 -5.550 1.00 0.00 C ATOM 1485 O LYS A 102 3.818 -11.551 -5.996 1.00 0.00 O ATOM 1486 CB LYS A 102 2.209 -12.915 -3.539 1.00 0.00 C ATOM 1487 CG LYS A 102 2.317 -12.943 -2.012 1.00 0.00 C ATOM 1488 CD LYS A 102 3.487 -13.839 -1.600 1.00 0.00 C ATOM 1489 CE LYS A 102 3.182 -14.486 -0.247 1.00 0.00 C ATOM 1490 NZ LYS A 102 3.206 -13.445 0.819 1.00 0.00 N ATOM 0 H LYS A 102 0.409 -11.189 -3.426 1.00 0.00 H new ATOM 0 HA LYS A 102 3.296 -11.054 -3.536 1.00 0.00 H new ATOM 0 HB2 LYS A 102 1.227 -13.272 -3.851 1.00 0.00 H new ATOM 0 HB3 LYS A 102 2.947 -13.586 -3.979 1.00 0.00 H new ATOM 0 HG2 LYS A 102 2.466 -11.934 -1.629 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.389 -13.316 -1.578 1.00 0.00 H new ATOM 0 HD2 LYS A 102 3.653 -14.608 -2.354 1.00 0.00 H new ATOM 0 HD3 LYS A 102 4.403 -13.252 -1.536 1.00 0.00 H new ATOM 0 HE2 LYS A 102 2.206 -14.970 -0.275 1.00 0.00 H new ATOM 0 HE3 LYS A 102 3.916 -15.262 -0.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.117 -13.900 1.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.104 -12.922 0.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 2.414 -12.786 0.678 1.00 0.00 H new ATOM 1504 N LEU A 103 1.651 -11.477 -6.340 1.00 0.00 N ATOM 1505 CA LEU A 103 1.838 -11.496 -7.818 1.00 0.00 C ATOM 1506 C LEU A 103 2.707 -10.307 -8.237 1.00 0.00 C ATOM 1507 O LEU A 103 3.450 -10.376 -9.195 1.00 0.00 O ATOM 1508 CB LEU A 103 0.474 -11.395 -8.504 1.00 0.00 C ATOM 1509 CG LEU A 103 0.034 -12.781 -8.980 1.00 0.00 C ATOM 1510 CD1 LEU A 103 0.899 -13.213 -10.165 1.00 0.00 C ATOM 1511 CD2 LEU A 103 0.196 -13.787 -7.837 1.00 0.00 C ATOM 0 H LEU A 103 0.681 -11.439 -6.025 1.00 0.00 H new ATOM 0 HA LEU A 103 2.326 -12.425 -8.111 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.263 -10.986 -7.812 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.531 -10.710 -9.350 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.011 -12.744 -9.288 1.00 0.00 H new ATOM 0 HD11 LEU A 103 0.585 -14.200 -10.504 1.00 0.00 H new ATOM 0 HD12 LEU A 103 0.785 -12.497 -10.979 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.944 -13.250 -9.858 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.117 -14.775 -8.175 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.241 -13.823 -7.529 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.420 -13.480 -6.992 1.00 0.00 H new ATOM 1523 N PHE A 104 2.613 -9.216 -7.527 1.00 0.00 N ATOM 1524 CA PHE A 104 3.429 -8.021 -7.883 1.00 0.00 C ATOM 1525 C PHE A 104 4.894 -8.266 -7.515 1.00 0.00 C ATOM 1526 O PHE A 104 5.797 -7.874 -8.226 1.00 0.00 O ATOM 1527 CB PHE A 104 2.905 -6.809 -7.113 1.00 0.00 C ATOM 1528 CG PHE A 104 3.657 -5.574 -7.541 1.00 0.00 C ATOM 1529 CD1 PHE A 104 4.967 -5.360 -7.091 1.00 0.00 C ATOM 1530 CD2 PHE A 104 3.044 -4.639 -8.386 1.00 0.00 C ATOM 1531 CE1 PHE A 104 5.664 -4.211 -7.486 1.00 0.00 C ATOM 1532 CE2 PHE A 104 3.742 -3.490 -8.781 1.00 0.00 C ATOM 1533 CZ PHE A 104 5.051 -3.276 -8.331 1.00 0.00 C ATOM 0 H PHE A 104 2.006 -9.101 -6.715 1.00 0.00 H new ATOM 0 HA PHE