USER MOD reduce.3.24.130724 H: found=0, std=0, add=648, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 646 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 ASN : amide:sc= 0.32 X(o=0.32,f=0.05) USER MOD Set 1.2: A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 15:sc= 0.332 USER MOD Single : A 9 GLN : amide:sc= -0.0135 X(o=-0.013,f=-0.16) USER MOD Single : A 13 LYS NZ :NH3+ 154:sc= -0.12 (180deg=-0.527) USER MOD Single : A 19 SER OG : rot 31:sc= 0.34 USER MOD Single : A 22 TYR OH : rot 30:sc= -0.0632 USER MOD Single : A 25 ASN : amide:sc= 0.219 X(o=0.22,f=-0.0058) USER MOD Single : A 27 ASN : amide:sc= -1.03 K(o=-1,f=-2.8!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 149:sc= 0.00124 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= -1.86 X(o=-1.9,f=-2.4) USER MOD Single : A 36 GLN : amide:sc= 0.0787 X(o=0.079,f=0) USER MOD Single : A 40 GLN : amide:sc= -0.299 X(o=-0.3,f=-0.037) USER MOD Single : A 41 GLN : amide:sc= -0.611 X(o=-0.61,f=-0.14) USER MOD Single : A 45 LYS NZ :NH3+ 148:sc= -0.722 (180deg=-2.16!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= -0.44 X(o=-0.44,f=-0.18) USER MOD Single : A 48 GLN : amide:sc= -1.47 K(o=-1.5,f=-5.6!) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN : amide:sc= -0.521 X(o=-0.52,f=-0.94) USER MOD Single : A 58 GLN : amide:sc= -1.05 K(o=-1,f=-4.3!) USER MOD Single : A 66 TYR OH : rot -82:sc= 0.92 USER MOD Single : A 69 GLN : amide:sc= -0.0928 K(o=-0.093,f=-1.3!) USER MOD Single : A 71 SER OG : rot -16:sc= 0.788 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 15:sc= 0.115 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.777 -13.207 -17.627 1.00 0.00 N ATOM 2 CA GLY A 1 -5.099 -12.841 -18.102 1.00 0.00 C ATOM 3 C GLY A 1 -5.287 -11.340 -18.194 1.00 0.00 C ATOM 4 O GLY A 1 -4.443 -10.635 -18.747 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.699 -14.243 -17.582 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.058 -12.834 -18.279 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.626 -12.807 -16.679 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.265 -13.286 -19.083 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.851 -13.258 -17.432 1.00 0.00 H new ATOM 8 N SER A 2 -6.398 -10.850 -17.653 1.00 0.00 N ATOM 9 CA SER A 2 -6.696 -9.423 -17.681 1.00 0.00 C ATOM 10 C SER A 2 -6.018 -8.702 -16.520 1.00 0.00 C ATOM 11 O SER A 2 -5.394 -9.330 -15.665 1.00 0.00 O ATOM 12 CB SER A 2 -8.208 -9.196 -17.624 1.00 0.00 C ATOM 13 OG SER A 2 -8.736 -9.591 -16.370 1.00 0.00 O ATOM 0 H SER A 2 -7.106 -11.420 -17.190 1.00 0.00 H new ATOM 0 HA SER A 2 -6.308 -9.015 -18.614 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.428 -8.143 -17.799 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.694 -9.760 -18.420 1.00 0.00 H new ATOM 0 HG SER A 2 -9.703 -9.434 -16.358 1.00 0.00 H new ATOM 19 N SER A 3 -6.145 -7.379 -16.498 1.00 0.00 N ATOM 20 CA SER A 3 -5.541 -6.571 -15.445 1.00 0.00 C ATOM 21 C SER A 3 -6.573 -5.638 -14.817 1.00 0.00 C ATOM 22 O SER A 3 -7.096 -4.741 -15.475 1.00 0.00 O ATOM 23 CB SER A 3 -4.374 -5.756 -16.004 1.00 0.00 C ATOM 24 OG SER A 3 -3.419 -5.474 -14.995 1.00 0.00 O ATOM 0 H SER A 3 -6.660 -6.844 -17.197 1.00 0.00 H new ATOM 0 HA SER A 3 -5.168 -7.244 -14.673 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.898 -6.306 -16.816 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.747 -4.823 -16.427 1.00 0.00 H new ATOM 0 HG SER A 3 -2.682 -4.954 -15.378 1.00 0.00 H new ATOM 30 N GLY A 4 -6.860 -5.859 -13.538 1.00 0.00 N ATOM 31 CA GLY A 4 -7.828 -5.032 -12.841 1.00 0.00 C ATOM 32 C GLY A 4 -7.855 -5.301 -11.350 1.00 0.00 C ATOM 33 O GLY A 4 -8.923 -5.345 -10.739 1.00 0.00 O ATOM 0 H GLY A 4 -6.440 -6.596 -12.972 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.594 -3.981 -13.013 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.820 -5.210 -13.257 1.00 0.00 H new ATOM 37 N SER A 5 -6.677 -5.484 -10.762 1.00 0.00 N ATOM 38 CA SER A 5 -6.570 -5.757 -9.333 1.00 0.00 C ATOM 39 C SER A 5 -6.752 -4.478 -8.521 1.00 0.00 C ATOM 40 O SER A 5 -5.793 -3.748 -8.270 1.00 0.00 O ATOM 41 CB SER A 5 -5.214 -6.389 -9.013 1.00 0.00 C ATOM 42 OG SER A 5 -5.150 -7.724 -9.485 1.00 0.00 O ATOM 0 H SER A 5 -5.783 -5.448 -11.253 1.00 0.00 H new ATOM 0 HA SER A 5 -7.361 -6.455 -9.061 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.418 -5.800 -9.469 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.046 -6.372 -7.936 1.00 0.00 H new ATOM 0 HG SER A 5 -4.273 -8.105 -9.270 1.00 0.00 H new ATOM 48 N SER A 6 -7.989 -4.215 -8.114 1.00 0.00 N ATOM 49 CA SER A 6 -8.299 -3.023 -7.333 1.00 0.00 C ATOM 50 C SER A 6 -8.000 -3.249 -5.854 1.00 0.00 C ATOM 51 O SER A 6 -8.510 -4.187 -5.243 1.00 0.00 O ATOM 52 CB SER A 6 -9.768 -2.636 -7.515 1.00 0.00 C ATOM 53 OG SER A 6 -10.621 -3.542 -6.837 1.00 0.00 O ATOM 0 H SER A 6 -8.793 -4.811 -8.312 1.00 0.00 H new ATOM 0 HA SER A 6 -7.669 -2.209 -7.693 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.931 -1.626 -7.138 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.015 -2.623 -8.576 1.00 0.00 H new ATOM 0 HG SER A 6 -10.094 -4.083 -6.213 1.00 0.00 H new ATOM 59 N GLY A 7 -7.169 -2.381 -5.285 1.00 0.00 N ATOM 60 CA GLY A 7 -6.815 -2.503 -3.883 1.00 0.00 C ATOM 61 C GLY A 7 -7.654 -1.605 -2.994 1.00 0.00 C ATOM 62 O GLY A 7 -8.747 -1.189 -3.376 1.00 0.00 O ATOM 0 H GLY A 7 -6.735 -1.596 -5.770 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.939 -3.539 -3.569 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.761 -2.255 -3.754 1.00 0.00 H new ATOM 66 N ILE A 8 -7.141 -1.308 -1.804 1.00 0.00 N ATOM 67 CA ILE A 8 -7.851 -0.456 -0.859 1.00 0.00 C ATOM 68 C ILE A 8 -7.519 1.015 -1.088 1.00 0.00 C ATOM 69 O ILE A 8 -6.442 1.348 -1.582 1.00 0.00 O ATOM 70 CB ILE A 8 -7.512 -0.825 0.597 1.00 0.00 C ATOM 71 CG1 ILE A 8 -6.009 -0.680 0.847 1.00 0.00 C ATOM 72 CG2 ILE A 8 -7.971 -2.243 0.904 1.00 0.00 C ATOM 73 CD1 ILE A 8 -5.648 -0.565 2.311 1.00 0.00 C ATOM 0 H ILE A 8 -6.237 -1.645 -1.472 1.00 0.00 H new ATOM 0 HA ILE A 8 -8.916 -0.617 -1.028 1.00 0.00 H new ATOM 0 HB ILE A 8 -8.039 -0.141 1.262 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.493 -1.540 0.421 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -5.645 0.203 0.321 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.725 -2.490 1.937 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -9.049 -2.315 0.761 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.469 -2.941 0.234 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -4.567 -0.465 2.413 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.135 0.312 2.738 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -5.981 -1.458 2.839 1.00 0.00 H new ATOM 85 N GLN A 9 -8.450 1.890 -0.725 1.00 0.00 N ATOM 86 CA GLN A 9 -8.255 3.326 -0.891 1.00 0.00 C ATOM 87 C GLN A 9 -7.866 3.978 0.431 1.00 0.00 C ATOM 88 O GLN A 9 -8.617 3.929 1.405 1.00 0.00 O ATOM 89 CB GLN A 9 -9.528 3.975 -1.438 1.00 0.00 C ATOM 90 CG GLN A 9 -9.287 5.319 -2.105 1.00 0.00 C ATOM 91 CD GLN A 9 -10.566 6.105 -2.313 1.00 0.00 C ATOM 92 OE1 GLN A 9 -10.759 7.168 -1.721 1.00 0.00 O ATOM 93 NE2 GLN A 9 -11.450 5.586 -3.158 1.00 0.00 N ATOM 0 H GLN A 9 -9.347 1.631 -0.314 1.00 0.00 H new ATOM 0 HA GLN A 9 -7.444 3.477 -1.603 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -9.990 3.299 -2.158 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -10.239 4.106 -0.622 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -8.600 5.905 -1.495 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -8.802 5.161 -3.068 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -11.249 4.703 -3.627 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -12.329 6.071 -3.338 1.00 0.00 H new ATOM 102 N VAL A 10 -6.686 4.590 0.459 1.00 0.00 N ATOM 103 CA VAL A 10 -6.196 5.253 1.661 1.00 0.00 C ATOM 104 C VAL A 10 -6.014 6.749 1.428 1.00 0.00 C ATOM 105 O VAL A 10 -5.715 7.183 0.315 1.00 0.00 O ATOM 106 CB VAL A 10 -4.858 4.651 2.129 1.00 0.00 C ATOM 107 CG1 VAL A 10 -5.022 3.174 2.455 1.00 0.00 C ATOM 108 CG2 VAL A 10 -3.783 4.856 1.072 1.00 0.00 C ATOM 0 H VAL A 10 -6.052 4.640 -0.338 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.946 5.097 2.436 1.00 0.00 H new ATOM 0 HB VAL A 10 -4.545 5.166 3.037 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -4.066 2.766 2.784 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -5.759 3.056 3.249 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.358 2.640 1.566 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.844 4.425 1.419 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -4.086 4.368 0.146 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.648 5.923 0.893 1.00 0.00 H new ATOM 118 N PHE A 11 -6.194 7.533 2.485 1.00 0.00 N ATOM 119 CA PHE A 11 -6.050 8.982 2.396 1.00 0.00 C ATOM 120 C PHE A 11 -4.715 9.432 2.982 1.00 0.00 C ATOM 121 O PHE A 11 -4.499 9.360 4.192 1.00 0.00 O ATOM 122 CB PHE A 11 -7.201 9.676 3.127 1.00 0.00 C ATOM 123 CG PHE A 11 -8.509 9.600 2.394 1.00 0.00 C ATOM 124 CD1 PHE A 11 -8.794 10.482 1.364 1.00 0.00 C ATOM 125 CD2 PHE A 11 -9.455 8.647 2.735 