USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=22 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+ 172:sc= -0.156 (180deg=-0.157) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 169:sc= -0.0177 (180deg=-0.137) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= -0.314 X(o=-0.31,f=0.0063) 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= 1.74 K(o=1.7,f=-0.3) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0905 USER MOD Single : A 25 SER OG : rot 20:sc= 0.163 USER MOD Single : A 28 LYS NZ :NH3+ -119:sc= -0.647 (180deg=-0.844) USER MOD Single : A 32 MET CE :methyl -127:sc= -0.634 (180deg=-1.52) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 87:sc= 1.21 USER MOD Single : A 40 GLN : amide:sc= 0.638 K(o=0.64,f=-0.95) USER MOD Single : A 48 CYS SG : rot 58:sc= -0.0837 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.0234 X(o=-0.023,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.0886 X(o=-0.089,f=-0.0042) USER MOD Single : A 60 ASN : amide:sc= 0.659 K(o=0.66,f=0) 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=-0.0584) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 166:sc= -0.0374 (180deg=-0.239) USER MOD Single : A 72 LYS NZ :NH3+ -164:sc= -0.0405 (180deg=-0.395) USER MOD Single : A 76 SER OG : rot -46:sc= 0.316 USER MOD Single : A 79 SER OG : rot 180:sc= -0.107 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 42:sc= 0.461 USER MOD Single : A 91 LYS NZ :NH3+ 158:sc= 1.41 (180deg=0.83) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.646 8.095 -1.392 1.00 25.00 N ATOM 2 CA GLY A 1 3.150 6.801 -1.969 1.00 25.00 C ATOM 3 C GLY A 1 4.184 6.000 -2.742 1.00 25.00 C ATOM 4 O GLY A 1 3.983 4.909 -3.222 1.00 25.00 O ATOM 0 H1 GLY A 1 2.844 8.631 -1.003 1.00 25.00 H new ATOM 0 H2 GLY A 1 4.331 7.898 -0.635 1.00 25.00 H new ATOM 0 H3 GLY A 1 4.107 8.654 -2.138 1.00 25.00 H new ATOM 0 HA2 GLY A 1 2.767 6.183 -1.157 1.00 25.00 H new ATOM 0 HA3 GLY A 1 2.310 7.015 -2.630 1.00 25.00 H new ATOM 9 N SER A 2 5.364 6.607 -2.869 1.00 25.00 N ATOM 10 CA SER A 2 6.482 5.979 -3.567 1.00 25.00 C ATOM 11 C SER A 2 7.138 4.939 -2.671 1.00 25.00 C ATOM 12 O SER A 2 7.330 5.178 -1.478 1.00 25.00 O ATOM 13 CB SER A 2 7.520 7.035 -3.942 1.00 25.00 C ATOM 14 OG SER A 2 6.912 8.109 -4.639 1.00 25.00 O ATOM 0 H SER A 2 5.569 7.534 -2.496 1.00 25.00 H new ATOM 0 HA SER A 2 6.103 5.498 -4.469 1.00 25.00 H new ATOM 0 HB2 SER A 2 8.008 7.409 -3.042 1.00 25.00 H new ATOM 0 HB3 SER A 2 8.296 6.586 -4.562 1.00 25.00 H new ATOM 0 HG SER A 2 7.592 8.776 -4.869 1.00 25.00 H new ATOM 20 N MET A 3 7.521 3.813 -3.256 1.00 25.00 N ATOM 21 CA MET A 3 8.234 2.768 -2.525 1.00 25.00 C ATOM 22 C MET A 3 9.576 3.324 -2.059 1.00 25.00 C ATOM 23 O MET A 3 10.220 4.099 -2.772 1.00 25.00 O ATOM 24 CB MET A 3 8.454 1.553 -3.440 1.00 25.00 C ATOM 25 CG MET A 3 9.172 0.369 -2.778 1.00 25.00 C ATOM 26 SD MET A 3 9.382 -1.014 -3.924 1.00 25.00 S ATOM 27 CE MET A 3 7.753 -1.788 -3.864 1.00 25.00 C ATOM 0 H MET A 3 7.350 3.597 -4.238 1.00 25.00 H new ATOM 0 HA MET A 3 7.649 2.452 -1.661 1.00 25.00 H new ATOM 0 HB2 MET A 3 7.486 1.213 -3.808 1.00 25.00 H new ATOM 0 HB3 MET A 3 9.031 1.870 -4.309 1.00 25.00 H new ATOM 0 HG2 MET A 3 10.148 0.692 -2.415 1.00 25.00 H new ATOM 0 HG3 MET A 3 8.603 0.038 -1.909 1.00 25.00 H new ATOM 0 HE1 MET A 3 7.738 -2.655 -4.524 1.00 25.00 H new ATOM 0 HE2 MET A 3 7.538 -2.105 -2.843 1.00 25.00 H new ATOM 0 HE3 MET A 3 6.998 -1.072 -4.189 1.00 25.00 H new ATOM 37 N LYS A 4 9.993 2.926 -0.866 1.00 25.00 N ATOM 38 CA LYS A 4 11.294 3.296 -0.317 1.00 25.00 C ATOM 39 C LYS A 4 11.813 2.007 0.260 1.00 25.00 C ATOM 40 O LYS A 4 11.015 1.219 0.754 1.00 25.00 O ATOM 41 CB LYS A 4 11.161 4.357 0.784 1.00 25.00 C ATOM 42 CG LYS A 4 10.627 5.708 0.302 1.00 25.00 C ATOM 43 CD LYS A 4 11.601 6.409 -0.654 1.00 25.00 C ATOM 44 CE LYS A 4 11.019 7.716 -1.169 1.00 25.00 C ATOM 45 NZ LYS A 4 10.802 8.699 -0.057 1.00 25.00 N ATOM 0 H LYS A 4 9.438 2.335 -0.247 1.00 25.00 H new ATOM 0 HA LYS A 4 11.951 3.731 -1.070 1.00 25.00 H new ATOM 0 HB2 LYS A 4 10.499 3.975 1.561 1.00 25.00 H new ATOM 0 HB3 LYS A 4 12.137 4.510 1.244 1.00 25.00 H new ATOM 0 HG2 LYS A 4 9.671 5.561 -0.200 1.00 25.00 H new ATOM 0 HG3 LYS A 4 10.440 6.350 1.162 1.00 25.00 H new ATOM 0 HD2 LYS A 4 12.542 6.604 -0.140 1.00 25.00 H new ATOM 0 HD3 LYS A 4 11.827 5.752 -1.494 1.00 25.00 H new ATOM 0 HE2 LYS A 4 11.691 8.147 -1.911 1.00 25.00 H new ATOM 0 HE3 LYS A 4 10.072 7.520 -1.672 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 10.584 9.634 -0.458 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 10.009 8.383 0.536 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 11.663 8.763 0.522 1.00 25.00 H new ATOM 59 N TYR A 5 13.125 1.810 0.179 1.00 25.00 N ATOM 60 CA TYR A 5 13.795 0.581 0.579 1.00 25.00 C ATOM 61 C TYR A 5 13.339 -0.645 -0.230 1.00 25.00 C ATOM 62 O TYR A 5 12.417 -0.578 -1.032 1.00 25.00 O ATOM 63 CB TYR A 5 13.629 0.360 2.077 1.00 25.00 C ATOM 64 CG TYR A 5 14.426 1.320 2.930 1.00 25.00 C ATOM 65 CD1 TYR A 5 13.798 2.090 3.930 1.00 25.00 C ATOM 66 CD2 TYR A 5 15.821 1.449 2.760 1.00 25.00 C ATOM 67 CE1 TYR A 5 14.554 2.968 4.751 1.00 25.00 C ATOM 68 CE2 TYR A 5 16.574 2.321 3.577 1.00 25.00 C ATOM 69 CZ TYR A 5 15.937 3.071 4.565 1.00 25.00 C ATOM 70 OH TYR A 5 16.670 3.909 5.366 1.00 25.00 O ATOM 0 H TYR A 5 13.766 2.519 -0.176 1.00 25.00 H new ATOM 0 HA TYR A 5 14.855 0.701 0.355 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.574 0.452 2.333 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.928 -0.660 2.319 1.00 25.00 H new ATOM 0 HD1 TYR A 5 12.730 2.011 4.073 1.00 25.00 H new ATOM 0 HD2 TYR A 5 16.320 0.873 1.995 1.00 25.00 H new ATOM 0 HE1 TYR A 5 14.064 3.553 5.515 1.00 25.00 H new ATOM 0 HE2 TYR A 5 17.641 2.407 3.437 1.00 25.00 H new ATOM 0 HH TYR A 5 17.615 3.864 5.109 1.00 25.00 H new ATOM 80 N LEU A 6 14.064 -1.741 -0.070 1.00 25.00 N ATOM 81 CA LEU A 6 13.827 -2.966 -0.841 1.00 25.00 C ATOM 82 C LEU A 6 12.587 -3.723 -0.360 1.00 25.00 C ATOM 83 O LEU A 6 11.919 -4.390 -1.141 1.00 25.00 O ATOM 84 CB LEU A 6 15.046 -3.890 -0.720 1.00 25.00 C ATOM 85 CG LEU A 6 16.410 -3.365 -1.195 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.497 -4.381 -0.830 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.433 -3.110 -2.699 1.00 25.00 C ATOM 0 H LEU A 6 14.834 -1.813 0.595 1.00 25.00 H new ATOM 0 HA LEU A 6 13.663 -2.671 -1.877 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.146 -4.173 0.328 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.829 -4.801 -1.277 1.00 25.00 H new ATOM 0 HG LEU A 6 16.595 -2.413 -0.697 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.467 -4.013 -1.165 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.516 -4.521 0.251 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.283 -5.333 -1.316 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.416 -2.740 -2.990 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.223 -4.039 -3.229 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.676 -2.368 -2.954 1.00 25.00 H new ATOM 99 N ASN A 7 12.320 -3.628 0.939 1.00 25.00 N ATOM 100 CA ASN A 7 11.159 -4.261 1.598 1.00 25.00 C ATOM 101 C ASN A 7 11.023 -5.783 1.357 1.00 25.00 C ATOM 102 O ASN A 7 9.917 -6.286 1.178 1.00 25.00 O ATOM 103 CB ASN A 7 9.838 -3.581 1.163 1.00 25.00 C ATOM 104 CG ASN A 7 9.854 -2.075 1.322 1.00 25.00 C ATOM 105 OD1 ASN A 7 9.291 -1.365 0.510 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.445 -1.585 2.384 1.00 25.00 N ATOM 0 H ASN A 7 12.909 -3.101 1.584 1.00 25.00 H new ATOM 0 HA ASN A 7 11.346 -4.121 2.663 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.638 -3.826 0.120 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.016 -3.992 1.750 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.442 -0.579 2.550 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.908 -2.210 3.044 1.00 25.00 H new ATOM 113 N VAL A 8 12.128 -6.516 1.364 1.00 25.00 N ATOM 114 CA VAL A 8 12.097 -7.960 1.110 1.00 25.00 C ATOM 115 C VAL A 8 12.177 -8.685 2.445 1.00 25.00 C ATOM 116 O VAL A 8 12.578 -8.102 3.436 1.00 25.00 O ATOM 117 CB VAL A 8 13.270 -8.409 0.142 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.808 -7.226 -0.640 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.433 -9.063 0.888 1.00 25.00 C ATOM 0 H VAL A 8 13.059 -6.140 1.542 1.00 25.00 H new ATOM 0 HA VAL A 8 11.166 -8.218 0.606 1.00 25.00 H new ATOM 0 HB VAL A 8 12.834 -9.145 -0.534 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.612 -7.559 -1.297 1.00 25.00 H new ATOM 0 HG12 VAL A 8 13.007 -6.791 -1.238 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.192 -6.477 0.052 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.207 -9.350 0.176 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.847 -8.357 1.608 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.076 -9.949 1.413 1.00 25.00 H new ATOM 129 N LEU A 9 11.834 -9.960 2.473 1.00 25.00 N ATOM 130 CA LEU A 9 11.969 -10.759 3.694 1.00 25.00 C ATOM 131 C LEU A 9 13.216 -11.635 3.598 1.00 25.00 C ATOM 132 O LEU A 9 13.556 -12.128 2.524 1.00 25.00 O ATOM 133 CB LEU A 9 10.731 -11.635 3.899 1.00 25.00 C ATOM 134 CG LEU A 9 9.398 -10.883 4.071 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.264 -11.898 4.220 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.420 -9.948 5.283 1.00 25.00 C ATOM 0 H LEU A 9 11.461 -10.470 1.672 1.00 25.00 H new ATOM 0 HA LEU A 9 12.063 -10.087 4.547 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.640 -12.307 3.046 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.891 -12.257 4.779 1.00 25.00 H new ATOM 0 HG LEU A 9 9.241 -10.267 3.186 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.318 -11.371 4.342 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.218 -12.525 3.330 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.447 -12.522 5.095 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.460 -9.438 5.367 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.602 -10.529 6.187 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.213 -9.211 5.159 1.00 25.00 H new ATOM 148 N ALA A 10 13.890 -11.838 4.720 1.00 25.00 N ATOM 149 CA ALA A 10 15.083 -12.681 4.764 1.00 25.00 C ATOM 150 C ALA A 10 15.056 -13.560 6.016 1.00 25.00 C ATOM 151 O ALA A 10 14.599 -13.116 7.064 1.00 25.00 O ATOM 152 CB ALA A 10 16.326 -11.806 4.753 1.00 25.00 C ATOM 0 H ALA A 10 13.632 -11.430 5.618 1.00 25.00 H new ATOM 0 HA ALA A 10 15.101 -13.329 3.888 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.215 -12.436 4.786 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.340 -11.206 3.843 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.315 -11.148 5.622 1.00 25.00 H new ATOM 158 N LYS A 11 15.547 -14.791 5.901 1.00 25.00 N ATOM 159 CA LYS A 11 15.604 -15.728 7.030 1.00 25.00 C ATOM 160 C LYS A 11 17.014 -15.847 7.591 1.00 25.00 C ATOM 161 O LYS A 11 17.979 -15.964 6.835 1.00 25.00 O ATOM 162 CB LYS A 11 15.131 -17.123 6.598 1.00 25.00 C ATOM 163 CG LYS A 11 15.298 -18.190 7.697 1.00 25.00 C ATOM 164 CD LYS A 11 14.442 -19.429 7.491 1.00 25.00 C ATOM 165 CE LYS A 11 12.995 -19.156 7.886 1.00 25.00 C ATOM 166 NZ LYS A 11 12.236 -20.389 8.283 1.00 25.00 N ATOM 0 H LYS A 11 15.916 -15.170 5.029 1.00 25.00 H new ATOM 0 HA LYS A 11 14.946 -15.332 7.804 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.081 -17.070 6.309 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.690 -17.431 5.714 