USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 747 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+ -167:sc= -0.214 (180deg=-0.24) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0968 USER MOD Single : A 3 MET CE :methyl 168:sc= 0 (180deg=-0.108) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= -0.0128 X(o=-0.013,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 1.44 K(o=1.4,f=-0.25) USER MOD Single : A 20 SER OG : rot -140:sc= 0 USER MOD Single : A 25 SER OG : rot 33:sc= 1.1 USER MOD Single : A 28 LYS NZ :NH3+ -164:sc= 0.877 (180deg=0.0792!) USER MOD Single : A 32 MET CE :methyl -129:sc= -0.426 (180deg=-1.45) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 98:sc= 1.17 USER MOD Single : A 40 GLN : amide:sc= 0.306 X(o=0.31,f=-0.0035) USER MOD Single : A 48 CYS SG : rot 56:sc= -0.125 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.0838 X(o=-0.084,f=-0.03) USER MOD Single : A 60 ASN : amide:sc= 0.514 K(o=0.51,f=-1.7!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -172:sc= 0 (180deg=-0.0626) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -169:sc= -0.0134 (180deg=-0.195) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 177:sc= 1.17 (180deg=1.11) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.375 3.930 1.896 1.00 25.00 N ATOM 2 CA GLY A 1 3.560 4.442 0.499 1.00 25.00 C ATOM 3 C GLY A 1 4.973 4.905 0.215 1.00 25.00 C ATOM 4 O GLY A 1 5.402 5.214 -0.876 1.00 25.00 O ATOM 0 H1 GLY A 1 2.466 3.430 1.965 1.00 25.00 H new ATOM 0 H2 GLY A 1 4.148 3.276 2.131 1.00 25.00 H new ATOM 0 H3 GLY A 1 3.383 4.729 2.562 1.00 25.00 H new ATOM 0 HA2 GLY A 1 3.293 3.656 -0.207 1.00 25.00 H new ATOM 0 HA3 GLY A 1 2.872 5.270 0.329 1.00 25.00 H new ATOM 9 N SER A 2 5.730 4.933 1.305 1.00 25.00 N ATOM 10 CA SER A 2 7.126 5.360 1.321 1.00 25.00 C ATOM 11 C SER A 2 8.077 4.194 1.027 1.00 25.00 C ATOM 12 O SER A 2 8.977 3.898 1.816 1.00 25.00 O ATOM 13 CB SER A 2 7.436 5.978 2.684 1.00 25.00 C ATOM 14 OG SER A 2 6.829 5.217 3.718 1.00 25.00 O ATOM 0 H SER A 2 5.384 4.654 2.223 1.00 25.00 H new ATOM 0 HA SER A 2 7.278 6.100 0.535 1.00 25.00 H new ATOM 0 HB2 SER A 2 8.515 6.017 2.837 1.00 25.00 H new ATOM 0 HB3 SER A 2 7.072 7.005 2.717 1.00 25.00 H new ATOM 0 HG SER A 2 7.036 5.621 4.586 1.00 25.00 H new ATOM 20 N MET A 3 7.894 3.546 -0.117 1.00 25.00 N ATOM 21 CA MET A 3 8.783 2.454 -0.539 1.00 25.00 C ATOM 22 C MET A 3 10.118 3.033 -1.013 1.00 25.00 C ATOM 23 O MET A 3 10.339 3.250 -2.201 1.00 25.00 O ATOM 24 CB MET A 3 8.163 1.619 -1.666 1.00 25.00 C ATOM 25 CG MET A 3 6.900 0.859 -1.268 1.00 25.00 C ATOM 26 SD MET A 3 5.387 1.840 -1.429 1.00 25.00 S ATOM 27 CE MET A 3 5.171 1.902 -3.226 1.00 25.00 C ATOM 0 H MET A 3 7.141 3.752 -0.773 1.00 25.00 H new ATOM 0 HA MET A 3 8.938 1.800 0.319 1.00 25.00 H new ATOM 0 HB2 MET A 3 7.928 2.278 -2.502 1.00 25.00 H new ATOM 0 HB3 MET A 3 8.905 0.904 -2.022 1.00 25.00 H new ATOM 0 HG2 MET A 3 6.812 -0.034 -1.887 1.00 25.00 H new ATOM 0 HG3 MET A 3 6.998 0.523 -0.236 1.00 25.00 H new ATOM 0 HE1 MET A 3 4.178 2.285 -3.460 1.00 25.00 H new ATOM 0 HE2 MET A 3 5.925 2.558 -3.661 1.00 25.00 H new ATOM 0 HE3 MET A 3 5.280 0.900 -3.640 1.00 25.00 H new ATOM 37 N LYS A 4 10.993 3.312 -0.059 1.00 25.00 N ATOM 38 CA LYS A 4 12.309 3.891 -0.334 1.00 25.00 C ATOM 39 C LYS A 4 13.372 2.817 -0.163 1.00 25.00 C ATOM 40 O LYS A 4 14.564 3.090 -0.176 1.00 25.00 O ATOM 41 CB LYS A 4 12.553 5.062 0.633 1.00 25.00 C ATOM 42 CG LYS A 4 13.568 6.108 0.152 1.00 25.00 C ATOM 43 CD LYS A 4 13.055 6.890 -1.057 1.00 25.00 C ATOM 44 CE LYS A 4 14.104 7.878 -1.538 1.00 25.00 C ATOM 45 NZ LYS A 4 13.623 8.626 -2.746 1.00 25.00 N ATOM 0 H LYS A 4 10.815 3.145 0.931 1.00 25.00 H new ATOM 0 HA LYS A 4 12.355 4.266 -1.357 1.00 25.00 H new ATOM 0 HB2 LYS A 4 11.602 5.561 0.820 1.00 25.00 H new ATOM 0 HB3 LYS A 4 12.895 4.659 1.586 1.00 25.00 H new ATOM 0 HG2 LYS A 4 13.788 6.800 0.965 1.00 25.00 H new ATOM 0 HG3 LYS A 4 14.504 5.613 -0.107 1.00 25.00 H new ATOM 0 HD2 LYS A 4 12.801 6.200 -1.862 1.00 25.00 H new ATOM 0 HD3 LYS A 4 12.141 7.422 -0.792 1.00 25.00 H new ATOM 0 HE2 LYS A 4 14.339 8.582 -0.740 1.00 25.00 H new ATOM 0 HE3 LYS A 4 15.026 7.348 -1.777 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 14.357 9.295 -3.055 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 13.422 7.953 -3.513 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 12.756 9.149 -2.508 1.00 25.00 H new ATOM 59 N TYR A 5 12.905 1.599 0.040 1.00 25.00 N ATOM 60 CA TYR A 5 13.759 0.473 0.358 1.00 25.00 C ATOM 61 C TYR A 5 13.361 -0.758 -0.442 1.00 25.00 C ATOM 62 O TYR A 5 12.334 -0.769 -1.106 1.00 25.00 O ATOM 63 CB TYR A 5 13.631 0.195 1.849 1.00 25.00 C ATOM 64 CG TYR A 5 14.415 1.175 2.689 1.00 25.00 C ATOM 65 CD1 TYR A 5 15.823 1.240 2.590 1.00 25.00 C ATOM 66 CD2 TYR A 5 13.766 2.041 3.590 1.00 25.00 C ATOM 67 CE1 TYR A 5 16.570 2.135 3.392 1.00 25.00 C ATOM 68 CE2 TYR A 5 14.514 2.943 4.393 1.00 25.00 C ATOM 69 CZ TYR A 5 15.912 2.974 4.289 1.00 25.00 C ATOM 70 OH TYR A 5 16.643 3.830 5.071 1.00 25.00 O ATOM 0 H TYR A 5 11.914 1.363 -0.012 1.00 25.00 H new ATOM 0 HA TYR A 5 14.791 0.710 0.100 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.580 0.236 2.134 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.978 -0.817 2.058 1.00 25.00 H new ATOM 0 HD1 TYR A 5 16.337 0.597 1.891 1.00 25.00 H new ATOM 0 HD2 TYR A 5 12.689 2.019 3.671 1.00 25.00 H new ATOM 0 HE1 TYR A 5 17.646 2.168 3.309 1.00 25.00 H new ATOM 0 HE2 TYR A 5 14.007 3.603 5.082 1.00 25.00 H new ATOM 0 HH TYR A 5 16.038 4.348 5.642 1.00 25.00 H new ATOM 80 N LEU A 6 14.186 -1.793 -0.357 1.00 25.00 N ATOM 81 CA LEU A 6 13.946 -3.059 -1.044 1.00 25.00 C ATOM 82 C LEU A 6 12.699 -3.745 -0.478 1.00 25.00 C ATOM 83 O LEU A 6 11.917 -4.324 -1.222 1.00 25.00 O ATOM 84 CB LEU A 6 15.157 -3.988 -0.863 1.00 25.00 C ATOM 85 CG LEU A 6 16.538 -3.504 -1.329 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.596 -4.545 -0.930 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.586 -3.273 -2.836 1.00 25.00 C ATOM 0 H LEU A 6 15.045 -1.780 0.193 1.00 25.00 H new ATOM 0 HA LEU A 6 13.793 -2.854 -2.104 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.232 -4.229 0.197 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.940 -4.919 -1.387 1.00 25.00 H new ATOM 0 HG LEU A 6 16.742 -2.548 -0.846 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.580 -4.208 -1.258 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.596 -4.667 0.153 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.363 -5.499 -1.402 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.581 -2.932 -3.120 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.360 -4.205 -3.354 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.851 -2.517 -3.112 1.00 25.00 H new ATOM 99 N ASN A 7 12.541 -3.669 0.843 1.00 25.00 N ATOM 100 CA ASN A 7 11.385 -4.233 1.564 1.00 25.00 C ATOM 101 C ASN A 7 11.136 -5.721 1.242 1.00 25.00 C ATOM 102 O ASN A 7 10.026 -6.121 0.900 1.00 25.00 O ATOM 103 CB ASN A 7 10.121 -3.389 1.287 1.00 25.00 C ATOM 104 CG ASN A 7 10.231 -1.978 1.828 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.161 -1.004 1.099 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.386 -1.865 3.121 1.00 25.00 N ATOM 0 H ASN A 7 13.216 -3.210 1.455 1.00 25.00 H new ATOM 0 HA ASN A 7 11.622 -4.190 2.627 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.944 -3.349 0.212 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.256 -3.879 1.734 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.452 -0.941 3.548 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.441 -2.701 3.703 1.00 25.00 H new ATOM 113 N VAL A 8 12.175 -6.537 1.381 1.00 25.00 N ATOM 114 CA VAL A 8 12.094 -7.978 1.093 1.00 25.00 C ATOM 115 C VAL A 8 12.173 -8.739 2.411 1.00 25.00 C ATOM 116 O VAL A 8 12.590 -8.183 3.413 1.00 25.00 O ATOM 117 CB VAL A 8 13.246 -8.436 0.106 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.800 -7.247 -0.660 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.406 -9.123 0.831 1.00 25.00 C ATOM 0 H VAL A 8 13.095 -6.228 1.694 1.00 25.00 H new ATOM 0 HA VAL A 8 11.148 -8.194 0.597 1.00 25.00 H new ATOM 0 HB VAL A 8 12.790 -9.154 -0.576 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.590 -7.583 -1.332 1.00 25.00 H new ATOM 0 HG12 VAL A 8 13.002 -6.784 -1.241 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.207 -6.519 0.042 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.166 -9.415 0.106 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.841 -8.434 1.555 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.038 -10.009 1.348 1.00 25.00 H new ATOM 129 N LEU A 9 11.811 -10.011 2.416 1.00 25.00 N ATOM 130 CA LEU A 9 11.938 -10.831 3.625 1.00 25.00 C ATOM 131 C LEU A 9 13.186 -11.707 3.542 1.00 25.00 C ATOM 132 O LEU A 9 13.513 -12.243 2.476 1.00 25.00 O ATOM 133 CB LEU A 9 10.696 -11.707 3.811 1.00 25.00 C ATOM 134 CG LEU A 9 9.363 -10.957 3.986 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.226 -11.970 4.111 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.379 -10.043 5.216 1.00 25.00 C ATOM 0 H LEU A 9 11.429 -10.502 1.607 1.00 25.00 H new ATOM 0 HA LEU A 9 12.029 -10.166 4.484 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.608 -12.367 2.948 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.850 -12.342 4.683 1.00 25.00 H new ATOM 0 HG LEU A 9 9.213 -10.327 3.109 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.280 -11.442 4.235 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.184 -12.583 3.211 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.401 -12.609 4.977 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.420 -9.533 5.303 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.554 -10.640 6.111 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.174 -9.305 5.111 1.00 25.00 H new ATOM 148 N ALA A 10 13.873 -11.863 4.664 1.00 25.00 N ATOM 149 CA ALA A 10 15.071 -12.699 4.737 1.00 25.00 C ATOM 150 C ALA A 10 15.036 -13.558 6.003 1.00 25.00 C ATOM 151 O ALA A 10 14.525 -13.119 7.025 1.00 25.00 O ATOM 152 CB ALA A 10 16.310 -11.826 4.728 1.00 25.00 C ATOM 0 H ALA A 10 13.621 -11.418 5.547 1.00 25.00 H new ATOM 0 HA ALA A 10 15.099 -13.358 3.869 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.199 -12.455 4.783 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.336 -11.240 3.809 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.288 -11.154 5.586 1.00 25.00 H new ATOM 158 N LYS A 11 15.587 -14.767 5.925 1.00 25.00 N ATOM 159 CA LYS A 11 15.647 -15.688 7.065 1.00 25.00 C ATOM 160 C LYS A 11 17.055 -15.798 7.620 1.00 25.00 C ATOM 161 O LYS A 11 18.018 -15.930 6.866 1.00 25.00 O ATOM 162 CB LYS A 11 15.194 -17.092 6.647 1.00 25.00 C ATOM 163 CG LYS A 11 15.327 -18.143 7.763 1.00 25.00 C ATOM 164 CD LYS A 11 14.540 -19.418 7.498 1.00 25.00 C ATOM 165 CE LYS A 11 13.053 -19.209 7.771 1.00 25.00 C ATOM 166 NZ LYS A 11 12.277 -20.492 7.822 1.00 25.00 N ATOM 0 H LYS A 11 16.005 -15.139 5.072 1.00 25.00 H new ATOM 0 HA LYS A 11 14.985 -15.285 7.831 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.154 -17.047 6.324 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.781 -17.412 5.786 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.380 -18.396 7.889 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.990 -17.707 8.703 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.683 -19.730 6.463 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.920 -20.222 8.129 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.934 -18.682 8.718 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.634 -18.569 6.995 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.275 -20.285 8.010 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.363 -20.986 6.911 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.654 -21.096 8.580 1.00 25.00 H new ATOM 180 N ALA A 12 17.155 -15.822 8.935 1.00 25.00 N ATOM 181 CA ALA A 12 18.413 -16.060 9.624 1.00 25.00 C ATOM 182 C ALA A 12 18.808 -17.541 9.510 1.00 25.00 C ATOM 183 O ALA A 12 18.038 -18.414 9.906 1.00 25.00 O ATOM 184 CB ALA A 12 18.238 -15.664 11.076 1.00 25.00 C ATOM 0 H ALA A 12 16.363 -15.676 9.561 1.00 25.00 H new ATOM 0 HA ALA A 12 19.209 -15.468 9.173 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.170 -15.834 11.614 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.972 -14.609 11.136 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.446 -16.264 11.524 1.00 25.00 H new ATOM 190 N LEU A 13 19.995 -17.833 8.992 1.00 25.00 N ATOM 191 CA LEU A 13 20.472 -19.220 8.920 1.00 25.00 C ATOM 192 C LEU A 13 21.168 -19.579 10.210 1.00 25.00 C ATOM 193 O LEU A 13 21.359 -20.745 10.509 1.00 25.00 O ATOM 194 CB LEU A 13 21.498 -19.418 7.805 1.00 25.00 C ATOM 195 CG LEU A 13 21.126 -19.232 6.336 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.651 -19.531 6.044 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.495 -17.838 5.907 1.00 25.00 C ATOM 0 H LEU A 13 20.643 -17.140 8.618 1.00 25.00 H new ATOM 0 HA LEU A 13 19.598 -19.844 8.732 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.325 -18.738 8.011 1.00 25.00 H new ATOM 0 HB3 LEU A 13 21.886 -20.432 7.908 1.00 25.00 H new ATOM 0 HG LEU A 13 21.691 -19.960 5.755 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.452 -19.380 4.983 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.429 -20.564 6.311 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.021 -18.862 6.630 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.232 -17.698 4.858 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.954 -17.114 6.516 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.567 -17.690 6.035 1.00 25.00 H new ATOM 209 N TYR A 14 21.566 -18.557 10.944 1.00 25.00 N ATOM 210 CA TYR A 14 22.299 -18.711 12.189 1.00 25.00 C ATOM 211 C TYR A 14 21.774 -17.611 13.078 1.00 25.00 C ATOM 212 O TYR A 14 21.185 -16.660 12.576 1.00 25.00 O ATOM 213 CB TYR A 14 23.796 -18.517 11.956 1.00 25.00 C ATOM 214 CG TYR A 14 24.350 -19.405 10.865 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.761 -20.721 11.142 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.447 -18.940 9.538 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.264 -21.557 10.114 1.00 25.00 C ATOM 218 CE2 TYR A 14 24.936 -19.779 8.504 1.00 25.00 C ATOM 219 CZ TYR A 14 25.339 -21.082 8.806 1.00 25.00 C ATOM 220 OH TYR A 14 25.817 -21.896 7.814 1.00 25.00 O ATOM 0 H TYR A 14 21.388 -17.585 10.691 1.00 25.00 H new ATOM 0 HA TYR A 14 22.167 -19.703 12.622 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.985 -17.475 11.698 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.330 -18.717 12.885 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.692 -21.100 12.151 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.144 -17.930 9.305 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.589 -22.561 10.344 1.00 25.00 H new ATOM 0 HE2 TYR A 14 24.996 -19.413 7.490 1.00 25.00 H new ATOM 0 HH TYR A 14 25.803 -21.414 6.961 1.00 25.00 H new ATOM 230 N ASP A 15 21.984 -17.715 14.375 1.00 25.00 N ATOM 231 CA ASP A 15 21.596 -16.649 15.288 1.00 25.00 C ATOM 232 C ASP A 15 22.648 -15.546 15.215 1.00 25.00 C ATOM 233 O ASP A 15 23.713 -15.718 14.609 1.00 25.00 O ATOM 234 CB ASP A 15 21.486 -17.186 16.716 1.00 25.00 C ATOM 235 CG ASP A 15 22.777 -17.797 17.203 1.00 25.00 C ATOM 236 OD1 ASP A 15 23.462 -17.180 18.037 1.00 25.00 O ATOM 237 OD2 ASP A 15 23.084 -18.928 16.763 1.00 25.00 O ATOM 0 H ASP A 15 22.419 -18.522 14.823 1.00 25.00 H new ATOM 0 HA ASP A 15 20.622 -16.252 15.003 1.00 25.00 H new ATOM 0 HB2 ASP A 15 21.196 -16.375 17.385 1.00 25.00 H new ATOM 0 HB3 ASP A 15 20.694 -17.934 16.760 1.00 25.00 H new ATOM 242 N ASN A 16 22.343 -14.406 15.808 1.00 25.00 N ATOM 243 CA ASN A 16 23.266 -13.287 15.833 1.00 25.00 C ATOM 244 C ASN A 16 23.127 -12.535 17.137 1.00 25.00 C ATOM 245 O ASN A 16 22.014 -12.253 17.584 1.00 25.00 O ATOM 246 CB ASN A 16 22.995 -12.328 14.677 1.00 25.00 C ATOM 247 CG ASN A 16 24.129 -11.362 14.476 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.271 -11.776 14.312 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.846 -10.095 14.526 1.00 25.00 N ATOM 0 H ASN A 16 21.457 -14.231 16.282 1.00 25.00 H new ATOM 0 HA ASN A 16 24.277 -13.683 15.735 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.836 -12.898 13.761 1.00 25.00 H new ATOM 0 HB3 ASN A 16 22.076 -11.775 14.871 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.588 -9.402 14.427 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.882 -9.793 14.664 1.00 25.00 H new ATOM 256 N VAL A 17 24.255 -12.177 17.721 1.00 25.00 N ATOM 257 CA VAL A 17 24.286 -11.382 18.933 1.00 25.00 C ATOM 258 C VAL A 17 24.803 -10.036 18.482 1.00 25.00 C ATOM 259 O VAL A 17 25.829 -9.949 17.806 1.00 25.00 O ATOM 260 CB VAL A 17 25.211 -12.008 20.011 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.270 -11.118 21.262 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.701 -13.413 20.390 1.00 25.00 C ATOM 0 H VAL A 17 25.178 -12.430 17.367 1.00 25.00 H new ATOM 0 HA VAL A 17 23.305 -11.317 19.404 1.00 25.00 H new ATOM 0 HB VAL A 17 26.216 -12.089 19.597 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.924 -11.576 22.004 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.659 -10.136 20.992 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.269 -11.009 21.679 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.355 -13.846 21.147 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.688 -13.338 20.786 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.698 -14.050 19.506 1.00 25.00 H new ATOM 272 N ALA A 18 24.035 -9.008 18.789 1.00 25.00 N ATOM 273 CA ALA A 18 24.370 -7.656 18.397 1.00 25.00 C ATOM 274 C ALA A 18 25.490 -7.151 19.303 1.00 25.00 C ATOM 275 O ALA A 18 25.366 -7.189 20.526 1.00 25.00 O ATOM 276 CB ALA A 18 23.137 -6.771 18.511 1.00 25.00 C ATOM 0 H ALA A 18 23.165 -9.088 19.315 1.00 25.00 H new ATOM 0 HA ALA A 18 24.709 -7.632 17.361 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.391 -5.753 18.215 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.353 -7.154 17.858 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.783 -6.772 19.542 1.00 25.00 H new ATOM 282 N GLU A 19 26.580 -6.711 18.697 1.00 25.00 N ATOM 283 CA GLU A 19 27.741 -6.216 19.440 1.00 25.00 C ATOM 284 C GLU A 19 27.828 -4.704 19.313 1.00 25.00 C ATOM 285 O GLU A 19 28.382 -4.021 20.169 1.00 25.00 O ATOM 286 CB GLU A 19 29.015 -6.863 18.894 1.00 25.00 C ATOM 287 CG GLU A 19 29.050 -8.365 19.125 1.00 25.00 C ATOM 288 CD GLU A 19 30.303 -9.019 18.564 1.00 25.00 C ATOM 289 OE1 GLU A 19 31.127 -9.523 19.352 1.00 25.00 O ATOM 290 OE2 GLU A 19 30.417 -9.106 17.318 1.00 25.00 O ATOM 0 H GLU A 19 26.691 -6.684 17.683 1.00 25.00 H new ATOM 0 HA GLU A 19 27.633 -6.476 20.493 1.00 25.00 H new ATOM 0 HB2 GLU A 19 29.092 -6.661 17.826 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.883 -6.405 19.368 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.989 -8.565 20.195 1.00 25.00 H new ATOM 0 HG3 GLU A 19 28.172 -8.819 18.666 1.00 25.00 H new ATOM 297 N SER A 20 27.243 -4.185 18.246 1.00 25.00 N ATOM 298 CA SER A 20 27.215 -2.748 18.000 1.00 25.00 C ATOM 299 C SER A 20 25.809 -2.230 18.244 1.00 25.00 C ATOM 300 O SER A 20 24.835 -2.970 18.104 1.00 25.00 O ATOM 301 CB SER A 20 27.655 -2.470 16.566 1.00 25.00 C ATOM 302 OG SER A 20 28.971 -2.950 16.372 1.00 25.00 O ATOM 0 H SER A 20 26.777 -4.741 17.529 1.00 25.00 H new ATOM 0 HA SER A 20 27.900 -2.236 18.676 1.00 25.00 H new ATOM 0 HB2 SER A 20 26.974 -2.953 15.866 1.00 25.00 H new ATOM 0 HB3 SER A 20 27.614 -1.400 16.363 1.00 25.00 H new ATOM 0 HG SER A 20 29.474 -2.313 15.823 1.00 25.00 H new ATOM 308 N PRO A 21 25.675 -0.943 18.601 1.00 25.00 N ATOM 309 CA PRO A 21 24.344 -0.400 18.885 1.00 25.00 C ATOM 310 C PRO A 21 23.463 -0.280 17.646 1.00 25.00 C ATOM 311 O PRO A 21 22.251 -0.119 17.759 1.00 25.00 O ATOM 312 CB PRO A 21 24.659 0.975 19.479 1.00 25.00 C ATOM 313 CG PRO A 21 25.953 1.350 18.853 1.00 25.00 C ATOM 314 CD PRO A 21 26.723 0.081 18.788 1.00 25.00 C ATOM 0 HA PRO A 21 23.770 -1.049 19.546 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.878 1.699 19.246 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.739 0.932 20.565 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.804 1.774 17.860 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.476 2.101 19.445 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.434 0.084 17.962 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.294 -0.090 19.700 1.00 25.00 H new ATOM 322 N ASP A 22 24.059 -0.395 16.470 1.00 25.00 N ATOM 323 CA ASP A 22 23.321 -0.311 15.226 1.00 25.00 C ATOM 324 C ASP A 22 22.917 -1.694 14.757 1.00 25.00 C ATOM 325 O ASP A 22 22.268 -1.823 13.753 1.00 25.00 O ATOM 326 CB ASP A 22 24.200 0.327 14.146 1.00 25.00 C ATOM 327 CG ASP A 22 23.506 1.475 13.425 1.00 25.00 C ATOM 328 OD1 ASP A 22 22.643 2.141 14.035 1.00 25.00 O ATOM 329 OD2 ASP A 22 23.808 1.687 12.232 1.00 25.00 O ATOM 0 H ASP A 22 25.061 -0.548 16.354 1.00 25.00 H new ATOM 0 HA ASP A 22 22.430 0.294 15.396 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.120 0.693 14.602 1.00 25.00 H new ATOM 0 HB3 ASP A 22 24.485 -0.434 13.419 1.00 25.00 H new ATOM 334 N GLU A 23 23.358 -2.735 15.449 1.00 25.00 N ATOM 335 CA GLU A 23 23.162 -4.107 14.987 1.00 25.00 C ATOM 336 C GLU A 23 21.916 -4.769 15.593 1.00 25.00 C ATOM 337 O GLU A 23 21.534 -4.487 16.728 1.00 25.00 O ATOM 338 CB GLU A 23 24.421 -4.924 15.317 1.00 25.00 C ATOM 339 CG GLU A 23 24.478 -6.282 14.634 1.00 25.00 C ATOM 340 CD GLU A 23 25.738 -7.062 14.956 1.00 25.00 C ATOM 341 OE1 GLU A 23 25.925 -8.136 14.342 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.514 -6.659 15.852 1.00 25.00 O ATOM 0 H GLU A 23 23.856 -2.658 16.336 1.00 25.00 H new ATOM 0 HA GLU A 23 22.997 -4.080 13.910 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.300 -4.348 15.030 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.474 -5.070 16.396 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.609 -6.868 14.933 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.411 -6.142 13.555 1.00 25.00 H new ATOM 349 N LEU A 24 21.297 -5.665 14.836 1.00 25.00 N ATOM 350 CA LEU A 24 20.156 -6.440 15.328 1.00 25.00 C ATOM 351 C LEU A 24 20.586 -7.799 15.853 1.00 25.00 C ATOM 352 O LEU A 24 21.461 -8.459 15.294 1.00 25.00 O ATOM 353 CB LEU A 24 19.124 -6.670 14.224 1.00 25.00 C ATOM 354 CG LEU A 24 18.337 -5.435 13.771 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.395 -5.812 12.635 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.550 -4.834 14.936 1.00 25.00 C ATOM 0 H LEU A 24 21.564 -5.877 13.875 1.00 25.00 H new ATOM 0 HA LEU A 24 19.717 -5.855 16.136 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.636 -7.088 