1.00 0.00 C ATOM 126 CE1 PHE A 11 -9.997 10.414 0.687 1.00 0.00 C ATOM 127 CE2 PHE A 11 -10.660 8.574 2.062 1.00 0.00 C ATOM 128 CZ PHE A 11 -10.931 9.460 1.037 1.00 0.00 C ATOM 0 H PHE A 11 -6.440 7.190 3.414 1.00 0.00 H new ATOM 0 HA PHE A 11 -6.077 9.261 1.343 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -7.319 9.225 4.112 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -6.942 10.723 3.284 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -8.067 11.231 1.087 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -9.248 7.953 3.536 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -10.206 11.107 -0.115 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -11.389 7.826 2.337 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.872 9.406 0.510 1.00 0.00 H new ATOM 138 N VAL A 12 -3.821 9.897 2.114 1.00 0.00 N ATOM 139 CA VAL A 12 -2.507 10.360 2.544 1.00 0.00 C ATOM 140 C VAL A 12 -2.517 11.859 2.825 1.00 0.00 C ATOM 141 O VAL A 12 -2.587 12.674 1.905 1.00 0.00 O ATOM 142 CB VAL A 12 -1.431 10.055 1.486 1.00 0.00 C ATOM 143 CG1 VAL A 12 -0.106 10.695 1.871 1.00 0.00 C ATOM 144 CG2 VAL A 12 -1.273 8.552 1.305 1.00 0.00 C ATOM 0 H VAL A 12 -3.983 9.963 1.109 1.00 0.00 H new ATOM 0 HA VAL A 12 -2.267 9.823 3.461 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.751 10.482 0.535 1.00 0.00 H new ATOM 0 HG11 VAL A 12 0.642 10.468 1.111 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -0.232 11.775 1.946 1.00 0.00 H new ATOM 0 HG13 VAL A 12 0.223 10.301 2.833 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -0.509 8.354 0.554 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -0.976 8.101 2.252 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -2.221 8.123 0.980 1.00 0.00 H new ATOM 154 N LYS A 13 -2.447 12.216 4.103 1.00 0.00 N ATOM 155 CA LYS A 13 -2.446 13.617 4.507 1.00 0.00 C ATOM 156 C LYS A 13 -1.027 14.177 4.524 1.00 0.00 C ATOM 157 O LYS A 13 -0.138 13.621 5.167 1.00 0.00 O ATOM 158 CB LYS A 13 -3.082 13.770 5.891 1.00 0.00 C ATOM 159 CG LYS A 13 -3.298 15.216 6.304 1.00 0.00 C ATOM 160 CD LYS A 13 -3.680 15.325 7.770 1.00 0.00 C ATOM 161 CE LYS A 13 -4.537 16.554 8.033 1.00 0.00 C ATOM 162 NZ LYS A 13 -5.864 16.458 7.366 1.00 0.00 N ATOM 0 H LYS A 13 -2.390 11.554 4.877 1.00 0.00 H new ATOM 0 HA LYS A 13 -3.032 14.180 3.780 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -4.040 13.251 5.901 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -2.447 13.281 6.630 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -2.388 15.788 6.121 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -4.082 15.658 5.689 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -4.223 14.430 8.073 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -2.778 15.372 8.380 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -4.678 16.675 9.107 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -4.016 17.443 7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -6.555 17.037 7.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -5.787 16.803 6.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -6.179 15.467 7.360 1.00 0.00 H new ATOM 176 N ASN A 14 -0.824 15.282 3.814 1.00 0.00 N ATOM 177 CA ASN A 14 0.487 15.919 3.749 1.00 0.00 C ATOM 178 C ASN A 14 0.733 16.785 4.980 1.00 0.00 C ATOM 179 O ASN A 14 -0.196 17.292 5.609 1.00 0.00 O ATOM 180 CB ASN A 14 0.601 16.769 2.482 1.00 0.00 C ATOM 181 CG ASN A 14 -0.103 16.138 1.296 1.00 0.00 C ATOM 182 OD1 ASN A 14 0.210 15.015 0.899 1.00 0.00 O ATOM 183 ND2 ASN A 14 -1.061 16.859 0.725 1.00 0.00 N ATOM 0 H ASN A 14 -1.550 15.755 3.276 1.00 0.00 H new ATOM 0 HA ASN A 14 1.244 15.135 3.722 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.177 17.755 2.670 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.654 16.916 2.240 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.571 16.487 -0.076 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.287 17.785 1.088 1.00 0.00 H new ATOM 190 N PRO A 15 2.015 16.961 5.333 1.00 0.00 N ATOM 191 CA PRO A 15 2.414 17.767 6.491 1.00 0.00 C ATOM 192 C PRO A 15 2.168 19.256 6.273 1.00 0.00 C ATOM 193 O PRO A 15 2.073 20.025 7.229 1.00 0.00 O ATOM 194 CB PRO A 15 3.913 17.486 6.619 1.00 0.00 C ATOM 195 CG PRO A 15 4.345 17.100 5.246 1.00 0.00 C ATOM 196 CD PRO A 15 3.174 16.386 4.629 1.00 0.00 C ATOM 0 HA PRO A 15 1.841 17.512 7.382 1.00 0.00 H new ATOM 0 HB2 PRO A 15 4.452 18.366 6.971 1.00 0.00 H new ATOM 0 HB3 PRO A 15 4.106 16.686 7.334 1.00 0.00 H new ATOM 0 HG2 PRO A 15 4.619 17.978 4.662 1.00 0.00 H new ATOM 0 HG3 PRO A 15 5.222 16.454 5.280 1.00 0.00 H new ATOM 0 HD2 PRO A 15 3.118 16.560 3.554 1.00 0.00 H new ATOM 0 HD3 PRO A 15 3.238 15.308 4.775 1.00 0.00 H new ATOM 204 N ASP A 16 2.065 19.655 5.010 1.00 0.00 N ATOM 205 CA ASP A 16 1.829 21.052 4.667 1.00 0.00 C ATOM 206 C ASP A 16 0.335 21.360 4.639 1.00 0.00 C ATOM 207 O ASP A 16 -0.113 22.366 5.186 1.00 0.00 O ATOM 208 CB ASP A 16 2.454 21.380 3.310 1.00 0.00 C ATOM 209 CG ASP A 16 3.934 21.694 3.415 1.00 0.00 C ATOM 210 OD1 ASP A 16 4.285 22.666 4.114 1.00 0.00 O ATOM 211 OD2 ASP A 16 4.740 20.967 2.797 1.00 0.00 O ATOM 0 H ASP A 16 2.141 19.031 4.207 1.00 0.00 H new ATOM 0 HA ASP A 16 2.296 21.671 5.433 1.00 0.00 H new ATOM 0 HB2 ASP A 16 2.311 20.537 2.634 1.00 0.00 H new ATOM 0 HB3 ASP A 16 1.935 22.232 2.871 1.00 0.00 H new ATOM 216 N GLY A 17 -0.433 20.484 3.996 1.00 0.00 N ATOM 217 CA GLY A 17 -1.868 20.680 3.908 1.00 0.00 C ATOM 218 C GLY A 17 -2.477 19.977 2.712 1.00 0.00 C ATOM 219 O GLY A 17 -2.026 20.157 1.581 1.00 0.00 O ATOM 0 H GLY A 17 -0.086 19.643 3.535 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -2.338 20.312 4.820 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -2.083 21.747 3.847 1.00 0.00 H new ATOM 223 N GLY A 18 -3.504 19.170 2.961 1.00 0.00 N ATOM 224 CA GLY A 18 -4.158 18.448 1.885 1.00 0.00 C ATOM 225 C GLY A 18 -4.227 16.956 2.147 1.00 0.00 C ATOM 226 O GLY A 18 -3.665 16.464 3.125 1.00 0.00 O ATOM 0 H GLY A 18 -3.895 19.003 3.888 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.167 18.837 1.751 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.621 18.626 0.953 1.00 0.00 H new ATOM 230 N SER A 19 -4.920 16.235 1.271 1.00 0.00 N ATOM 231 CA SER A 19 -5.066 14.791 1.416 1.00 0.00 C ATOM 232 C SER A 19 -5.532 14.159 0.108 1.00 0.00 C ATOM 233 O SER A 19 -6.575 14.524 -0.434 1.00 0.00 O ATOM 234 CB SER A 19 -6.058 14.467 2.534 1.00 0.00 C ATOM 235 OG SER A 19 -7.329 15.035 2.269 1.00 0.00 O ATOM 0 H SER A 19 -5.389 16.627 0.454 1.00 0.00 H new ATOM 0 HA SER A 19 -4.092 14.376 1.674 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.154 13.386 2.637 1.00 0.00 H new ATOM 0 HB3 SER A 19 -5.678 14.846 3.483 1.00 0.00 H new ATOM 0 HG SER A 19 -7.472 15.079 1.301 1.00 0.00 H new ATOM 241 N TYR A 20 -4.750 13.209 -0.394 1.00 0.00 N ATOM 242 CA TYR A 20 -5.080 12.527 -1.640 1.00 0.00 C ATOM 243 C TYR A 20 -5.448 11.069 -1.381 1.00 0.00 C ATOM 244 O TYR A 20 -5.076 10.495 -0.358 1.00 0.00 O ATOM 245 CB TYR A 20 -3.904 12.603 -2.614 1.00 0.00 C ATOM 246 CG TYR A 20 -3.181 13.931 -2.588 1.00 0.00 C ATOM 247 CD1 TYR A 20 -3.842 15.111 -2.904 1.00 0.00 C ATOM 248 CD2 TYR A 20 -1.836 14.005 -2.247 1.00 0.00 C ATOM 249 CE1 TYR A 20 -3.185 16.326 -2.882 1.00 0.00 C ATOM 250 CE2 TYR A 20 -1.171 15.215 -2.222 1.00 0.00 C ATOM 251 CZ TYR A 20 -1.850 16.373 -2.540 1.00 0.00 C ATOM 252 OH TYR A 20 -1.192 17.581 -2.516 1.00 0.00 O ATOM 0 H TYR A 20 -3.884 12.894 0.043 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.942 13.027 -2.082 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -3.196 11.809 -2.378 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -4.267 12.416 -3.625 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -4.888 15.078 -3.172 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -1.301 13.100 -1.997 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -3.714 17.234 -3.131 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -0.125 15.255 -1.955 1.00 0.00 H new ATOM 0 HH TYR A 20 -0.258 17.440 -2.254 1.00 0.00 H new ATOM 262 N ALA A 21 -6.181 10.476 -2.318 1.00 0.00 N ATOM 263 CA ALA A 21 -6.597 9.084 -2.194 1.00 0.00 C ATOM 264 C ALA A 21 -5.763 8.179 -3.094 1.00 0.00 C ATOM 265 O ALA A 21 -5.844 8.261 -4.320 1.00 0.00 O ATOM 266 CB ALA A 21 -8.076 8.944 -2.526 1.00 0.00 C ATOM 0 H ALA A 21 -6.499 10.937 -3.170 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.436 8.773 -1.162 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.373 7.900 -2.429 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.663 9.553 -1.838 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -8.253 9.279 -3.548 1.00 0.00 H new ATOM 272 N TYR A 22 -4.961 7.318 -2.479 1.00 0.00 N ATOM 273 CA TYR A 22 -4.109 6.400 -3.225 1.00 0.00 C ATOM 274 C TYR A 22 -4.772 5.033 -3.365 1.00 0.00 C ATOM 275 O TYR A 22 -5.631 4.663 -2.565 1.00 0.00 O ATOM 276 CB TYR A 22 -2.752 6.253 -2.534 1.00 0.00 C ATOM 277 CG TYR A 22 -1.807 7.401 -2.806 1.00 0.00 C ATOM 278 CD1 TYR A 22 -2.029 8.656 -2.253 1.00 0.00 C ATOM 279 CD2 TYR A 22 -0.690 7.230 -3.614 1.00 0.00 C ATOM 280 