A 104 3.356 -7.837 -8.955 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.839 -6.681 -7.299 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.025 -6.967 -6.041 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.439 -6.081 -6.440 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.034 -4.804 -8.732 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.673 -4.046 -7.139 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.271 -2.769 -9.433 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.588 -2.390 -8.635 1.00 0.00 H new ATOM 1543 N THR A 105 5.136 -8.909 -6.405 1.00 0.00 N ATOM 1544 CA THR A 105 6.543 -9.175 -5.989 1.00 0.00 C ATOM 1545 C THR A 105 7.167 -10.221 -6.915 1.00 0.00 C ATOM 1546 O THR A 105 8.368 -10.273 -7.087 1.00 0.00 O ATOM 1547 CB THR A 105 6.558 -9.697 -4.550 1.00 0.00 C ATOM 1548 OG1 THR A 105 5.760 -8.853 -3.727 1.00 0.00 O ATOM 1549 CG2 THR A 105 7.995 -9.714 -4.027 1.00 0.00 C ATOM 0 H THR A 105 4.421 -9.261 -5.769 1.00 0.00 H new ATOM 0 HA THR A 105 7.117 -8.251 -6.050 1.00 0.00 H new ATOM 0 HB THR A 105 6.153 -10.709 -4.528 1.00 0.00 H new ATOM 0 HG1 THR A 105 6.200 -8.730 -2.860 1.00 0.00 H new ATOM 0 HG21 THR A 105 8.005 -10.086 -3.002 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.603 -10.365 -4.655 1.00 0.00 H new ATOM 0 HG23 THR A 105 8.403 -8.703 -4.050 1.00 0.00 H new ATOM 1557 N GLU A 106 6.362 -11.057 -7.511 1.00 0.00 N ATOM 1558 CA GLU A 106 6.914 -12.099 -8.423 1.00 0.00 C ATOM 1559 C GLU A 106 7.028 -11.535 -9.840 1.00 0.00 C ATOM 1560 O GLU A 106 7.465 -12.209 -10.751 1.00 0.00 O ATOM 1561 CB GLU A 106 5.982 -13.313 -8.433 1.00 0.00 C ATOM 1562 CG GLU A 106 6.005 -13.985 -7.059 1.00 0.00 C ATOM 1563 CD GLU A 106 4.703 -14.761 -6.848 1.00 0.00 C ATOM 1564 OE1 GLU A 106 3.732 -14.149 -6.437 1.00 0.00 O ATOM 1565 OE2 GLU A 106 4.701 -15.954 -7.104 1.00 0.00 O ATOM 0 H GLU A 106 5.347 -11.064 -7.406 1.00 0.00 H new ATOM 0 HA GLU A 106 7.902 -12.399 -8.072 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.967 -13.003 -8.681 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.296 -14.020 -9.201 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.858 -14.659 -6.986 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.124 -13.235 -6.277 1.00 0.00 H new ATOM 1572 N GLY A 107 6.640 -10.304 -10.036 1.00 0.00 N ATOM 1573 CA GLY A 107 6.729 -9.704 -11.396 1.00 0.00 C ATOM 1574 C GLY A 107 5.879 -10.520 -12.371 1.00 0.00 C ATOM 1575 O GLY A 107 6.124 -10.536 -13.561 1.00 0.00 O ATOM 0 H GLY A 107 6.266 -9.689 -9.313 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.383 -8.671 -11.372 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.767 -9.685 -11.729 1.00 0.00 H new ATOM 1579 N ASN A 108 4.879 -11.199 -11.877 1.00 0.00 N ATOM 1580 CA ASN A 108 4.013 -12.012 -12.776 1.00 0.00 C ATOM 1581 C ASN A 108 2.871 -11.142 -13.306 1.00 0.00 C ATOM 1582 O ASN A 108 2.653 -11.046 -14.497 1.00 0.00 O ATOM 1583 CB ASN A 108 3.437 -13.198 -12.000 1.00 0.00 C ATOM 1584 CG ASN A 108 3.958 -14.502 -12.604 1.00 0.00 C