13.357 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.414 -7.422 14.569 1.00 25.00 H new ATOM 0 HG LEU A 24 19.042 -4.684 13.416 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.838 -4.931 12.317 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.973 -6.198 11.796 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.699 -6.577 12.978 1.00 25.00 H new ATOM 0 HD21 LEU A 24 17.000 -3.959 14.590 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.849 -5.574 15.322 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.239 -4.540 15.727 1.00 25.00 H new ATOM 368 N SER A 25 19.902 -8.247 16.895 1.00 25.00 N ATOM 369 CA SER A 25 20.128 -9.563 17.465 1.00 25.00 C ATOM 370 C SER A 25 18.887 -10.390 17.200 1.00 25.00 C ATOM 371 O SER A 25 17.765 -9.930 17.409 1.00 25.00 O ATOM 372 CB SER A 25 20.390 -9.472 18.970 1.00 25.00 C ATOM 373 OG SER A 25 20.663 -10.751 19.519 1.00 25.00 O ATOM 0 H SER A 25 19.176 -7.708 17.367 1.00 25.00 H new ATOM 0 HA SER A 25 21.006 -10.022 17.011 1.00 25.00 H new ATOM 0 HB2 SER A 25 21.232 -8.806 19.156 1.00 25.00 H new ATOM 0 HB3 SER A 25 19.523 -9.037 19.467 1.00 25.00 H new ATOM 0 HG SER A 25 21.136 -11.297 18.857 1.00 25.00 H new ATOM 379 N PHE A 26 19.103 -11.596 16.708 1.00 25.00 N ATOM 380 CA PHE A 26 18.013 -12.519 16.377 1.00 25.00 C ATOM 381 C PHE A 26 18.445 -13.973 16.491 1.00 25.00 C ATOM 382 O PHE A 26 19.623 -14.272 16.666 1.00 25.00 O ATOM 383 CB PHE A 26 17.495 -12.249 14.963 1.00 25.00 C ATOM 384 CG PHE A 26 18.566 -12.198 13.913 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.210 -13.369 13.463 1.00 25.00 C ATOM 386 CD2 PHE A 26 18.902 -10.971 13.326 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.170 -13.309 12.420 1.00 25.00 C ATOM 388 CE2 PHE A 26 19.839 -10.903 12.294 1.00 25.00 C ATOM 389 CZ PHE A 26 20.469 -12.080 11.822 1.00 25.00 C ATOM 0 H PHE A 26 20.034 -11.970 16.524 1.00 25.00 H new ATOM 0 HA PHE A 26 17.215 -12.345 17.099 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.778 -13.026 14.697 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.955 -11.302 14.961 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.970 -14.320 13.916 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.429 -10.065 13.677 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.668 -14.208 12.089 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.085 -9.948 11.853 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.175 -12.029 11.006 1.00 25.00 H new ATOM 399 N ARG A 27 17.483 -14.877 16.377 1.00 25.00 N ATOM 400 CA ARG A 27 17.720 -16.307 16.472 1.00 25.00 C ATOM 401 C ARG A 27 17.696 -16.926 15.076 1.00 25.00 C ATOM 402 O ARG A 27 17.052 -16.410 14.168 1.00 25.00 O ATOM 403 CB ARG A 27 16.605 -16.912 17.337 1.00 25.00 C ATOM 404 CG ARG A 27 16.853 -18.326 17.837 1.00 25.00 C ATOM 405 CD ARG A 27 17.926 -18.356 18.928 1.00 25.00 C ATOM 406 NE ARG A 27 18.203 -19.729 19.386 1.00 25.00 N ATOM 407 CZ ARG A 27 17.496 -20.396 20.295 1.00 25.00 C ATOM 408 NH1 ARG A 27 16.441 -19.883 20.882 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.862 -21.607 20.617 1.00 25.00 N ATOM 0 H ARG A 27 16.506 -14.634 16.214 1.00 25.00 H new ATOM 0 HA ARG A 27 18.694 -16.506 16.920 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.447 -16.264 18.199 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.680 -16.907 16.761 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.925 -18.743 18.227 1.00 25.00 H new ATOM 0 HG3 ARG A 27 17.162 -18.958 17.005 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.844 -17.908 18.547 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.602 -17.749 19.773 1.00 25.00 H new ATOM 0 HE ARG A 27 19.003 -20.208 18.972 1.00 25.00 H new ATOM 0 HH11 ARG A 27 16.135 -18.939 20.647 1.00 25.00 H new ATOM 0 HH12 ARG A 27 15.927 -20.428 21.574 1.00 25.00 H new ATOM 0 HH21 ARG A 27 18.679 -22.028 20.174 1.00 25.00 H new ATOM 0 HH22 ARG A 27 17.331 -22.132 21.312 1.00 25.00 H new ATOM 423 N LYS A 28 18.362 -18.060 14.921 1.00 25.00 N ATOM 424 CA LYS A 28 18.296 -18.833 13.683 1.00 25.00 C ATOM 425 C LYS A 28 16.834 -19.151 13.387 1.00 25.00 C ATOM 426 O LYS A 28 16.108 -19.619 14.258 1.00 25.00 O ATOM 427 CB LYS A 28 19.089 -20.134 13.854 1.00 25.00 C ATOM 428 CG LYS A 28 18.962 -21.102 12.689 1.00 25.00 C ATOM 429 CD LYS A 28 19.880 -22.303 12.879 1.00 25.00 C ATOM 430 CE LYS A 28 19.746 -23.292 11.727 1.00 25.00 C ATOM 431 NZ LYS A 28 20.692 -24.435 11.897 1.00 25.00 N ATOM 0 H LYS A 28 18.959 -18.470 15.640 1.00 25.00 H new ATOM 0 HA LYS A 28 18.723 -18.263 12.858 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.142 -19.888 13.994 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.754 -20.633 14.764 1.00 25.00 H new ATOM 0 HG2 LYS A 28 17.929 -21.439 12.601 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.211 -20.592 11.758 1.00 25.00 H new ATOM 0 HD2 LYS A 28 20.914 -21.965 12.952 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.640 -22.801 13.818 1.00 25.00 H new ATOM 0 HE2 LYS A 28 18.723 -23.665 11.679 1.00 25.00 H new ATOM 0 HE3 LYS A 28 19.946 -22.786 10.782 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.785 -24.945 10.996 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 21.623 -24.075 12.189 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 20.327 -25.082 12.625 1.00 25.00 H new ATOM 445 N GLY A 29 16.426 -18.903 12.151 1.00 25.00 N ATOM 446 CA GLY A 29 15.066 -19.168 11.718 1.00 25.00 C ATOM 447 C GLY A 29 14.178 -17.939 11.683 1.00 25.00 C ATOM 448 O GLY A 29 13.103 -17.989 11.081 1.00 25.00 O ATOM 0 H GLY A 29 17.027 -18.514 11.424 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.093 -19.612 10.723 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.621 -19.906 12.385 1.00 25.00 H new ATOM 452 N ASP A 30 14.614 -16.846 12.296 1.00 25.00 N ATOM 453 CA ASP A 30 13.808 -15.625 12.367 1.00 25.00 C ATOM 454 C ASP A 30 13.719 -14.970 11.004 1.00 25.00 C ATOM 455 O ASP A 30 14.594 -15.161 10.152 1.00 25.00 O ATOM 456 CB ASP A 30 14.420 -14.619 13.352 1.00 25.00 C ATOM 457 CG ASP A 30 14.174 -14.995 14.808 1.00 25.00 C ATOM 458 OD1 ASP A 30 14.815 -14.386 15.692 1.00 25.00 O ATOM 459 OD2 ASP A 30 13.339 -15.884 15.072 1.00 25.00 O ATOM 0 H ASP A 30 15.523 -16.776 12.753 1.00 25.00 H new ATOM 0 HA ASP A 30 12.813 -15.909 12.710 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.493 -14.551 13.175 1.00 25.00 H new ATOM 0 HB3 ASP A 30 14.003 -13.630 13.161 1.00 25.00 H new ATOM 464 N ILE A 31 12.670 -14.182 10.807 1.00 25.00 N ATOM 465 CA ILE A 31 12.456 -13.452 9.561 1.00 25.00 C ATOM 466 C ILE A 31 12.520 -11.964 9.853 1.00 25.00 C ATOM 467 O ILE A 31 11.838 -11.476 10.750 1.00 25.00 O ATOM 468 CB ILE A 31 11.059 -13.759 8.933 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.910 -15.261 8.630 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.850 -12.935 7.631 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.981 -15.850 7.724 1.00 25.00 C ATOM 0 H ILE A 31 11.943 -14.030 11.506 1.00 25.00 H new ATOM 0 HA ILE A 31 13.228 -13.762 8.857 1.00 25.00 H new ATOM 0 HB ILE A 31 10.298 -13.473 9.659 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.914 -15.807 9.573 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.936 -15.427 8.170 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.871 -13.163 7.209 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.907 -11.871 7.861 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.625 -13.192 6.909 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.786 -16.912 7.572 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.966 -15.337 6.762 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.959 -15.724 8.187 1.00 25.00 H new ATOM 483 N MET A 32 13.304 -11.240 9.070 1.00 25.00 N ATOM 484 CA MET A 32 13.384 -9.790 9.182 1.00 25.00 C ATOM 485 C MET A 32 13.141 -9.173 7.825 1.00 25.00 C ATOM 486 O MET A 32 13.310 -9.826 6.788 1.00 25.00 O ATOM 487 CB MET A 32 14.747 -9.359 9.721 1.00 25.00 C ATOM 488 CG MET A 32 15.932 -9.902 8.953 1.00 25.00 C ATOM 489 SD MET A 32 17.225 -10.369 10.098 1.00 25.00 S ATOM 490 CE MET A 32 16.517 -11.911 10.822 1.00 25.00 C ATOM 0 H MET A 32 13.900 -11.636 8.343 1.00 25.00 H new ATOM 0 HA MET A 32 12.623 -9.447 9.883 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.796 -8.270 9.716 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.828 -9.677 10.760 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.629 -10.764 8.359 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.303 -9.150 8.257 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.550 -11.851 11.910 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.483 -12.025 10.496 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.099 -12.770 10.488 1.00 25.00 H new ATOM 500 N THR A 33 12.732 -7.918 7.840 1.00 25.00 N ATOM 501 CA THR A 33 12.472 -7.178 6.608 1.00 25.00 C ATOM 502 C THR A 33 13.744 -6.469 6.194 1.00 25.00 C ATOM 503 O THR A 33 14.203 -5.594 6.905 1.00 25.00 O ATOM 504 CB THR A 33 11.375 -6.115 6.813 1.00 25.00 C ATOM 505 OG1 THR A 33 10.154 -6.763 7.179 1.00 25.00 O ATOM 506 CG2 THR A 33 11.134 -5.313 5.544 1.00 25.00 C ATOM 0 H THR A 33 12.571 -7.383 8.693 1.00 25.00 H new ATOM 0 HA THR A 33 12.140 -7.884 5.846 1.00 25.00 H new ATOM 0 HB THR A 33 11.707 -5.436 7.598 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.454 -6.090 7.312 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.355 -4.573 5.724 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.055 -4.807 5.253 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.820 -5.983 4.744 1.00 25.00 H new ATOM 514 N VAL A 34 14.319 -6.844 5.064 1.00 25.00 N ATOM 515 CA VAL A 34 15.533 -6.203 4.568 1.00 25.00 C ATOM 516 C VAL A 34 15.141 -4.925 3.878 1.00 25.00 C ATOM 517 O VAL A 34 14.300 -4.916 2.974 1.00 25.00 O ATOM 518 CB VAL A 34 16.300 -7.089 3.580 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.626 -6.434 3.154 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.557 -8.437 4.207 1.00 25.00 C ATOM 0 H VAL A 34 13.965 -7.592 4.468 1.00 25.00 H new ATOM 0 HA VAL A 34 16.191 -6.017 5.417 1.00 25.00 H new ATOM 0 HB VAL A 34 15.692 -7.215 2.684 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.146 -7.087 2.453 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.421 -5.477 2.674 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.251 -6.273 4.032 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.102 -9.067 3.504 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.148 -8.310 5.114 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.607 -8.910 4.456 1.00 25.00 H new ATOM 530 N LEU A 35 15.739 -3.841 4.325 1.00 25.00 N ATOM 531 CA LEU A 35 15.462 -2.531 3.794 1.00 25.00 C ATOM 532 C LEU A 35 16.498 -2.212 2.734 1.00 25.00 C ATOM 533 O LEU A 35 16.151 -1.869 1.618 1.00 25.00 O ATOM 534 CB LEU A 35 15.495 -1.522 4.933 1.00 25.00 C ATOM 535 CG LEU A 35 14.453 -1.798 6.029 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.712 -0.892 7.188 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.027 -1.600 5.517 1.00 25.00 C ATOM 0 H LEU A 35 16.434 -3.848 5.071 1.00 25.00 H new ATOM 0 HA LEU A 35 14.475 -2.491 3.334 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.489 -1.523 5.380 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.329 -0.524 4.528 1.00 25.00 H new ATOM 0 HG LEU A 35 14.546 -2.839 6.338 