CE1 TYR A 22 -1.168 9.708 -2.499 1.00 0.00 C ATOM 281 CE2 TYR A 22 0.177 8.276 -3.865 1.00 0.00 C ATOM 282 CZ TYR A 22 -0.066 9.513 -3.306 1.00 0.00 C ATOM 283 OH TYR A 22 0.795 10.557 -3.553 1.00 0.00 O ATOM 0 H TYR A 22 -4.883 7.236 -1.465 1.00 0.00 H new ATOM 0 HA TYR A 22 -3.958 6.814 -4.222 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -2.908 6.169 -1.459 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -2.286 5.324 -2.862 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -2.890 8.812 -1.620 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -0.496 6.263 -4.054 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -1.356 10.678 -2.062 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.041 8.126 -4.496 1.00 0.00 H new ATOM 0 HH TYR A 22 0.799 11.166 -2.785 1.00 0.00 H new ATOM 293 N ALA A 23 -4.365 4.287 -4.387 1.00 0.00 N ATOM 294 CA ALA A 23 -4.916 2.960 -4.631 1.00 0.00 C ATOM 295 C ALA A 23 -3.830 1.892 -4.559 1.00 0.00 C ATOM 296 O ALA A 23 -2.861 1.927 -5.318 1.00 0.00 O ATOM 297 CB ALA A 23 -5.612 2.918 -5.983 1.00 0.00 C ATOM 0 H ALA A 23 -3.656 4.579 -5.059 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.648 2.749 -3.851 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -6.019 1.921 -6.152 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -6.422 3.648 -5.998 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.895 3.155 -6.769 1.00 0.00 H new ATOM 303 N ILE A 24 -3.997 0.945 -3.642 1.00 0.00 N ATOM 304 CA ILE A 24 -3.030 -0.133 -3.473 1.00 0.00 C ATOM 305 C ILE A 24 -3.675 -1.352 -2.823 1.00 0.00 C ATOM 306 O ILE A 24 -4.577 -1.224 -1.997 1.00 0.00 O ATOM 307 CB ILE A 24 -1.830 0.317 -2.618 1.00 0.00 C ATOM 308 CG1 ILE A 24 -1.046 -0.899 -2.122 1.00 0.00 C ATOM 309 CG2 ILE A 24 -2.303 1.163 -1.445 1.00 0.00 C ATOM 310 CD1 ILE A 24 0.344 -0.562 -1.628 1.00 0.00 C ATOM 0 H ILE A 24 -4.792 0.902 -3.005 1.00 0.00 H new ATOM 0 HA ILE A 24 -2.676 -0.400 -4.469 1.00 0.00 H new ATOM 0 HB ILE A 24 -1.169 0.925 -3.236 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -1.603 -1.376 -1.316 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -0.969 -1.626 -2.931 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -1.444 1.473 -0.850 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -2.823 2.045 -1.819 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -2.981 0.578 -0.824 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.841 -1.472 -1.292 1.00 0.00 H new ATOM 0 HD12 ILE A 24 0.919 -0.112 -2.438 1.00 0.00 H new ATOM 0 HD13 ILE A 24 0.275 0.141 -0.798 1.00 0.00 H new ATOM 322 N ASN A 25 -3.203 -2.536 -3.201 1.00 0.00 N ATOM 323 CA ASN A 25 -3.732 -3.780 -2.654 1.00 0.00 C ATOM 324 C ASN A 25 -3.197 -4.027 -1.247 1.00 0.00 C ATOM 325 O ASN A 25 -2.048 -3.719 -0.930 1.00 0.00 O ATOM 326 CB ASN A 25 -3.370 -4.956 -3.563 1.00 0.00 C ATOM 327 CG ASN A 25 -4.376 -5.155 -4.680 1.00 0.00 C ATOM 328 OD1 ASN A 25 -5.376 -5.853 -4.514 1.00 0.00 O ATOM 329 ND2 ASN A 25 -4.115 -4.539 -5.828 1.00 0.00 N ATOM 0 H ASN A 25 -2.455 -2.660 -3.884 1.00 0.00 H new ATOM 0 HA ASN A 25 -4.817 -3.691 -2.600 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -2.382 -4.789 -3.993 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -3.308 -5.867 -2.967 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -4.756 -4.635 -6.616 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -3.274 -3.970 -5.922 1.00 0.00 H new ATOM 336 N PRO A 26 -4.049 -4.596 -0.381 1.00 0.00 N ATOM 337 CA PRO A 26 -3.684 -4.898 1.006 1.00 0.00 C ATOM 338 C PRO A 26 -2.670 -6.034 1.105 1.00 0.00 C ATOM 339 O PRO A 26 -2.027 -6.215 2.137 1.00 0.00 O ATOM 340 CB PRO A 26 -5.014 -5.312 1.641 1.00 0.00 C ATOM 341 CG PRO A 26 -5.837 -5.810 0.504 1.00 0.00 C ATOM 342 CD PRO A 26 -5.434 -4.990 -0.690 1.00 0.00 C ATOM 0 HA PRO A 26 -3.208 -4.049 1.496 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -4.869 -6.087 2.394 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -5.494 -4.470 2.139 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -5.657 -6.871 0.328 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.901 -5.697 0.714 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -5.491 -5.568 -1.612 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -6.080 -4.121 -0.818 1.00 0.00 H new ATOM 350 N ASN A 27 -2.534 -6.795 0.024 1.00 0.00 N ATOM 351 CA ASN A 27 -1.598 -7.913 -0.011 1.00 0.00 C ATOM 352 C ASN A 27 -0.211 -7.448 -0.443 1.00 0.00 C ATOM 353 O ASN A 27 0.759 -8.202 -0.368 1.00 0.00 O ATOM 354 CB ASN A 27 -2.104 -8.999 -0.962 1.00 0.00 C ATOM 355 CG ASN A 27 -1.164 -10.187 -1.036 1.00 0.00 C ATOM 356 OD1 ASN A 27 -0.346 -10.401 -0.142 1.00 0.00 O ATOM 357 ND2 ASN A 27 -1.277 -10.965 -2.106 1.00 0.00 N ATOM 0 H ASN A 27 -3.060 -6.658 -0.839 1.00 0.00 H new ATOM 0 HA ASN A 27 -1.526 -8.326 0.995 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -3.087 -9.337 -0.633 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.229 -8.576 -1.959 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -0.671 -11.779 -2.211 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -1.970 -10.749 -2.823 1.00 0.00 H new ATOM 364 N SER A 28 -0.125 -6.201 -0.896 1.00 0.00 N ATOM 365 CA SER A 28 1.143 -5.636 -1.344 1.00 0.00 C ATOM 366 C SER A 28 1.896 -5.002 -0.179 1.00 0.00 C ATOM 367 O SER A 28 1.292 -4.553 0.796 1.00 0.00 O ATOM 368 CB SER A 28 0.903 -4.595 -2.439 1.00 0.00 C ATOM 369 OG SER A 28 0.782 -5.210 -3.710 1.00 0.00 O ATOM 0 H SER A 28 -0.918 -5.563 -0.962 1.00 0.00 H new ATOM 0 HA SER A 28 1.751 -6.445 -1.749 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.003 -4.031 -2.217 1.00 0.00 H new ATOM 0 HB3 SER A 28 1.727 -3.882 -2.454 1.00 0.00 H new ATOM 0 HG SER A 28 0.627 -4.524 -4.392 1.00 0.00 H new ATOM 375 N PHE A 29 3.220 -4.968 -0.288 1.00 0.00 N ATOM 376 CA PHE A 29 4.058 -4.389 0.756 1.00 0.00 C ATOM 377 C PHE A 29 3.746 -2.908 0.946 1.00 0.00 C ATOM 378 O PHE A 29 3.232 -2.250 0.040 1.00 0.00 O ATOM 379 CB PHE A 29 5.538 -4.570 0.411 1.00 0.00 C ATOM 380 CG PHE A 29 5.928 -6.001 0.176 1.00 0.00 C ATOM 381 CD1 PHE A 29 5.651 -6.973 1.125 1.00 0.00 C ATOM 382 CD2 PHE A 29 6.571 -6.375 -0.992 1.00 0.00 C ATOM 383 CE1 PHE A 29 6.010 -8.290 0.912 1.00 0.00 C ATOM 384 CE2 PHE A 29 6.932 -7.691 -1.211 1.00 0.00 C ATOM 385 CZ PHE A 29 6.650 -8.650 -0.258 1.00 0.00 C ATOM 0 H PHE A 29 3.736 -5.334 -1.088 1.00 0.00 H new ATOM 0 HA PHE A 29 3.843 -4.910 1.689 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.769 -3.988 -0.481 1.00 0.00 H new ATOM 0 HB3 PHE A 29 6.144 -4.165 1.222 1.00 0.00 H new ATOM 0 HD1 PHE A 29 5.149 -6.698 2.041 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.793 -5.629 -1.741 1.00 0.00 H new ATOM 0 HE1 PHE A 29 5.790 -9.038 1.660 1.00 0.00 H new ATOM 0 HE2 PHE A 29 7.434 -7.969 -2.126 1.00 0.00 H new ATOM 0 HZ PHE A 29 6.929 -9.679 -0.427 1.00 0.00 H new ATOM 395 N ILE A 30 4.059 -2.390 2.129 1.00 0.00 N ATOM 396 CA ILE A 30 3.813 -0.987 2.437 1.00 0.00 C ATOM 397 C ILE A 30 4.516 -0.073 1.440 1.00 0.00 C ATOM 398 O ILE A 30 3.947 0.919 0.981 1.00 0.00 O ATOM 399 CB ILE A 30 4.282 -0.632 3.861 1.00 0.00 C ATOM 400 CG1 ILE A 30 3.316 -1.208 4.898 1.00 0.00 C ATOM 401 CG2 ILE A 30 4.400 0.876 4.019 1.00 0.00 C ATOM 402 CD1 ILE A 30 2.119 -0.324 5.166 1.00 0.00 C ATOM 0 H ILE A 30 4.483 -2.921 2.890 1.00 0.00 H new ATOM 0 HA ILE A 30 2.736 -0.834 2.369 1.00 0.00 H new ATOM 0 HB ILE A 30 5.265 -1.073 4.024 1.00 0.00 H new ATOM 0 HG12 ILE A 30 2.968 -2.183 4.556 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.854 -1.371 5.832 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.732 1.111 5.030 1.00 0.00 H new ATOM 0 HG22 ILE A 30 5.123 1.262 3.301 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.429 1.338 3.840 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.478 -0.795 5.911 1.00 0.00 H new ATOM 0 HD12 ILE A 30 2.457 0.643 5.538 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.558 -0.182 4.242 1.00 0.00 H new ATOM 414 N LEU A 31 5.756 -0.413 1.106 1.00 0.00 N ATOM 415 CA LEU A 31 6.538 0.376 0.160 1.00 0.00 C ATOM 416 C LEU A 31 5.699 0.758 -1.055 1.00 0.00 C ATOM 417 O LEU A 31 5.705 1.909 -1.489 1.00 0.00 O ATOM 418 CB LEU A 31 7.775 -0.406 -0.285 1.00 0.00 C ATOM 419 CG LEU A 31 8.704 0.311 -1.266 1.00 0.00 C ATOM 420 CD1 LEU A 31 9.667 1.222 -0.521 1.00 0.00 C ATOM 421 CD2 LEU A 31 9.468 -0.698 -2.111 1.00 0.00 C ATOM 0 H LEU A 31 6.242 -1.230 1.476 1.00 0.00 H new ATOM 0 HA LEU A 31 6.855 1.291 0.661 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.351 -0.672 0.602 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.446 -1.339 -0.743 1.00 0.00 H new ATOM 0 HG LEU A 31 8.095 0.925 -1.930 1.00 0.00 H new ATOM 0 HD11 LEU A 31 10.320 1.723 -1.235 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.103 1.967 0.040 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.270 0.629 0.167 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.124 -0.170 -2.803 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.065 -1.338 -1.462 1.00 0.00 H new ATOM 0 HD23 LEU A 31 8.763 -1.309 -2.674 1.00 0.00 H new ATOM 433 