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.345 -18.488 7.743 1.00 25.00 H new ATOM 0 HG3 LYS A 11 15.050 -17.746 8.661 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.487 -19.739 6.447 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.837 -20.253 8.085 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.981 -18.449 8.715 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.483 -18.678 7.051 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.262 -20.130 8.539 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.219 -21.058 7.487 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.701 -20.835 9.099 1.00 25.00 H new ATOM 180 N ALA A 12 17.116 -15.886 8.908 1.00 25.00 N ATOM 181 CA ALA A 12 18.380 -16.099 9.598 1.00 25.00 C ATOM 182 C ALA A 12 18.807 -17.574 9.499 1.00 25.00 C ATOM 183 O ALA A 12 18.045 -18.461 9.876 1.00 25.00 O ATOM 184 CB ALA A 12 18.204 -15.685 11.054 1.00 25.00 C ATOM 0 H ALA A 12 16.320 -15.770 9.535 1.00 25.00 H new ATOM 0 HA ALA A 12 19.164 -15.499 9.135 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.140 -15.836 11.591 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.924 -14.633 11.102 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.421 -16.290 11.512 1.00 25.00 H new ATOM 190 N LEU A 13 20.017 -17.838 9.018 1.00 25.00 N ATOM 191 CA LEU A 13 20.543 -19.211 8.959 1.00 25.00 C ATOM 192 C LEU A 13 21.267 -19.533 10.236 1.00 25.00 C ATOM 193 O LEU A 13 21.545 -20.684 10.519 1.00 25.00 O ATOM 194 CB LEU A 13 21.567 -19.386 7.836 1.00 25.00 C ATOM 195 CG LEU A 13 21.200 -19.201 6.367 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.758 -19.585 6.044 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.484 -17.785 5.953 1.00 25.00 C ATOM 0 H LEU A 13 20.656 -17.127 8.663 1.00 25.00 H new ATOM 0 HA LEU A 13 19.686 -19.863 8.791 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.383 -18.694 8.045 1.00 25.00 H new ATOM 0 HB3 LEU A 13 21.971 -20.394 7.934 1.00 25.00 H new ATOM 0 HG LEU A 13 21.821 -19.888 5.793 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.569 -19.428 4.982 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.597 -20.635 6.290 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.077 -18.967 6.629 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.222 -17.653 4.903 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.893 -17.102 6.563 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.544 -17.571 6.092 1.00 25.00 H new ATOM 209 N TYR A 14 21.607 -18.498 10.977 1.00 25.00 N ATOM 210 CA TYR A 14 22.334 -18.623 12.228 1.00 25.00 C ATOM 211 C TYR A 14 21.777 -17.528 13.099 1.00 25.00 C ATOM 212 O TYR A 14 21.141 -16.614 12.587 1.00 25.00 O ATOM 213 CB TYR A 14 23.831 -18.417 12.015 1.00 25.00 C ATOM 214 CG TYR A 14 24.416 -19.352 10.982 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.511 -18.957 9.634 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.864 -20.641 11.336 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.031 -19.835 8.650 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.396 -21.519 10.354 1.00 25.00 C ATOM 219 CZ TYR A 14 25.473 -21.108 9.022 1.00 25.00 C ATOM 220 OH TYR A 14 25.990 -21.947 8.071 1.00 25.00 O ATOM 0 H TYR A 14 21.385 -17.535 10.726 1.00 25.00 H new ATOM 0 HA TYR A 14 22.219 -19.613 12.669 1.00 25.00 H new ATOM 0 HB2 TYR A 14 24.010 -17.387 11.707 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.350 -18.561 12.963 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.183 -17.970 9.345 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.802 -20.964 12.365 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.085 -19.522 7.618 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.740 -22.503 10.637 1.00 25.00 H new ATOM 0 HH TYR A 14 26.253 -22.793 8.489 1.00 25.00 H new ATOM 230 N ASP A 15 22.008 -17.604 14.392 1.00 25.00 N ATOM 231 CA ASP A 15 21.596 -16.544 15.298 1.00 25.00 C ATOM 232 C ASP A 15 22.604 -15.411 15.167 1.00 25.00 C ATOM 233 O ASP A 15 23.630 -15.546 14.489 1.00 25.00 O ATOM 234 CB ASP A 15 21.577 -17.066 16.733 1.00 25.00 C ATOM 235 CG ASP A 15 22.911 -17.638 17.148 1.00 25.00 C ATOM 236 OD1 ASP A 15 23.676 -16.955 17.853 1.00 25.00 O ATOM 237 OD2 ASP A 15 23.201 -18.783 16.729 1.00 25.00 O ATOM 0 H ASP A 15 22.479 -18.388 14.844 1.00 25.00 H new ATOM 0 HA ASP A 15 20.594 -16.193 15.050 1.00 25.00 H new ATOM 0 HB2 ASP A 15 21.305 -16.256 17.409 1.00 25.00 H new ATOM 0 HB3 ASP A 15 20.809 -17.833 16.829 1.00 25.00 H new ATOM 242 N ASN A 16 22.313 -14.290 15.801 1.00 25.00 N ATOM 243 CA ASN A 16 23.217 -13.161 15.797 1.00 25.00 C ATOM 244 C ASN A 16 23.093 -12.405 17.100 1.00 25.00 C ATOM 245 O ASN A 16 21.989 -12.205 17.606 1.00 25.00 O ATOM 246 CB ASN A 16 22.918 -12.211 14.642 1.00 25.00 C ATOM 247 CG ASN A 16 24.032 -11.223 14.435 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.181 -11.616 14.265 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.727 -9.963 14.500 1.00 25.00 N ATOM 0 H ASN A 16 21.452 -14.140 16.327 1.00 25.00 H new ATOM 0 HA ASN A 16 24.230 -13.545 15.676 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.766 -12.785 13.728 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.989 -11.676 14.841 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.457 -9.256 14.408 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.758 -9.680 14.643 1.00 25.00 H new ATOM 256 N VAL A 17 24.224 -11.952 17.608 1.00 25.00 N ATOM 257 CA VAL A 17 24.274 -11.153 18.813 1.00 25.00 C ATOM 258 C VAL A 17 24.677 -9.780 18.339 1.00 25.00 C ATOM 259 O VAL A 17 25.645 -9.632 17.598 1.00 25.00 O ATOM 260 CB VAL A 17 25.306 -11.711 19.829 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.388 -10.817 21.077 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.916 -13.144 20.238 1.00 25.00 C ATOM 0 H VAL A 17 25.138 -12.130 17.192 1.00 25.00 H new ATOM 0 HA VAL A 17 23.318 -11.152 19.337 1.00 25.00 H new ATOM 0 HB VAL A 17 26.285 -11.723 19.350 1.00 25.00 H new ATOM 0 HG11 VAL A 17 26.118 -11.230 21.773 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.693 -9.812 20.785 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.411 -10.774 21.559 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.644 -13.530 20.951 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.928 -13.135 20.698 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.900 -13.783 19.355 1.00 25.00 H new ATOM 272 N ALA A 18 23.892 -8.794 18.725 1.00 25.00 N ATOM 273 CA ALA A 18 24.150 -7.420 18.353 1.00 25.00 C ATOM 274 C ALA A 18 25.253 -6.875 19.252 1.00 25.00 C ATOM 275 O ALA A 18 25.060 -6.705 20.455 1.00 25.00 O ATOM 276 CB ALA A 18 22.886 -6.606 18.496 1.00 25.00 C ATOM 0 H ALA A 18 23.061 -8.923 19.303 1.00 25.00 H new ATOM 0 HA ALA A 18 24.472 -7.361 17.313 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.085 -5.572 18.215 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.113 -7.016 17.846 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.546 -6.641 19.531 1.00 25.00 H new ATOM 282 N GLU A 19 26.416 -6.648 18.668 1.00 25.00 N ATOM 283 CA GLU A 19 27.574 -6.145 19.404 1.00 25.00 C ATOM 284 C GLU A 19 27.687 -4.646 19.172 1.00 25.00 C ATOM 285 O GLU A 19 28.126 -3.895 20.037 1.00 25.00 O ATOM 286 CB GLU A 19 28.835 -6.858 18.922 1.00 25.00 C ATOM 287 CG GLU A 19 28.840 -8.344 19.263 1.00 25.00 C ATOM 288 CD GLU A 19 30.042 -9.074 18.682 1.00 25.00 C ATOM 289 OE1 GLU A 19 31.188 -8.734 19.019 1.00 25.00 O ATOM 290 OE2 GLU A 19 29.824 -9.988 17.849 1.00 25.00 O ATOM 0 H GLU A 19 26.589 -6.805 17.675 1.00 25.00 H new ATOM 0 HA GLU A 19 27.456 -6.336 20.471 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.925 -6.737 17.842 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.709 -6.384 19.370 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.835 -8.464 20.346 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.925 -8.802 18.887 1.00 25.00 H new ATOM 297 N SER A 20 27.229 -4.215 18.008 1.00 25.00 N ATOM 298 CA SER A 20 27.163 -2.795 17.683 1.00 25.00 C ATOM 299 C SER A 20 25.795 -2.296 18.119 1.00 25.00 C ATOM 300 O SER A 20 24.804 -3.023 18.017 1.00 25.00 O ATOM 301 CB SER A 20 27.341 -2.593 16.174 1.00 25.00 C ATOM 302 OG SER A 20 27.024 -1.265 15.784 1.00 25.00 O ATOM 0 H SER A 20 26.895 -4.831 17.267 1.00 25.00 H new ATOM 0 HA SER A 20 27.954 -2.245 18.192 1.00 25.00 H new ATOM 0 HB2 SER A 20 28.370 -2.819 15.895 1.00 25.00 H new ATOM 0 HB3 SER A 20 26.703 -3.293 15.635 1.00 25.00 H new ATOM 0 HG SER A 20 27.150 -1.169 14.817 1.00 25.00 H new ATOM 308 N PRO A 21 25.700 -1.030 18.563 1.00 25.00 N ATOM 309 CA PRO A 21 24.383 -0.497 18.926 1.00 25.00 C ATOM 310 C PRO A 21 23.457 -0.318 17.720 1.00 25.00 C ATOM 311 O PRO A 21 22.262 -0.083 17.887 1.00 25.00 O ATOM 312 CB PRO A 21 24.731 0.847 19.570 1.00 25.00 C ATOM 313 CG PRO A 21 25.998 1.245 18.903 1.00 25.00 C ATOM 314 CD PRO A 21 26.760 -0.022 18.760 1.00 25.00 C ATOM 0 HA PRO A 21 23.829 -1.170 19.580 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.945 1.584 19.406 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.860 0.752 20.648 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.808 1.705 17.933 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.548 1.973 19.499 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.445 0.013 17.913 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.359 -0.234 19.646 1.00 25.00 H new ATOM 322 N ASP A 22 23.992 -0.455 16.513 1.00 25.00 N ATOM 323 CA ASP A 22 23.188 -0.362 15.297 1.00 25.00 C ATOM 324 C ASP A 22 22.776 -1.734 14.809 1.00 25.00 C ATOM 325 O ASP A 22 22.062 -1.862 13.850 1.00 25.00 O ATOM 326 CB ASP A 22 24.005 0.279 14.186 1.00 25.00 C ATOM 327 CG ASP A 22 23.153 1.132 13.244 1.00 25.00 C ATOM 328 OD1 ASP A 22 23.738 1.784 12.358 1.00 25.00 O ATOM 329 OD2 ASP A 22 21.908 1.147 13.379 1.00 25.00 O ATOM 0 H ASP A 22 24.983 -0.632 16.348 1.00 25.00 H new ATOM 0 HA ASP A 22 22.306 0.232 15.536 1.00 25.00 H new ATOM 0 HB2 ASP A 22 24.785 0.900 14.626 1.00 25.00 H new ATOM 0 HB3 ASP A 22 24.505 -0.501 13.611 1.00 25.00 H new ATOM 334 N GLU A 23 23.311 -2.770 15.419 1.00 25.00 N ATOM 335 CA GLU A 23 23.095 -4.130 14.947 1.00 25.00 C ATOM 336 C GLU A 23 21.821 -4.754 15.524 1.00 25.00 C ATOM 337 O GLU A 23 21.378 -4.409 16.620 1.00 25.00 O ATOM 338 CB GLU A 23 24.328 -4.970 15.301 1.00 25.00 C ATOM 339 CG GLU A 23 24.402 -6.312 14.608 1.00 25.00 C ATOM 340 CD GLU A 23 25.685 -7.059 14.915 1.00 25.00 C ATOM 341 OE1 GLU A 23 25.901 -8.113 14.284 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.465 -6.636 15.804 1.00 25.00 O ATOM 0 H GLU A 23 23.902 -2.700 16.247 1.00 25.00 H new ATOM 0 HA GLU A 23 22.955 -4.106 13.866 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.223 -4.399 15.053 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.342 -5.132 16.379 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.550 -6.921 14.912 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.321 -6.165 13.531 1.00 25.00 H new ATOM 349 N LEU A 24 21.246 -5.693 14.787 1.00 25.00 N ATOM 350 CA LEU A 24 20.093 -6.458 15.265 1.00 25.00 C ATOM 351 C LEU A 24 20.506 -7.812 15.802 1.00 25.00 C ATOM 352 O LEU A 24 21.322 -8.515 15.214 1.00 25.00 O ATOM 353 CB LEU A 24 19.071 -6.695 14.155 1.00 25.00 C ATOM 354 CG LEU A 24 18.271 -5.478 13.685 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.287 -5.908 12.610 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.527 -4.831 