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.977 -1.082 7.970 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.713 -1.078 7.578 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.636 0.146 6.863 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.320 -1.805 6.321 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.902 -0.572 5.177 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.840 -2.282 4.687 1.00 25.00 H new ATOM 549 N GLU A 36 17.766 -2.411 3.043 1.00 25.00 N ATOM 550 CA GLU A 36 18.812 -2.248 2.035 1.00 25.00 C ATOM 551 C GLU A 36 19.973 -3.169 2.357 1.00 25.00 C ATOM 552 O GLU A 36 19.996 -3.792 3.414 1.00 25.00 O ATOM 553 CB GLU A 36 19.268 -0.784 1.933 1.00 25.00 C ATOM 554 CG GLU A 36 20.241 -0.330 2.935 1.00 25.00 C ATOM 555 CD GLU A 36 20.460 1.168 2.884 1.00 25.00 C ATOM 556 OE1 GLU A 36 20.386 1.811 3.954 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.716 1.705 1.792 1.00 25.00 O ATOM 0 H GLU A 36 18.099 -2.682 3.968 1.00 25.00 H new ATOM 0 HA GLU A 36 18.408 -2.521 1.060 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.699 -0.629 0.944 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.386 -0.146 2.000 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.894 -0.611 3.929 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.191 -0.840 2.773 1.00 25.00 H new ATOM 564 N ARG A 37 20.932 -3.264 1.453 1.00 25.00 N ATOM 565 CA ARG A 37 22.117 -4.078 1.668 1.00 25.00 C ATOM 566 C ARG A 37 23.312 -3.179 1.499 1.00 25.00 C ATOM 567 O ARG A 37 23.235 -2.224 0.740 1.00 25.00 O ATOM 568 CB ARG A 37 22.214 -5.182 0.629 1.00 25.00 C ATOM 569 CG ARG A 37 21.040 -6.146 0.588 1.00 25.00 C ATOM 570 CD ARG A 37 21.339 -7.339 -0.343 1.00 25.00 C ATOM 571 NE ARG A 37 21.761 -6.895 -1.689 1.00 25.00 N ATOM 572 CZ ARG A 37 23.024 -6.750 -2.094 1.00 25.00 C ATOM 573 NH1 ARG A 37 24.044 -7.049 -1.334 1.00 25.00 N ATOM 574 NH2 ARG A 37 23.263 -6.273 -3.283 1.00 25.00 N ATOM 0 H ARG A 37 20.913 -2.782 0.554 1.00 25.00 H new ATOM 0 HA ARG A 37 22.072 -4.530 2.659 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.320 -4.724 -0.354 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.124 -5.753 0.814 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.827 -6.509 1.594 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.148 -5.624 0.242 1.00 25.00 H new ATOM 0 HD2 ARG A 37 22.122 -7.956 0.098 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.450 -7.964 -0.429 1.00 25.00 H new ATOM 0 HE ARG A 37 21.026 -6.682 -2.363 1.00 25.00 H new ATOM 0 HH11 ARG A 37 23.890 -7.408 -0.392 1.00 25.00 H new ATOM 0 HH12 ARG A 37 24.994 -6.923 -1.683 1.00 25.00 H new ATOM 0 HH21 ARG A 37 22.488 -6.015 -3.894 1.00 25.00 H new ATOM 0 HH22 ARG A 37 24.225 -6.158 -3.603 1.00 25.00 H new ATOM 588 N ASP A 38 24.392 -3.513 2.189 1.00 25.00 N ATOM 589 CA ASP A 38 25.674 -2.809 2.095 1.00 25.00 C ATOM 590 C ASP A 38 25.456 -1.340 2.484 1.00 25.00 C ATOM 591 O ASP A 38 26.019 -0.399 1.922 1.00 25.00 O ATOM 592 CB ASP A 38 26.286 -3.034 0.705 1.00 25.00 C ATOM 593 CG ASP A 38 26.236 -4.517 0.287 1.00 25.00 C ATOM 594 OD1 ASP A 38 26.506 -5.401 1.149 1.00 25.00 O ATOM 595 OD2 ASP A 38 25.783 -4.810 -0.847 1.00 25.00 O ATOM 0 H ASP A 38 24.408 -4.295 2.844 1.00 25.00 H new ATOM 0 HA ASP A 38 26.411 -3.202 2.796 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.750 -2.432 -0.029 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.321 -2.692 0.704 1.00 25.00 H new ATOM 600 N THR A 39 24.568 -1.191 3.457 1.00 25.00 N ATOM 601 CA THR A 39 24.115 0.102 3.963 1.00 25.00 C ATOM 602 C THR A 39 25.252 0.872 4.612 1.00 25.00 C ATOM 603 O THR A 39 26.144 0.281 5.185 1.00 25.00 O ATOM 604 CB THR A 39 22.984 -0.106 5.004 1.00 25.00 C ATOM 605 OG1 THR A 39 22.540 1.151 5.518 1.00 25.00 O ATOM 606 CG2 THR A 39 23.412 -0.983 6.142 1.00 25.00 C ATOM 0 H THR A 39 24.131 -1.983 3.929 1.00 25.00 H new ATOM 0 HA THR A 39 23.744 0.679 3.116 1.00 25.00 H new ATOM 0 HB THR A 39 22.166 -0.604 4.484 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.727 1.428 5.047 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.586 -1.098 6.843 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.701 -1.961 5.758 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.261 -0.528 6.653 1.00 25.00 H new ATOM 614 N GLN A 40 25.214 2.194 4.493 1.00 25.00 N ATOM 615 CA GLN A 40 26.236 3.104 5.047 1.00 25.00 C ATOM 616 C GLN A 40 27.651 2.824 4.524 1.00 25.00 C ATOM 617 O GLN A 40 28.631 3.315 5.073 1.00 25.00 O ATOM 618 CB GLN A 40 26.229 3.075 6.586 1.00 25.00 C ATOM 619 CG GLN A 40 24.842 3.076 7.193 1.00 25.00 C ATOM 620 CD GLN A 40 24.853 3.426 8.665 1.00 25.00 C ATOM 621 OE1 GLN A 40 25.183 4.537 9.044 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.481 2.485 9.491 1.00 25.00 N ATOM 0 H GLN A 40 24.464 2.682 4.003 1.00 25.00 H new ATOM 0 HA GLN A 40 25.961 4.101 4.701 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.763 2.187 6.925 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.779 3.939 6.958 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.215 3.790 6.658 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.390 2.093 7.060 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.212 1.569 9.133 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.459 2.667 10.494 1.00 25.00 H new ATOM 631 N GLY A 41 27.750 2.027 3.469 1.00 25.00 N ATOM 632 CA GLY A 41 29.045 1.645 2.928 1.00 25.00 C ATOM 633 C GLY A 41 29.645 0.493 3.712 1.00 25.00 C ATOM 634 O GLY A 41 30.819 0.162 3.552 1.00 25.00 O ATOM 0 H GLY A 41 26.951 1.634 2.972 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.936 1.359 1.882 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.721 2.500 2.956 1.00 25.00 H new ATOM 638 N LEU A 42 28.839 -0.122 4.565 1.00 25.00 N ATOM 639 CA LEU A 42 29.267 -1.244 5.370 1.00 25.00 C ATOM 640 C LEU A 42 29.021 -2.489 4.540 1.00 25.00 C ATOM 641 O LEU A 42 27.946 -3.077 4.578 1.00 25.00 O ATOM 642 CB LEU A 42 28.461 -1.287 6.665 1.00 25.00 C ATOM 643 CG LEU A 42 28.523 -0.028 7.530 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.438 -0.102 8.571 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.866 0.107 8.203 1.00 25.00 C ATOM 0 H LEU A 42 27.867 0.148 4.715 1.00 25.00 H new ATOM 0 HA LEU A 42 30.319 -1.166 5.643 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.418 -1.482 6.415 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.810 -2.131 7.260 1.00 25.00 H new ATOM 0 HG LEU A 42 28.379 0.845 6.893 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.471 0.791 9.195 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.467 -0.166 8.080 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.589 -0.985 9.192 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.879 1.012 8.811 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.043 -0.760 8.839 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.648 0.167 7.446 1.00 25.00 H new ATOM 657 N ASP A 43 29.992 -2.843 3.725 1.00 25.00 N ATOM 658 CA ASP A 43 29.832 -3.978 2.823 1.00 25.00 C ATOM 659 C ASP A 43 29.548 -5.235 3.624 1.00 25.00 C ATOM 660 O ASP A 43 30.186 -5.505 4.648 1.00 25.00 O ATOM 661 CB ASP A 43 31.080 -4.204 1.989 1.00 25.00 C ATOM 662 CG ASP A 43 30.757 -4.607 0.564 1.00 25.00 C ATOM 663 OD1 ASP A 43 30.605 -5.821 0.307 1.00 25.00 O ATOM 664 OD2 ASP A 43 30.652 -3.713 -0.300 1.00 25.00 O ATOM 0 H ASP A 43 30.894 -2.371 3.664 1.00 25.00 H new ATOM 0 HA ASP A 43 28.999 -3.755 2.156 1.00 25.00 H new ATOM 0 HB2 ASP A 43 31.677 -3.292 1.979 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.689 -4.979 2.454 1.00 25.00 H new ATOM 669 N GLY A 44 28.562 -5.991 3.182 1.00 25.00 N ATOM 670 CA GLY A 44 28.190 -7.205 3.875 1.00 25.00 C ATOM 671 C GLY A 44 27.177 -6.989 4.989 1.00 25.00 C ATOM 672 O GLY A 44 26.545 -7.955 5.434 1.00 25.00 O ATOM 0 H GLY A 44 28.008 -5.786 2.351 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.779 -7.912 3.155 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.086 -7.662 4.295 1.00 25.00 H new ATOM 676 N TRP A 45 26.994 -5.755 5.442 1.00 25.00 N ATOM 677 CA TRP A 45 26.014 -5.448 6.467 1.00 25.00 C ATOM 678 C TRP A 45 24.721 -5.031 5.787 1.00 25.00 C ATOM 679 O TRP A 45 24.722 -4.197 4.896 1.00 25.00 O ATOM 680 CB TRP A 45 26.549 -4.306 7.316 1.00 25.00 C ATOM 681 CG TRP A 45 27.594 -4.759 8.278 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.934 -4.556 8.203 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.388 -5.494 9.490 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.583 -5.090 9.275 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.663 -5.694 10.089 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.249 -5.998 10.138 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.817 -6.390 11.304 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.397 -6.681 11.357 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.680 -6.876 11.925 1.00 25.00 C ATOM 0 H TRP A 45 27.519 -4.946 5.109 1.00 25.00 H new ATOM 0 HA TRP A 45 25.826 -6.315 7.101 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.966 -3.537 6.666 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.726 -3.848 7.865 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.425 -4.036 7.394 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.588 -5.047 9.443 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.269 -5.862 9.704 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.794 -6.540 11.738 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.524 -7.061 11.866 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.772 -7.413 12.858 1.00 25.00 H new ATOM 700 N TRP A 46 23.610 -5.625 6.185 1.00 25.00 N ATOM 701 CA TRP A 46 22.329 -5.363 5.536 1.00 25.00 C ATOM 702 C TRP A 46 21.374 -4.727 6.529 1.00 25.00 C ATOM 703 O TRP A 46 21.179 -5.242 7.620 1.00 25.00 O ATOM 704 CB TRP A 46 21.740 -6.671 4.990 1.00 25.00 C ATOM 705 CG TRP A 46 22.597 -7.331 3.910 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.738 -6.851 3.339 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.370 -8.605 3.274 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.235 -7.700 2.401 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.427 -8.801 2.333 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.384 -9.604 3.403 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.509 -9.953 1.522 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.480 -10.769 2.608 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.531 -10.924 1.667 1.00 25.00 C ATOM 0 H TRP A 46 23.565 -6.293 6.954 1.00 25.00 H new ATOM 0 HA TRP A 46 22.481 -4.677 4.703 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.609 -7.371 5.815 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.749 -6.470 4.582 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.193 -5.907 3.601 1.00 25.00 H new ATOM 0 HE1 TRP A 46 25.072 -7.542 1.840 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.567 -9.481 4.099 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.311 -10.074 0.809 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.744 -11.551 2.718 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.569 -11.813 1.054 1.00 25.00 H new ATOM 724 N LEU A 47 20.791 -3.601 6.152 1.00 25.00 N ATOM 725 CA LEU A 47 19.848 -2.901 7.011 1.00 25.00 C ATOM 726 C LEU A 47 18.554 -3.676 7.009 1.00 25.00 C ATOM 727 O LEU A 47 17.955 -3.873 5.955 1.00 25.00 O ATOM 728 CB LEU A 47 19.586 -1.493 6.475 1.00 