N GLY A 32 4.975 -0.217 -1.598 1.00 0.00 N ATOM 434 CA GLY A 32 4.139 0.037 -2.757 1.00 0.00 C ATOM 435 C GLY A 32 3.380 1.345 -2.648 1.00 0.00 C ATOM 436 O GLY A 32 3.138 2.017 -3.651 1.00 0.00 O ATOM 0 H GLY A 32 4.953 -1.178 -1.256 1.00 0.00 H new ATOM 0 HA2 GLY A 32 4.760 0.054 -3.653 1.00 0.00 H new ATOM 0 HA3 GLY A 32 3.430 -0.782 -2.877 1.00 0.00 H new ATOM 440 N LEU A 33 3.000 1.706 -1.427 1.00 0.00 N ATOM 441 CA LEU A 33 2.261 2.942 -1.190 1.00 0.00 C ATOM 442 C LEU A 33 3.198 4.145 -1.193 1.00 0.00 C ATOM 443 O LEU A 33 2.935 5.149 -1.856 1.00 0.00 O ATOM 444 CB LEU A 33 1.515 2.865 0.143 1.00 0.00 C ATOM 445 CG LEU A 33 0.750 4.122 0.558 1.00 0.00 C ATOM 446 CD1 LEU A 33 0.090 4.768 -0.651 1.00 0.00 C ATOM 447 CD2 LEU A 33 -0.287 3.790 1.620 1.00 0.00 C ATOM 0 H LEU A 33 3.191 1.161 -0.586 1.00 0.00 H new ATOM 0 HA LEU A 33 1.539 3.066 -1.997 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.811 2.035 0.095 1.00 0.00 H new ATOM 0 HB3 LEU A 33 2.235 2.627 0.926 1.00 0.00 H new ATOM 0 HG LEU A 33 1.460 4.832 0.982 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -0.450 5.661 -0.337 1.00 0.00 H new ATOM 0 HD12 LEU A 33 0.853 5.043 -1.379 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.607 4.063 -1.105 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.821 4.697 1.903 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.994 3.061 1.223 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.210 3.374 2.496 1.00 0.00 H new ATOM 459 N LYS A 34 4.294 4.038 -0.449 1.00 0.00 N ATOM 460 CA LYS A 34 5.273 5.115 -0.368 1.00 0.00 C ATOM 461 C LYS A 34 5.819 5.459 -1.750 1.00 0.00 C ATOM 462 O LYS A 34 5.644 6.577 -2.235 1.00 0.00 O ATOM 463 CB LYS A 34 6.422 4.719 0.562 1.00 0.00 C ATOM 464 CG LYS A 34 6.145 5.008 2.027 1.00 0.00 C ATOM 465 CD LYS A 34 5.450 3.839 2.705 1.00 0.00 C ATOM 466 CE LYS A 34 5.614 3.892 4.216 1.00 0.00 C ATOM 467 NZ LYS A 34 6.939 3.367 4.649 1.00 0.00 N ATOM 0 H LYS A 34 4.526 3.215 0.107 1.00 0.00 H new ATOM 0 HA LYS A 34 4.774 5.996 0.036 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.625 3.655 0.442 1.00 0.00 H new ATOM 0 HB3 LYS A 34 7.324 5.252 0.259 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.083 5.222 2.540 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.524 5.900 2.112 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.390 3.849 2.453 1.00 0.00 H new ATOM 0 HD3 LYS A 34 5.859 2.902 2.326 1.00 0.00 H new ATOM 0 HE2 LYS A 34 5.502 4.921 4.558 1.00 0.00 H new ATOM 0 HE3 LYS A 34 4.821 3.311 4.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 7.241 3.859 5.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 6.863 2.347 4.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.639 3.528 3.897 1.00 0.00 H new ATOM 481 N GLN A 35 6.479 4.492 -2.378 1.00 0.00 N ATOM 482 CA GLN A 35 7.050 4.694 -3.704 1.00 0.00 C ATOM 483 C GLN A 35 6.086 5.464 -4.600 1.00 0.00 C ATOM 484 O GLN A 35 6.490 6.371 -5.328 1.00 0.00 O ATOM 485 CB GLN A 35 7.395 3.348 -4.345 1.00 0.00 C ATOM 486 CG GLN A 35 8.558 3.420 -5.322 1.00 0.00 C ATOM 487 CD GLN A 35 8.320 4.415 -6.440 1.00 0.00 C ATOM 488 OE1 GLN A 35 7.235 4.466 -7.021 1.00 0.00 O ATOM 489 NE2 GLN A 35 9.335 5.212 -6.750 1.00 0.00 N ATOM 0 H GLN A 35 6.632 3.561 -1.990 1.00 0.00 H new ATOM 0 HA GLN A 35 7.962 5.280 -3.593 1.00 0.00 H new ATOM 0 HB2 GLN A 35 7.635 2.632 -3.559 1.00 0.00 H new ATOM 0 HB3 GLN A 35 6.517 2.967 -4.866 1.00 0.00 H new ATOM 0 HG2 GLN A 35 9.464 3.695 -4.783 1.00 0.00 H new ATOM 0 HG3 GLN A 35 8.730 2.432 -5.750 1.00 0.00 H new ATOM 0 HE21 GLN A 35 10.217 5.136 -6.243 1.00 0.00 H new ATOM 0 HE22 GLN A 35 9.233 5.901 -7.495 1.00 0.00 H new ATOM 498 N GLN A 36 4.810 5.096 -4.542 1.00 0.00 N ATOM 499 CA GLN A 36 3.788 5.752 -5.350 1.00 0.00 C ATOM 500 C GLN A 36 3.751 7.251 -5.067 1.00 0.00 C ATOM 501 O GLN A 36 3.572 8.059 -5.979 1.00 0.00 O ATOM 502 CB GLN A 36 2.416 5.135 -5.075 1.00 0.00 C ATOM 503 CG GLN A 36 2.091 3.951 -5.972 1.00 0.00 C ATOM 504 CD GLN A 36 0.627 3.561 -5.915 1.00 0.00 C ATOM 505 OE1 GLN A 36 -0.164 3.946 -6.777 1.00 0.00 O ATOM 506 NE2 GLN A 36 0.258 2.792 -4.897 1.00 0.00 N ATOM 0 H GLN A 36 4.459 4.348 -3.944 1.00 0.00 H new ATOM 0 HA GLN A 36 4.040 5.604 -6.400 1.00 0.00 H new ATOM 0 HB2 GLN A 36 2.373 4.814 -4.034 1.00 0.00 H new ATOM 0 HB3 GLN A 36 1.650 5.900 -5.205 1.00 0.00 H new ATOM 0 HG2 GLN A 36 2.359 4.195 -7.000 1.00 0.00 H new ATOM 0 HG3 GLN A 36 2.702 3.098 -5.677 1.00 0.00 H new ATOM 0 HE21 GLN A 36 0.947 2.496 -4.205 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -0.714 2.497 -4.807 1.00 0.00 H new ATOM 515 N ILE A 37 3.919 7.613 -3.800 1.00 0.00 N ATOM 516 CA ILE A 37 3.905 9.014 -3.399 1.00 0.00 C ATOM 517 C ILE A 37 5.134 9.749 -3.922 1.00 0.00 C ATOM 518 O ILE A 37 5.051 10.908 -4.325 1.00 0.00 O ATOM 519 CB ILE A 37 3.847 9.160 -1.867 1.00 0.00 C ATOM 520 CG1 ILE A 37 2.543 8.571 -1.325 1.00 0.00 C ATOM 521 CG2 ILE A 37 3.978 10.623 -1.469 1.00 0.00 C ATOM 522 CD1 ILE A 37 2.635 8.123 0.117 1.00 0.00 C ATOM 0 H ILE A 37 4.066 6.956 -3.034 1.00 0.00 H new ATOM 0 HA ILE A 37 3.009 9.457 -3.833 1.00 0.00 H new ATOM 0 HB ILE A 37 4.681 8.609 -1.433 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.752 9.316 -1.416 1.00 0.00 H new ATOM 0 HG13 ILE A 37 2.253 7.721 -1.943 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.935 10.710 -0.383 1.00 0.00 H new ATOM 0 HG22 ILE A 37 4.931 11.014 -1.827 1.00 0.00 H new ATOM 0 HG23 ILE A 37 3.162 11.195 -1.911 1.00 0.00 H new ATOM 0 HD11 ILE A 37 1.675 7.716 0.434 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.403 7.355 0.211 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.894 8.974 0.747 1.00 0.00 H new ATOM 534 N GLU A 38 6.274 9.064 -3.914 1.00 0.00 N ATOM 535 CA GLU A 38 7.521 9.652 -4.389 1.00 0.00 C ATOM 536 C GLU A 38 7.473 9.886 -5.896 1.00 0.00 C ATOM 537 O GLU A 38 8.127 10.789 -6.416 1.00 0.00 O ATOM 538 CB GLU A 38 8.703 8.746 -4.039 1.00 0.00 C ATOM 539 CG GLU A 38 10.020 9.204 -4.643 1.00 0.00 C ATOM 540 CD GLU A 38 11.111 8.157 -4.528 1.00 0.00 C ATOM 541 OE1 GLU A 38 11.325 7.646 -3.408 1.00 0.00 O ATOM 542 OE2 GLU A 38 11.749 7.849 -5.555 1.00 0.00 O ATOM 0 H GLU A 38 6.359 8.103 -3.584 1.00 0.00 H new ATOM 0 HA GLU A 38 7.651 10.614 -3.894 1.00 0.00 H new ATOM 0 HB2 GLU A 38 8.806 8.700 -2.955 1.00 0.00 H new ATOM 0 HB3 GLU A 38 8.488 7.734 -4.382 1.00 0.00 H new ATOM 0 HG2 GLU A 38 9.867 9.450 -5.694 1.00 0.00 H new ATOM 0 HG3 GLU A 38 10.345 10.118 -4.146 1.00 0.00 H new ATOM 549 N ASP A 39 6.693 9.064 -6.591 1.00 0.00 N ATOM 550 CA ASP A 39 6.559 9.181 -8.038 1.00 0.00 C ATOM 551 C ASP A 39 5.489 10.205 -8.404 1.00 0.00 C ATOM 552 O ASP A 39 5.491 10.751 -9.507 1.00 0.00 O ATOM 553 CB ASP A 39 6.212 7.823 -8.650 1.00 0.00 C ATOM 554 CG ASP A 39 7.445 7.024 -9.025 1.00 0.00 C ATOM 555 OD1 ASP A 39 8.548 7.609 -9.038 1.00 0.00 O ATOM 556 OD2 ASP A 39 7.307 5.815 -9.304 1.00 0.00 O ATOM 0 H ASP A 39 6.145 8.311 -6.176 1.00 0.00 H new ATOM 0 HA ASP A 39 7.514 9.520 -8.440 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.614 7.251 -7.941 1.00 0.00 H new ATOM 0 HB3 ASP A 39 5.597 7.974 -9.537 1.00 0.00 H new ATOM 561 N GLN A 40 4.578 10.461 -7.471 1.00 0.00 N ATOM 562 CA GLN A 40 3.502 11.418 -7.697 1.00 0.00 C ATOM 563 C GLN A 40 3.912 12.815 -7.242 1.00 0.00 C ATOM 564 O GLN A 40 3.885 13.765 -8.024 1.00 0.00 O ATOM 565 CB GLN A 40 2.237 10.980 -6.957 1.00 0.00 C ATOM 566 CG GLN A 40 1.654 9.673 -7.471 1.00 0.00 C ATOM 567 CD GLN A 40 0.742 9.870 -8.665 1.00 0.00 C ATOM 568 OE1 GLN A 40 0.918 9.236 -9.707 1.00 0.00 O ATOM 569 NE2 GLN A 40 -0.240 10.752 -8.522 1.00 0.00 N ATOM 0 H GLN A 40 4.564 10.019 -6.552 1.00 0.00 H new ATOM 0 HA GLN A 40 3.297 11.449 -8.767 1.00 0.00 H new ATOM 0 HB2 GLN A 40 2.465 10.875 -5.896 1.00 0.00 H new ATOM 0 HB3 GLN A 40 1.485 11.764 -7.045 1.00 0.00 H new ATOM 0 HG2 GLN A 40 2.467 9.001 -7.746 1.00 0.00 H new ATOM 0 HG3 GLN A 40 1.097 9.188 -6.669 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -0.349 11.255 -7.641 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -0.885 10.926 -9.293 1.00 0.00 H new ATOM 578 N GLN A 41 4.291 12.932 -5.973 1.00 0.00 N ATOM 579 CA GLN A 41 4.705 14.213 -5.415 1.00 0.00 C ATOM 580 C GLN A 41 6.167 14.501 -5.740 1.00 0.00 C ATOM 581 O GLN A 41 6.530 15.630 -6.067 1.00 0.00 O ATOM 582 CB GLN A 41 4.496 14.225 -3.900 1.00 0.00 C ATOM 583 CG GLN A 41 3.058 13.961 -3.482 1.00 0.00 C ATOM 584 CD GLN A 41 2.697 14.637 -2.174 1.00 0.00 C ATOM 585 OE1 GLN A 41 2.234 15.778 -2.158 1.00 0.00 O ATOM 586 NE2 GLN A 41 2.908 13.935 -1.067 1.00 0.00 N ATOM 0 H GLN A 41 4.320 12.155 -5.313 1.00 0.00 H new ATOM 0 HA GLN A 41 4.091 14.992 -5.866 1.00 0.00 H new ATOM 0 HB2 GLN A 41 5.141 13.473 -3.447 1.00 0.00 H new ATOM 0 HB3 GLN A 41 4.808 15.192 -3.506 1.00 0.00 H new ATOM 0 HG2 GLN A 41 2.386 14.311 -4.265 1.00 0.00 H new ATOM 0 HG3 GLN A 41 2.903 12.886 -3.386 1.00 0.00 H new ATOM 0 HE21 GLN A 41 3.293 12.993 -1.126 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.685 14.338 -0.157 1.00 0.00 H new ATOM 595 N GLY A 42 7.003 13.471 -5.648 