ATOM 1585 OD1 ASN A 108 4.134 -14.603 -13.801 1.00 0.00 O ATOM 1586 ND2 ASN A 108 4.213 -15.514 -11.819 1.00 0.00 N ATOM 0 H ASN A 108 4.625 -11.225 -10.889 1.00 0.00 H new ATOM 0 HA ASN A 108 4.605 -12.383 -13.612 1.00 0.00 H new ATOM 0 HB2 ASN A 108 3.721 -13.132 -10.950 1.00 0.00 H new ATOM 0 HB3 ASN A 108 2.348 -13.177 -12.038 1.00 0.00 H new ATOM 0 HD21 ASN A 108 4.560 -16.389 -12.212 1.00 0.00 H new ATOM 0 HD22 ASN A 108 4.065 -15.429 -10.813 1.00 0.00 H new ATOM 1593 N LEU A 109 2.142 -10.505 -12.431 1.00 0.00 N ATOM 1594 CA LEU A 109 1.017 -9.640 -12.888 1.00 0.00 C ATOM 1595 C LEU A 109 1.558 -8.250 -13.231 1.00 0.00 C ATOM 1596 O LEU A 109 2.269 -7.643 -12.455 1.00 0.00 O ATOM 1597 CB LEU A 109 -0.026 -9.523 -11.775 1.00 0.00 C ATOM 1598 CG LEU A 109 -1.361 -9.072 -12.369 1.00 0.00 C ATOM 1599 CD1 LEU A 109 -2.009 -10.239 -13.116 1.00 0.00 C ATOM 1600 CD2 LEU A 109 -2.290 -8.610 -11.244 1.00 0.00 C ATOM 0 H LEU A 109 2.276 -10.546 -11.421 1.00 0.00 H new ATOM 0 HA LEU A 109 0.553 -10.081 -13.770 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -0.146 -10.483 -11.272 1.00 0.00 H new ATOM 0 HB3 LEU A 109 0.309 -8.809 -11.023 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.189 -8.248 -13.061 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -2.960 -9.917 -13.539 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -1.349 -10.569 -13.918 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -2.180 -11.064 -12.424 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.242 -8.288 -11.667 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.461 -9.434 -10.552 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.830 -7.778 -10.711 1.00 0.00 H new ATOM 1612 N GLU A 110 1.230 -7.741 -14.387 1.00 0.00 N ATOM 1613 CA GLU A 110 1.733 -6.392 -14.773 1.00 0.00 C ATOM 1614 C GLU A 110 0.945 -5.872 -15.977 1.00 0.00 C ATOM 1615 O GLU A 110 -0.092 -6.398 -16.331 1.00 0.00 O ATOM 1616 CB GLU A 110 3.216 -6.487 -15.138 1.00 0.00 C ATOM 1617 CG GLU A 110 4.063 -5.968 -13.975 1.00 0.00 C ATOM 1618 CD GLU A 110 5.091 -7.029 -13.578 1.00 0.00 C ATOM 1619 OE1 GLU A 110 5.952 -7.325 -14.391 1.00 0.00 O ATOM 1620 OE2 GLU A 110 5.001 -7.527 -12.468 1.00 0.00 O ATOM 0 H GLU A 110 0.637 -8.199 -15.079 1.00 0.00 H new ATOM 0 HA GLU A 110 1.605 -5.706 -13.935 1.00 0.00 H new ATOM 0 HB2 GLU A 110 3.481 -7.520 -15.362 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.418 -5.905 -16.037 1.00 0.00 H new ATOM 0 HG2 GLU A 110 4.569 -5.046 -14.263 1.00 0.00 H new ATOM 0 HG3 GLU A 110 3.424 -5.729 -13.125 1.00 0.00 H new ATOM 1627 N GLU A 111 1.431 -4.839 -16.609 1.00 0.00 N ATOM 1628 CA GLU A 111 0.720 -4.276 -17.790 1.00 0.00 C ATOM 1629 C GLU A 111 1.592 -3.199 -18.442 1.00 0.00 C ATOM 1630 O GLU A 111 2.647 -3.484 -18.973 1.00 0.00 O ATOM 1631 CB GLU A 111 -0.629 -3.695 -17.347 1.00 0.00 C ATOM 1632 CG GLU A 111 -1.422 -3.252 -18.578 1.00 0.00 C ATOM 1633 CD GLU A 111 -2.614 -2.398 -18.137 1.00 0.00 C ATOM 1634 OE1 GLU A 111 -2.791 -2.236 -16.942 1.00 0.00 O ATOM 1635 OE2 GLU