25.00 C ATOM 729 CG LEU A 47 18.591 -0.633 7.263 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.026 -0.436 8.704 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.418 0.715 6.578 1.00 25.00 C ATOM 0 H LEU A 47 20.955 -3.150 5.252 1.00 25.00 H new ATOM 0 HA LEU A 47 20.256 -2.822 8.019 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.537 -0.962 6.433 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.224 -1.580 5.450 1.00 25.00 H new ATOM 0 HG LEU A 47 17.637 -1.160 7.280 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.292 0.179 9.225 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.102 -1.405 9.197 1.00 25.00 H new ATOM 0 HD13 LEU A 47 19.996 0.060 8.727 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.710 1.322 7.142 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.379 1.227 6.534 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.041 0.563 5.567 1.00 25.00 H new ATOM 743 N CYS A 48 18.109 -4.105 8.174 1.00 25.00 N ATOM 744 CA CYS A 48 16.858 -4.826 8.287 1.00 25.00 C ATOM 745 C CYS A 48 16.046 -4.302 9.450 1.00 25.00 C ATOM 746 O CYS A 48 16.531 -3.523 10.263 1.00 25.00 O ATOM 747 CB CYS A 48 17.113 -6.332 8.458 1.00 25.00 C ATOM 748 SG CYS A 48 18.327 -7.011 7.296 1.00 25.00 S ATOM 0 H CYS A 48 18.598 -3.966 9.058 1.00 25.00 H new ATOM 0 HA CYS A 48 16.293 -4.671 7.368 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.456 -6.519 9.476 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.171 -6.866 8.336 1.00 25.00 H new ATOM 0 HG CYS A 48 19.441 -6.348 7.395 1.00 25.00 H new ATOM 754 N SER A 49 14.805 -4.748 9.522 1.00 25.00 N ATOM 755 CA SER A 49 13.907 -4.382 10.600 1.00 25.00 C ATOM 756 C SER A 49 13.344 -5.659 11.210 1.00 25.00 C ATOM 757 O SER A 49 12.854 -6.545 10.489 1.00 25.00 O ATOM 758 CB SER A 49 12.808 -3.470 10.062 1.00 25.00 C ATOM 759 OG SER A 49 11.553 -4.125 10.002 1.00 25.00 O ATOM 0 H SER A 49 14.391 -5.376 8.833 1.00 25.00 H new ATOM 0 HA SER A 49 14.434 -3.830 11.378 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.726 -2.588 10.697 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.082 -3.121 9.066 1.00 25.00 H new ATOM 0 HG SER A 49 10.877 -3.506 9.654 1.00 25.00 H new ATOM 765 N LEU A 50 13.464 -5.770 12.525 1.00 25.00 N ATOM 766 CA LEU A 50 13.045 -6.952 13.274 1.00 25.00 C ATOM 767 C LEU A 50 12.574 -6.484 14.646 1.00 25.00 C ATOM 768 O LEU A 50 13.198 -5.614 15.230 1.00 25.00 O ATOM 769 CB LEU A 50 14.238 -7.889 13.447 1.00 25.00 C ATOM 770 CG LEU A 50 13.960 -9.189 14.206 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.927 -10.361 13.277 1.00 25.00 C ATOM 772 CD2 LEU A 50 15.019 -9.369 15.272 1.00 25.00 C ATOM 0 H LEU A 50 13.859 -5.035 13.111 1.00 25.00 H new ATOM 0 HA LEU A 50 12.249 -7.479 12.749 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.623 -8.142 12.459 1.00 25.00 H new ATOM 0 HB3 LEU A 50 15.028 -7.348 13.968 1.00 25.00 H new ATOM 0 HG LEU A 50 12.979 -9.128 14.677 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.728 -11.270 13.845 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.141 -10.216 12.536 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.889 -10.452 12.772 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.831 -10.293 15.819 1.00 25.00 H new ATOM 0 HD22 LEU A 50 16.002 -9.419 14.804 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.988 -8.526 15.962 1.00 25.00 H new ATOM 784 N HIS A 51 11.462 -7.029 15.129 1.00 25.00 N ATOM 785 CA HIS A 51 10.882 -6.660 16.439 1.00 25.00 C ATOM 786 C HIS A 51 10.606 -5.149 16.547 1.00 25.00 C ATOM 787 O HIS A 51 10.680 -4.573 17.623 1.00 25.00 O ATOM 788 CB HIS A 51 11.807 -7.090 17.599 1.00 25.00 C ATOM 789 CG HIS A 51 12.094 -8.560 17.639 1.00 25.00 C ATOM 790 ND1 HIS A 51 13.163 -9.118 18.295 1.00 25.00 N ATOM 791 CD2 HIS A 51 11.424 -9.616 17.099 1.00 25.00 C ATOM 792 CE1 HIS A 51 13.108 -10.438 18.135 1.00 25.00 C ATOM 793 NE2 HIS A 51 12.063 -10.796 17.416 1.00 25.00 N ATOM 0 H HIS A 51 10.928 -7.741 14.631 1.00 25.00 H new ATOM 0 HA HIS A 51 9.933 -7.190 16.514 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.750 -6.549 17.518 1.00 25.00 H new ATOM 0 HB3 HIS A 51 11.350 -6.794 18.543 1.00 25.00 H new ATOM 0 HD2 HIS A 51 10.523 -9.540 16.508 1.00 25.00 H new ATOM 0 HE1 HIS A 51 13.830 -11.130 18.543 1.00 25.00 H new ATOM 0 HE2 HIS A 51 11.787 -11.742 17.151 1.00 25.00 H new ATOM 801 N GLY A 52 10.301 -4.512 15.421 1.00 25.00 N ATOM 802 CA GLY A 52 10.043 -3.076 15.417 1.00 25.00 C ATOM 803 C GLY A 52 11.293 -2.230 15.608 1.00 25.00 C ATOM 804 O GLY A 52 11.205 -1.036 15.872 1.00 25.00 O ATOM 0 H GLY A 52 10.227 -4.961 14.508 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.571 -2.803 14.473 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.332 -2.841 16.209 1.00 25.00 H new ATOM 808 N ARG A 53 12.461 -2.846 15.477 1.00 25.00 N ATOM 809 CA ARG A 53 13.740 -2.175 15.664 1.00 25.00 C ATOM 810 C ARG A 53 14.482 -2.311 14.351 1.00 25.00 C ATOM 811 O ARG A 53 14.424 -3.355 13.713 1.00 25.00 O ATOM 812 CB ARG A 53 14.510 -2.870 16.798 1.00 25.00 C ATOM 813 CG ARG A 53 15.367 -1.955 17.677 1.00 25.00 C ATOM 814 CD ARG A 53 16.694 -1.587 17.026 1.00 25.00 C ATOM 815 NE ARG A 53 17.646 -1.067 18.017 1.00 25.00 N ATOM 816 CZ ARG A 53 18.902 -0.707 17.766 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.433 -0.749 16.572 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.640 -0.299 18.752 1.00 25.00 N ATOM 0 H ARG A 53 12.547 -3.833 15.236 1.00 25.00 H new ATOM 0 HA ARG A 53 13.622 -1.125 15.934 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.793 -3.388 17.435 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.156 -3.632 16.360 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.810 -1.044 17.897 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.559 -2.449 18.629 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.117 -2.464 16.536 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.527 -0.839 16.251 1.00 25.00 H new ATOM 0 HE ARG A 53 17.316 -0.974 18.978 1.00 25.00 H new ATOM 0 HH11 ARG A 53 18.878 -1.069 15.778 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.402 -0.461 16.434 1.00 25.00 H new ATOM 0 HH21 ARG A 53 19.254 -0.259 19.695 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.606 -0.018 18.584 1.00 25.00 H new ATOM 832 N GLN A 54 15.156 -1.259 13.936 1.00 25.00 N ATOM 833 CA GLN A 54 15.926 -1.280 12.699 1.00 25.00 C ATOM 834 C GLN A 54 17.397 -1.396 13.047 1.00 25.00 C ATOM 835 O GLN A 54 17.819 -0.917 14.096 1.00 25.00 O ATOM 836 CB GLN A 54 15.681 0.006 11.917 1.00 25.00 C ATOM 837 CG GLN A 54 14.948 -0.214 10.627 1.00 25.00 C ATOM 838 CD GLN A 54 14.652 1.083 9.897 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.518 1.355 9.547 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.666 1.876 9.659 1.00 25.00 N ATOM 0 H GLN A 54 15.189 -0.371 14.437 1.00 25.00 H new ATOM 0 HA GLN A 54 15.621 -2.128 12.085 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.111 0.697 12.538 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.638 0.483 11.706 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.541 -0.863 9.982 1.00 25.00 H new ATOM 0 HG3 GLN A 54 14.012 -0.735 10.829 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.602 1.614 9.968 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.520 2.756 9.165 1.00 25.00 H new ATOM 849 N GLY A 55 18.173 -2.019 12.177 1.00 25.00 N ATOM 850 CA GLY A 55 19.600 -2.131 12.408 1.00 25.00 C ATOM 851 C GLY A 55 20.294 -2.966 11.357 1.00 25.00 C ATOM 852 O GLY A 55 19.633 -3.573 10.511 1.00 25.00 O ATOM 0 H GLY A 55 17.843 -2.450 11.314 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.041 -1.134 12.425 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.772 -2.572 13.390 1.00 25.00 H new ATOM 856 N ILE A 56 21.616 -2.991 11.390 1.00 25.00 N ATOM 857 CA ILE A 56 22.398 -3.751 10.426 1.00 25.00 C ATOM 858 C ILE A 56 22.478 -5.213 10.860 1.00 25.00 C ATOM 859 O ILE A 56 22.286 -5.554 12.031 1.00 25.00 O ATOM 860 CB ILE A 56 23.824 -3.146 10.243 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.625 -3.263 11.554 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.700 -1.665 9.828 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.022 -2.691 11.492 1.00 25.00 C ATOM 0 H ILE A 56 22.175 -2.489 12.080 1.00 25.00 H new ATOM 0 HA ILE A 56 21.897 -3.696 9.459 1.00 25.00 H new ATOM 0 HB ILE A 56 24.352 -3.698 9.465 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.074 -2.757 12.347 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.689 -4.315 11.832 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.695 -1.239 9.699 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.151 -1.595 8.889 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.167 -1.114 10.602 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.510 -2.818 12.458 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.595 -3.212 10.725 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.970 -1.630 11.248 1.00 25.00 H new ATOM 875 N VAL A 57 22.714 -6.074 9.887 1.00 25.00 N ATOM 876 CA VAL A 57 22.764 -7.522 10.088 1.00 25.00 C ATOM 877 C VAL A 57 23.875 -8.083 9.213 1.00 25.00 C ATOM 878 O VAL A 57 24.012 -7.672 8.064 1.00 25.00 O ATOM 879 CB VAL A 57 21.435 -8.171 9.620 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.485 -9.675 9.668 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.261 -7.636 10.439 1.00 25.00 C ATOM 0 H VAL A 57 22.879 -5.790 8.921 1.00 25.00 H new ATOM 0 HA VAL A 57 22.931 -7.733 11.144 1.00 25.00 H new ATOM 0 HB VAL A 57 21.289 -7.894 8.576 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.531 -10.082 9.331 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.283 -10.033 9.017 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.677 -10.000 10.690 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.337 -8.102 10.097 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.417 -7.868 11.493 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.191 -6.556 10.312 1.00 25.00 H new ATOM 891 N PRO A 58 24.651 -9.055 9.712 1.00 25.00 N ATOM 892 CA PRO A 58 25.636 -9.668 8.823 1.00 25.00 C ATOM 893 C PRO A 58 24.948 -10.526 7.755 1.00 25.00 C ATOM 894 O PRO A 58 24.368 -11.577 8.052 1.00 25.00 O ATOM 895 CB PRO A 58 26.481 -10.508 9.781 1.00 25.00 C ATOM 896 CG PRO A 58 25.545 -10.877 10.885 1.00 25.00 C ATOM 897 CD PRO A 58 24.640 -9.686 11.044 1.00 25.00 C ATOM 0 HA PRO A 58 26.231 -8.948 8.261 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.879 -11.394 9.286 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.334 -9.943 10.157 1.00 25.00 H new ATOM 0 HG2 PRO A 58 24.977 -11.774 10.637 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.086 -11.087 11.807 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.633 -9.985 11.337 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.006 -9.005 11.812 1.00 25.00 H new ATOM 905 N GLY A 59 25.020 -10.088 6.505 1.00 25.00 N ATOM 906 CA GLY A 59 24.393 -10.804 5.405 1.00 25.00 C ATOM 907 C GLY A 59 24.933 -12.210 5.247 1.00 25.00 C ATOM 908 O GLY A 59 24.260 -13.093 4.738 1.00 25.00 O ATOM 0 H GLY A 59 25.509 -9.237 6.228 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.317 -10.848 5.571 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.551 -10.251 4.479 1.00 25.00 H new ATOM 912 N ASN A 60 26.133 -12.435 5.759 1.00 25.00 N ATOM 913 CA ASN A 60 26.770 -13.754 5.725 