1.00 0.00 N ATOM 596 CA GLY A 42 8.416 13.635 -5.935 1.00 0.00 C ATOM 597 C GLY A 42 9.281 13.483 -4.699 1.00 0.00 C ATOM 598 O GLY A 42 10.502 13.361 -4.797 1.00 0.00 O ATOM 0 H GLY A 42 6.727 12.526 -5.380 1.00 0.00 H new ATOM 0 HA2 GLY A 42 8.720 12.900 -6.680 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.583 14.619 -6.372 1.00 0.00 H new ATOM 602 N LEU A 43 8.647 13.491 -3.531 1.00 0.00 N ATOM 603 CA LEU A 43 9.366 13.354 -2.269 1.00 0.00 C ATOM 604 C LEU A 43 9.884 11.931 -2.089 1.00 0.00 C ATOM 605 O LEU A 43 9.177 10.952 -2.328 1.00 0.00 O ATOM 606 CB LEU A 43 8.457 13.731 -1.098 1.00 0.00 C ATOM 607 CG LEU A 43 9.157 14.284 0.144 1.00 0.00 C ATOM 608 CD1 LEU A 43 8.250 15.261 0.876 1.00 0.00 C ATOM 609 CD2 LEU A 43 9.579 13.150 1.067 1.00 0.00 C ATOM 0 H LEU A 43 7.637 13.591 -3.432 1.00 0.00 H new ATOM 0 HA LEU A 43 10.220 14.031 -2.290 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.738 14.473 -1.446 1.00 0.00 H new ATOM 0 HB3 LEU A 43 7.888 12.848 -0.807 1.00 0.00 H new ATOM 0 HG LEU A 43 10.052 14.819 -0.174 1.00 0.00 H new ATOM 0 HD11 LEU A 43 8.764 15.645 1.757 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.998 16.089 0.214 1.00 0.00 H new ATOM 0 HD13 LEU A 43 7.337 14.750 1.182 1.00 0.00 H new ATOM 0 HD21 LEU A 43 10.076 13.562 1.946 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.699 12.587 1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.265 12.488 0.539 1.00 0.00 H new ATOM 621 N PRO A 44 11.148 11.811 -1.655 1.00 0.00 N ATOM 622 CA PRO A 44 11.788 10.512 -1.430 1.00 0.00 C ATOM 623 C PRO A 44 11.202 9.777 -0.229 1.00 0.00 C ATOM 624 O PRO A 44 10.536 10.378 0.615 1.00 0.00 O ATOM 625 CB PRO A 44 13.252 10.877 -1.172 1.00 0.00 C ATOM 626 CG PRO A 44 13.208 12.275 -0.657 1.00 0.00 C ATOM 627 CD PRO A 44 12.049 12.935 -1.351 1.00 0.00 C ATOM 0 HA PRO A 44 11.646 9.836 -2.273 1.00 0.00 H new ATOM 0 HB2 PRO A 44 13.707 10.202 -0.447 1.00 0.00 H new ATOM 0 HB3 PRO A 44 13.844 10.810 -2.085 1.00 0.00 H new ATOM 0 HG2 PRO A 44 13.074 12.288 0.425 1.00 0.00 H new ATOM 0 HG3 PRO A 44 14.140 12.799 -0.870 1.00 0.00 H new ATOM 0 HD2 PRO A 44 11.567 13.675 -0.712 1.00 0.00 H new ATOM 0 HD3 PRO A 44 12.365 13.453 -2.257 1.00 0.00 H new ATOM 635 N LYS A 45 11.455 8.475 -0.157 1.00 0.00 N ATOM 636 CA LYS A 45 10.955 7.658 0.942 1.00 0.00 C ATOM 637 C LYS A 45 11.802 7.854 2.195 1.00 0.00 C ATOM 638 O LYS A 45 11.282 7.881 3.311 1.00 0.00 O ATOM 639 CB LYS A 45 10.948 6.180 0.544 1.00 0.00 C ATOM 640 CG LYS A 45 10.323 5.919 -0.816 1.00 0.00 C ATOM 641 CD LYS A 45 10.486 4.468 -1.235 1.00 0.00 C ATOM 642 CE LYS A 45 11.804 4.242 -1.960 1.00 0.00 C ATOM 643 NZ LYS A 45 12.957 4.215 -1.019 1.00 0.00 N ATOM 0 H LYS A 45 12.004 7.962 -0.847 1.00 0.00 H new ATOM 0 HA LYS A 45 9.935 7.974 1.161 1.00 0.00 H new ATOM 0 HB2 LYS A 45 11.973 5.808 0.541 1.00 0.00 H new ATOM 0 HB3 LYS A 45 10.405 5.612 1.299 1.00 0.00 H new ATOM 0 HG2 LYS A 45 9.263 6.173 -0.785 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.785 6.568 -1.560 1.00 0.00 H new ATOM 0 HD2 LYS A 45 10.439 3.827 -0.355 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.659 4.180 -1.884 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.760 3.301 -2.508 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.954 5.032 -2.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 13.686 3.568 -1.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.355 5.172 -0.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 12.636 3.886 -0.086 1.00 0.00 H new ATOM 657 N LYS A 46 13.109 7.991 2.004 1.00 0.00 N ATOM 658 CA LYS A 46 14.029 8.188 3.118 1.00 0.00 C ATOM 659 C LYS A 46 13.623 9.398 3.953 1.00 0.00 C ATOM 660 O LYS A 46 14.101 9.580 5.071 1.00 0.00 O ATOM 661 CB LYS A 46 15.458 8.368 2.601 1.00 0.00 C ATOM 662 CG LYS A 46 15.607 9.510 1.611 1.00 0.00 C ATOM 663 CD LYS A 46 17.060 9.928 1.455 1.00 0.00 C ATOM 664 CE LYS A 46 17.248 10.856 0.265 1.00 0.00 C ATOM 665 NZ LYS A 46 17.043 12.283 0.638 1.00 0.00 N ATOM 0 H LYS A 46 13.556 7.969 1.087 1.00 0.00 H new ATOM 0 HA LYS A 46 13.987 7.302 3.751 1.00 0.00 H new ATOM 0 HB2 LYS A 46 16.122 8.543 3.447 1.00 0.00 H new ATOM 0 HB3 LYS A 46 15.783 7.442 2.127 1.00 0.00 H new ATOM 0 HG2 LYS A 46 15.209 9.207 0.643 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.016 10.363 1.946 1.00 0.00 H new ATOM 0 HD2 LYS A 46 17.396 10.427 2.364 1.00 0.00 H new ATOM 0 HD3 LYS A 46 17.683 9.042 1.329 1.00 0.00 H new ATOM 0 HE2 LYS A 46 18.251 10.727 -0.141 1.00 0.00 H new ATOM 0 HE3 LYS A 46 16.547 10.582 -0.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.180 12.884 -0.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 16.077 12.411 1.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 17.729 12.552 1.372 1.00 0.00 H new ATOM 679 N GLN A 47 12.737 10.221 3.401 1.00 0.00 N ATOM 680 CA GLN A 47 12.266 11.413 4.095 1.00 0.00 C ATOM 681 C GLN A 47 10.856 11.206 4.638 1.00 0.00 C ATOM 682 O GLN A 47 10.617 11.342 5.838 1.00 0.00 O ATOM 683 CB GLN A 47 12.291 12.620 3.156 1.00 0.00 C ATOM 684 CG GLN A 47 13.625 13.348 3.136 1.00 0.00 C ATOM 685 CD GLN A 47 13.490 14.805 2.741 1.00 0.00 C ATOM 686 OE1 GLN A 47 13.690 15.703 3.559 1.00 0.00 O ATOM 687 NE2 GLN A 47 13.148 15.047 1.481 1.00 0.00 N ATOM 0 H GLN A 47 12.331 10.084 2.475 1.00 0.00 H new ATOM 0 HA GLN A 47 12.935 11.601 4.935 1.00 0.00 H new ATOM 0 HB2 GLN A 47 12.052 12.289 2.145 1.00 0.00 H new ATOM 0 HB3 GLN A 47 11.510 13.319 3.455 1.00 0.00 H new ATOM 0 HG2 GLN A 47 14.084 13.284 4.123 1.00 0.00 H new ATOM 0 HG3 GLN A 47 14.297 12.848 2.439 1.00 0.00 H new ATOM 0 HE21 GLN A 47 12.992 14.272 0.837 1.00 0.00 H new ATOM 0 HE22 GLN A 47 13.041 16.008 1.157 1.00 0.00 H new ATOM 696 N GLN A 48 9.926 10.876 3.747 1.00 0.00 N ATOM 697 CA GLN A 48 8.540 10.651 4.138 1.00 0.00 C ATOM 698 C GLN A 48 8.438 9.523 5.159 1.00 0.00 C ATOM 699 O GLN A 48 9.201 8.559 5.110 1.00 0.00 O ATOM 700 CB GLN A 48 7.689 10.322 2.910 1.00 0.00 C ATOM 701 CG GLN A 48 7.626 8.837 2.594 1.00 0.00 C ATOM 702 CD GLN A 48 7.016 8.554 1.235 1.00 0.00 C ATOM 703 OE1 GLN A 48 6.056 7.793 1.118 1.00 0.00 O ATOM 704 NE2 GLN A 48 7.573 9.168 0.197 1.00 0.00 N ATOM 0 H GLN A 48 10.108 10.759 2.750 1.00 0.00 H new ATOM 0 HA GLN A 48 8.165 11.566 4.597 1.00 0.00 H new ATOM 0 HB2 GLN A 48 6.677 10.694 3.069 1.00 0.00 H new ATOM 0 HB3 GLN A 48 8.092 10.852 2.047 1.00 0.00 H new ATOM 0 HG2 GLN A 48 8.632 8.419 2.631 1.00 0.00 H new ATOM 0 HG3 GLN A 48 7.042 8.330 3.363 1.00 0.00 H new ATOM 0 HE21 GLN A 48 8.368 9.791 0.339 1.00 0.00 H new ATOM 0 HE22 GLN A 48 7.206 9.016 -0.742 1.00 0.00 H new ATOM 713 N GLN A 49 7.491 9.651 6.082 1.00 0.00 N ATOM 714 CA GLN A 49 7.291 8.642 7.116 1.00 0.00 C ATOM 715 C GLN A 49 5.816 8.531 7.490 1.00 0.00 C ATOM 716 O GLN A 49 5.252 9.435 8.108 1.00 0.00 O ATOM 717 CB GLN A 49 8.119 8.981 8.356 1.00 0.00 C ATOM 718 CG GLN A 49 7.980 7.964 9.477 1.00 0.00 C ATOM 719 CD GLN A 49 8.823 8.311 10.689 1.00 0.00 C ATOM 720 OE1 GLN A 49 8.943 9.479 11.062 1.00 0.00 O ATOM 721 NE2 GLN A 49 9.413 7.297 11.310 1.00 0.00 N ATOM 0 H GLN A 49 6.850 10.443 6.135 1.00 0.00 H new ATOM 0 HA GLN A 49 7.620 7.682 6.719 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.169 9.056 8.072 1.00 0.00 H new ATOM 0 HB3 GLN A 49 7.819 9.961 8.726 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.933 7.898 9.774 1.00 0.00 H new ATOM 0 HG3 GLN A 49 8.269 6.980 9.108 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.286 6.345 10.966 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.993 7.470 12.131 1.00 0.00 H new ATOM 730 N LEU A 50 5.198 7.418 7.112 1.00 0.00 N ATOM 731 CA LEU A 50 3.788 7.188 7.407 1.00 0.00 C ATOM 732 C LEU A 50 3.618 6.526 8.770 1.00 0.00 C ATOM 733 O LEU A 50 4.320 5.570 9.098 1.00 0.00 O ATOM 734 CB LEU A 50 3.155 6.316 6.321 1.00 0.00 C ATOM 735 CG LEU A 50 3.046 6.946 4.932 1.00 0.00 C ATOM 736 CD1 LEU A 50 2.689 5.893 3.895 1.00 0.00 C ATOM 737 CD2 LEU A 50 2.015 8.066 4.934 1.00 0.00 C ATOM 0 H LEU A 50 5.651 6.660 6.601 1.00 0.00 H new ATOM 0 HA LEU A 50 3.284 8.154 7.428 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.736 5.397 6.237 1.00 0.00 H new ATOM 0 HB3 LEU A 50 2.155 6.032 6.648 1.00 0.00 H new ATOM 0 HG LEU A 50 4.015 7.371 4.670 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.616 6.360 2.913 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.462 5.125 3.875 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.733 5.438 4.153 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.951 8.503 3.938 1.00 0.00 H new ATOM 0 HD22 LEU A 50 1.042 7.665 5.218 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.313 8.834 5.648 1.00 0.00 H new ATOM 749 N GLU A 51 2.680 7.040 9.559 1.00 0.00 N ATOM 750 CA GLU A 51 2.417 6.497 10.887 1.00 0.00 C ATOM 751 C GLU A 51 0.926 6.241 11.085 1.00 0.00 C ATOM 752 O GLU A 51 0.084 6.968 10.557 1.00 0.00 O ATOM 753 CB GLU A 51 2.929 7.455 11.965 1.00 0.00 C ATOM 754 CG GLU A 51 4.377 7.213 12.356 1.00 0.00 C ATOM 755 CD GLU A 51 4.836 8.120 13.481 1.00 0.00 C ATOM 756 OE1 GLU A 51 4.801 9.355 13.301 1.00 0.00 