A 111 -3.327 -1.921 -19.004 1.00 0.00 O ATOM 0 H GLU A 111 2.295 -4.359 -16.356 1.00 0.00 H new ATOM 0 HA GLU A 111 0.533 -5.061 -18.522 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -1.193 -4.442 -16.787 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -0.471 -2.848 -16.679 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -0.781 -2.682 -19.251 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -1.771 -4.123 -19.132 1.00 0.00 H new ATOM 1642 N ILE A 112 1.169 -1.974 -18.408 1.00 0.00 N ATOM 1643 CA ILE A 112 1.980 -0.888 -19.027 1.00 0.00 C ATOM 1644 C ILE A 112 3.067 -0.450 -18.047 1.00 0.00 C ATOM 1645 O ILE A 112 2.841 -0.357 -16.857 1.00 0.00 O ATOM 1646 CB ILE A 112 1.079 0.304 -19.358 1.00 0.00 C ATOM 1647 CG1 ILE A 112 0.140 -0.070 -20.507 1.00 0.00 C ATOM 1648 CG2 ILE A 112 1.941 1.496 -19.777 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -1.275 0.413 -20.188 1.00 0.00 C ATOM 0 H ILE A 112 0.295 -1.672 -17.978 1.00 0.00 H new ATOM 0 HA ILE A 112 2.440 -1.255 -19.944 1.00 0.00 H new ATOM 0 HB ILE A 112 0.493 0.569 -18.478 1.00 0.00 H new ATOM 0 HG12 ILE A 112 0.488 0.380 -21.437 1.00 0.00 H new ATOM 0 HG13 ILE A 112 0.142 -1.150 -20.656 1.00 0.00 H new ATOM 0 HG21 ILE A 112 1.299 2.345 -20.013 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.612 1.764 -18.961 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.527 1.230 -20.656 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -1.944 0.147 -21.007 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -1.622 -0.058 -19.268 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -1.270 1.496 -20.061 1.00 0.00 H new ATOM 1661 N ARG A 113 4.248 -0.182 -18.534 1.00 0.00 N ATOM 1662 CA ARG A 113 5.346 0.247 -17.624 1.00 0.00 C ATOM 1663 C ARG A 113 6.170 1.347 -18.296 1.00 0.00 C ATOM 1664 O ARG A 113 6.177 1.483 -19.503 1.00 0.00 O ATOM 1665 CB ARG A 113 6.251 -0.949 -17.317 1.00 0.00 C ATOM 1666 CG ARG A 113 6.945 -1.408 -18.601 1.00 0.00 C ATOM 1667 CD ARG A 113 8.395 -0.920 -18.601 1.00 0.00 C ATOM 1668 NE ARG A 113 9.189 -1.721 -17.628 1.00 0.00 N ATOM 1669 CZ ARG A 113 9.234 -3.021 -17.736 1.00 0.00 C ATOM 1670 NH1 ARG A 113 8.841 -3.598 -18.839 1.00 0.00 N ATOM 1671 NH2 ARG A 113 9.674 -3.743 -16.742 1.00 0.00 N ATOM 0 H ARG A 113 4.499 -0.242 -19.521 1.00 0.00 H new ATOM 0 HA ARG A 113 4.918 0.629 -16.697 1.00 0.00 H new ATOM 0 HB2 ARG A 113 6.994 -0.674 -16.568 1.00 0.00 H new ATOM 0 HB3 ARG A 113 5.663 -1.765 -16.897 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.916 -2.495 -18.674 1.00 0.00 H new ATOM 0 HG3 ARG A 113 6.418 -1.016 -19.471 1.00 0.00 H new ATOM 0 HD2 ARG A 113 8.822 -1.014 -19.600 1.00 0.00 H new ATOM 0 HD3 ARG A 113 8.434 0.137 -18.336 1.00 0.00 H new ATOM 0 HE ARG A 113 9.697 -1.254 -16.877 1.00 0.00 H new ATOM 0 HH11 ARG A 113 8.499 -3.033 -19.616 1.00 0.00 H new ATOM 0 HH12 ARG A 113 8.876 -4.614 -18.924 1.00 0.00 H new ATOM 0 HH21 ARG A 113 9.983 -3.291 -15.881 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.709 -4.759 -16.826 1.00 0.00 H new