1.00 25.00 C ATOM 914 C ASN A 60 26.007 -14.805 6.557 1.00 25.00 C ATOM 915 O ASN A 60 26.222 -16.003 6.410 1.00 25.00 O ATOM 916 CB ASN A 60 28.211 -13.628 6.240 1.00 25.00 C ATOM 917 CG ASN A 60 29.108 -14.737 5.738 1.00 25.00 C ATOM 918 OD1 ASN A 60 28.831 -15.375 4.741 1.00 25.00 O ATOM 919 ND2 ASN A 60 30.206 -14.935 6.405 1.00 25.00 N ATOM 0 H ASN A 60 26.696 -11.714 6.210 1.00 25.00 H new ATOM 0 HA ASN A 60 26.760 -14.100 4.692 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.621 -12.666 5.930 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.205 -13.636 7.330 1.00 25.00 H new ATOM 0 HD21 ASN A 60 30.869 -15.646 6.096 1.00 25.00 H new ATOM 0 HD22 ASN A 60 30.404 -14.380 7.237 1.00 25.00 H new ATOM 926 N ARG A 61 25.099 -14.352 7.418 1.00 25.00 N ATOM 927 CA ARG A 61 24.270 -15.252 8.229 1.00 25.00 C ATOM 928 C ARG A 61 22.799 -15.136 7.845 1.00 25.00 C ATOM 929 O ARG A 61 21.924 -15.667 8.538 1.00 25.00 O ATOM 930 CB ARG A 61 24.426 -14.914 9.716 1.00 25.00 C ATOM 931 CG ARG A 61 25.832 -15.122 10.249 1.00 25.00 C ATOM 932 CD ARG A 61 25.860 -14.916 11.751 1.00 25.00 C ATOM 933 NE ARG A 61 27.192 -15.207 12.303 1.00 25.00 N ATOM 934 CZ ARG A 61 27.492 -15.273 13.595 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.603 -15.102 14.541 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.723 -15.530 13.933 1.00 25.00 N ATOM 0 H ARG A 61 24.915 -13.361 7.575 1.00 25.00 H new ATOM 0 HA ARG A 61 24.605 -16.273 8.043 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.138 -13.875 9.875 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.735 -15.528 10.293 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.175 -16.128 10.006 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.518 -14.426 9.767 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.583 -13.888 11.985 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.119 -15.561 12.223 1.00 25.00 H new ATOM 0 HE ARG A 61 27.948 -15.372 11.638 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.631 -14.909 14.299 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.882 -15.162 15.520 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.430 -15.675 13.212 1.00 25.00 H new ATOM 0 HH22 ARG A 61 28.980 -15.586 14.918 1.00 25.00 H new ATOM 950 N LEU A 62 22.522 -14.436 6.754 1.00 25.00 N ATOM 951 CA LEU A 62 21.148 -14.164 6.343 1.00 25.00 C ATOM 952 C LEU A 62 20.861 -14.621 4.923 1.00 25.00 C ATOM 953 O LEU A 62 21.700 -14.525 4.040 1.00 25.00 O ATOM 954 CB LEU A 62 20.881 -12.663 6.447 1.00 25.00 C ATOM 955 CG LEU A 62 19.442 -12.256 6.761 1.00 25.00 C ATOM 956 CD1 LEU A 62 18.988 -12.702 8.104 1.00 25.00 C ATOM 957 CD2 LEU A 62 19.299 -10.756 6.631 1.00 25.00 C ATOM 0 H LEU A 62 23.231 -14.044 6.135 1.00 25.00 H new ATOM 0 HA LEU A 62 20.492 -14.726 7.008 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.530 -12.252 7.220 1.00 25.00 H new ATOM 0 HB3 LEU A 62 21.172 -12.197 5.506 1.00 25.00 H new ATOM 0 HG LEU A 62 18.801 -12.759 6.037 1.00 25.00 H new ATOM 0 HD11 LEU A 62 17.959 -12.382 8.265 1.00 25.00 H new ATOM 0 HD12 LEU A 62 19.043 -13.789 8.164 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.629 -12.263 8.869 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.272 -10.468 6.855 1.00 25.00 H new ATOM 0 HD22 LEU A 62 19.975 -10.264 7.330 1.00 25.00 H new ATOM 0 HD23 LEU A 62 19.547 -10.454 5.613 1.00 25.00 H new ATOM 969 N LYS A 63 19.650 -15.105 4.703 1.00 25.00 N ATOM 970 CA LYS A 63 19.234 -15.539 3.372 1.00 25.00 C ATOM 971 C LYS A 63 18.039 -14.779 2.899 1.00 25.00 C ATOM 972 O LYS A 63 16.971 -14.863 3.485 1.00 25.00 O ATOM 973 CB LYS A 63 18.897 -17.028 3.362 1.00 25.00 C ATOM 974 CG LYS A 63 18.424 -17.542 1.990 1.00 25.00 C ATOM 975 CD LYS A 63 18.335 -19.065 1.929 1.00 25.00 C ATOM 976 CE LYS A 63 19.731 -19.674 1.920 1.00 25.00 C ATOM 977 NZ LYS A 63 19.731 -21.164 1.732 1.00 25.00 N ATOM 0 H LYS A 63 18.936 -15.209 5.424 1.00 25.00 H new ATOM 0 HA LYS A 63 20.072 -15.346 2.702 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.777 -17.593 3.669 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.120 -17.221 4.101 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.446 -17.116 1.764 1.00 25.00 H new ATOM 0 HG3 LYS A 63 19.110 -17.191 1.219 1.00 25.00 H new ATOM 0 HD2 LYS A 63 17.773 -19.438 2.785 1.00 25.00 H new ATOM 0 HD3 LYS A 63 17.792 -19.369 1.034 1.00 25.00 H new ATOM 0 HE2 LYS A 63 20.314 -19.215 1.122 1.00 25.00 H new ATOM 0 HE3 LYS A 63 20.230 -19.434 2.859 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 20.710 -21.514 1.735 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 19.200 -21.612 2.506 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 19.282 -21.399 0.824 1.00 25.00 H new ATOM 991 N ILE A 64 18.209 -14.093 1.788 1.00 25.00 N ATOM 992 CA ILE A 64 17.122 -13.380 1.151 1.00 25.00 C ATOM 993 C ILE A 64 16.169 -14.426 0.591 1.00 25.00 C ATOM 994 O ILE A 64 16.590 -15.333 -0.121 1.00 25.00 O ATOM 995 CB ILE A 64 17.664 -12.484 0.015 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.745 -11.532 0.556 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.549 -11.682 -0.639 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.301 -10.593 1.695 1.00 25.00 C ATOM 0 H ILE A 64 19.102 -14.014 1.302 1.00 25.00 H new ATOM 0 HA ILE A 64 16.610 -12.734 1.865 1.00 25.00 H new ATOM 0 HB ILE A 64 18.103 -13.135 -0.741 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.585 -12.130 0.910 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.112 -10.923 -0.270 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.964 -11.062 -1.434 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.809 -12.363 -1.059 1.00 25.00 H new ATOM 0 HG23 ILE A 64 16.073 -11.045 0.107 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.140 -9.967 1.999 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.484 -9.961 1.348 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.964 -11.186 2.545 1.00 25.00 H new ATOM 1010 N LEU A 65 14.896 -14.322 0.938 1.00 25.00 N ATOM 1011 CA LEU A 65 13.904 -15.319 0.524 1.00 25.00 C ATOM 1012 C LEU A 65 13.185 -14.906 -0.754 1.00 25.00 C ATOM 1013 O LEU A 65 12.137 -15.444 -1.084 1.00 25.00 O ATOM 1014 CB LEU A 65 12.891 -15.547 1.647 1.00 25.00 C ATOM 1015 CG LEU A 65 13.500 -15.984 2.989 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.369 -16.151 3.995 1.00 25.00 C ATOM 1017 CD2 LEU A 65 14.319 -17.294 2.856 1.00 25.00 C ATOM 0 H LEU A 65 14.519 -13.561 1.504 1.00 25.00 H new ATOM 0 HA LEU A 65 14.434 -16.249 0.318 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.329 -14.626 1.802 1.00 25.00 H new ATOM 0 HB3 LEU A 65 12.177 -16.305 1.324 1.00 25.00 H new ATOM 0 HG LEU A 65 14.197 -15.219 3.330 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.780 -16.461 4.956 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.845 -15.203 4.114 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.672 -16.909 3.637 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.731 -17.566 3.828 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.670 -18.094 2.500 1.00 25.00 H new ATOM 0 HD23 LEU A 65 15.132 -17.144 2.146 1.00 25.00 H new ATOM 1029 N VAL A 66 13.794 -13.957 -1.458 1.00 25.00 N ATOM 1030 CA VAL A 66 13.337 -13.421 -2.761 1.00 25.00 C ATOM 1031 C VAL A 66 12.030 -12.605 -2.708 1.00 25.00 C ATOM 1032 O VAL A 66 11.959 -11.531 -3.294 1.00 25.00 O ATOM 1033 CB VAL A 66 13.228 -14.547 -3.854 1.00 25.00 C ATOM 1034 CG1 VAL A 66 13.063 -13.936 -5.253 1.00 25.00 C ATOM 1035 CG2 VAL A 66 14.493 -15.441 -3.845 1.00 25.00 C ATOM 0 H VAL A 66 14.654 -13.515 -1.134 1.00 25.00 H new ATOM 0 HA VAL A 66 14.119 -12.716 -3.043 1.00 25.00 H new ATOM 0 HB VAL A 66 12.352 -15.151 -3.617 1.00 25.00 H new ATOM 0 HG11 VAL A 66 12.990 -14.734 -5.992 1.00 25.00 H new ATOM 0 HG12 VAL A 66 12.157 -13.331 -5.281 1.00 25.00 H new ATOM 0 HG13 VAL A 66 13.925 -13.309 -5.480 1.00 25.00 H new ATOM 0 HG21 VAL A 66 14.398 -16.214 -4.608 1.00 25.00 H new ATOM 0 HG22 VAL A 66 15.371 -14.831 -4.054 1.00 25.00 H new ATOM 0 HG23 VAL A 66 14.601 -15.909 -2.866 1.00 25.00 H new ATOM 1045 N GLY A 67 11.024 -13.083 -1.991 1.00 25.00 N ATOM 1046 CA GLY A 67 9.763 -12.367 -1.870 1.00 25.00 C ATOM 1047 C GLY A 67 8.590 -13.261 -2.200 1.00 25.00 C ATOM 1048 O GLY A 67 8.480 -14.358 -1.679 1.00 25.00 O ATOM 0 H GLY A 67 11.057 -13.967 -1.483 1.00 25.00 H new ATOM 0 HA2 GLY A 67 9.656 -11.983 -0.855 1.00 25.00 H new ATOM 0 HA3 GLY A 67 9.766 -11.506 -2.538 1.00 25.00 H new ATOM 1052 N MET A 68 7.718 -12.796 -3.083 1.00 25.00 N ATOM 1053 CA MET A 68 6.512 -13.540 -3.476 1.00 25.00 C ATOM 1054 C MET A 68 6.784 -14.721 -4.420 1.00 25.00 C ATOM 1055 O MET A 68 5.856 -15.354 -4.916 1.00 25.00 O ATOM 1056 CB MET A 68 5.542 -12.580 -4.173 1.00 25.00 C ATOM 1057 CG MET A 68 6.058 -12.057 -5.526 1.00 25.00 C ATOM 1058 SD MET A 68 4.889 -10.944 -6.331 1.00 25.00 S ATOM 1059 CE MET A 68 3.598 -12.092 -6.875 1.00 25.00 C ATOM 0 H MET A 68 7.819 -11.895 -3.551 1.00 25.00 H new ATOM 0 HA MET A 68 6.095 -13.956 -2.559 1.00 25.00 H new ATOM 0 HB2 MET A 68 4.590 -13.088 -4.328 1.00 25.00 H new ATOM 0 HB3 MET A 68 5.347 -11.733 -3.516 1.00 25.00 H new ATOM 0 HG2 MET A 68 7.003 -11.536 -5.373 1.00 25.00 H new ATOM 0 HG3 MET A 68 6.262 -12.902 -6.184 1.00 25.00 H new ATOM 0 HE1 MET A 68 2.885 -11.564 -7.509 1.00 25.00 H new ATOM 0 HE2 MET A 68 4.050 -12.908 -7.439 1.00 25.00 H new ATOM 0 HE3 MET A 68 3.080 -12.496 -6.005 1.00 25.00 H new ATOM 1069 N TYR A 69 8.047 -14.976 -4.719 1.00 25.00 N ATOM 1070 CA TYR A 69 8.405 -15.991 -5.702 1.00 25.00 C ATOM 1071 C TYR A 69 8.702 -17.338 -5.056 1.00 25.00 C ATOM 1072 O TYR A 69 9.672 -17.484 -4.323 1.00 25.00 O ATOM 1073 CB TYR A 69 9.625 -15.528 -6.498 1.00 25.00 C ATOM 1074 CG TYR A 69 9.361 -14.282 -7.319 1.00 25.00 C ATOM 1075 CD1 TYR A 69 8.823 -14.380 -8.619 1.00 25.00 C ATOM 1076 CD2 TYR A 69 9.642 -12.997 -6.805 1.00 25.00 C ATOM 1077 CE1 TYR A 69 8.578 -13.215 -9.395 1.00 25.00 C ATOM 1078 CE2 TYR A 69 9.393 -11.832 -7.579 1.00 25.00 C ATOM 1079 CZ TYR A 69 8.865 -11.956 -8.868 1.00 25.00 C ATOM 1080 OH TYR A 69 8.626 -10.839 -9.626 1.00 25.00 O ATOM 0 H TYR A 69 8.842 -14.496 -4.297 1.00 25.00 H new ATOM 0 HA TYR A 69 7.549 -16.123 -6.364 1.00 25.00 H new ATOM 0 HB2 TYR A 69 10.448 -15.335 -5.810 1.00 25.00 H new ATOM 0 HB3 TYR A 69 9.945 -16.332 -7.161 1.00 25.00 H new ATOM 0 HD1 TYR A 69 8.594 -15.352 -9.030 1.00 25.00 H new ATOM 0 HD2 TYR A 69 10.052 -12.899 -5.811 1.00 25.00 H new ATOM 0 HE1 TYR A 69 8.170 -13.304 -10.391 1.00 25.00 H new ATOM 0 HE2 TYR A 69 9.611 -10.855 -7.174 1.00 25.00 H new ATOM 0 HH TYR A 69 8.877 -10.039 -9.118 1.00 25.00 H new ATOM 1090 N ASP A 70 7.897 -18.332 -5.400 1.00 25.00 N ATOM 1091 CA ASP A 70 8.102 -19.710 -4.950 1.00 25.00 C ATOM 1092 C ASP A 70 7.875 -20.619 -6.158 1.00 25.00 C ATOM 1093 O ASP A 70 7.425 -20.157 -7.214 1.00 25.00 O ATOM 1094 CB ASP A 70 7.128 -20.079 -3.816 1.00 25.00 C ATOM 1095 CG ASP A 70 7.334 -21.506 -3.312 1.00 25.00 C ATOM 1096 OD1 ASP A 70 6.334 -22.226 -3.126 1.00 25.00 O ATOM 1097 OD2 ASP A 70 8.503 -21.966 -3.303 1.00 25.00 O ATOM 0 H ASP A 70 7.081 -18.211 -6.000 1.00 25.00 H new ATOM 0 HA ASP A 70 9.111 -19.827 -4.554 1.00 25.00 H new ATOM 0 HB2 ASP A 70 7.258 -19.382 -2.988 1.00 25.00 H new ATOM 0 HB3 ASP A 70 6.103 -19.966 -4.170 1.00 25.00 H new ATOM 1102 N LYS A 71 8.217 -21.892 -6.016 1.00 25.00 