O ATOM 757 OE2 GLU A 51 5.231 7.594 14.543 1.00 0.00 O ATOM 0 H GLU A 51 2.090 7.831 9.302 1.00 0.00 H new ATOM 0 HA GLU A 51 2.946 5.548 10.974 1.00 0.00 H new ATOM 0 HB2 GLU A 51 2.824 8.480 11.608 1.00 0.00 H new ATOM 0 HB3 GLU A 51 2.301 7.360 12.851 1.00 0.00 H new ATOM 0 HG2 GLU A 51 4.499 6.173 12.660 1.00 0.00 H new ATOM 0 HG3 GLU A 51 5.015 7.368 11.486 1.00 0.00 H new ATOM 764 N PHE A 52 0.606 5.202 11.849 1.00 0.00 N ATOM 765 CA PHE A 52 -0.783 4.848 12.116 1.00 0.00 C ATOM 766 C PHE A 52 -0.969 4.441 13.575 1.00 0.00 C ATOM 767 O PHE A 52 -0.121 3.763 14.154 1.00 0.00 O ATOM 768 CB PHE A 52 -1.227 3.708 11.197 1.00 0.00 C ATOM 769 CG PHE A 52 -2.717 3.611 11.039 1.00 0.00 C ATOM 770 CD1 PHE A 52 -3.472 4.737 10.750 1.00 0.00 C ATOM 771 CD2 PHE A 52 -3.364 2.394 11.180 1.00 0.00 C ATOM 772 CE1 PHE A 52 -4.843 4.651 10.606 1.00 0.00 C ATOM 773 CE2 PHE A 52 -4.736 2.301 11.036 1.00 0.00 C ATOM 774 CZ PHE A 52 -5.476 3.431 10.748 1.00 0.00 C ATOM 0 H PHE A 52 1.290 4.590 12.294 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.400 5.725 11.919 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.774 3.846 10.215 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -0.850 2.765 11.593 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -2.982 5.693 10.636 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.790 1.507 11.405 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -5.420 5.536 10.383 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -5.228 1.346 11.149 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.548 3.361 10.634 1.00 0.00 H new ATOM 784 N GLN A 53 -2.086 4.861 14.162 1.00 0.00 N ATOM 785 CA GLN A 53 -2.383 4.541 15.553 1.00 0.00 C ATOM 786 C GLN A 53 -1.139 4.686 16.423 1.00 0.00 C ATOM 787 O GLN A 53 -1.005 4.020 17.448 1.00 0.00 O ATOM 788 CB GLN A 53 -2.936 3.119 15.665 1.00 0.00 C ATOM 789 CG GLN A 53 -4.169 2.877 14.811 1.00 0.00 C ATOM 790 CD GLN A 53 -4.852 1.562 15.132 1.00 0.00 C ATOM 791 OE1 GLN A 53 -5.873 1.531 15.820 1.00 0.00 O ATOM 792 NE2 GLN A 53 -4.291 0.466 14.633 1.00 0.00 N ATOM 0 H GLN A 53 -2.799 5.423 13.696 1.00 0.00 H new ATOM 0 HA GLN A 53 -3.136 5.245 15.908 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -2.159 2.412 15.375 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -3.180 2.914 16.707 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -4.875 3.694 14.959 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -3.885 2.887 13.759 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -3.445 0.538 14.068 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -4.706 -0.448 14.815 1.00 0.00 H new ATOM 801 N GLY A 54 -0.230 5.563 16.006 1.00 0.00 N ATOM 802 CA GLY A 54 0.992 5.779 16.758 1.00 0.00 C ATOM 803 C GLY A 54 2.005 4.671 16.550 1.00 0.00 C ATOM 804 O GLY A 54 2.647 4.222 17.499 1.00 0.00 O ATOM 0 H GLY A 54 -0.319 6.127 15.161 1.00 0.00 H new ATOM 0 HA2 GLY A 54 1.433 6.731 16.462 1.00 0.00 H new ATOM 0 HA3 GLY A 54 0.753 5.854 17.819 1.00 0.00 H new ATOM 808 N GLN A 55 2.147 4.228 15.305 1.00 0.00 N ATOM 809 CA GLN A 55 3.088 3.163 14.976 1.00 0.00 C ATOM 810 C GLN A 55 3.799 3.453 13.658 1.00 0.00 C ATOM 811 O GLN A 55 3.203 3.991 12.725 1.00 0.00 O ATOM 812 CB GLN A 55 2.361 1.820 14.892 1.00 0.00 C ATOM 813 CG GLN A 55 1.831 1.500 13.504 1.00 0.00 C ATOM 814 CD GLN A 55 0.809 0.380 13.513 1.00 0.00 C ATOM 815 OE1 GLN A 55 0.620 -0.295 14.525 1.00 0.00 O ATOM 816 NE2 GLN A 55 0.144 0.177 12.382 1.00 0.00 N ATOM 0 H GLN A 55 1.623 4.589 14.508 1.00 0.00 H new ATOM 0 HA GLN A 55 3.835 3.115 15.768 1.00 0.00 H new ATOM 0 HB2 GLN A 55 3.042 1.028 15.203 1.00 0.00 H new ATOM 0 HB3 GLN A 55 1.530 1.822 15.598 1.00 0.00 H new ATOM 0 HG2 GLN A 55 1.379 2.395 13.076 1.00 0.00 H new ATOM 0 HG3 GLN A 55 2.663 1.222 12.857 1.00 0.00 H new ATOM 0 HE21 GLN A 55 0.333 0.761 11.567 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -0.556 -0.563 12.328 1.00 0.00 H new ATOM 825 N VAL A 56 5.077 3.093 13.589 1.00 0.00 N ATOM 826 CA VAL A 56 5.869 3.314 12.385 1.00 0.00 C ATOM 827 C VAL A 56 5.666 2.187 11.379 1.00 0.00 C ATOM 828 O VAL A 56 5.667 1.009 11.741 1.00 0.00 O ATOM 829 CB VAL A 56 7.369 3.429 12.714 1.00 0.00 C ATOM 830 CG1 VAL A 56 8.161 3.812 11.473 1.00 0.00 C ATOM 831 CG2 VAL A 56 7.594 4.437 13.832 1.00 0.00 C ATOM 0 H VAL A 56 5.586 2.647 14.353 1.00 0.00 H new ATOM 0 HA VAL A 56 5.527 4.252 11.949 1.00 0.00 H new ATOM 0 HB VAL A 56 7.723 2.456 13.056 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.219 3.888 11.726 1.00 0.00 H new ATOM 0 HG12 VAL A 56 8.025 3.050 10.705 1.00 0.00 H new ATOM 0 HG13 VAL A 56 7.807 4.772 11.098 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.660 4.505 14.051 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.224 5.414 13.521 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.060 4.115 14.726 1.00 0.00 H new ATOM 841 N LEU A 57 5.491 2.554 10.115 1.00 0.00 N ATOM 842 CA LEU A 57 5.287 1.574 9.054 1.00 0.00 C ATOM 843 C LEU A 57 6.591 1.294 8.313 1.00 0.00 C ATOM 844 O LEU A 57 7.366 2.209 8.035 1.00 0.00 O ATOM 845 CB LEU A 57 4.225 2.070 8.071 1.00 0.00 C ATOM 846 CG LEU A 57 2.981 2.706 8.693 1.00 0.00 C ATOM 847 CD1 LEU A 57 2.059 3.245 7.610 1.00 0.00 C ATOM 848 CD2 LEU A 57 2.247 1.698 9.567 1.00 0.00 C ATOM 0 H LEU A 57 5.486 3.524 9.799 1.00 0.00 H new ATOM 0 HA LEU A 57 4.944 0.646 9.512 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.687 2.799 7.405 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.909 1.229 7.454 1.00 0.00 H new ATOM 0 HG LEU A 57 3.297 3.539 9.320 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.179 3.694 8.071 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.586 3.999 7.025 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.750 2.429 6.956 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.365 2.168 10.001 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.943 0.845 8.961 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.908 1.359 10.365 1.00 0.00 H new ATOM 860 N GLN A 58 6.823 0.025 7.994 1.00 0.00 N ATOM 861 CA GLN A 58 8.032 -0.374 7.283 1.00 0.00 C ATOM 862 C GLN A 58 7.803 -0.374 5.775 1.00 0.00 C ATOM 863 O GLN A 58 6.733 0.009 5.301 1.00 0.00 O ATOM 864 CB GLN A 58 8.484 -1.762 7.742 1.00 0.00 C ATOM 865 CG GLN A 58 8.801 -1.839 9.226 1.00 0.00 C ATOM 866 CD GLN A 58 9.960 -0.946 9.622 1.00 0.00 C ATOM 867 OE1 GLN A 58 10.527 -0.239 8.789 1.00 0.00 O ATOM 868 NE2 GLN A 58 10.320 -0.975 10.900 1.00 0.00 N ATOM 0 H GLN A 58 6.191 -0.744 8.216 1.00 0.00 H new ATOM 0 HA GLN A 58 8.814 0.350 7.513 1.00 0.00 H new ATOM 0 HB2 GLN A 58 7.703 -2.485 7.508 1.00 0.00 H new ATOM 0 HB3 GLN A 58 9.368 -2.053 7.175 1.00 0.00 H new ATOM 0 HG2 GLN A 58 7.917 -1.556 9.798 1.00 0.00 H new ATOM 0 HG3 GLN A 58 9.035 -2.870 9.491 1.00 0.00 H new ATOM 0 HE21 GLN A 58 9.822 -1.576 11.557 1.00 0.00 H new ATOM 0 HE22 GLN A 58 11.094 -0.396 11.225 1.00 0.00 H new ATOM 877 N ASP A 59 8.813 -0.804 5.028 1.00 0.00 N ATOM 878 CA ASP A 59 8.721 -0.854 3.573 1.00 0.00 C ATOM 879 C ASP A 59 8.650 -2.296 3.083 1.00 0.00 C ATOM 880 O ASP A 59 8.255 -2.557 1.946 1.00 0.00 O ATOM 881 CB ASP A 59 9.920 -0.145 2.941 1.00 0.00 C ATOM 882 CG ASP A 59 10.266 1.151 3.648 1.00 0.00 C ATOM 883 OD1 ASP A 59 10.889 1.089 4.728 1.00 0.00 O ATOM 884 OD2 ASP A 59 9.912 2.227 3.122 1.00 0.00 O ATOM 0 H ASP A 59 9.705 -1.123 5.405 1.00 0.00 H new ATOM 0 HA ASP A 59 7.807 -0.342 3.273 1.00 0.00 H new ATOM 0 HB2 ASP A 59 10.784 -0.809 2.963 1.00 0.00 H new ATOM 0 HB3 ASP A 59 9.704 0.063 1.893 1.00 0.00 H new ATOM 889 N TRP A 60 9.036 -3.229 3.945 1.00 0.00 N ATOM 890 CA TRP A 60 9.017 -4.646 3.599 1.00 0.00 C ATOM 891 C TRP A 60 7.723 -5.303 4.065 1.00 0.00 C ATOM 892 O TRP A 60 7.216 -6.224 3.423 1.00 0.00 O ATOM 893 CB TRP A 60 10.219 -5.360 4.219 1.00 0.00 C ATOM 894 CG TRP A 60 9.974 -5.826 5.622 1.00 0.00 C ATOM 895 CD1 TRP A 60 9.239 -6.910 6.009 1.00 0.00 C ATOM 896 CD2 TRP A 60 10.463 -5.220 6.824 1.00 0.00 C ATOM 897 NE1 TRP A 60 9.241 -7.015 7.379 1.00 0.00 N ATOM 898 CE2 TRP A 60 9.986 -5.991 7.903 1.00 0.00 C ATOM 899 CE3 TRP A 60 11.259 -4.104 7.094 1.00 0.00 C ATOM 900 CZ2 TRP A 60 10.279 -5.678 9.227 1.00 0.00 C ATOM 901 CZ3 TRP A 60 11.548 -3.795 8.410 1.00 0.00 C ATOM 902 CH2 TRP A 60 11.060 -4.580 9.463 1.00 0.00 C ATOM 0 H TRP A 60 9.366 -3.030 4.889 1.00 0.00 H new ATOM 0 HA TRP A 60 9.074 -4.730 2.514 1.00 0.00 H new ATOM 0 HB2 TRP A 60 10.482 -6.217 3.600 1.00 0.00 H new ATOM 0 HB3 TRP A 60 11.076 -4.686 4.212 1.00 0.00 H new ATOM 0 HD1 TRP A 60 8.731 -7.586 5.337 1.00 0.00 H new ATOM 0 HE1 TRP A 60 8.765 -7.738 7.919 1.00 0.00 H new ATOM 0 HE3 TRP A 60 11.642 -3.494 6.289 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 9.903 -6.281 10.040 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 12.161 -2.933 8.630 1.00 0.00 H new ATOM 0 HH2 TRP A 60 11.305 -4.313 10.480 1.00 0.00 H new ATOM 913 N LEU A 61 7.192 -4.825 5.185 1.00 0.00 N ATOM 914 CA LEU A 61 5.956 -5.367 5.738 1.00 0.00 C ATOM 915 C LEU A 61 4.779 -5.099 4.805 1.00 0.00 C ATOM 916 O LEU A 61 4.942 -4.511 3.737 1.00 