14.853 1.00 25.00 C ATOM 0 H LEU A 24 21.558 -5.948 13.850 1.00 25.00 H new ATOM 0 HA LEU A 24 19.648 -5.859 16.059 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.594 -7.111 13.294 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.367 -7.453 14.497 1.00 25.00 H new ATOM 0 HG LEU A 24 18.960 -4.740 13.275 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.715 -5.043 12.273 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.832 -6.334 11.767 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.607 -6.656 13.017 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.966 -3.968 14.494 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.839 -5.554 15.292 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.244 -4.509 15.608 1.00 25.00 H new ATOM 368 N SER A 25 19.871 -8.205 16.890 1.00 25.00 N ATOM 369 CA SER A 25 20.073 -9.510 17.479 1.00 25.00 C ATOM 370 C SER A 25 18.852 -10.328 17.138 1.00 25.00 C ATOM 371 O SER A 25 17.720 -9.851 17.263 1.00 25.00 O ATOM 372 CB SER A 25 20.204 -9.397 18.994 1.00 25.00 C ATOM 373 OG SER A 25 19.069 -8.737 19.531 1.00 25.00 O ATOM 0 H SER A 25 19.198 -7.624 17.390 1.00 25.00 H new ATOM 0 HA SER A 25 20.985 -9.969 17.098 1.00 25.00 H new ATOM 0 HB2 SER A 25 20.300 -10.390 19.434 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.110 -8.847 19.249 1.00 25.00 H new ATOM 0 HG SER A 25 18.332 -8.778 18.887 1.00 25.00 H new ATOM 379 N PHE A 26 19.083 -11.546 16.700 1.00 25.00 N ATOM 380 CA PHE A 26 18.002 -12.466 16.338 1.00 25.00 C ATOM 381 C PHE A 26 18.433 -13.918 16.456 1.00 25.00 C ATOM 382 O PHE A 26 19.603 -14.217 16.669 1.00 25.00 O ATOM 383 CB PHE A 26 17.502 -12.182 14.922 1.00 25.00 C ATOM 384 CG PHE A 26 18.580 -12.151 13.881 1.00 25.00 C ATOM 385 CD1 PHE A 26 18.974 -10.924 13.330 1.00 25.00 C ATOM 386 CD2 PHE A 26 19.181 -13.337 13.407 1.00 25.00 C ATOM 387 CE1 PHE A 26 19.920 -10.872 12.306 1.00 25.00 C ATOM 388 CE2 PHE A 26 20.148 -13.291 12.371 1.00 25.00 C ATOM 389 CZ PHE A 26 20.501 -12.061 11.807 1.00 25.00 C ATOM 0 H PHE A 26 20.018 -11.935 16.581 1.00 25.00 H new ATOM 0 HA PHE A 26 17.188 -12.300 17.043 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.771 -12.943 14.648 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.982 -11.224 14.918 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.540 -10.008 13.703 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.902 -14.288 13.837 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.210 -9.918 11.892 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.610 -14.202 12.019 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.213 -12.019 10.996 1.00 25.00 H new ATOM 399 N ARG A 27 17.470 -14.818 16.320 1.00 25.00 N ATOM 400 CA ARG A 27 17.689 -16.254 16.465 1.00 25.00 C ATOM 401 C ARG A 27 17.626 -16.925 15.085 1.00 25.00 C ATOM 402 O ARG A 27 16.926 -16.479 14.185 1.00 25.00 O ATOM 403 CB ARG A 27 16.608 -16.787 17.439 1.00 25.00 C ATOM 404 CG ARG A 27 16.229 -18.265 17.338 1.00 25.00 C ATOM 405 CD ARG A 27 17.322 -19.205 17.836 1.00 25.00 C ATOM 406 NE ARG A 27 17.271 -20.471 17.087 1.00 25.00 N ATOM 407 CZ ARG A 27 17.966 -21.566 17.369 1.00 25.00 C ATOM 408 NH1 ARG A 27 18.807 -21.635 18.371 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.809 -22.614 16.618 1.00 25.00 N ATOM 0 H ARG A 27 16.504 -14.572 16.104 1.00 25.00 H new ATOM 0 HA ARG A 27 18.674 -16.479 16.874 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.950 -16.597 18.456 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.703 -16.198 17.291 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.320 -18.440 17.913 1.00 25.00 H new ATOM 0 HG3 ARG A 27 16.000 -18.504 16.299 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.299 -18.738 17.713 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.192 -19.397 18.901 1.00 25.00 H new ATOM 0 HE ARG A 27 16.647 -20.510 16.281 1.00 25.00 H new ATOM 0 HH11 ARG A 27 18.950 -20.825 18.974 1.00 25.00 H new ATOM 0 HH12 ARG A 27 19.319 -22.499 18.549 1.00 25.00 H new ATOM 0 HH21 ARG A 27 17.162 -22.584 15.830 1.00 25.00 H new ATOM 0 HH22 ARG A 27 18.333 -23.466 16.816 1.00 25.00 H new ATOM 423 N LYS A 28 18.366 -18.013 14.935 1.00 25.00 N ATOM 424 CA LYS A 28 18.347 -18.824 13.715 1.00 25.00 C ATOM 425 C LYS A 28 16.921 -19.257 13.395 1.00 25.00 C ATOM 426 O LYS A 28 16.259 -19.897 14.214 1.00 25.00 O ATOM 427 CB LYS A 28 19.239 -20.047 13.953 1.00 25.00 C ATOM 428 CG LYS A 28 19.254 -21.086 12.854 1.00 25.00 C ATOM 429 CD LYS A 28 20.408 -22.052 13.132 1.00 25.00 C ATOM 430 CE LYS A 28 20.542 -23.158 12.101 1.00 25.00 C ATOM 431 NZ LYS A 28 21.999 -23.313 11.773 1.00 25.00 N ATOM 0 H LYS A 28 18.999 -18.364 15.654 1.00 25.00 H new ATOM 0 HA LYS A 28 18.718 -18.248 12.867 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.260 -19.701 14.111 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.920 -20.530 14.877 1.00 25.00 H new ATOM 0 HG2 LYS A 28 18.306 -21.623 12.825 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.381 -20.610 11.882 1.00 25.00 H new ATOM 0 HD2 LYS A 28 21.340 -21.488 13.170 1.00 25.00 H new ATOM 0 HD3 LYS A 28 20.266 -22.500 14.116 1.00 25.00 H new ATOM 0 HE2 LYS A 28 20.138 -24.092 12.490 1.00 25.00 H new ATOM 0 HE3 LYS A 28 19.973 -22.913 11.204 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 22.150 -23.120 10.762 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 22.556 -22.642 12.340 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 22.302 -24.284 11.989 1.00 25.00 H new ATOM 445 N GLY A 29 16.473 -18.906 12.196 1.00 25.00 N ATOM 446 CA GLY A 29 15.125 -19.214 11.744 1.00 25.00 C ATOM 447 C GLY A 29 14.207 -18.004 11.697 1.00 25.00 C ATOM 448 O GLY A 29 13.128 -18.085 11.104 1.00 25.00 O ATOM 0 H GLY A 29 17.035 -18.400 11.511 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.177 -19.659 10.750 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.691 -19.963 12.406 1.00 25.00 H new ATOM 452 N ASP A 30 14.629 -16.893 12.288 1.00 25.00 N ATOM 453 CA ASP A 30 13.807 -15.678 12.349 1.00 25.00 C ATOM 454 C ASP A 30 13.695 -15.035 10.979 1.00 25.00 C ATOM 455 O ASP A 30 14.523 -15.286 10.097 1.00 25.00 O ATOM 456 CB ASP A 30 14.420 -14.650 13.311 1.00 25.00 C ATOM 457 CG ASP A 30 14.257 -15.036 14.777 1.00 25.00 C ATOM 458 OD1 ASP A 30 13.612 -16.064 15.070 1.00 25.00 O ATOM 459 OD2 ASP A 30 14.789 -14.302 15.638 1.00 25.00 O ATOM 0 H ASP A 30 15.541 -16.803 12.736 1.00 25.00 H new ATOM 0 HA ASP A 30 12.820 -15.974 12.703 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.481 -14.537 13.086 1.00 25.00 H new ATOM 0 HB3 ASP A 30 13.954 -13.679 13.142 1.00 25.00 H new ATOM 464 N ILE A 31 12.686 -14.186 10.815 1.00 25.00 N ATOM 465 CA ILE A 31 12.463 -13.451 9.567 1.00 25.00 C ATOM 466 C ILE A 31 12.533 -11.961 9.856 1.00 25.00 C ATOM 467 O ILE A 31 11.844 -11.471 10.745 1.00 25.00 O ATOM 468 CB ILE A 31 11.059 -13.747 8.954 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.887 -15.250 8.661 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.845 -12.926 7.650 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.945 -15.858 7.754 1.00 25.00 C ATOM 0 H ILE A 31 11.998 -13.985 11.541 1.00 25.00 H new ATOM 0 HA ILE A 31 13.229 -13.767 8.859 1.00 25.00 H new ATOM 0 HB ILE A 31 10.309 -13.450 9.687 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.888 -15.791 9.607 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.909 -15.406 8.206 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.860 -13.147 7.238 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.914 -11.862 7.875 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.611 -13.193 6.922 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.735 -16.918 7.609 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.932 -15.351 6.789 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.927 -15.742 8.212 1.00 25.00 H new ATOM 483 N MET A 32 13.326 -11.240 9.079 1.00 25.00 N ATOM 484 CA MET A 32 13.415 -9.789 9.191 1.00 25.00 C ATOM 485 C MET A 32 13.203 -9.165 7.830 1.00 25.00 C ATOM 486 O MET A 32 13.399 -9.810 6.795 1.00 25.00 O ATOM 487 CB MET A 32 14.771 -9.372 9.758 1.00 25.00 C ATOM 488 CG MET A 32 15.963 -9.918 9.000 1.00 25.00 C ATOM 489 SD MET A 32 17.249 -10.382 10.152 1.00 25.00 S ATOM 490 CE MET A 32 16.524 -11.897 10.895 1.00 25.00 C ATOM 0 H MET A 32 13.924 -11.640 8.356 1.00 25.00 H new ATOM 0 HA MET A 32 12.641 -9.440 9.874 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.828 -8.284 9.765 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.834 -9.701 10.795 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.664 -10.782 8.407 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.338 -9.168 8.304 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.524 -11.806 11.981 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.500 -12.022 10.542 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.116 -12.764 10.604 1.00 25.00 H new ATOM 500 N THR A 33 12.780 -7.914 7.843 1.00 25.00 N ATOM 501 CA THR A 33 12.514 -7.171 6.612 1.00 25.00 C ATOM 502 C THR A 33 13.774 -6.441 6.188 1.00 25.00 C ATOM 503 O THR A 33 14.210 -5.544 6.882 1.00 25.00 O ATOM 504 CB THR A 33 11.406 -6.123 6.833 1.00 25.00 C ATOM 505 OG1 THR A 33 10.205 -6.784 7.233 1.00 25.00 O ATOM 506 CG2 THR A 33 11.130 -5.333 5.569 1.00 25.00 C ATOM 0 H THR A 33 12.610 -7.383 8.697 1.00 25.00 H new ATOM 0 HA THR A 33 12.196 -7.879 5.847 1.00 25.00 H new ATOM 0 HB THR A 33 11.743 -5.433 7.606 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.498 -6.120 7.376 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.344 -4.603 5.761 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.037 -4.815 5.258 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.810 -6.012 4.778 1.00 25.00 H new ATOM 514 N VAL A 34 14.357 -6.813 5.061 1.00 25.00 N ATOM 515 CA VAL A 34 15.561 -6.151 4.566 1.00 25.00 C ATOM 516 C VAL A 34 15.166 -4.860 3.892 1.00 25.00 C ATOM 517 O VAL A 34 14.310 -4.833 2.999 1.00 25.00 O ATOM 518 CB VAL A 34 16.343 -7.022 3.570 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.671 -6.360 3.174 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.603 -8.381 4.186 1.00 25.00 C ATOM 0 H VAL A 34 14.019 -7.571 4.468 1.00 25.00 H new ATOM 0 HA VAL A 34 16.213 -5.965 5.419 1.00 25.00 H new ATOM 0 HB VAL A 34 15.745 -7.136 2.666 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.201 -7.000 2.469 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.472 -5.395 2.709 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.284 -6.214 4.063 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.158 -9.000 3.481 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.185 -8.261 5.100 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.653 -8.861 4.422 1.00 25.00 H new ATOM 530 N LEU A 35 15.777 -3.785 4.344 1.00 25.00 N ATOM 531 CA LEU A 35 15.496 -2.462 3.843 1.00 25.00 C ATOM 532 C LEU A 35 16.531 -2.086 2.805 1.00 25.00 C ATOM 533 O LEU A 35 16.182 -1.675 1.717 1.00 25.00 O ATOM 534 CB LEU A 35 15.515 -1.481 5.003 1.00 25.00 C ATOM 535 CG LEU A 35 14.463 -1.776 6.080 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.710 -0.860 7.230 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.035 -1.597 5.557 1.00 25.00 C ATOM 0 H LEU A 35 16.488 -3.808 5.075 1.00 25.00 H new ATOM 0 HA LEU A 35 14.512 -2.436 3.374 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.504 -1.493 5.461 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.355 -0.474 4.618 1.00 25.00 H new ATOM 0 HG LEU A 35 14.555 -2.818 6.387 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.974 -1.050 8.011 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.711 -1.034 7.625 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.626 0.174 6.896 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.325 -1.817 6.355 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.897 -0.569 5.221 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.865 -2.277 4.723 1.00 25.00 H new ATOM 549 N GLU A 36 17.799 -2.306 3.104 1.00 25.00 N ATOM 550 CA GLU A 36 18.844 -2.099 2.105 1.00 25.00 C ATOM 551 C GLU A 36 20.017 -3.002 2.426 1.00 25.00 C ATOM 552 O GLU A 36 20.042 -3.632 3.476 1.00 25.00 O ATOM 553 CB GLU A 36 19.255 -0.621 2.011 1.00 25.00 C ATOM 554 CG GLU A 36 20.151 -0.095 3.063 1.00 25.00 C ATOM 555 CD GLU A 36 20.308 1.422 2.984 1.00 25.00 C ATOM 556 OE1 GLU A 36 19.723 2.045 2.074 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.991 1.994 3.861 1.00 25.00 O ATOM 0 H GLU A 36 18.131 -2.623 4.015 1.00 25.00 H new ATOM 0 HA GLU A 36 18.459 -2.363 1.120 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.741 -0.467 1.047 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.347 -0.018 2.010 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.757 -0.367 4.042 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.130 -0.565 2.972 1.00 25.00 H new ATOM 564 N ARG A 37 20.968 -3.100 1.514 1.00 25.00 N ATOM 565 CA ARG A 37 22.133 -3.951 1.700 1.00 25.00 C ATOM 566 C ARG A 37 23.334 -3.082 1.481 1.00 25.00 C ATOM 567 O ARG A 37 23.241 -2.119 0.729 1.00 25.00 O ATOM 568 CB ARG A 37 22.137 -5.088 0.687 1.00 25.00 C ATOM 569 CG ARG A 37 20.929 -5.993 0.808 1.00 25.00 C ATOM 570 CD ARG A 37 21.074 -7.221 -0.065 1.00 25.00 C ATOM 571 NE ARG A 37 21.244 -6.846 -1.479 1.00 25.00 N ATOM 572 CZ ARG A 37 21.352 -7.695 -2.492 1.00 25.00 C ATOM 573 NH1 ARG A 37 21.298 -8.995 -2.321 1.00 25.00 N ATOM 574 NH2 ARG A 37 21.519 -7.226 -3.696 1.00 25.00 N ATOM 0 H ARG A 37 20.956 -2.595 0.628 1.00 25.00 H new ATOM 0 HA ARG A 37 22.130 -4.394 2.696 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.172 -4.670 -0.319 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.042 -5.681 0.818 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.801 -6.296 1.847 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.031 -5.445 0.523 1.00 25.00 H new ATOM 0 HD2 ARG A 37 21.932 -7.807 0.265 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.194 -7.855 0.044 1.00 25.00 H new ATOM 0 HE ARG A 37 21.282 -5.850 -1.697 1.00 25.00 H new ATOM 0 HH11 ARG A 37 21.169 -9.381 -1.386 1.00 25.00 H new ATOM 0 HH12 ARG A 37 21.385 -9.619 -3.123 1.00 25.00 H new ATOM 0 HH21 ARG A 37 21.565 -6.219 -3.849 1.00 25.00 H new ATOM 0 HH22 ARG A 37 21.604 -7.866 -4.486 1.00 25.00 H new ATOM 588 N ASP A 38 24.421 -3.422 2.156 1.00 25.00 N ATOM 589 CA ASP A 38 25.694 -2.710 2.056 1.00 25.00 C ATOM 590 C ASP A 38 25.443 -1.257 2.477 1.00 25.00 C ATOM 591 O ASP A 38 25.961 -0.283 1.927 1.00 25.00 O ATOM 592 CB ASP A 38 26.271 -2.918 0.655 1.00 25.00 C ATOM 593 CG ASP A 38 26.221 -4.396 0.239 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.535 -4.715 -0.765 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.697 -5.258 1.029 1.00 25.00 O ATOM 0 H ASP A 38 24.448 -4.212 2.800 1.00 25.00 H new ATOM 0 HA ASP A 38 26.464 -3.090 2.727 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.712 -2.318 -0.063 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.302 -2.566 0.629 1.00 25.00 H new ATOM 600 N THR A 39 24.574 -1.161 3.476 1.00 25.00 N ATOM 601 CA THR A 39 24.102 0.101 4.038 1.00 25.00 C ATOM 602 C THR A 39 25.249 0.869 4.667 1.00 25.00 C ATOM 603 O THR A 39 26.166 0.277 5.199 1.00 25.00 O ATOM 604 CB THR A 39 23.011 -0.174 5.106 1.00 25.00 C ATOM 605 OG1 THR A 39 22.626 1.039 5.753 1.00 25.00 O ATOM 606 CG2 THR A 39 23.457 -1.163 6.133 1.00 25.00 C ATOM 0 H THR A 39 24.167 -1.979 3.930 1.00 25.00 H new ATOM 0 HA THR A 39 23.680 0.702 3.232 1.00 25.00 H new ATOM 0 HB THR A 39 22.157 -0.600 4.579 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.912 1.471 5.240 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.658 -1.321 6.857 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.698 -2.108 5.647 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.341 -0.782 6.645 1.00 25.00 H new ATOM 614 N GLN A 40 25.201 2.195 4.569 1.00 25.00 N ATOM 615 CA GLN A 40 26.250 3.106 5.069 1.00 25.00 C ATOM 616 C GLN A 40 27.622 2.854 4.424 1.00 25.00 C ATOM 617 O GLN A 40 28.627 3.406 4.852 1.00 25.00 O ATOM 618 CB GLN A 40 26.379 3.047 6.602 1.00 25.00 C ATOM 619 CG GLN A 40 25.071 2.793 7.340 1.00 25.00 C ATOM 620 CD GLN A 40 25.221 2.872 8.847 1.00 25.00 C ATOM 621 OE1 GLN A 40 26.193 3.398 9.363 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.261 2.336 9.551 1.00 25.00 N ATOM 0 H GLN A 40 24.420 2.685 4.133 1.00 25.00 H new ATOM 0 HA GLN A 40 25.925 4.105 4.779 1.00 25.00 H new ATOM 0 HB2 GLN A 40 27.087 2.261 6.864 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.803 3.988 6.954 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.328 3.522 7.015 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.691 1.808 7.068 1.00 25.00 H new ATOM 0 HE21 GLN A 40 23.464 1.905 9.082 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.308 2.348 10.570 1.00 25.00 H new ATOM 631 N GLY A 41 27.644 2.012 3.399 1.00 25.00 N ATOM 632 CA GLY A 41 28.889 1.636 2.748 1.00 25.00 C ATOM 633 C GLY A 41 29.562 0.491 3.483 1.00 25.00 C ATOM 634 O GLY A 41 30.740 0.212 3.283 1.00 25.00 O ATOM 0 H GLY A 41 26.812 1.577 3.001 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.691 1.344 1.717 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.559 2.495 2.713 1.00 25.00 H new ATOM 638 N LEU A 42 28.814 -0.164 4.358 1.00 25.00 N ATOM 639 CA LEU A 42 29.320 -1.270 5.147 1.00 25.00 C ATOM 640 C LEU A 42 29.093 -2.558 4.372 1.00 25.00 C ATOM 641 O LEU A 42 28.018 -3.151 4.436 1.00 25.00 O ATOM 642 CB LEU A 42 28.587 -1.325 6.487 1.00 25.00 C ATOM 643 CG LEU A 42 28.670 -0.083 7.374 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.615 -0.174 8.460 1.00 25.00 C ATOM 645 CD2 LEU A 42 30.031 0.044 8.017 1.00 25.00 C ATOM 0 H LEU A 42 27.836 0.060 4.539 1.00 25.00 H new ATOM 0 HA LEU A 42 30.385 -1.139 5.340 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.535 -1.531 6.290 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.977 -2.172 7.052 1.00 25.00 H new ATOM 0 HG LEU A 42 28.502 0.794 6.749 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.670 0.710 9.096 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.627 -0.232 8.003 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.789 -1.066 9.062 1.00 25.00 H new ATOM 0 HD21 LEU A 42 30.057 0.937 8.641 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.226 -0.834 8.632 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.794 0.121 7.242 1.00 25.00 H new ATOM 657 N ASP A 43 30.092 -2.973 3.614 1.00 25.00 N ATOM 658 CA ASP A 43 29.974 -4.172 2.779 1.00 25.00 C ATOM 659 C ASP A 43 29.574 -5.385 3.612 1.00 25.00 C ATOM 660 O ASP A 43 30.179 -5.690 4.641 1.00 25.00 O ATOM 661 CB ASP A 43 31.295 -4.485 2.075 1.00 25.00 C ATOM 662 CG ASP A 43 31.426 -3.790 0.732 1.00 25.00 C ATOM 663 OD1 ASP A 43 30.499 -3.918 -0.095 1.00 25.00 O ATOM 664 OD2 ASP A 43 32.482 -3.174 0.479 1.00 25.00 O ATOM 0 H ASP A 43 30.996 -2.504 3.554 1.00 25.00 H new ATOM 0 HA ASP A 43 29.202 -3.966 2.037 1.00 25.00 H new ATOM 0 HB2 ASP A 43 32.123 -4.184 2.717 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.378 -5.562 1.931 1.00 25.00 H new ATOM 669 N GLY A 44 28.536 -6.075 3.164 1.00 25.00 N ATOM 670 CA GLY A 44 28.080 -7.271 3.849 1.00 25.00 C ATOM 671 C GLY A 44 27.092 -7.016 4.972 1.00 25.00 C ATOM 672 O GLY A 44 26.420 -7.954 5.415 1.00 25.00 O ATOM 0 H GLY A 44 27.997 -5.828 2.334 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.618 -7.938 3.121 1.00 25.00 H new ATOM 0 HA3 GLY A 44 28.946 -7.794 4.256 1.00 25.00 H new ATOM 676 N TRP A 45 26.966 -5.779 5.435 1.00 25.00 N ATOM 677 CA TRP A 45 25.993 -5.446 6.453 1.00 25.00 C ATOM 678 C TRP A 45 24.697 -5.065 5.753 1.00 25.00 C ATOM 679 O TRP A 45 24.691 -4.261 4.832 1.00 25.00 O ATOM 680 CB TRP A 45 26.516 -4.270 7.264 1.00 25.00 C ATOM 681 CG TRP A 45 27.571 -4.671 8.258 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.905 -4.426 8.202 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.373 -5.397 9.479 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.555 -4.908 9.296 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.645 -5.525 10.111 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.246 -5.947 10.110 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.805 -6.183 11.346 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.399 -6.597 11.344 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.676 -6.713 11.951 1.00 25.00 C ATOM 0 H TRP A 45 27.530 -4.991 5.117 1.00 25.00 H new ATOM 0 HA TRP A 45 25.818 -6.288 7.122 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.927 -3.522 6.587 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.686 -3.800 7.792 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.392 -3.911 7.387 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.555 -4.823 9.478 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.272 -5.871 9.650 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.777 -6.272 11.807 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.534 -7.014 11.838 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.770 -7.222 12.899 1.00 25.00 H new ATOM 700 N TRP A 46 23.594 -5.658 6.168 1.00 25.00 N ATOM 701 CA TRP A 46 22.302 -5.408 5.531 1.00 25.00 C ATOM 702 C TRP A 46 21.361 -4.766 6.540 1.00 25.00 C ATOM 703 O TRP A 46 21.145 -5.304 7.618 1.00 25.00 O ATOM 704 CB TRP A 46 21.709 -6.724 5.005 1.00 25.00 C ATOM 705 CG TRP A 46 22.545 -7.393 3.910 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.660 -6.906 3.298 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.316 -8.679 3.298 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.141 -7.765 2.359 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.349 -8.878 2.331 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.343 -9.684 3.463 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.425 -10.041 1.535 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.428 -10.862 2.680 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.464 -11.023 1.718 1.00 25.00 C ATOM 0 H TRP A 46 23.560 -6.319 6.944 1.00 25.00 H new ATOM 0 HA TRP A 46 22.437 -4.732 4.687 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.598 -7.418 5.838 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.709 -6.530 4.616 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.109 -5.952 3.530 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.959 -7.604 1.772 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.543 -9.558 4.177 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.210 -10.162 0.804 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.698 -11.647 2.815 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.502 -11.923 1.122 1.00 25.00 H new ATOM 724 N LEU A 47 20.811 -3.614 6.194 1.00 25.00 N ATOM 725 CA LEU A 47 19.876 -2.913 7.063 1.00 25.00 C ATOM 726 C LEU A 47 18.572 -3.672 7.031 1.00 25.00 C ATOM 727 O LEU A 47 17.984 -3.849 5.969 1.00 