N ATOM 1103 CA LYS A 71 8.021 -22.890 -7.067 1.00 25.00 C ATOM 1104 C LYS A 71 7.454 -24.201 -6.526 1.00 25.00 C ATOM 1105 O LYS A 71 6.807 -24.930 -7.276 1.00 25.00 O ATOM 1106 CB LYS A 71 9.339 -23.155 -7.804 1.00 25.00 C ATOM 1107 CG LYS A 71 9.887 -21.906 -8.486 1.00 25.00 C ATOM 1108 CD LYS A 71 11.065 -22.203 -9.397 1.00 25.00 C ATOM 1109 CE LYS A 71 11.659 -20.899 -9.942 1.00 25.00 C ATOM 1110 NZ LYS A 71 10.631 -20.062 -10.669 1.00 25.00 N ATOM 0 H LYS A 71 8.640 -22.266 -5.167 1.00 25.00 H new ATOM 0 HA LYS A 71 7.289 -22.480 -7.763 1.00 25.00 H new ATOM 0 HB2 LYS A 71 10.078 -23.533 -7.097 1.00 25.00 H new ATOM 0 HB3 LYS A 71 9.184 -23.934 -8.550 1.00 25.00 H new ATOM 0 HG2 LYS A 71 9.093 -21.437 -9.067 1.00 25.00 H new ATOM 0 HG3 LYS A 71 10.193 -21.187 -7.726 1.00 25.00 H new ATOM 0 HD2 LYS A 71 11.827 -22.756 -8.848 1.00 25.00 H new ATOM 0 HD3 LYS A 71 10.744 -22.837 -10.223 1.00 25.00 H new ATOM 0 HE2 LYS A 71 12.079 -20.321 -9.119 1.00 25.00 H new ATOM 0 HE3 LYS A 71 12.481 -21.131 -10.620 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 11.108 -19.290 -11.177 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 10.116 -20.657 -11.349 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 9.960 -19.662 -9.982 1.00 25.00 H new ATOM 1124 N LYS A 72 7.710 -24.516 -5.258 1.00 25.00 N ATOM 1125 CA LYS A 72 7.204 -25.748 -4.630 1.00 25.00 C ATOM 1126 C LYS A 72 7.199 -25.570 -3.113 1.00 25.00 C ATOM 1127 O LYS A 72 8.123 -24.991 -2.565 1.00 25.00 O ATOM 1128 CB LYS A 72 8.097 -26.956 -4.955 1.00 25.00 C ATOM 1129 CG LYS A 72 7.580 -27.830 -6.092 1.00 25.00 C ATOM 1130 CD LYS A 72 8.434 -27.697 -7.342 1.00 25.00 C ATOM 1131 CE LYS A 72 7.683 -28.247 -8.546 1.00 25.00 C ATOM 1132 NZ LYS A 72 8.454 -28.048 -9.816 1.00 25.00 N ATOM 0 H LYS A 72 8.269 -23.933 -4.635 1.00 25.00 H new ATOM 0 HA LYS A 72 6.201 -25.930 -5.017 1.00 25.00 H new ATOM 0 HB2 LYS A 72 9.094 -26.598 -5.212 1.00 25.00 H new ATOM 0 HB3 LYS A 72 8.200 -27.569 -4.059 1.00 25.00 H new ATOM 0 HG2 LYS A 72 7.565 -28.872 -5.771 1.00 25.00 H new ATOM 0 HG3 LYS A 72 6.551 -27.553 -6.324 1.00 25.00 H new ATOM 0 HD2 LYS A 72 8.689 -26.650 -7.509 1.00 25.00 H new ATOM 0 HD3 LYS A 72 9.372 -28.236 -7.211 1.00 25.00 H new ATOM 0 HE2 LYS A 72 7.489 -29.310 -8.400 1.00 25.00 H new ATOM 0 HE3 LYS A 72 6.714 -27.754 -8.627 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 7.912 -28.435 -10.615 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 8.617 -27.032 -9.967 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 9.368 -28.539 -9.748 1.00 25.00 H new ATOM 1146 N PRO A 73 6.207 -26.152 -2.415 1.00 25.00 N ATOM 1147 CA PRO A 73 6.147 -26.039 -0.952 1.00 25.00 C ATOM 1148 C PRO A 73 7.075 -27.009 -0.209 1.00 25.00 C ATOM 1149 O PRO A 73 6.994 -27.143 1.008 1.00 25.00 O ATOM 1150 CB PRO A 73 4.681 -26.364 -0.661 1.00 25.00 C ATOM 1151 CG PRO A 73 4.339 -27.379 -1.681 1.00 25.00 C ATOM 1152 CD PRO A 73 5.067 -26.936 -2.934 1.00 25.00 C ATOM 0 HA PRO A 73 6.480 -25.059 -0.610 1.00 25.00 H new ATOM 0 HB2 PRO A 73 4.549 -26.751 0.349 1.00 25.00 H new ATOM 0 HB3 PRO A 73 4.050 -25.480 -0.748 1.00 25.00 H new ATOM 0 HG2 PRO A 73 4.658 -28.374 -1.370 1.00 25.00 H new ATOM 0 HG3 PRO A 73 3.263 -27.426 -1.846 1.00 25.00 H new ATOM 0 HD2 PRO A 73 5.403 -27.788 -3.525 1.00 25.00 H new ATOM 0 HD3 PRO A 73 4.426 -26.334 -3.578 1.00 25.00 H new ATOM 1160 N ALA A 74 7.938 -27.701 -0.942 1.00 25.00 N ATOM 1161 CA ALA A 74 8.856 -28.668 -0.356 1.00 25.00 C ATOM 1162 C ALA A 74 10.168 -28.655 -1.140 1.00 25.00 C ATOM 1163 O ALA A 74 10.179 -28.387 -2.343 1.00 25.00 O ATOM 1164 CB ALA A 74 8.229 -30.071 -0.385 1.00 25.00 C ATOM 0 H ALA A 74 8.021 -27.608 -1.954 1.00 25.00 H new ATOM 0 HA ALA A 74 9.056 -28.401 0.682 1.00 25.00 H new ATOM 0 HB1 ALA A 74 8.922 -30.788 0.055 1.00 25.00 H new ATOM 0 HB2 ALA A 74 7.300 -30.066 0.186 1.00 25.00 H new ATOM 0 HB3 ALA A 74 8.020 -30.355 -1.416 1.00 25.00 H new ATOM 1170 N GLY A 75 11.259 -28.957 -0.449 1.00 25.00 N ATOM 1171 CA GLY A 75 12.571 -29.011 -1.074 1.00 25.00 C ATOM 1172 C GLY A 75 12.918 -30.416 -1.528 1.00 25.00 C ATOM 1173 O GLY A 75 12.083 -31.315 -1.485 1.00 25.00 O ATOM 0 H GLY A 75 11.260 -29.169 0.549 1.00 25.00 H new ATOM 0 HA2 GLY A 75 12.595 -28.336 -1.929 1.00 25.00 H new ATOM 0 HA3 GLY A 75 13.325 -28.660 -0.369 1.00 25.00 H new ATOM 1177 N SER A 76 14.156 -30.618 -1.950 1.00 25.00 N ATOM 1178 CA SER A 76 14.627 -31.933 -2.384 1.00 25.00 C ATOM 1179 C SER A 76 16.100 -32.049 -2.018 1.00 25.00 C ATOM 1180 O SER A 76 16.759 -31.036 -1.821 1.00 25.00 O ATOM 1181 CB SER A 76 14.452 -32.080 -3.895 1.00 25.00 C ATOM 1182 OG SER A 76 13.094 -31.893 -4.255 1.00 25.00 O ATOM 0 H SER A 76 14.862 -29.884 -2.003 1.00 25.00 H new ATOM 0 HA SER A 76 14.052 -32.720 -1.895 1.00 25.00 H new ATOM 0 HB2 SER A 76 15.076 -31.351 -4.412 1.00 25.00 H new ATOM 0 HB3 SER A 76 14.786 -33.068 -4.212 1.00 25.00 H new ATOM 0 HG SER A 76 12.997 -31.988 -5.225 1.00 25.00 H new ATOM 1188 N GLY A 77 16.607 -33.272 -1.918 1.00 25.00 N ATOM 1189 CA GLY A 77 18.017 -33.482 -1.605 1.00 25.00 C ATOM 1190 C GLY A 77 18.327 -33.508 -0.119 1.00 25.00 C ATOM 1191 O GLY A 77 19.457 -33.764 0.272 1.00 25.00 O ATOM 0 H GLY A 77 16.068 -34.128 -2.048 1.00 25.00 H new ATOM 0 HA2 GLY A 77 18.340 -34.424 -2.049 1.00 25.00 H new ATOM 0 HA3 GLY A 77 18.603 -32.691 -2.073 1.00 25.00 H new ATOM 1195 N GLY A 78 17.320 -33.265 0.710 1.00 25.00 N ATOM 1196 CA GLY A 78 17.501 -33.251 2.157 1.00 25.00 C ATOM 1197 C GLY A 78 17.510 -34.627 2.799 1.00 25.00 C ATOM 1198 O GLY A 78 16.761 -34.878 3.735 1.00 25.00 O ATOM 0 H GLY A 78 16.366 -33.074 0.404 1.00 25.00 H new ATOM 0 HA2 GLY A 78 18.440 -32.749 2.389 1.00 25.00 H new ATOM 0 HA3 GLY A 78 16.703 -32.659 2.605 1.00 25.00 H new ATOM 1202 N SER A 79 18.330 -35.524 2.279 1.00 25.00 N ATOM 1203 CA SER A 79 18.443 -36.876 2.821 1.00 25.00 C ATOM 1204 C SER A 79 19.332 -36.843 4.063 1.00 25.00 C ATOM 1205 O SER A 79 20.212 -35.996 4.173 1.00 25.00 O ATOM 1206 CB SER A 79 19.063 -37.802 1.778 1.00 25.00 C ATOM 1207 OG SER A 79 18.290 -37.804 0.587 1.00 25.00 O ATOM 0 H SER A 79 18.933 -35.343 1.477 1.00 25.00 H new ATOM 0 HA SER A 79 17.452 -37.246 3.084 1.00 25.00 H new ATOM 0 HB2 SER A 79 20.080 -37.479 1.557 1.00 25.00 H new ATOM 0 HB3 SER A 79 19.129 -38.814 2.176 1.00 25.00 H new ATOM 0 HG SER A 79 18.704 -38.402 -0.070 1.00 25.00 H new ATOM 1213 N GLY A 80 19.126 -37.780 4.978 1.00 25.00 N ATOM 1214 CA GLY A 80 19.932 -37.823 6.188 1.00 25.00 C ATOM 1215 C GLY A 80 19.368 -36.901 7.251 1.00 25.00 C ATOM 1216 O GLY A 80 18.165 -36.658 7.291 1.00 25.00 O ATOM 0 H GLY A 80 18.418 -38.511 4.907 1.00 25.00 H new ATOM 0 HA2 GLY A 80 19.968 -38.844 6.569 1.00 25.00 H new ATOM 0 HA3 GLY A 80 20.957 -37.533 5.957 1.00 25.00 H new ATOM 1220 N SER A 81 20.223 -36.406 8.134 1.00 25.00 N ATOM 1221 CA SER A 81 19.806 -35.498 9.198 1.00 25.00 C ATOM 1222 C SER A 81 20.955 -34.552 9.506 1.00 25.00 C ATOM 1223 O SER A 81 22.104 -34.860 9.203 1.00 25.00 O ATOM 1224 CB SER A 81 19.434 -36.289 10.452 1.00 25.00 C ATOM 1225 OG SER A 81 18.362 -37.174 10.172 1.00 25.00 O ATOM 0 H SER A 81 21.220 -36.620 8.136 1.00 25.00 H new ATOM 0 HA SER A 81 18.932 -34.932 8.876 1.00 25.00 H new ATOM 0 HB2 SER A 81 20.298 -36.852 10.805 1.00 25.00 H new ATOM 0 HB3 SER A 81 19.151 -35.605 11.252 1.00 25.00 H new ATOM 0 HG SER A 81 18.133 -37.677 10.981 1.00 25.00 H new ATOM 1231 N GLY A 82 20.642 -33.411 10.104 1.00 25.00 N ATOM 1232 CA GLY A 82 21.667 -32.454 10.494 1.00 25.00 C ATOM 1233 C GLY A 82 22.079 -32.683 11.933 1.00 25.00 C ATOM 1234 O GLY A 82 21.553 -33.578 12.591 1.00 25.00 O ATOM 0 H GLY A 82 19.689 -33.126 10.329 1.00 25.00 H new ATOM 0 HA2 GLY A 82 22.534 -32.552 9.840 1.00 25.00 H new ATOM 0 HA3 GLY A 82 21.291 -31.438 10.374 1.00 25.00 H new ATOM 1238 N LEU A 83 22.994 -31.862 12.428 1.00 25.00 N ATOM 1239 CA LEU A 83 23.471 -31.958 13.808 1.00 25.00 C ATOM 1240 C LEU A 83 23.163 -30.655 14.523 1.00 25.00 C ATOM 1241 O LEU A 83 22.922 -29.635 13.884 1.00 25.00 O ATOM 1242 CB LEU A 83 24.988 -32.193 13.836 1.00 25.00 C ATOM 1243 CG LEU A 83 25.515 -33.470 13.160 1.00 25.00 C ATOM 1244 CD1 LEU A 83 27.040 -33.455 13.190 1.00 25.00 C ATOM 1245 CD2 LEU A 83 24.997 -34.734 13.856 1.00 25.00 C ATOM 0 H LEU A 83 23.428 -31.112 11.890 1.00 25.00 H new ATOM 0 HA LEU A 83 22.973 -32.794 14.300 1.00 25.00 H new ATOM 0 HB2 LEU A 83 25.471 -31.337 13.364 1.00 25.00 H new ATOM 0 HB3 LEU A 83 25.309 -32.206 14.878 1.00 25.00 H new ATOM 0 HG LEU A 83 25.155 -33.488 12.131 1.00 25.00 H new ATOM 0 HD11 LEU A 83 27.422 -34.357 12.713 1.00 25.00 H new ATOM 0 HD12 LEU A 83 27.406 -32.579 12.655 1.00 25.00 H new ATOM 0 HD13 LEU A 83 27.383 -33.418 14.224 1.00 25.00 H new ATOM 0 HD21 LEU A 83 25.391 -35.615 13.350 1.00 25.00 H new ATOM 0 HD22 LEU A 83 25.324 -34.736 14.896 1.00 25.00 H new ATOM 0 HD23 LEU A 83 23.908 -34.750 13.818 1.00 25.00 H new ATOM 1257 N THR A 84 23.219 -30.684 15.847 1.00 25.00 N ATOM 1258 CA THR A 84 23.072 -29.475 16.655 1.00 25.00 C ATOM 1259 C THR A 84 24.348 -28.652 16.503 1.00 25.00 C ATOM 1260 O THR A 84 24.349 -27.428 16.623 1.00 25.00 O ATOM 1261 CB THR A 84 22.896 -29.846 18.146 1.00 25.00 C ATOM 1262 OG1 THR A 84 21.933 -30.899 18.255 1.00 25.00 O ATOM 1263 CG2 THR A 84 22.400 -28.666 18.968 1.00 25.00 C ATOM 0 H THR A 84 23.366 -31.535 16.390 1.00 25.00 H new ATOM 0 HA THR A 84 22.198 -28.914 16.324 1.00 25.00 H new ATOM 0 HB THR A 84 23.869 -30.154 18.528 1.00 25.00 H new ATOM 0 HG1 THR A 84 21.818 -31.141 19.198 1.00 25.00 H new ATOM 0 HG21 THR A 84 22.290 -28.969 20.009 1.00 25.00 H new ATOM 0 HG22 THR A 84 23.118 -27.849 18.902 1.00 25.00 H new ATOM 0 HG23 THR A 84 21.436 -28.334 18.583 1.00 25.00 H new ATOM 1271 N ASP A 85 25.433 -29.362 16.241 1.00 25.00 N ATOM 1272 CA ASP A 85 26.757 -28.781 16.087 1.00 25.00 C ATOM 1273 C ASP A 85 26.899 -28.107 14.725 1.00 25.00 C ATOM 1274 O ASP A 85 27.279 -28.729 13.734 1.00 25.00 O ATOM 1275 CB ASP A 85 27.805 -29.885 16.243 1.00 25.00 C ATOM 1276 CG ASP A 85 27.625 -30.673 17.526 1.00 25.00 C ATOM 1277 OD1 ASP A 85 28.265 -30.332 18.542 1.00 25.00 O ATOM 1278 OD2 ASP A 85 26.790 -31.616 17.528 1.00 25.00 O ATOM 0 H ASP A 85 25.418 -30.376 16.127 1.00 25.00 H new ATOM 0 HA ASP A 85 26.906 -28.020 16.853 1.00 25.00 H new ATOM 0 HB2 ASP A 85 27.745 -30.563 15.392 1.00 25.00 H new ATOM 0 HB3 ASP A 85 28.801 -29.442 16.228 1.00 25.00 H new ATOM 1283 N GLU A 86 26.563 -26.829 14.682 1.00 25.00 N ATOM 1284 CA GLU A 86 26.616 -26.046 13.457 1.00 25.00 C ATOM 1285 C GLU A 86 27.295 -24.716 13.775 1.00 25.00 C ATOM 1286 O GLU A 86 26.766 -23.895 14.521 1.00 25.00 O ATOM 1287 CB GLU A 86 25.196 -25.809 12.933 1.00 25.00 C ATOM 1288 CG GLU A 86 25.149 -25.177 11.553 1.00 25.00 C ATOM 1289 CD GLU A 86 23.761 -24.657 11.225 1.00 25.00 C ATOM 1290 OE1 GLU A 86 23.342 -23.662 11.854 1.00 25.00 O ATOM 1291 OE2 GLU A 86 23.051 -25.263 10.388 1.00 25.00 O ATOM 0 H GLU A 86 26.245 -26.303 15.496 1.00 25.00 H new ATOM 0 HA GLU A 86 27.179 -26.575 12.688 1.00 25.00 H new ATOM 0 HB2 GLU A 86 24.666 -26.761 12.905 1.00 25.00 H new ATOM 0 HB3 GLU A 86 24.662 -25.168 13.634 1.00 25.00 H new ATOM 0 HG2 GLU A 86 25.867 -24.358 11.502 1.00 25.00 H new ATOM 0 HG3 GLU A 86 25.450 -25.911 10.805 1.00 25.00 H new ATOM 1298 N LEU A 87 28.494 -24.525 13.250 1.00 25.00 N ATOM 1299 CA LEU