0.00 O ATOM 917 CB LEU A 61 5.679 -4.757 7.114 1.00 0.00 C ATOM 918 CG LEU A 61 6.797 -4.898 8.147 1.00 0.00 C ATOM 919 CD1 LEU A 61 6.525 -4.011 9.352 1.00 0.00 C ATOM 920 CD2 LEU A 61 6.949 -6.350 8.575 1.00 0.00 C ATOM 0 H LEU A 61 7.598 -4.063 5.728 1.00 0.00 H new ATOM 0 HA LEU A 61 6.076 -6.445 5.842 1.00 0.00 H new ATOM 0 HB2 LEU A 61 5.464 -3.696 6.983 1.00 0.00 H new ATOM 0 HB3 LEU A 61 4.777 -5.217 7.519 1.00 0.00 H new ATOM 0 HG LEU A 61 7.732 -4.576 7.688 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.331 -4.125 10.077 1.00 0.00 H new ATOM 0 HD12 LEU A 61 6.468 -2.970 9.032 1.00 0.00 H new ATOM 0 HD13 LEU A 61 5.580 -4.301 9.812 1.00 0.00 H new ATOM 0 HD21 LEU A 61 7.749 -6.431 9.310 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.015 -6.699 9.015 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.192 -6.962 7.706 1.00 0.00 H new ATOM 932 N GLY A 62 3.592 -5.534 5.217 1.00 0.00 N ATOM 933 CA GLY A 62 2.405 -5.331 4.407 1.00 0.00 C ATOM 934 C GLY A 62 1.303 -4.618 5.164 1.00 0.00 C ATOM 935 O GLY A 62 1.362 -4.488 6.388 1.00 0.00 O ATOM 0 H GLY A 62 3.431 -6.023 6.097 1.00 0.00 H new ATOM 0 HA2 GLY A 62 2.667 -4.752 3.522 1.00 0.00 H new ATOM 0 HA3 GLY A 62 2.037 -6.296 4.059 1.00 0.00 H new ATOM 939 N LEU A 63 0.293 -4.153 4.437 1.00 0.00 N ATOM 940 CA LEU A 63 -0.828 -3.447 5.047 1.00 0.00 C ATOM 941 C LEU A 63 -1.594 -4.360 5.998 1.00 0.00 C ATOM 942 O LEU A 63 -2.045 -3.930 7.059 1.00 0.00 O ATOM 943 CB LEU A 63 -1.770 -2.913 3.965 1.00 0.00 C ATOM 944 CG LEU A 63 -1.322 -1.635 3.256 1.00 0.00 C ATOM 945 CD1 LEU A 63 -0.170 -1.927 2.307 1.00 0.00 C ATOM 946 CD2 LEU A 63 -2.486 -1.005 2.507 1.00 0.00 C ATOM 0 H LEU A 63 0.227 -4.252 3.424 1.00 0.00 H new ATOM 0 HA LEU A 63 -0.429 -2.609 5.619 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.908 -3.692 3.215 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.745 -2.731 4.418 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.975 -0.927 4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 63 0.136 -1.006 1.811 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.671 -2.332 2.870 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.490 -2.653 1.559 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.149 -0.096 2.008 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.864 -1.708 1.764 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.281 -0.759 3.211 1.00 0.00 H new ATOM 958 N GLY A 64 -1.735 -5.625 5.612 1.00 0.00 N ATOM 959 CA GLY A 64 -2.444 -6.580 6.443 1.00 0.00 C ATOM 960 C GLY A 64 -1.760 -6.809 7.776 1.00 0.00 C ATOM 961 O GLY A 64 -2.383 -6.680 8.831 1.00 0.00 O ATOM 0 H GLY A 64 -1.371 -6.005 4.738 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.459 -6.223 6.616 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -2.526 -7.529 5.912 1.00 0.00 H new ATOM 965 N ILE A 65 -0.477 -7.150 7.730 1.00 0.00 N ATOM 966 CA ILE A 65 0.291 -7.398 8.944 1.00 0.00 C ATOM 967 C ILE A 65 -0.152 -6.475 10.073 1.00 0.00 C ATOM 968 O ILE A 65 -0.405 -6.922 11.192 1.00 0.00 O ATOM 969 CB ILE A 65 1.801 -7.209 8.703 1.00 0.00 C ATOM 970 CG1 ILE A 65 2.319 -8.263 7.723 1.00 0.00 C ATOM 971 CG2 ILE A 65 2.560 -7.282 10.020 1.00 0.00 C ATOM 972 CD1 ILE A 65 2.154 -7.872 6.271 1.00 0.00 C ATOM 0 H ILE A 65 0.053 -7.261 6.865 1.00 0.00 H new ATOM 0 HA ILE A 65 0.104 -8.433 9.230 1.00 0.00 H new ATOM 0 HB ILE A 65 1.964 -6.224 8.266 1.00 0.00 H new ATOM 0 HG12 ILE A 65 3.375 -8.446 7.924 1.00 0.00 H new ATOM 0 HG13 ILE A 65 1.793 -9.201 7.900 1.00 0.00 H new ATOM 0 HG21 ILE A 65 3.625 -7.147 9.834 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.206 -6.497 10.688 1.00 0.00 H new ATOM 0 HG23 ILE A 65 2.393 -8.255 10.483 1.00 0.00 H new ATOM 0 HD11 ILE A 65 2.543 -8.666 5.634 1.00 0.00 H new ATOM 0 HD12 ILE A 65 1.097 -7.717 6.054 1.00 0.00 H new ATOM 0 HD13 ILE A 65 2.703 -6.950 6.078 1.00 0.00 H new ATOM 984 N TYR A 66 -0.245 -5.184 9.773 1.00 0.00 N ATOM 985 CA TYR A 66 -0.657 -4.197 10.763 1.00 0.00 C ATOM 986 C TYR A 66 -2.169 -4.226 10.965 1.00 0.00 C ATOM 987 O TYR A 66 -2.658 -4.156 12.091 1.00 0.00 O ATOM 988 CB TYR A 66 -0.216 -2.797 10.332 1.00 0.00 C ATOM 989 CG TYR A 66 1.252 -2.524 10.572 1.00 0.00 C ATOM 990 CD1 TYR A 66 1.758 -2.424 11.861 1.00 0.00 C ATOM 991 CD2 TYR A 66 2.132 -2.367 9.508 1.00 0.00 C ATOM 992 CE1 TYR A 66 3.098 -2.174 12.085 1.00 0.00 C ATOM 993 CE2 TYR A 66 3.474 -2.118 9.722 1.00 0.00 C ATOM 994 CZ TYR A 66 3.952 -2.022 11.012 1.00 0.00 C ATOM 995 OH TYR A 66 5.288 -1.774 11.230 1.00 0.00 O ATOM 0 H TYR A 66 -0.040 -4.797 8.852 1.00 0.00 H new ATOM 0 HA TYR A 66 -0.177 -4.447 11.709 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -0.432 -2.667 9.272 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -0.807 -2.057 10.871 1.00 0.00 H new ATOM 0 HD1 TYR A 66 1.092 -2.544 12.703 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.761 -2.441 8.497 1.00 0.00 H new ATOM 0 HE1 TYR A 66 3.475 -2.098 13.094 1.00 0.00 H new ATOM 0 HE2 TYR A 66 4.145 -1.999 8.884 1.00 0.00 H new ATOM 0 HH TYR A 66 5.419 -0.819 11.405 1.00 0.00 H new ATOM 1005 N GLY A 67 -2.905 -4.331 9.862 1.00 0.00 N ATOM 1006 CA GLY A 67 -4.354 -4.368 9.938 1.00 0.00 C ATOM 1007 C GLY A 67 -4.998 -3.132 9.342 1.00 0.00 C ATOM 1008 O GLY A 67 -6.097 -2.744 9.740 1.00 0.00 O ATOM 0 H GLY A 67 -2.524 -4.391 8.918 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.720 -5.252 9.416 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.658 -4.465 10.980 1.00 0.00 H new ATOM 1012 N ILE A 68 -4.313 -2.512 8.388 1.00 0.00 N ATOM 1013 CA ILE A 68 -4.825 -1.312 7.737 1.00 0.00 C ATOM 1014 C ILE A 68 -6.035 -1.633 6.866 1.00 0.00 C ATOM 1015 O ILE A 68 -6.110 -2.703 6.262 1.00 0.00 O ATOM 1016 CB ILE A 68 -3.746 -0.638 6.870 1.00 0.00 C ATOM 1017 CG1 ILE A 68 -2.555 -0.218 7.734 1.00 0.00 C ATOM 1018 CG2 ILE A 68 -4.327 0.565 6.141 1.00 0.00 C ATOM 1019 CD1 ILE A 68 -1.292 0.035 6.940 1.00 0.00 C ATOM 0 H ILE A 68 -3.402 -2.820 8.048 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.123 -0.626 8.530 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.398 -1.356 6.127 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.816 0.686 8.284 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.360 -0.995 8.473 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.552 1.031 5.532 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.146 0.241 5.499 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.699 1.286 6.868 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.490 0.329 7.617 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -1.006 -0.874 6.411 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.469 0.833 6.219 1.00 0.00 H new ATOM 1031 N GLN A 69 -6.978 -0.699 6.805 1.00 0.00 N ATOM 1032 CA GLN A 69 -8.184 -0.882 6.006 1.00 0.00 C ATOM 1033 C GLN A 69 -8.449 0.340 5.133 1.00 0.00 C ATOM 1034 O GLN A 69 -7.862 1.402 5.339 1.00 0.00 O ATOM 1035 CB GLN A 69 -9.387 -1.147 6.913 1.00 0.00 C ATOM 1036 CG GLN A 69 -9.882 0.091 7.643 1.00 0.00 C ATOM 1037 CD GLN A 69 -11.318 -0.044 8.112 1.00 0.00 C ATOM 1038 OE1 GLN A 69 -12.131 -0.712 7.474 1.00 0.00 O ATOM 1039 NE2 GLN A 69 -11.637 0.593 9.232 1.00 0.00 N ATOM 0 H GLN A 69 -6.930 0.192 7.299 1.00 0.00 H new ATOM 0 HA GLN A 69 -8.032 -1.744 5.356 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -10.201 -1.555 6.313 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -9.119 -1.908 7.646 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -9.239 0.283 8.502 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -9.799 0.955 6.984 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -10.931 1.136 9.729 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -12.588 0.540 9.596 1.00 0.00 H new ATOM 1048 N ASP A 70 -9.337 0.182 4.157 1.00 0.00 N ATOM 1049 CA ASP A 70 -9.681 1.273 3.253 1.00 0.00 C ATOM 1050 C ASP A 70 -10.287 2.444 4.020 1.00 0.00 C ATOM 1051 O ASP A 70 -10.591 2.330 5.207 1.00 0.00 O ATOM 1052 CB ASP A 70 -10.660 0.787 2.183 1.00 0.00 C ATOM 1053 CG ASP A 70 -11.899 0.147 2.778 1.00 0.00 C ATOM 1054 OD1 ASP A 70 -11.771 -0.929 3.398 1.00 0.00 O ATOM 1055 OD2 ASP A 70 -12.996 0.723 2.624 1.00 0.00 O ATOM 0 H ASP A 70 -9.831 -0.691 3.972 1.00 0.00 H new ATOM 0 HA ASP A 70 -8.766 1.614 2.769 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.955 1.628 1.556 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -10.158 0.068 1.536 1.00 0.00 H new ATOM 1060 N SER A 71 -10.459 3.569 3.333 1.00 0.00 N ATOM 1061 CA SER A 71 -11.024 4.763 3.951 1.00 0.00 C ATOM 1062 C SER A 71 -10.241 5.150 5.202 1.00 0.00 C ATOM 1063 O SER A 71 -10.781 5.769 6.119 1.00 0.00 O ATOM 1064 CB SER A 71 -12.494 4.532 4.307 1.00 0.00 C ATOM 1065 OG SER A 71 -12.617 3.748 5.481 1.00 0.00 O ATOM 0 H SER A 71 -10.215 3.679 2.349 1.00 0.00 H new ATOM 0 HA SER A 71 -10.955 5.580 3.233 1.00 0.00 H new ATOM 0 HB2 SER A 71 -12.991 5.491 4.453 1.00 0.00 H new ATOM 0 HB3 SER A 71 -12.998 4.034 3.479 1.00 0.00 H new ATOM 0 HG SER A 71 -11.760 3.314 5.676 1.00 0.00 H new ATOM 1071 N ASP A 72 -8.965 4.780 5.231 1.00 0.00 N ATOM 1072 CA ASP