25.00 O ATOM 728 CB LEU A 47 19.641 -1.492 6.556 1.00 25.00 C ATOM 729 CG LEU A 47 18.629 -0.645 7.338 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.038 -0.460 8.786 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.453 0.712 6.667 1.00 25.00 C ATOM 0 H LEU A 47 20.997 -3.140 5.310 1.00 25.00 H new ATOM 0 HA LEU A 47 20.277 -2.856 8.075 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.597 -0.968 6.555 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.309 -1.550 5.520 1.00 25.00 H new ATOM 0 HG LEU A 47 17.680 -1.181 7.332 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.292 0.146 9.300 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.112 -1.434 9.271 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.005 0.041 8.830 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.733 1.306 7.230 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.411 1.232 6.641 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.090 0.570 5.649 1.00 25.00 H new ATOM 743 N CYS A 48 18.118 -4.124 8.183 1.00 25.00 N ATOM 744 CA CYS A 48 16.866 -4.847 8.277 1.00 25.00 C ATOM 745 C CYS A 48 16.047 -4.329 9.434 1.00 25.00 C ATOM 746 O CYS A 48 16.519 -3.533 10.238 1.00 25.00 O ATOM 747 CB CYS A 48 17.127 -6.348 8.450 1.00 25.00 C ATOM 748 SG CYS A 48 18.336 -7.026 7.286 1.00 25.00 S ATOM 0 H CYS A 48 18.602 -4.002 9.073 1.00 25.00 H new ATOM 0 HA CYS A 48 16.308 -4.692 7.353 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.475 -6.531 9.467 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.186 -6.885 8.334 1.00 25.00 H new ATOM 0 HG CYS A 48 19.460 -6.383 7.404 1.00 25.00 H new ATOM 754 N SER A 49 14.815 -4.795 9.512 1.00 25.00 N ATOM 755 CA SER A 49 13.911 -4.432 10.583 1.00 25.00 C ATOM 756 C SER A 49 13.317 -5.702 11.174 1.00 25.00 C ATOM 757 O SER A 49 12.811 -6.562 10.441 1.00 25.00 O ATOM 758 CB SER A 49 12.832 -3.500 10.040 1.00 25.00 C ATOM 759 OG SER A 49 11.576 -4.148 9.921 1.00 25.00 O ATOM 0 H SER A 49 14.413 -5.439 8.831 1.00 25.00 H new ATOM 0 HA SER A 49 14.440 -3.901 11.374 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.733 -2.638 10.700 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.138 -3.122 9.065 1.00 25.00 H new ATOM 0 HG SER A 49 10.914 -3.516 9.572 1.00 25.00 H new ATOM 765 N LEU A 50 13.417 -5.832 12.486 1.00 25.00 N ATOM 766 CA LEU A 50 12.910 -6.994 13.213 1.00 25.00 C ATOM 767 C LEU A 50 12.308 -6.494 14.516 1.00 25.00 C ATOM 768 O LEU A 50 12.915 -5.676 15.190 1.00 25.00 O ATOM 769 CB LEU A 50 14.054 -7.965 13.513 1.00 25.00 C ATOM 770 CG LEU A 50 13.622 -9.257 14.221 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.808 -10.435 13.315 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.403 -9.446 15.511 1.00 25.00 C ATOM 0 H LEU A 50 13.855 -5.132 13.085 1.00 25.00 H new ATOM 0 HA LEU A 50 12.162 -7.518 12.618 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.547 -8.226 12.577 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.793 -7.456 14.132 1.00 25.00 H new ATOM 0 HG LEU A 50 12.564 -9.177 14.471 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.497 -11.344 13.831 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.204 -10.303 12.418 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.859 -10.517 13.036 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.083 -10.367 15.999 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.468 -9.506 15.286 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.219 -8.601 16.175 1.00 25.00 H new ATOM 784 N HIS A 51 11.097 -6.942 14.830 1.00 25.00 N ATOM 785 CA HIS A 51 10.370 -6.533 16.047 1.00 25.00 C ATOM 786 C HIS A 51 10.221 -5.004 16.148 1.00 25.00 C ATOM 787 O HIS A 51 10.182 -4.445 17.236 1.00 25.00 O ATOM 788 CB HIS A 51 11.072 -7.069 17.313 1.00 25.00 C ATOM 789 CG HIS A 51 11.132 -8.565 17.393 1.00 25.00 C ATOM 790 ND1 HIS A 51 11.840 -9.256 18.343 1.00 25.00 N ATOM 791 CD2 HIS A 51 10.546 -9.525 16.624 1.00 25.00 C ATOM 792 CE1 HIS A 51 11.667 -10.558 18.126 1.00 25.00 C ATOM 793 NE2 HIS A 51 10.879 -10.778 17.094 1.00 25.00 N ATOM 0 H HIS A 51 10.581 -7.603 14.250 1.00 25.00 H new ATOM 0 HA HIS A 51 9.372 -6.966 15.976 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.087 -6.673 17.348 1.00 25.00 H new ATOM 0 HB3 HIS A 51 10.551 -6.689 18.192 1.00 25.00 H new ATOM 0 HD2 HIS A 51 9.913 -9.333 15.770 1.00 25.00 H new ATOM 0 HE1 HIS A 51 12.117 -11.338 18.723 1.00 25.00 H new ATOM 0 HE2 HIS A 51 10.580 -11.680 16.723 1.00 25.00 H new ATOM 801 N GLY A 52 10.146 -4.332 15.004 1.00 25.00 N ATOM 802 CA GLY A 52 10.004 -2.881 14.993 1.00 25.00 C ATOM 803 C GLY A 52 11.292 -2.129 15.284 1.00 25.00 C ATOM 804 O GLY A 52 11.282 -0.912 15.427 1.00 25.00 O ATOM 0 H GLY A 52 10.181 -4.764 14.081 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.627 -2.571 14.018 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.254 -2.595 15.730 1.00 25.00 H new ATOM 808 N ARG A 53 12.411 -2.842 15.353 1.00 25.00 N ATOM 809 CA ARG A 53 13.713 -2.241 15.606 1.00 25.00 C ATOM 810 C ARG A 53 14.453 -2.369 14.299 1.00 25.00 C ATOM 811 O ARG A 53 14.381 -3.402 13.648 1.00 25.00 O ATOM 812 CB ARG A 53 14.437 -3.011 16.719 1.00 25.00 C ATOM 813 CG ARG A 53 15.338 -2.168 17.629 1.00 25.00 C ATOM 814 CD ARG A 53 16.646 -1.749 16.963 1.00 25.00 C ATOM 815 NE ARG A 53 17.643 -1.353 17.969 1.00 25.00 N ATOM 816 CZ ARG A 53 18.892 -0.973 17.711 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.382 -0.879 16.503 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.664 -0.683 18.714 1.00 25.00 N ATOM 0 H ARG A 53 12.439 -3.855 15.235 1.00 25.00 H new ATOM 0 HA ARG A 53 13.642 -1.204 15.934 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.690 -3.508 17.337 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.043 -3.793 16.261 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.795 -1.276 17.941 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.564 -2.735 18.532 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.035 -2.573 16.365 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.462 -0.919 16.281 1.00 25.00 H new ATOM 0 HE ARG A 53 17.353 -1.371 18.947 1.00 25.00 H new ATOM 0 HH11 ARG A 53 18.798 -1.103 15.697 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.348 -0.582 16.366 1.00 25.00 H new ATOM 0 HH21 ARG A 53 19.308 -0.750 19.668 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.626 -0.389 18.548 1.00 25.00 H new ATOM 832 N GLN A 54 15.142 -1.319 13.909 1.00 25.00 N ATOM 833 CA GLN A 54 15.903 -1.317 12.668 1.00 25.00 C ATOM 834 C GLN A 54 17.374 -1.435 13.005 1.00 25.00 C ATOM 835 O GLN A 54 17.799 -0.947 14.047 1.00 25.00 O ATOM 836 CB GLN A 54 15.647 -0.018 11.914 1.00 25.00 C ATOM 837 CG GLN A 54 14.847 -0.211 10.662 1.00 25.00 C ATOM 838 CD GLN A 54 14.512 1.099 9.974 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.365 1.366 9.665 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.509 1.911 9.723 1.00 25.00 N ATOM 0 H GLN A 54 15.194 -0.447 14.435 1.00 25.00 H new ATOM 0 HA GLN A 54 15.599 -2.154 12.040 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.123 0.678 12.569 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.602 0.442 11.660 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.405 -0.846 9.974 1.00 25.00 H new ATOM 0 HG3 GLN A 54 13.923 -0.737 10.903 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.457 1.654 9.997 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.337 2.800 9.254 1.00 25.00 H new ATOM 849 N GLY A 55 18.140 -2.068 12.135 1.00 25.00 N ATOM 850 CA GLY A 55 19.567 -2.180 12.356 1.00 25.00 C ATOM 851 C GLY A 55 20.293 -3.020 11.329 1.00 25.00 C ATOM 852 O GLY A 55 19.656 -3.675 10.504 1.00 25.00 O ATOM 0 H GLY A 55 17.802 -2.507 11.279 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.001 -1.180 12.363 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.737 -2.608 13.344 1.00 25.00 H new ATOM 856 N ILE A 56 21.616 -2.990 11.360 1.00 25.00 N ATOM 857 CA ILE A 56 22.437 -3.749 10.418 1.00 25.00 C ATOM 858 C ILE A 56 22.509 -5.218 10.839 1.00 25.00 C ATOM 859 O ILE A 56 22.303 -5.567 12.005 1.00 25.00 O ATOM 860 CB ILE A 56 23.872 -3.138 10.279 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.639 -3.247 11.613 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.756 -1.659 9.858 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.055 -2.669 11.586 1.00 25.00 C ATOM 0 H ILE A 56 22.153 -2.443 12.033 1.00 25.00 H new ATOM 0 HA ILE A 56 21.963 -3.689 9.438 1.00 25.00 H new ATOM 0 HB ILE A 56 24.423 -3.693 9.520 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.067 -2.736 12.388 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.695 -4.297 11.899 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.753 -1.229 9.760 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.237 -1.592 8.902 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.196 -1.108 10.614 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.516 -2.790 12.566 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.648 -3.195 10.838 1.00 25.00 H new ATOM 0 HD13 ILE A 56 26.011 -1.609 11.334 1.00 25.00 H new ATOM 875 N VAL A 57 22.747 -6.076 9.862 1.00 25.00 N ATOM 876 CA VAL A 57 22.794 -7.526 10.059 1.00 25.00 C ATOM 877 C VAL A 57 23.891 -8.109 9.174 1.00 25.00 C ATOM 878 O VAL A 57 24.017 -7.714 8.019 1.00 25.00 O ATOM 879 CB VAL A 57 21.456 -8.169 9.600 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.499 -9.673 9.635 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.293 -7.633 10.434 1.00 25.00 C ATOM 0 H VAL A 57 22.916 -5.789 8.898 1.00 25.00 H new ATOM 0 HA VAL A 57 22.976 -7.729 11.114 1.00 25.00 H new ATOM 0 HB VAL A 57 21.301 -7.886 8.559 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.540 -10.072 9.305 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.288 -10.030 8.973 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.701 -10.008 10.653 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.363 -8.093 10.100 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.459 -7.871 11.485 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.227 -6.552 10.313 1.00 25.00 H new ATOM 891 N PRO A 58 24.666 -9.081 9.675 1.00 25.00 N ATOM 892 CA PRO A 58 25.643 -9.716 8.791 1.00 25.00 C ATOM 893 C PRO A 58 24.960 -10.593 7.734 1.00 25.00 C ATOM 894 O PRO A 58 24.361 -11.628 8.045 1.00 25.00 O ATOM 895 CB PRO A 58 26.484 -10.546 9.762 1.00 25.00 C ATOM 896 CG PRO A 58 25.556 -10.884 10.874 1.00 25.00 C ATOM 897 CD PRO A 58 24.664 -9.682 11.020 1.00 25.00 C ATOM 0 HA PRO A 58 26.233 -9.003 8.215 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.870 -11.445 9.282 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.344 -9.982 10.122 1.00 25.00 H new ATOM 0 HG2 PRO A 58 24.977 -11.779 10.646 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.102 -11.084 11.796 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.658 -9.965 11.331 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.046 -8.988 11.769 1.00 25.00 H new ATOM 905 N GLY A 59 25.071 -10.194 6.474 1.00 25.00 N ATOM 906 CA GLY A 59 24.470 -10.940 5.377 1.00 25.00 C ATOM 907 C GLY A 59 24.992 -12.359 5.267 1.00 25.00 C ATOM 908 O GLY A 59 24.321 -13.236 4.746 1.00 25.00 O ATOM 0 H GLY A 59 25.574 -9.355 6.186 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.389 -10.966 5.513 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.661 -10.415 4.441 1.00 25.00 H new ATOM 912 N ASN A 60 26.171 -12.608 5.821 