A 87 29.251 -23.306 13.519 1.00 25.00 C ATOM 1300 C LEU A 87 28.832 -22.204 12.557 1.00 25.00 C ATOM 1301 O LEU A 87 28.846 -22.384 11.339 1.00 25.00 O ATOM 1302 CB LEU A 87 30.756 -23.566 13.392 1.00 25.00 C ATOM 1303 CG LEU A 87 31.348 -24.577 14.392 1.00 25.00 C ATOM 1304 CD1 LEU A 87 32.822 -24.813 14.064 1.00 25.00 C ATOM 1305 CD2 LEU A 87 31.216 -24.092 15.841 1.00 25.00 C ATOM 0 H LEU A 87 28.965 -25.192 12.638 1.00 25.00 H new ATOM 0 HA LEU A 87 29.038 -22.988 14.539 1.00 25.00 H new ATOM 0 HB2 LEU A 87 30.960 -23.921 12.382 1.00 25.00 H new ATOM 0 HB3 LEU A 87 31.281 -22.618 13.509 1.00 25.00 H new ATOM 0 HG LEU A 87 30.787 -25.507 14.300 1.00 25.00 H new ATOM 0 HD11 LEU A 87 33.242 -25.528 14.771 1.00 25.00 H new ATOM 0 HD12 LEU A 87 32.911 -25.208 13.052 1.00 25.00 H new ATOM 0 HD13 LEU A 87 33.366 -23.871 14.135 1.00 25.00 H new ATOM 0 HD21 LEU A 87 31.646 -24.834 16.514 1.00 25.00 H new ATOM 0 HD22 LEU A 87 31.746 -23.147 15.958 1.00 25.00 H new ATOM 0 HD23 LEU A 87 30.163 -23.950 16.083 1.00 25.00 H new ATOM 1317 N ALA A 88 28.458 -21.063 13.113 1.00 25.00 N ATOM 1318 CA ALA A 88 28.043 -19.920 12.312 1.00 25.00 C ATOM 1319 C ALA A 88 29.269 -19.245 11.671 1.00 25.00 C ATOM 1320 O ALA A 88 30.333 -19.161 12.293 1.00 25.00 O ATOM 1321 CB ALA A 88 27.282 -18.928 13.195 1.00 25.00 C ATOM 0 H ALA A 88 28.433 -20.902 14.120 1.00 25.00 H new ATOM 0 HA ALA A 88 27.385 -20.260 11.512 1.00 25.00 H new ATOM 0 HB1 ALA A 88 26.971 -18.072 12.596 1.00 25.00 H new ATOM 0 HB2 ALA A 88 26.402 -19.416 13.615 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.930 -18.589 14.003 1.00 25.00 H new ATOM 1327 N PRO A 89 29.129 -18.725 10.437 1.00 25.00 N ATOM 1328 CA PRO A 89 30.271 -18.057 9.810 1.00 25.00 C ATOM 1329 C PRO A 89 30.545 -16.677 10.420 1.00 25.00 C ATOM 1330 O PRO A 89 29.700 -16.124 11.142 1.00 25.00 O ATOM 1331 CB PRO A 89 29.830 -17.949 8.350 1.00 25.00 C ATOM 1332 CG PRO A 89 28.370 -17.796 8.429 1.00 25.00 C ATOM 1333 CD PRO A 89 27.957 -18.718 9.543 1.00 25.00 C ATOM 0 HA PRO A 89 31.207 -18.598 9.946 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.294 -17.096 7.855 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.108 -18.837 7.782 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.090 -16.765 8.642 1.00 25.00 H new ATOM 0 HG3 PRO A 89 27.890 -18.069 7.489 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.065 -18.356 10.054 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.729 -19.717 9.173 1.00 25.00 H new ATOM 1341 N PRO A 90 31.731 -16.101 10.154 1.00 25.00 N ATOM 1342 CA PRO A 90 32.026 -14.802 10.770 1.00 25.00 C ATOM 1343 C PRO A 90 31.224 -13.646 10.172 1.00 25.00 C ATOM 1344 O PRO A 90 30.742 -13.719 9.037 1.00 25.00 O ATOM 1345 CB PRO A 90 33.522 -14.629 10.494 1.00 25.00 C ATOM 1346 CG PRO A 90 33.738 -15.352 9.219 1.00 25.00 C ATOM 1347 CD PRO A 90 32.857 -16.570 9.322 1.00 25.00 C ATOM 0 HA PRO A 90 31.758 -14.785 11.826 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.793 -13.577 10.407 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.127 -15.048 11.298 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.465 -14.736 8.362 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.785 -15.629 9.092 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.520 -16.908 8.342 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.379 -17.407 9.786 1.00 25.00 H new ATOM 1355 N LYS A 91 31.096 -12.573 10.941 1.00 25.00 N ATOM 1356 CA LYS A 91 30.433 -11.356 10.476 1.00 25.00 C ATOM 1357 C LYS A 91 31.514 -10.440 9.888 1.00 25.00 C ATOM 1358 O LYS A 91 32.675 -10.526 10.295 1.00 25.00 O ATOM 1359 CB LYS A 91 29.702 -10.653 11.643 1.00 25.00 C ATOM 1360 CG LYS A 91 30.581 -10.337 12.867 1.00 25.00 C ATOM 1361 CD LYS A 91 29.863 -9.450 13.905 1.00 25.00 C ATOM 1362 CE LYS A 91 28.691 -10.157 14.617 1.00 25.00 C ATOM 1363 NZ LYS A 91 28.119 -9.281 15.702 1.00 25.00 N ATOM 0 H LYS A 91 31.445 -12.518 11.898 1.00 25.00 H new ATOM 0 HA LYS A 91 29.683 -11.596 9.722 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.272 -9.722 11.274 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.872 -11.283 11.964 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.885 -11.270 13.341 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.491 -9.837 12.536 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.586 -9.122 14.652 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.489 -8.555 13.409 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.914 -10.402 13.893 1.00 25.00 H new ATOM 0 HE3 LYS A 91 29.035 -11.098 15.046 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.300 -9.754 16.134 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.843 -9.110 16.428 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.818 -8.373 15.293 1.00 25.00 H new ATOM 1377 N PRO A 92 31.158 -9.576 8.920 1.00 25.00 N ATOM 1378 CA PRO A 92 32.168 -8.630 8.428 1.00 25.00 C ATOM 1379 C PRO A 92 32.503 -7.582 9.509 1.00 25.00 C ATOM 1380 O PRO A 92 31.752 -7.425 10.471 1.00 25.00 O ATOM 1381 CB PRO A 92 31.488 -8.014 7.196 1.00 25.00 C ATOM 1382 CG PRO A 92 30.048 -8.113 7.475 1.00 25.00 C ATOM 1383 CD PRO A 92 29.853 -9.375 8.256 1.00 25.00 C ATOM 0 HA PRO A 92 33.126 -9.088 8.183 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.793 -6.977 7.052 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.753 -8.553 6.287 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.702 -7.249 8.042 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.474 -8.137 6.549 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.045 -9.277 8.981 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.600 -10.213 7.607 1.00 25.00 H new ATOM 1391 N PRO A 93 33.655 -6.889 9.390 1.00 25.00 N ATOM 1392 CA PRO A 93 34.037 -5.927 10.434 1.00 25.00 C ATOM 1393 C PRO A 93 33.250 -4.619 10.381 1.00 25.00 C ATOM 1394 O PRO A 93 32.479 -4.384 9.450 1.00 25.00 O ATOM 1395 CB PRO A 93 35.516 -5.680 10.132 1.00 25.00 C ATOM 1396 CG PRO A 93 35.596 -5.796 8.666 1.00 25.00 C ATOM 1397 CD PRO A 93 34.679 -6.946 8.327 1.00 25.00 C ATOM 0 HA PRO A 93 33.834 -6.312 11.433 1.00 25.00 H new ATOM 0 HB2 PRO A 93 35.836 -4.696 10.474 1.00 25.00 H new ATOM 0 HB3 PRO A 93 36.154 -6.412 10.627 1.00 25.00 H new ATOM 0 HG2 PRO A 93 35.276 -4.876 8.177 1.00 25.00 H new ATOM 0 HG3 PRO A 93 36.617 -5.993 8.339 1.00 25.00 H new ATOM 0 HD2 PRO A 93 34.238 -6.830 7.337 1.00 25.00 H new ATOM 0 HD3 PRO A 93 35.210 -7.898 8.330 1.00 25.00 H new ATOM 1405 N LEU A 94 33.460 -3.772 11.383 1.00 25.00 N ATOM 1406 CA LEU A 94 32.797 -2.472 11.476 1.00 25.00 C ATOM 1407 C LEU A 94 33.784 -1.354 11.832 1.00 25.00 C ATOM 1408 O LEU A 94 34.832 -1.623 12.419 1.00 25.00 O ATOM 1409 CB LEU A 94 31.700 -2.532 12.549 1.00 25.00 C ATOM 1410 CG LEU A 94 30.381 -3.163 12.094 1.00 25.00 C ATOM 1411 CD1 LEU A 94 29.419 -3.205 13.225 1.00 25.00 C ATOM 1412 CD2 LEU A 94 29.740 -2.379 10.961 1.00 25.00 C ATOM 0 H LEU A 94 34.096 -3.966 12.156 1.00 25.00 H new ATOM 0 HA LEU A 94 32.366 -2.248 10.500 1.00 25.00 H new ATOM 0 HB2 LEU A 94 32.079 -3.094 13.403 1.00 25.00 H new ATOM 0 HB3 LEU A 94 31.499 -1.519 12.898 1.00 25.00 H new ATOM 0 HG LEU A 94 30.614 -4.169 11.744 1.00 25.00 H new ATOM 0 HD11 LEU A 94 28.484 -3.655 12.891 1.00 25.00 H new ATOM 0 HD12 LEU A 94 29.838 -3.799 14.037 1.00 25.00 H new ATOM 0 HD13 LEU A 94 29.228 -2.192 13.578 1.00 25.00 H new ATOM 0 HD21 LEU A 94 28.807 -2.860 10.668 1.00 25.00 H new ATOM 0 HD22 LEU A 94 29.535 -1.361 11.293 1.00 25.00 H new ATOM 0 HD23 LEU A 94 30.418 -2.352 10.108 1.00 25.00 H new ATOM 1424 N PRO A 95 33.459 -0.094 11.476 1.00 25.00 N ATOM 1425 CA PRO A 95 34.286 1.074 11.808 1.00 25.00 C ATOM 1426 C PRO A 95 34.109 1.578 13.245 1.00 25.00 C ATOM 1427 O PRO A 95 33.194 1.184 13.955 1.00 25.00 O ATOM 1428 CB PRO A 95 33.770 2.130 10.832 1.00 25.00 C ATOM 1429 CG PRO A 95 32.323 1.824 10.730 1.00 25.00 C ATOM 1430 CD PRO A 95 32.255 0.314 10.724 1.00 25.00 C ATOM 0 HA PRO A 95 35.348 0.839 11.732 1.00 25.00 H new ATOM 0 HB2 PRO A 95 33.942 3.140 11.204 1.00 25.00 H new ATOM 0 HB3 PRO A 95 34.265 2.059 9.864 1.00 25.00 H new ATOM 0 HG2 PRO A 95 31.769 2.243 11.570 1.00 25.00 H new ATOM 0 HG3 PRO A 95 31.891 2.244 9.822 1.00 25.00 H new ATOM 0 HD2 PRO A 95 31.344 -0.048 11.200 1.00 25.00 H new ATOM 0 HD3 PRO A 95 32.263 -0.083 9.709 1.00 25.00 H new ATOM 1438 N GLU A 96 34.968 2.513 13.625 1.00 25.00 N ATOM 1439 CA GLU A 96 34.959 3.123 14.964 1.00 25.00 C ATOM 1440 C GLU A 96 34.011 4.336 15.081 1.00 25.00 C ATOM 1441 O GLU A 96 34.282 5.271 15.833 1.00 25.00 O ATOM 1442 CB GLU A 96 36.386 3.583 15.314 1.00 25.00 C ATOM 1443 CG GLU A 96 37.414 2.457 15.421 1.00 25.00 C ATOM 1444 CD GLU A 96 37.159 1.535 16.608 1.00 25.00 C ATOM 1445 OE1 GLU A 96 37.202 0.302 16.421 1.00 25.00 O ATOM 1446 OE2 GLU A 96 36.968 2.043 17.735 1.00 25.00 O ATOM 0 H GLU A 96 35.699 2.878 13.015 1.00 25.00 H new ATOM 0 HA GLU A 96 34.596 2.361 15.654 1.00 25.00 H new ATOM 0 HB2 GLU A 96 36.721 4.291 14.556 1.00 25.00 H new ATOM 0 HB3 GLU A 96 36.357 4.121 16.262 1.00 25.00 H new ATOM 0 HG2 GLU A 96 37.401 1.871 14.502 1.00 25.00 H new ATOM 0 HG3 GLU A 96 38.411 2.889 15.510 1.00 25.00 H new ATOM 1453 N GLY A 97 32.916 4.361 14.331 1.00 25.00 N ATOM 1454 CA GLY A 97 31.998 5.486 14.447 1.00 25.00 C ATOM 1455 C GLY A 97 30.861 5.566 13.448 1.00 25.00 C ATOM 1456 O GLY A 97 30.918 5.006 12.358 1.00 25.00 O ATOM 0 H GLY A 97 32.648 3.642 13.659 1.00 25.00 H new ATOM 0 HA2 GLY A 97 31.566 5.466 15.448 1.00 25.00 H new ATOM 0 HA3 GLY A 97 32.580 6.404 14.369 1.00 25.00 H new ATOM 1460 N GLU A 98 29.836 6.312 13.837 1.00 25.00 N ATOM 1461 CA GLU A 98 28.615 6.515 13.043 1.00 25.00 C ATOM 1462 C GLU A 98 28.715 7.833 12.261 1.00 25.00 C ATOM 1463 O GLU A 98 27.811 8.665 12.261 1.00 25.00 O ATOM 1464 CB GLU A 98 27.413 6.574 14.000 1.00 25.00 C ATOM 1465 CG GLU A 98 27.175 5.278 14.788 1.00 25.00 C ATOM 1466 CD GLU A 98 26.352 5.507 16.053 1.00 25.00 C ATOM 1467 OE1 GLU A 98 25.479 6.404 16.061 1.00 25.00 O ATOM 1468 OE2 GLU A 98 26.624 4.819 17.066 1.00 25.00 O ATOM 0 H GLU A 98 29.822 6.806 14.729 1.00 25.00 H new ATOM 0 HA GLU A 98 28.492 5.694 12.336 1.00 25.00 H new ATOM 0 HB2 GLU A 98 27.563 7.392 14.704 1.00 25.00 H new ATOM 0 HB3 GLU A 98 26.516 6.807 13.426 1.00 25.00 H new ATOM 0 HG2 GLU A 98 26.663 4.558 14.150 1.00 25.00 H new ATOM 0 HG3 GLU A 98 28.135 4.839 15.058 1.00 25.00 H new ATOM 1475 N VAL A 99 29.861 8.052 11.611 1.00 25.00 N ATOM 1476 CA VAL A 99 30.130 9.309 10.884 1.00 25.00 C ATOM 1477 C VAL A 99 30.675 9.088 9.463 1.00 25.00 C ATOM 1478 O VAL A 99 30.486 9.840 8.530 1.00 25.00 O ATOM 1479 CB VAL A 99 31.034 10.244 11.760 1.00 25.00 C ATOM 1480 CG1 VAL A 99 32.478 9.701 11.894 1.00 25.00 C ATOM 1481 CG2 VAL A 99 31.047 11.696 11.220 1.00 25.00 C ATOM 1482 OXT VAL A 99 31.360 7.999 9.304 1.00 25.00 O ATOM 0 H VAL A 99 30.624 7.376 11.570 1.00 25.00 H new ATOM 0 HA VAL A 99 29.178 9.816 10.723 1.00 25.00 H new ATOM 0 HB VAL A 99 30.592 10.256 12.756 1.00 25.00 H new ATOM 0 HG11 VAL A 99 33.067 10.381 12.509 1.00 25.00 H new ATOM 0 HG12 VAL A 99 32.455 8.717 12.362 1.00 25.00 H new ATOM 0 HG13 VAL A 99 32.930 9.622 10.905 1.00 25.00 H new ATOM 0 HG21 VAL A 99 31.684 12.314 11.853 1.00 25.00 H new ATOM 0 HG22 VAL A 99 31.433 11.702 10.201 1.00 25.00 H new ATOM 0 HG23 VAL A 99 30.033 12.095 11.226 1.00 25.00 H new TER 1493 VAL A 99