1.00 25.00 N ATOM 913 CA ASN A 60 26.762 -13.949 5.821 1.00 25.00 C ATOM 914 C ASN A 60 25.936 -14.942 6.653 1.00 25.00 C ATOM 915 O ASN A 60 26.077 -16.157 6.508 1.00 25.00 O ATOM 916 CB ASN A 60 28.196 -13.891 6.368 1.00 25.00 C ATOM 917 CG ASN A 60 29.143 -14.812 5.623 1.00 25.00 C ATOM 918 OD1 ASN A 60 30.164 -14.382 5.129 1.00 25.00 O ATOM 919 ND2 ASN A 60 28.798 -16.065 5.524 1.00 25.00 N ATOM 0 H ASN A 60 26.743 -11.899 6.279 1.00 25.00 H new ATOM 0 HA ASN A 60 26.770 -14.301 4.790 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.565 -12.867 6.303 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.189 -14.160 7.424 1.00 25.00 H new ATOM 0 HD21 ASN A 60 29.394 -16.720 5.018 1.00 25.00 H new ATOM 0 HD22 ASN A 60 27.932 -16.391 5.953 1.00 25.00 H new ATOM 926 N ARG A 61 25.061 -14.431 7.514 1.00 25.00 N ATOM 927 CA ARG A 61 24.194 -15.272 8.341 1.00 25.00 C ATOM 928 C ARG A 61 22.738 -15.124 7.920 1.00 25.00 C ATOM 929 O ARG A 61 21.835 -15.612 8.611 1.00 25.00 O ATOM 930 CB ARG A 61 24.337 -14.887 9.820 1.00 25.00 C ATOM 931 CG ARG A 61 25.740 -15.077 10.378 1.00 25.00 C ATOM 932 CD ARG A 61 25.756 -14.845 11.880 1.00 25.00 C ATOM 933 NE ARG A 61 27.094 -15.062 12.450 1.00 25.00 N ATOM 934 CZ ARG A 61 27.383 -15.105 13.745 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.472 -14.983 14.679 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.619 -15.291 14.104 1.00 25.00 N ATOM 0 H ARG A 61 24.931 -13.430 7.660 1.00 25.00 H new ATOM 0 HA ARG A 61 24.498 -16.310 8.204 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.047 -13.843 9.942 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.640 -15.483 10.409 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.091 -16.085 10.157 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.427 -14.386 9.891 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.430 -13.827 12.094 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.043 -15.516 12.359 1.00 25.00 H new ATOM 0 HE ARG A 61 27.865 -15.190 11.795 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.494 -14.849 14.423 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.741 -15.022 15.662 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.345 -15.401 13.396 1.00 25.00 H new ATOM 0 HH22 ARG A 61 28.863 -15.327 15.094 1.00 25.00 H new ATOM 950 N LEU A 62 22.500 -14.452 6.802 1.00 25.00 N ATOM 951 CA LEU A 62 21.141 -14.165 6.355 1.00 25.00 C ATOM 952 C LEU A 62 20.870 -14.610 4.928 1.00 25.00 C ATOM 953 O LEU A 62 21.709 -14.490 4.050 1.00 25.00 O ATOM 954 CB LEU A 62 20.888 -12.663 6.461 1.00 25.00 C ATOM 955 CG LEU A 62 19.448 -12.252 6.772 1.00 25.00 C ATOM 956 CD1 LEU A 62 18.983 -12.709 8.111 1.00 25.00 C ATOM 957 CD2 LEU A 62 19.310 -10.751 6.652 1.00 25.00 C ATOM 0 H LEU A 62 23.230 -14.094 6.186 1.00 25.00 H new ATOM 0 HA LEU A 62 20.469 -14.731 7.000 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.537 -12.258 7.237 1.00 25.00 H new ATOM 0 HB3 LEU A 62 21.185 -12.196 5.522 1.00 25.00 H new ATOM 0 HG LEU A 62 18.809 -12.747 6.040 1.00 25.00 H new ATOM 0 HD11 LEU A 62 17.954 -12.385 8.269 1.00 25.00 H new ATOM 0 HD12 LEU A 62 19.033 -13.797 8.162 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.621 -12.280 8.884 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.283 -10.461 6.874 1.00 25.00 H new ATOM 0 HD22 LEU A 62 19.985 -10.266 7.358 1.00 25.00 H new ATOM 0 HD23 LEU A 62 19.563 -10.442 5.638 1.00 25.00 H new ATOM 969 N LYS A 63 19.664 -15.106 4.697 1.00 25.00 N ATOM 970 CA LYS A 63 19.261 -15.531 3.357 1.00 25.00 C ATOM 971 C LYS A 63 18.045 -14.791 2.892 1.00 25.00 C ATOM 972 O LYS A 63 16.976 -14.901 3.477 1.00 25.00 O ATOM 973 CB LYS A 63 18.974 -17.032 3.307 1.00 25.00 C ATOM 974 CG LYS A 63 18.419 -17.492 1.951 1.00 25.00 C ATOM 975 CD LYS A 63 18.516 -18.996 1.754 1.00 25.00 C ATOM 976 CE LYS A 63 17.617 -19.779 2.709 1.00 25.00 C ATOM 977 NZ LYS A 63 17.851 -21.255 2.534 1.00 25.00 N ATOM 0 H LYS A 63 18.948 -15.225 5.413 1.00 25.00 H new ATOM 0 HA LYS A 63 20.097 -15.304 2.695 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.892 -17.579 3.522 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.260 -17.286 4.091 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.376 -17.186 1.868 1.00 25.00 H new ATOM 0 HG3 LYS A 63 18.964 -16.990 1.151 1.00 25.00 H new ATOM 0 HD2 LYS A 63 18.247 -19.241 0.727 1.00 25.00 H new ATOM 0 HD3 LYS A 63 19.550 -19.310 1.896 1.00 25.00 H new ATOM 0 HE2 LYS A 63 17.824 -19.488 3.739 1.00 25.00 H new ATOM 0 HE3 LYS A 63 16.571 -19.542 2.515 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 17.237 -21.784 3.186 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 17.632 -21.527 1.555 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 18.846 -21.476 2.740 1.00 25.00 H new ATOM 991 N ILE A 64 18.209 -14.086 1.792 1.00 25.00 N ATOM 992 CA ILE A 64 17.117 -13.358 1.175 1.00 25.00 C ATOM 993 C ILE A 64 16.109 -14.356 0.621 1.00 25.00 C ATOM 994 O ILE A 64 16.465 -15.257 -0.143 1.00 25.00 O ATOM 995 CB ILE A 64 17.645 -12.468 0.023 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.742 -11.514 0.534 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.520 -11.667 -0.603 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.311 -10.538 1.657 1.00 25.00 C ATOM 0 H ILE A 64 19.099 -14.001 1.301 1.00 25.00 H new ATOM 0 HA ILE A 64 16.644 -12.720 1.922 1.00 25.00 H new ATOM 0 HB ILE A 64 18.070 -13.124 -0.736 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.578 -12.112 0.898 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.111 -10.930 -0.309 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.917 -11.050 -1.409 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.768 -12.347 -1.003 1.00 25.00 H new ATOM 0 HG23 ILE A 64 16.065 -11.027 0.153 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.158 -9.914 1.941 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.499 -9.906 1.298 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.972 -11.107 2.523 1.00 25.00 H new ATOM 1010 N LEU A 65 14.856 -14.205 1.013 1.00 25.00 N ATOM 1011 CA LEU A 65 13.794 -15.076 0.534 1.00 25.00 C ATOM 1012 C LEU A 65 13.179 -14.421 -0.698 1.00 25.00 C ATOM 1013 O LEU A 65 12.160 -13.742 -0.624 1.00 25.00 O ATOM 1014 CB LEU A 65 12.754 -15.304 1.637 1.00 25.00 C ATOM 1015 CG LEU A 65 13.318 -15.878 2.948 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.195 -15.992 3.971 1.00 25.00 C ATOM 1017 CD2 LEU A 65 13.997 -17.251 2.738 1.00 25.00 C ATOM 0 H LEU A 65 14.547 -13.484 1.665 1.00 25.00 H new ATOM 0 HA LEU A 65 14.186 -16.057 0.265 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.262 -14.356 1.854 1.00 25.00 H new ATOM 0 HB3 LEU A 65 11.988 -15.982 1.260 1.00 25.00 H new ATOM 0 HG LEU A 65 14.086 -15.197 3.314 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.591 -16.399 4.902 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.771 -15.005 4.157 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.419 -16.654 3.587 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.380 -17.617 3.691 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.270 -17.960 2.343 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.821 -17.145 2.032 1.00 25.00 H new ATOM 1029 N VAL A 66 13.861 -14.576 -1.822 1.00 25.00 N ATOM 1030 CA VAL A 66 13.439 -13.959 -3.077 1.00 25.00 C ATOM 1031 C VAL A 66 12.096 -14.520 -3.547 1.00 25.00 C ATOM 1032 O VAL A 66 11.952 -15.715 -3.782 1.00 25.00 O ATOM 1033 CB VAL A 66 14.497 -14.172 -4.203 1.00 25.00 C ATOM 1034 CG1 VAL A 66 15.539 -13.051 -4.173 1.00 25.00 C ATOM 1035 CG2 VAL A 66 15.203 -15.539 -4.060 1.00 25.00 C ATOM 0 H VAL A 66 14.716 -15.128 -1.894 1.00 25.00 H new ATOM 0 HA VAL A 66 13.336 -12.892 -2.881 1.00 25.00 H new ATOM 0 HB VAL A 66 13.971 -14.154 -5.158 1.00 25.00 H new ATOM 0 HG11 VAL A 66 16.271 -13.213 -4.964 1.00 25.00 H new ATOM 0 HG12 VAL A 66 15.045 -12.091 -4.326 1.00 25.00 H new ATOM 0 HG13 VAL A 66 16.044 -13.049 -3.207 1.00 25.00 H new ATOM 0 HG21 VAL A 66 15.934 -15.656 -4.860 1.00 25.00 H new ATOM 0 HG22 VAL A 66 15.709 -15.588 -3.096 1.00 25.00 H new ATOM 0 HG23 VAL A 66 14.465 -16.338 -4.123 1.00 25.00 H new ATOM 1045 N GLY A 67 11.116 -13.639 -3.694 1.00 25.00 N ATOM 1046 CA GLY A 67 9.780 -14.052 -4.099 1.00 25.00 C ATOM 1047 C GLY A 67 9.594 -14.192 -5.597 1.00 25.00 C ATOM 1048 O GLY A 67 8.490 -14.413 -6.066 1.00 25.00 O ATOM 0 H GLY A 67 11.221 -12.636 -3.539 1.00 25.00 H new ATOM 0 HA2 GLY A 67 9.549 -15.006 -3.626 1.00 25.00 H new ATOM 0 HA3 GLY A 67 9.059 -13.327 -3.722 1.00 25.00 H new ATOM 1052 N MET A 68 10.675 -14.069 -6.356 1.00 25.00 N ATOM 1053 CA MET A 68 10.611 -14.182 -7.818 1.00 25.00 C ATOM 1054 C MET A 68 10.581 -15.644 -8.273 1.00 25.00 C ATOM 1055 O MET A 68 10.544 -15.925 -9.466 1.00 25.00 O ATOM 1056 CB MET A 68 11.802 -13.454 -8.461 1.00 25.00 C ATOM 1057 CG MET A 68 13.155 -14.103 -8.186 1.00 25.00 C ATOM 1058 SD MET A 68 14.530 -13.178 -8.921 1.00 25.00 S ATOM 1059 CE MET A 68 14.638 -11.724 -7.854 1.00 25.00 C ATOM 0 H MET A 68 11.610 -13.891 -5.989 1.00 25.00 H new ATOM 0 HA MET A 68 9.683 -13.713 -8.144 1.00 25.00 H new ATOM 0 HB2 MET A 68 11.646 -13.408 -9.539 1.00 25.00 H new ATOM 0 HB3 MET A 68 11.824 -12.426 -8.098 1.00 25.00 H new ATOM 0 HG2 MET A 68 13.306 -14.178 -7.109 1.00 25.00 H new ATOM 0 HG3 MET A 68 13.154 -15.120 -8.579 1.00 25.00 H new ATOM 0 HE1 MET A 68 15.529 -11.150 -8.110 1.00 25.00 H new ATOM 0 HE2 MET A 68 13.753 -11.103 -7.995 1.00 25.00 H new ATOM 0 HE3 MET A 68 14.697 -12.040 -6.813 1.00 25.00 H new ATOM 1069 N TYR A 69 10.600 -16.567 -7.319 1.00 25.00 N ATOM 1070 CA TYR A 69 10.561 -17.995 -7.622 1.00 25.00 C ATOM 1071 C TYR A 69 9.370 -18.661 -6.946 1.00 25.00 C ATOM 1072 O TYR A 69 9.392 -18.929 -5.744 1.00 25.00 O ATOM 1073 CB TYR A 69 11.853 -18.673 -7.159 1.00 25.00 C ATOM 1074 CG TYR A 69 13.094 -18.125 -7.829 1.00 25.00 C ATOM 1075 CD1 TYR A 69 14.102 -17.493 -7.075 1.00 25.00 C ATOM 1076 CD2 TYR A 69 13.269 -18.233 -9.226 1.00 25.00 C ATOM 1077 CE1 TYR A 69 15.272 -16.986 -7.702 1.00 25.00 C ATOM 1078 CE2 TYR A 69 14.432 -17.720 -9.855 1.00 25.00 C ATOM 1079 CZ TYR A 69 15.423 -17.105 -9.085 1.00 25.00 C ATOM 1080 OH TYR A 69 16.554 -16.614 -9.687 1.00 25.00 O ATOM 0 H TYR A 69 10.642 -16.352 -6.323 1.00 25.00 H new ATOM 0 HA TYR A 69 10.461 -18.106 -8.702 1.00 25.00 H new ATOM 0 HB2 TYR A 69 11.950 -18.555 -6.080 1.00 25.00 H new ATOM 0 HB3 TYR A 69 11.784 -19.743 -7.358 1.00 25.00 H new ATOM 0 HD1 TYR A 69 13.984 -17.392 -6.006 1.00 25.00 H new ATOM 0 HD2 TYR A 69 12.507 -18.712 -9.823 1.00 25.00 H new ATOM 0 HE1 TYR A 69 16.041 -16.511 -7.111 1.00 25.00 H new ATOM 0 HE2 TYR A 69 14.551 -17.804 -10.925 1.00 25.00 H new ATOM 0 HH TYR A 69 16.507 -16.776 -10.652 1.00 25.00 H new ATOM 1090 N ASP A 70 8.343 -18.956 -7.728 1.00 25.00 N ATOM 1091 CA ASP A 70 7.172 -19.678 -7.228 1.00 25.00 C ATOM 1092 C ASP A 70 7.534 -21.151 -7.050 1.00 25.00 C ATOM 1093 O ASP A 70 7.016 -21.852 -6.174 1.00 25.00 O ATOM 1094 CB ASP A 70 6.019 -19.585 -8.244 1.00 25.00 C ATOM 1095 CG ASP A 70 6.327 -20.329 -9.548 1.00 25.00 C ATOM 1096 OD1 ASP A 70 5.625 -21.315 -9.862 1.00 25.00 O ATOM 1097 OD2 ASP A 70 7.342 -19.991 -10.201 1.00 25.00 O ATOM 0 H ASP A 70 8.292 -18.708 -8.716 1.00 25.00 H new ATOM 0 HA ASP A 70 6.863 -19.238 -6.280 1.00 25.00 H new ATOM 0 HB2 ASP A 70 5.113 -19.997 -7.800 1.00 25.00 H new ATOM 0 HB3 ASP A 70 5.818 -18.537 -8.466 1.00 25.00 H new ATOM 1102 N LYS A 71 8.413 -21.617 -7.925 1.00 25.00 N ATOM 1103 CA LYS A 71 8.750 -23.027 -8.024 1.00 25.00 C ATOM 1104 C LYS A 71 10.117 -23.338 -7.460 1.00 25.00 C ATOM 1105 O LYS A 71 11.098 -22.665 -7.745 1.00 25.00 O ATOM 1106 CB LYS A 71 8.702 -23.435 -9.497 1.00 25.00 C ATOM 1107 CG LYS A 71 7.591 -24.410 -9.830 1.00 25.00 C ATOM 1108 CD LYS A 71 8.066 -25.861 -9.702 1.00 25.00 C ATOM 1109 CE LYS A 71 6.950 -26.838 -10.062 1.00 25.00 C ATOM 1110 NZ LYS A 71 6.480 -26.655 -11.481 1.00 25.00 N ATOM 0 H LYS A 71 8.913 -21.025 -8.588 1.00 25.00 H new ATOM 0 HA LYS A 71 8.026 -23.589 -7.435 1.00 25.00 H new ATOM 0 HB2 LYS A 71 8.581 -22.540 -10.108 1.00 25.00 H new ATOM 0 HB3 LYS A 71 9.658 -23.882 -9.771 1.00 25.00 H new ATOM 0 HG2 LYS A 71 6.745 -24.242 -9.163 1.00 25.00 H new ATOM 0 HG3 LYS A 71 7.238 -24.229 -10.845 1.00 25.00 H new ATOM 0 HD2 LYS A 71 8.923 -26.026 -10.356 1.00 25.00 H new ATOM 0 HD3 LYS A 71 8.403 -26.048 -8.682 1.00 25.00 H new ATOM 0 HE2 LYS A 71 7.304 -27.860 -9.926 1.00 25.00 H new ATOM 0 HE3 LYS A 71 6.111 -26.698 -9.381 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 5.903 -27.473 -11.764 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 5.909 -25.788 -11.549 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 7.303 -26.577 -12.112 1.00 25.00 H new ATOM 1124 N LYS A 72 10.166 -24.410 -6.691 1.00 25.00 N ATOM 1125 CA LYS A 72 11.400 -24.932 -6.115 1.00 25.00 C ATOM 1126 C LYS A 72 11.076 -26.383 -5.814 1.00 25.00 C ATOM 1127 O LYS A 72 9.891 -26.726 -5.695 1.00 25.00 O ATOM 1128 CB LYS A 72 11.751 -24.178 -4.822 1.00 25.00 C ATOM 1129 CG LYS A 72 10.708 -24.355 -3.731 1.00 25.00 C ATOM 1130 CD LYS A 72 11.005 -23.513 -2.511 1.00 25.00 C ATOM 1131 CE LYS A 72 9.989 -23.818 -1.412 1.00 25.00 C ATOM 1132 NZ LYS A 72 8.580 -23.549 -1.889 1.00 25.00 N ATOM 0 H LYS A 72 9.339 -24.954 -6.443 1.00 25.00 H new ATOM 0 HA LYS A 72 12.257 -24.820 -6.779 1.00 25.00 H new ATOM 0 HB2 LYS A 72 12.716 -24.527 -4.455 1.00 25.00 H new ATOM 0 HB3 LYS A 72 11.860 -23.117 -5.045 1.00 25.00 H new ATOM 0 HG2 LYS A 72 9.726 -24.089 -4.123 1.00 25.00 H new ATOM 0 HG3 LYS A 72 10.662 -25.405 -3.442 1.00 25.00 H new ATOM 0 HD2 LYS A 72 12.014 -23.718 -2.153 1.00 25.00 H new ATOM 0 HD3 LYS A 72 10.968 -22.455 -2.770 1.00 25.00 H new ATOM 0 HE2 LYS A 72 10.081 -24.860 -1.106 1.00 25.00 H new ATOM 0 HE3 LYS A 72 10.203 -23.208 -0.534 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 7.940 -23.498 -1.071 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 8.555 -22.646 -2.405 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 8.274 -24.317 -2.520 1.00 25.00 H new ATOM 1146 N PRO A 73 12.087 -27.254 -5.693 1.00 25.00 N ATOM 1147 CA PRO A 73 11.685 -28.600 -5.274 1.00 25.00 C ATOM 1148 C PRO A 73 11.301 -28.632 -3.788 1.00 25.00 C ATOM 1149 O PRO A 73 11.908 -27.942 -2.967 1.00 25.00 O ATOM 1150 CB PRO A 73 12.942 -29.430 -5.543 1.00 25.00 C ATOM 1151 CG PRO A 73 14.065 -28.467 -5.338 1.00 25.00 C ATOM 1152 CD PRO A 73 13.551 -27.142 -5.857 1.00 25.00 C ATOM 0 HA PRO A 73 10.805 -28.969 -5.801 1.00 25.00 H new ATOM 0 HB2 PRO A 73 13.014 -30.277 -4.861 1.00 25.00 H new ATOM 0 HB3 PRO A 73 12.944 -29.835 -6.555 1.00 25.00 H new ATOM 0 HG2 PRO A 73 14.338 -28.398 -4.285 1.00 25.00 H new ATOM 0 HG3 PRO A 73 14.958 -28.782 -5.878 1.00 25.00 H new ATOM 0 HD2 PRO A 73 13.956 -26.304 -5.290 1.00 25.00 H new ATOM 0 HD3 PRO A 73 13.828 -26.984 -6.899 1.00 25.00 H new ATOM 1160 N ALA A 74 10.311 -29.457 -3.465 1.00 25.00 N ATOM 1161 CA ALA A 74 9.852 -29.688 -2.085 1.00 25.00 C ATOM 1162 C ALA A 74 9.437 -28.422 -1.291 1.00 25.00 C ATOM 1163 O ALA A 74 9.284 -27.320 -1.833 1.00 25.00 O ATOM 1164 CB ALA A 74 10.937 -30.489 -1.310 1.00 25.00 C ATOM 0 H ALA A 74 9.792 -29.996 -4.159 1.00 25.00 H new ATOM 0 HA ALA A 74 8.928 -30.259 -2.176 1.00 25.00 H new ATOM 0 HB1 ALA A 74 10.601 -30.662 -0.288 1.00 25.00 H new ATOM 0 HB2 ALA A 74 11.105 -31.446 -1.804 1.00 25.00 H new ATOM 0 HB3 ALA A 74 11.867 -29.921 -1.295 1.00 25.00 H new ATOM 1170 N GLY A 75 9.213 -28.613 0.001 1.00 25.00 N ATOM 1171 CA GLY A 75 8.794 -27.539 0.882 1.00 25.00 C ATOM 1172 C GLY A 75 8.596 -28.129 2.263 1.00 25.00 C ATOM 1173 O GLY A 75 8.762 -29.332 2.421 1.00 25.00 O ATOM 0 H GLY A 75 9.317 -29.516 0.465 1.00 25.00 H new ATOM 0 HA2 GLY A 75 9.545 -26.750 0.907 1.00 25.00 H new ATOM 0 HA3 GLY A 75 7.869 -27.088 0.522 1.00 25.00 H new ATOM 1177 N SER A 76 8.249 -27.291 3.236 1.00 25.00 N ATOM 1178 CA SER A 76 7.963 -27.714 4.626 1.00 25.00 C ATOM 1179 C SER A 76 9.082 -28.490 5.344 1.00 25.00 C ATOM 1180 O SER A 76 8.837 -29.133 6.360 1.00 25.00 O ATOM 1181 CB SER A 76 6.671 -28.542 4.660 1.00 25.00 C ATOM 1182 OG SER A 76 6.103 -28.533 5.957 1.00 25.00 O ATOM 0 H SER A 76 8.154 -26.286 3.092 1.00 25.00 H new ATOM 0 HA SER A 76 7.867 -26.781 5.180 1.00 25.00 H new ATOM 0 HB2 SER A 76 5.956 -28.139 3.942 1.00 25.00 H new ATOM 0 HB3 SER A 76 6.883 -29.568 4.358 1.00 25.00 H new ATOM 0 HG SER A 76 6.803 -28.702 6.622 1.00 25.00 H new ATOM 1188 N GLY A 77 10.303 -28.418 4.834 1.00 25.00 N ATOM 1189 CA GLY A 77 11.414 -29.118 5.459 1.00 25.00 C ATOM 1190 C GLY A 77 12.044 -28.321 6.588 1.00 25.00 C ATOM 1191 O GLY A 77 11.923 -27.095 6.639 1.00 25.00 O ATOM 0 H GLY A 77 10.547 -27.888 3.998 1.00 25.00 H new ATOM 0 HA2 GLY A 77 11.064 -30.075 5.846 1.00 25.00 H new ATOM 0 HA3 GLY A 77 12.171 -29.336 4.706 1.00 25.00 H new ATOM 1195 N GLY A 78 12.747 -29.017 7.469 1.00 25.00 N ATOM 1196 CA GLY A 78 13.435 -28.389 8.584 1.00 25.00 C ATOM 1197 C GLY A 78 14.391 -29.427 9.131 1.00 25.00 C ATOM 1198 O GLY A 78 14.383 -30.553 8.636 1.00 25.00 O ATOM 0 H GLY A 78 12.856 -30.030 7.430 1.00 25.00 H new ATOM 0 HA2 GLY A 78 13.973 -27.499 8.258 1.00 25.00 H new ATOM 0 HA3 GLY A 78 12.727 -28.071 9.349 1.00 25.00 H new ATOM 1202 N SER A 79 15.219 -29.073 10.107 1.00 25.00 N ATOM 1203 CA SER A 79 16.186 -30.024 10.671 1.00 25.00 C ATOM 1204 C SER A 79 16.479 -29.729 12.146 1.00 25.00 C ATOM 1205 O SER A 79 15.815 -30.259 13.030 1.00 25.00 O ATOM 1206 CB SER A 79 17.489 -30.004 9.854 1.00 25.00 C ATOM 1207 OG SER A 79 17.211 -30.167 8.473 1.00 25.00 O ATOM 0 H SER A 79 15.245 -28.143 10.526 1.00 25.00 H new ATOM 0 HA SER A 79 15.743 -31.018 10.616 1.00 25.00 H new ATOM 0 HB2 SER A 79 18.013 -29.062 10.017 1.00 25.00 H new ATOM 0 HB3 SER A 79 18.151 -30.800 10.194 1.00 25.00 H new ATOM 0 HG SER A 79 18.050 -30.151 7.966 1.00 25.00 H new ATOM 1213 N GLY A 80 17.452 -28.867 12.414 1.00 25.00 N ATOM 1214 CA GLY A 80 17.780 -28.519 13.788 1.00 25.00 C ATOM 1215 C GLY A 80 16.761 -27.566 14.379 1.00 25.00 C ATOM 1216 O GLY A 80 16.079 -26.848 13.646 1.00 25.00 O ATOM 0 H GLY A 80 18.021 -28.402 11.707 1.00 25.00 H new ATOM 0 HA2 GLY A 80 17.826 -29.425 14.393 1.00 25.00 H new ATOM 0 HA3 GLY A 80 18.769 -28.062 13.822 1.00 25.00 H new ATOM 1220 N SER A 81 16.669 -27.543 15.702 1.00 25.00 N ATOM 1221 CA SER A 81 15.747 -26.641 16.399 1.00 25.00 C ATOM 1222 C SER A 81 16.316 -26.185 17.748 1.00 25.00 C ATOM 1223 O SER A 81 16.850 -25.089 17.849 1.00 25.00 O ATOM 1224 CB SER A 81 14.387 -27.321 16.591 1.00 25.00 C ATOM 1225 OG SER A 81 13.482 -26.456 17.254 1.00 25.00 O ATOM 0 H SER A 81 17.221 -28.138 16.320 1.00 25.00 H new ATOM 0 HA SER A 81 15.616 -25.753 15.781 1.00 25.00 H new ATOM 0 HB2 SER A 81 13.979 -27.608 15.622 1.00 25.00 H new ATOM 0 HB3 SER A 81 14.511 -28.237 17.169 1.00 25.00 H new ATOM 0 HG SER A 81 12.620 -26.908 17.365 1.00 25.00 H new ATOM 1231 N GLY A 82 16.228 -27.031 18.769 1.00 25.00 N ATOM 1232 CA GLY A 82 16.701 -26.657 20.100 1.00 25.00 C ATOM 1233 C GLY A 82 18.141 -27.036 20.402 1.00 25.00 C ATOM 1234 O GLY A 82 18.613 -26.832 21.509 1.00 25.00 O ATOM 0 H GLY A 82 15.838 -27.971 18.704 1.00 25.00 H new ATOM 0 HA2 GLY A 82 16.593 -25.579 20.217 1.00 25.00 H new ATOM 0 HA3 GLY A 82 16.055 -27.125 20.843 1.00 25.00 H new ATOM 1238 N LEU A 83 18.827 -27.619 19.429 1.00 25.00 N ATOM 1239 CA LEU A 83 20.213 -28.043 19.622 1.00 25.00 C ATOM 1240 C LEU A 83 21.149 -26.855 19.446 1.00 25.00 C ATOM 1241 O LEU A 83 20.842 -25.917 18.706 1.00 25.00 O ATOM 1242 CB LEU A 83 20.584 -29.141 18.616 1.00 25.00 C ATOM 1243 CG LEU A 83 19.796 -30.460 18.731 1.00 25.00 C ATOM 1244 CD1 LEU A 83 20.186 -31.389 17.585 1.00 25.00 C ATOM 1245 CD2 LEU A 83 20.055 -31.161 20.071 1.00 25.00 C ATOM 0 H LEU A 83 18.451 -27.810 18.500 1.00 25.00 H new ATOM 0 HA LEU A 83 20.315 -28.440 20.632 1.00 25.00 H new ATOM 0 HB2 LEU A 83 20.446 -28.745 17.610 1.00 25.00 H new ATOM 0 HB3 LEU A 83 21.645 -29.364 18.728 1.00 25.00 H new ATOM 0 HG LEU A 83 18.734 -30.222 18.677 1.00 25.00 H new ATOM 0 HD11 LEU A 83 19.628 -32.322 17.667 1.00 25.00 H new ATOM 0 HD12 LEU A 83 19.954 -30.910 16.634 1.00 25.00 H new ATOM 0 HD13 LEU A 83 21.254 -31.599 17.635 1.00 25.00 H new ATOM 0 HD21 LEU A 83 19.482 -32.087 20.114 1.00 25.00 H new ATOM 0 HD22 LEU A 83 21.117 -31.387 20.164 1.00 25.00 H new ATOM 0 HD23 LEU A 83 19.750 -30.507 20.888 1.00 25.00 H new ATOM 1257 N THR A 84 22.288 -26.915 20.117 1.00 25.00 N ATOM 1258 CA THR A 84 23.297 -25.860 20.072 1.00 25.00 C ATOM 1259 C THR A 84 24.572 -26.430 19.457 1.00 25.00 C ATOM 1260 O THR A 84 25.440 -26.945 20.155 1.00 25.00 O ATOM 1261 CB THR A 84 23.583 -25.321 21.491 1.00 25.00 C ATOM 1262 OG1 THR A 84 23.860 -26.417 22.366 1.00 25.00 O ATOM 1263 CG2 THR A 84 22.372 -24.579 22.043 1.00 25.00 C ATOM 0 H THR A 84 22.544 -27.702 20.714 1.00 25.00 H new ATOM 0 HA THR A 84 22.931 -25.031 19.466 1.00 25.00 H new ATOM 0 HB THR A 84 24.433 -24.641 21.431 1.00 25.00 H new ATOM 0 HG1 THR A 84 24.431 -27.067 21.906 1.00 25.00 H new ATOM 0 HG21 THR A 84 22.597 -24.209 23.043 1.00 25.00 H new ATOM 0 HG22 THR A 84 22.131 -23.740 21.391 1.00 25.00 H new ATOM 0 HG23 THR A 84 21.520 -25.257 22.091 1.00 25.00 H new ATOM 1271 N ASP A 85 24.633 -26.377 18.136 1.00 25.00 N ATOM 1272 CA ASP A 85 25.746 -26.913 17.354 1.00 25.00 C ATOM 1273 C ASP A 85 25.715 -26.079 16.071 1.00 25.00 C ATOM 1274 O ASP A 85 24.897 -25.160 15.990 1.00 25.00 O ATOM 1275 CB ASP A 85 25.523 -28.407 17.064 1.00 25.00 C ATOM 1276 CG ASP A 85 26.827 -29.167 16.824 1.00 25.00 C ATOM 1277 OD1 ASP A 85 27.781 -28.586 16.255 1.00 25.00 O ATOM 1278 OD2 ASP A 85 26.880 -30.359 17.183 1.00 25.00 O ATOM 0 H ASP A 85 23.902 -25.955 17.564 1.00 25.00 H new ATOM 0 HA ASP A 85 26.707 -26.851 17.864 1.00 25.00 H new ATOM 0 HB2 ASP A 85 24.994 -28.860 17.902 1.00 25.00 H new ATOM 0 HB3 ASP A 85 24.882 -28.510 16.189 1.00 25.00 H new ATOM 1283 N GLU A 86 26.558 -26.420 15.100 1.00 25.00 N ATOM 1284 CA GLU A 86 26.652 -25.738 13.793 1.00 25.00 C ATOM 1285 C GLU A 86 27.214 -24.314 13.944 1.00 25.00 C ATOM 1286 O GLU A 86 26.482 -23.332 14.090 1.00 25.00 O ATOM 1287 CB GLU A 86 25.299 -25.750 13.056 1.00 25.00 C ATOM 1288 CG GLU A 86 25.399 -25.525 11.551 1.00 25.00 C ATOM 1289 CD GLU A 86 24.024 -25.357 10.903 1.00 25.00 C ATOM 1290 OE1 GLU A 86 23.031 -25.935 11.412 1.00 25.00 O ATOM 1291 OE2 GLU A 86 23.900 -24.552 9.957 1.00 25.00 O ATOM 0 H GLU A 86 27.214 -27.195 15.193 1.00 25.00 H new ATOM 0 HA GLU A 86 27.357 -26.296 13.176 1.00 25.00 H new ATOM 0 HB2 GLU A 86 24.809 -26.707 13.236 1.00 25.00 H new ATOM 0 HB3 GLU A 86 24.659 -24.979 13.485 1.00 25.00 H new ATOM 0 HG2 GLU A 86 26.002 -24.638 11.357 1.00 25.00 H new ATOM 0 HG3 GLU A 86 25.915 -26.368 11.092 1.00 25.00 H new ATOM 1298 N LEU A 87 28.541 -24.225 13.933 1.00 25.00 N ATOM 1299 CA LEU A 87 29.237 -22.953 14.124 1.00 25.00 C ATOM 1300 C LEU A 87 28.864 -21.953 13.043 1.00 25.00 C ATOM 1301 O LEU A 87 28.886 -22.254 11.851 1.00 25.00 O ATOM 1302 CB LEU A 87 30.757 -23.154 14.106 1.00 25.00 C ATOM 1303 CG LEU A 87 31.382 -23.892 15.301 1.00 25.00 C ATOM 1304 CD1 LEU A 87 32.859 -24.159 15.019 1.00 25.00 C ATOM 1305 CD2 LEU A 87 31.247 -23.079 16.593 1.00 25.00 C ATOM 0 H LEU A 87 29.160 -25.023 13.793 1.00 25.00 H new ATOM 0 HA LEU A 87 28.930 -22.564 15.095 1.00 25.00 H new ATOM 0 HB2 LEU A 87 31.015 -23.701 13.199 1.00 25.00 H new ATOM 0 HB3 LEU A 87 31.227 -22.173 14.031 1.00 25.00 H new ATOM 0 HG LEU A 87 30.850 -24.834 15.435 1.00 25.00 H new ATOM 0 HD11 LEU A 87 33.302 -24.682 15.866 1.00 25.00 H new ATOM 0 HD12 LEU A 87 32.953 -24.773 14.123 1.00 25.00 H new ATOM 0 HD13 LEU A 87 33.377 -23.212 14.866 1.00 25.00 H new ATOM 0 HD21 LEU A 87 31.699 -23.629 17.418 1.00 25.00 H new ATOM 0 HD22 LEU A 87 31.754 -22.121 16.475 1.00 25.00 H new ATOM 0 HD23 LEU A 87 30.192 -22.907 16.806 1.00 25.00 H new ATOM 1317 N ALA A 88 28.513 -20.757 13.479 1.00 25.00 N ATOM 1318 CA ALA A 88 28.095 -19.710 12.569 1.00 25.00 C ATOM 1319 C ALA A 88 29.313 -19.035 11.910 1.00 25.00 C ATOM 1320 O ALA A 88 30.367 -18.898 12.535 1.00 25.00 O ATOM 1321 CB ALA A 88 27.265 -18.678 13.338 1.00 25.00 C ATOM 0 H ALA A 88 28.510 -20.487 14.463 1.00 25.00 H new ATOM 0 HA ALA A 88 27.489 -20.149 11.777 1.00 25.00 H new ATOM 0 HB1 ALA A 88 26.947 -17.887 12.658 1.00 25.00 H new ATOM 0 HB2 ALA A 88 26.388 -19.163 13.766 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.869 -18.249 14.138 1.00 25.00 H new ATOM 1327 N PRO A 89 29.166 -18.560 10.659 1.00 25.00 N ATOM 1328 CA PRO A 89 30.277 -17.847 10.022 1.00 25.00 C ATOM 1329 C PRO A 89 30.498 -16.467 10.646 1.00 25.00 C ATOM 1330 O PRO A 89 29.631 -15.953 11.371 1.00 25.00 O ATOM 1331 CB PRO A 89 29.817 -17.739 8.567 1.00 25.00 C ATOM 1332 CG PRO A 89 28.352 -17.671 8.659 1.00 25.00 C ATOM 1333 CD PRO A 89 27.994 -18.619 9.766 1.00 25.00 C ATOM 0 HA PRO A 89 31.234 -18.356 10.136 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.228 -16.853 8.084 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.140 -18.600 7.982 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.016 -16.658 8.881 1.00 25.00 H new ATOM 0 HG3 PRO A 89 27.882 -17.964 7.720 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.082 -18.312 10.279 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.825 -19.629 9.391 1.00 25.00 H new ATOM 1341 N PRO A 90 31.660 -15.845 10.386 1.00 25.00 N ATOM 1342 CA PRO A 90 31.901 -14.541 11.011 1.00 25.00 C ATOM 1343 C PRO A 90 31.048 -13.423 10.420 1.00 25.00 C ATOM 1344 O PRO A 90 30.473 -13.554 9.335 1.00 25.00 O ATOM 1345 CB PRO A 90 33.387 -14.303 10.730 1.00 25.00 C ATOM 1346 CG PRO A 90 33.627 -15.000 9.448 1.00 25.00 C ATOM 1347 CD PRO A 90 32.802 -16.259 9.546 1.00 25.00 C ATOM 0 HA PRO A 90 31.639 -14.540 12.069 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.613 -13.239 10.654 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.013 -14.706 11.526 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.320 -14.389 8.600 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.684 -15.227 9.311 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.477 -16.605 8.565 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.363 -17.075 10.002 1.00 25.00 H new ATOM 1355 N LYS A 91 30.981 -12.313 11.142 1.00 25.00 N ATOM 1356 CA LYS A 91 30.303 -11.112 10.663 1.00 25.00 C ATOM 1357 C LYS A 91 31.382 -10.225 10.036 1.00 25.00 C ATOM 1358 O LYS A 91 32.546 -10.305 10.437 1.00 25.00 O ATOM 1359 CB LYS A 91 29.593 -10.386 11.823 1.00 25.00 C ATOM 1360 CG LYS A 91 30.480 -10.101 13.048 1.00 25.00 C ATOM 1361 CD LYS A 91 29.756 -9.277 14.123 1.00 25.00 C ATOM 1362 CE LYS A 91 28.570 -10.021 14.754 1.00 25.00 C ATOM 1363 NZ LYS A 91 27.987 -9.225 15.873 1.00 25.00 N ATOM 0 H LYS A 91 31.392 -12.217 12.071 1.00 25.00 H new ATOM 0 HA LYS A 91 29.532 -11.360 9.933 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.196 -9.441 11.452 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.741 -10.987 12.141 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.810 -11.046 13.481 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.375 -9.567 12.728 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.466 -9.007 14.905 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.400 -8.346 13.681 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.807 -10.209 13.998 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.898 -10.992 15.124 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.006 -9.528 16.040 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.548 -9.376 16.736 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 28.000 -8.215 15.624 1.00 25.00 H new ATOM 1377 N PRO A 92 31.025 -9.399 9.038 1.00 25.00 N ATOM 1378 CA PRO A 92 32.057 -8.507 8.494 1.00 25.00 C ATOM 1379 C PRO A 92 32.454 -7.436 9.525 1.00 25.00 C ATOM 1380 O PRO A 92 31.732 -7.211 10.499 1.00 25.00 O ATOM 1381 CB PRO A 92 31.376 -7.911 7.255 1.00 25.00 C ATOM 1382 CG PRO A 92 29.939 -7.972 7.545 1.00 25.00 C ATOM 1383 CD PRO A 92 29.723 -9.196 8.373 1.00 25.00 C ATOM 0 HA PRO A 92 32.993 -9.009 8.249 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.700 -6.885 7.082 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.622 -8.479 6.358 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.613 -7.080 8.080 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.359 -8.020 6.623 1.00 25.00 H new ATOM 0 HD2 PRO A 92 28.921 -9.054 9.097 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.449 -10.053 7.758 1.00 25.00 H new ATOM 1391 N PRO A 93 33.627 -6.798 9.348 1.00 25.00 N ATOM 1392 CA PRO A 93 34.083 -5.806 10.332 1.00 25.00 C ATOM 1393 C PRO A 93 33.314 -4.487 10.263 1.00 25.00 C ATOM 1394 O PRO A 93 32.453 -4.298 9.404 1.00 25.00 O ATOM 1395 CB PRO A 93 35.550 -5.598 9.941 1.00 25.00 C ATOM 1396 CG PRO A 93 35.554 -5.792 8.483 1.00 25.00 C ATOM 1397 CD PRO A 93 34.614 -6.950 8.259 1.00 25.00 C ATOM 0 HA PRO A 93 33.931 -6.148 11.356 1.00 25.00 H new ATOM 0 HB2 PRO A 93 35.899 -4.602 10.213 1.00 25.00 H new ATOM 0 HB3 PRO A 93 36.203 -6.313 10.442 1.00 25.00 H new ATOM 0 HG2 PRO A 93 35.214 -4.897 7.962 1.00 25.00 H new ATOM 0 HG3 PRO A 93 36.555 -6.015 8.114 1.00 25.00 H new ATOM 0 HD2 PRO A 93 34.142 -6.902 7.278 1.00 25.00 H new ATOM 0 HD3 PRO A 93 35.133 -7.907 8.316 1.00 25.00 H new ATOM 1405 N LEU A 94 33.652 -3.571 11.162 1.00 25.00 N ATOM 1406 CA LEU A 94 33.036 -2.247 11.213 1.00 25.00 C ATOM 1407 C LEU A 94 34.131 -1.177 11.339 1.00 25.00 C ATOM 1408 O LEU A 94 35.237 -1.485 11.785 1.00 25.00 O ATOM 1409 CB LEU A 94 32.074 -2.158 12.410 1.00 25.00 C ATOM 1410 CG LEU A 94 30.681 -2.784 12.222 1.00 25.00 C ATOM 1411 CD1 LEU A 94 29.860 -2.548 13.459 1.00 25.00 C ATOM 1412 CD2 LEU A 94 29.930 -2.183 11.042 1.00 25.00 C ATOM 0 H LEU A 94 34.362 -3.724 11.878 1.00 25.00 H new ATOM 0 HA LEU A 94 32.471 -2.078 10.296 1.00 25.00 H new ATOM 0 HB2 LEU A 94 32.550 -2.637 13.266 1.00 25.00 H new ATOM 0 HB3 LEU A 94 31.943 -1.106 12.665 1.00 25.00 H new ATOM 0 HG LEU A 94 30.830 -3.847 12.034 1.00 25.00 H new ATOM 0 HD11 LEU A 94 28.872 -2.990 13.330 1.00 25.00 H new ATOM 0 HD12 LEU A 94 30.353 -3.006 14.316 1.00 25.00 H new ATOM 0 HD13 LEU A 94 29.758 -1.476 13.629 1.00 25.00 H new ATOM 0 HD21 LEU A 94 28.953 -2.658 10.952 1.00 25.00 H new ATOM 0 HD22 LEU A 94 29.799 -1.113 11.201 1.00 25.00 H new ATOM 0 HD23 LEU A 94 30.499 -2.347 10.127 1.00 25.00 H new ATOM 1424 N PRO A 95 33.836 0.075 10.924 1.00 25.00 N ATOM 1425 CA PRO A 95 34.767 1.211 10.989 1.00 25.00 C ATOM 1426 C PRO A 95 34.953 1.771 12.406 1.00 25.00 C ATOM 1427 O PRO A 95 34.532 1.155 13.377 1.00 25.00 O ATOM 1428 CB PRO A 95 34.091 2.238 10.073 1.00 25.00 C ATOM 1429 CG PRO A 95 32.673 1.995 10.285 1.00 25.00 C ATOM 1430 CD PRO A 95 32.555 0.500 10.328 1.00 25.00 C ATOM 0 HA PRO A 95 35.778 0.933 10.690 1.00 25.00 H new ATOM 0 HB2 PRO A 95 34.368 3.258 10.339 1.00 25.00 H new ATOM 0 HB3 PRO A 95 34.372 2.093 9.030 1.00 25.00 H new ATOM 0 HG2 PRO A 95 32.326 2.448 11.214 1.00 25.00 H new ATOM 0 HG3 PRO A 95 32.072 2.418 9.480 1.00 25.00 H new ATOM 0 HD2 PRO A 95 31.705 0.181 10.931 1.00 25.00 H new ATOM 0 HD3 PRO A 95 32.415 0.079 9.332 1.00 25.00 H new ATOM 1438 N GLU A 96 35.617 2.926 12.487 1.00 25.00 N ATOM 1439 CA GLU A 96 36.004 3.589 13.742 1.00 25.00 C ATOM 1440 C GLU A 96 36.991 2.694 14.502 1.00 25.00 C ATOM 1441 O GLU A 96 37.157 2.768 15.718 1.00 25.00 O ATOM 1442 CB GLU A 96 34.783 3.997 14.569 1.00 25.00 C ATOM 1443 CG GLU A 96 35.056 5.212 15.461 1.00 25.00 C ATOM 1444 CD GLU A 96 33.895 5.556 16.394 1.00 25.00 C ATOM 1445 OE1 GLU A 96 34.152 6.142 17.471 1.00 25.00 O ATOM 1446 OE2 GLU A 96 32.726 5.300 16.028 1.00 25.00 O ATOM 0 H GLU A 96 35.911 3.444 11.659 1.00 25.00 H new ATOM 0 HA GLU A 96 36.514 4.526 13.519 1.00 25.00 H new ATOM 0 HB2 GLU A 96 33.953 4.222 13.899 1.00 25.00 H new ATOM 0 HB3 GLU A 96 34.472 3.157 15.190 1.00 25.00 H new ATOM 0 HG2 GLU A 96 35.948 5.021 16.058 1.00 25.00 H new ATOM 0 HG3 GLU A 96 35.273 6.074 14.831 1.00 25.00 H new ATOM 1453 N GLY A 97 37.685 1.876 13.725 1.00 25.00 N ATOM 1454 CA GLY A 97 38.754 1.049 14.244 1.00 25.00 C ATOM 1455 C GLY A 97 39.782 0.822 13.156 1.00 25.00 C ATOM 1456 O GLY A 97 39.435 0.479 12.024 1.00 25.00 O ATOM 0 H GLY A 97 37.521 1.770 12.724 1.00 25.00 H new ATOM 0 HA2 GLY A 97 39.218 1.532 15.104 1.00 25.00 H new ATOM 0 HA3 GLY A 97 38.356 0.095 14.590 1.00 25.00 H new ATOM 1460 N GLU A 98 41.047 1.022 13.490 1.00 25.00 N ATOM 1461 CA GLU A 98 42.137 0.863 12.530 1.00 25.00 C ATOM 1462 C GLU A 98 43.025 -0.307 12.929 1.00 25.00 C ATOM 1463 O GLU A 98 43.180 -0.636 14.105 1.00 25.00 O ATOM 1464 CB GLU A 98 42.994 2.135 12.459 1.00 25.00 C ATOM 1465 CG GLU A 98 42.275 3.351 11.870 1.00 25.00 C ATOM 1466 CD GLU A 98 41.311 4.002 12.853 1.00 25.00 C ATOM 1467 OE1 GLU A 98 40.118 4.152 12.514 1.00 25.00 O ATOM 1468 OE2 GLU A 98 41.754 4.371 13.963 1.00 25.00 O ATOM 0 H GLU A 98 41.349 1.297 14.425 1.00 25.00 H new ATOM 0 HA GLU A 98 41.694 0.674 11.552 1.00 25.00 H new ATOM 0 HB2 GLU A 98 43.338 2.383 13.463 1.00 25.00 H new ATOM 0 HB3 GLU A 98 43.881 1.928 11.860 1.00 25.00 H new ATOM 0 HG2 GLU A 98 43.015 4.086 11.553 1.00 25.00 H new ATOM 0 HG3 GLU A 98 41.727 3.046 10.979 1.00 25.00 H new ATOM 1475 N VAL A 99 43.631 -0.943 11.923 1.00 25.00 N ATOM 1476 CA VAL A 99 44.543 -2.071 12.127 1.00 25.00 C ATOM 1477 C VAL A 99 46.009 -1.643 12.026 1.00 25.00 C ATOM 1478 O VAL A 99 46.459 -0.855 11.219 1.00 25.00 O ATOM 1479 CB VAL A 99 44.203 -3.245 11.161 1.00 25.00 C ATOM 1480 CG1 VAL A 99 42.809 -3.829 11.502 1.00 25.00 C ATOM 1481 CG2 VAL A 99 44.230 -2.802 9.671 1.00 25.00 C ATOM 1482 OXT VAL A 99 46.777 -2.198 12.903 1.00 25.00 O ATOM 0 H VAL A 99 43.503 -0.690 10.943 1.00 25.00 H new ATOM 0 HA VAL A 99 44.399 -2.436 13.144 1.00 25.00 H new ATOM 0 HB VAL A 99 44.969 -4.008 11.297 1.00 25.00 H new ATOM 0 HG11 VAL A 99 42.581 -4.649 10.821 1.00 25.00 H new ATOM 0 HG12 VAL A 99 42.810 -4.199 12.527 1.00 25.00 H new ATOM 0 HG13 VAL A 99 42.053 -3.051 11.398 1.00 25.00 H new ATOM 0 HG21 VAL A 99 43.987 -3.653 9.034 1.00 25.00 H new ATOM 0 HG22 VAL A 99 43.498 -2.010 9.514 1.00 25.00 H new ATOM 0 HG23 VAL A 99 45.224 -2.432 9.419 1.00 25.00 H new TER 1493 VAL A 99