A 72 -8.106 5.089 6.368 1.00 0.00 C ATOM 1073 C ASP A 72 -7.301 6.359 6.112 1.00 0.00 C ATOM 1074 O ASP A 72 -7.162 6.801 4.971 1.00 0.00 O ATOM 1075 CB ASP A 72 -7.161 3.920 6.652 1.00 0.00 C ATOM 1076 CG ASP A 72 -7.793 2.866 7.540 1.00 0.00 C ATOM 1077 OD1 ASP A 72 -9.016 2.948 7.778 1.00 0.00 O ATOM 1078 OD2 ASP A 72 -7.065 1.960 7.995 1.00 0.00 O ATOM 0 H ASP A 72 -8.503 4.266 4.481 1.00 0.00 H new ATOM 0 HA ASP A 72 -8.741 5.253 7.238 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -6.860 3.463 5.709 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -6.255 4.296 7.128 1.00 0.00 H new ATOM 1083 N THR A 73 -6.773 6.945 7.183 1.00 0.00 N ATOM 1084 CA THR A 73 -5.985 8.166 7.075 1.00 0.00 C ATOM 1085 C THR A 73 -4.535 7.921 7.476 1.00 0.00 C ATOM 1086 O THR A 73 -4.260 7.281 8.492 1.00 0.00 O ATOM 1087 CB THR A 73 -6.566 9.289 7.954 1.00 0.00 C ATOM 1088 OG1 THR A 73 -7.920 9.558 7.574 1.00 0.00 O ATOM 1089 CG2 THR A 73 -5.737 10.559 7.828 1.00 0.00 C ATOM 0 H THR A 73 -6.877 6.593 8.135 1.00 0.00 H new ATOM 0 HA THR A 73 -6.023 8.476 6.031 1.00 0.00 H new ATOM 0 HB THR A 73 -6.539 8.958 8.992 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.283 10.272 8.139 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.167 11.338 8.458 1.00 0.00 H new ATOM 0 HG22 THR A 73 -4.714 10.359 8.146 1.00 0.00 H new ATOM 0 HG23 THR A 73 -5.736 10.891 6.790 1.00 0.00 H new ATOM 1097 N LEU A 74 -3.609 8.433 6.672 1.00 0.00 N ATOM 1098 CA LEU A 74 -2.185 8.271 6.944 1.00 0.00 C ATOM 1099 C LEU A 74 -1.484 9.625 7.005 1.00 0.00 C ATOM 1100 O LEU A 74 -1.627 10.449 6.102 1.00 0.00 O ATOM 1101 CB LEU A 74 -1.537 7.396 5.870 1.00 0.00 C ATOM 1102 CG LEU A 74 -2.158 6.014 5.664 1.00 0.00 C ATOM 1103 CD1 LEU A 74 -1.964 5.550 4.229 1.00 0.00 C ATOM 1104 CD2 LEU A 74 -1.558 5.010 6.638 1.00 0.00 C ATOM 0 H LEU A 74 -3.819 8.964 5.827 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.079 7.784 7.913 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -1.573 7.933 4.922 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.485 7.265 6.123 1.00 0.00 H new ATOM 0 HG LEU A 74 -3.228 6.084 5.859 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -2.412 4.565 4.101 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.442 6.257 3.550 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.899 5.496 4.005 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -2.011 4.032 6.478 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.482 4.943 6.475 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.750 5.336 7.660 1.00 0.00 H new ATOM 1116 N ILE A 75 -0.726 9.845 8.074 1.00 0.00 N ATOM 1117 CA ILE A 75 -0.001 11.097 8.250 1.00 0.00 C ATOM 1118 C ILE A 75 1.334 11.067 7.513 1.00 0.00 C ATOM 1119 O ILE A 75 2.046 10.063 7.536 1.00 0.00 O ATOM 1120 CB ILE A 75 0.255 11.394 9.740 1.00 0.00 C ATOM 1121 CG1 ILE A 75 -1.048 11.290 10.534 1.00 0.00 C ATOM 1122 CG2 ILE A 75 0.874 12.774 9.905 1.00 0.00 C ATOM 1123 CD1 ILE A 75 -1.946 12.498 10.383 1.00 0.00 C ATOM 0 H ILE A 75 -0.598 9.173 8.831 1.00 0.00 H new ATOM 0 HA ILE A 75 -0.627 11.886 7.832 1.00 0.00 H new ATOM 0 HB ILE A 75 0.955 10.654 10.129 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.591 10.401 10.211 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.811 11.153 11.589 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.049 12.970 10.963 1.00 0.00 H new ATOM 0 HG22 ILE A 75 1.821 12.815 9.367 1.00 0.00 H new ATOM 0 HG23 ILE A 75 0.196 13.527 9.504 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -2.851 12.355 10.973 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -1.422 13.387 10.733 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.213 12.624 9.334 1.00 0.00 H new ATOM 1135 N LEU A 76 1.667 12.176 6.861 1.00 0.00 N ATOM 1136 CA LEU A 76 2.918 12.279 6.117 1.00 0.00 C ATOM 1137 C LEU A 76 3.845 13.311 6.751 1.00 0.00 C ATOM 1138 O LEU A 76 3.473 14.471 6.924 1.00 0.00 O ATOM 1139 CB LEU A 76 2.639 12.654 4.661 1.00 0.00 C ATOM 1140 CG LEU A 76 3.867 12.844 3.770 1.00 0.00 C ATOM 1141 CD1 LEU A 76 4.410 11.498 3.315 1.00 0.00 C ATOM 1142 CD2 LEU A 76 3.526 13.716 2.570 1.00 0.00 C ATOM 0 H LEU A 76 1.089 13.016 6.832 1.00 0.00 H new ATOM 0 HA LEU A 76 3.411 11.307 6.147 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.012 11.879 4.221 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.060 13.577 4.649 1.00 0.00 H new ATOM 0 HG LEU A 76 4.639 13.347 4.352 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.284 11.653 2.682 1.00 0.00 H new ATOM 0 HD12 LEU A 76 4.693 10.907 4.186 1.00 0.00 H new ATOM 0 HD13 LEU A 76 3.643 10.968 2.751 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.412 13.840 1.947 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.737 13.241 1.988 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.185 14.692 2.915 1.00 0.00 H new ATOM 1154 N SER A 77 5.055 12.881 7.094 1.00 0.00 N ATOM 1155 CA SER A 77 6.035 13.767 7.711 1.00 0.00 C ATOM 1156 C SER A 77 7.450 13.404 7.269 1.00 0.00 C ATOM 1157 O SER A 77 7.817 12.229 7.223 1.00 0.00 O ATOM 1158 CB SER A 77 5.931 13.696 9.235 1.00 0.00 C ATOM 1159 OG SER A 77 4.865 14.499 9.712 1.00 0.00 O ATOM 0 H SER A 77 5.380 11.924 6.955 1.00 0.00 H new ATOM 0 HA SER A 77 5.821 14.786 7.387 1.00 0.00 H new ATOM 0 HB2 SER A 77 5.778 12.662 9.544 1.00 0.00 H new ATOM 0 HB3 SER A 77 6.868 14.027 9.682 1.00 0.00 H new ATOM 0 HG SER A 77 4.279 14.742 8.965 1.00 0.00 H new ATOM 1165 N LYS A 78 8.241 14.420 6.944 1.00 0.00 N ATOM 1166 CA LYS A 78 9.616 14.211 6.507 1.00 0.00 C ATOM 1167 C LYS A 78 10.546 14.033 7.702 1.00 0.00 C ATOM 1168 O LYS A 78 10.373 14.675 8.738 1.00 0.00 O ATOM 1169 CB LYS A 78 10.086 15.391 5.653 1.00 0.00 C ATOM 1170 CG LYS A 78 10.244 16.684 6.436 1.00 0.00 C ATOM 1171 CD LYS A 78 10.136 17.900 5.531 1.00 0.00 C ATOM 1172 CE LYS A 78 11.351 18.029 4.625 1.00 0.00 C ATOM 1173 NZ LYS A 78 11.130 19.026 3.540 1.00 0.00 N ATOM 0 H LYS A 78 7.953 15.398 6.975 1.00 0.00 H new ATOM 0 HA LYS A 78 9.646 13.301 5.907 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.040 15.137 5.191 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.373 15.550 4.844 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.479 16.737 7.211 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.210 16.689 6.941 1.00 0.00 H new ATOM 0 HD2 LYS A 78 9.234 17.824 4.924 1.00 0.00 H new ATOM 0 HD3 LYS A 78 10.036 18.800 6.138 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.217 18.323 5.218 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.581 17.059 4.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 11.980 19.085 2.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 10.319 18.732 2.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 10.936 19.958 3.959 1.00 0.00 H new ATOM 1187 N LYS A 79 11.534 13.157 7.552 1.00 0.00 N ATOM 1188 CA LYS A 79 12.494 12.895 8.618 1.00 0.00 C ATOM 1189 C LYS A 79 13.363 14.120 8.880 1.00 0.00 C ATOM 1190 O LYS A 79 13.904 14.721 7.951 1.00 0.00 O ATOM 1191 CB LYS A 79 13.376 11.698 8.255 1.00 0.00 C ATOM 1192 CG LYS A 79 12.600 10.519 7.693 1.00 0.00 C ATOM 1193 CD LYS A 79 13.273 9.198 8.028 1.00 0.00 C ATOM 1194 CE LYS A 79 12.502 8.019 7.457 1.00 0.00 C ATOM 1195 NZ LYS A 79 13.233 6.735 7.643 1.00 0.00 N ATOM 0 H LYS A 79 11.691 12.616 6.702 1.00 0.00 H new ATOM 0 HA LYS A 79 11.937 12.666 9.527 1.00 0.00 H new ATOM 0 HB2 LYS A 79 14.120 12.014 7.524 1.00 0.00 H new ATOM 0 HB3 LYS A 79 13.919 11.375 9.143 1.00 0.00 H new ATOM 0 HG2 LYS A 79 11.587 10.524 8.095 1.00 0.00 H new ATOM 0 HG3 LYS A 79 12.515 10.621 6.611 1.00 0.00 H new ATOM 0 HD2 LYS A 79 14.289 9.196 7.633 1.00 0.00 H new ATOM 0 HD3 LYS A 79 13.352 9.093 9.110 1.00 0.00 H new ATOM 0 HE2 LYS A 79 11.527 7.955 7.940 1.00 0.00 H new ATOM 0 HE3 LYS A 79 12.322 8.183 6.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 12.674 5.956 7.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 14.153 6.786 7.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 13.383 6.565 8.658 1.00 0.00 H new ATOM 1209 N LYS A 80 13.495 14.486 10.151 1.00 0.00 N ATOM 1210 CA LYS A 80 14.301 15.638 10.536 1.00 0.00 C ATOM 1211 C LYS A 80 15.597 15.195 11.208 1.00 0.00 C ATOM 1212 O LYS A 80 15.581 14.655 12.314 1.00 0.00 O ATOM 1213 CB LYS A 80 13.510 16.547 11.479 1.00 0.00 C ATOM 1214 CG LYS A 80 14.318 17.717 12.015 1.00 0.00 C ATOM 1215 CD LYS A 80 14.464 18.816 10.977 1.00 0.00 C ATOM 1216 CE LYS A 80 15.462 19.874 11.422 1.00 0.00 C ATOM 1217 NZ LYS A 80 16.866 19.463 11.146 1.00 0.00 N ATOM 0 H LYS A 80 13.054 14.001 10.932 1.00 0.00 H new ATOM 0 HA LYS A 80 14.552 16.193 9.632 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.636 16.931 10.952 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.143 15.955 12.317 1.00 0.00 H new ATOM 0 HG2 LYS A 80 13.833 18.118 12.905 1.00 0.00 H new ATOM 0 HG3 LYS A 80 15.305 17.369 12.319 1.00 0.00 H new ATOM 0 HD2 LYS A 80 14.789 18.383 10.031 1.00 0.00 H new ATOM 0 HD3 LYS A 80 13.494 19.281 10.799 1.00 0.00 H new ATOM 0 HE2 LYS A 80 15.250 20.812 10.908 1.00 0.00 H new ATOM 0 HE3 LYS A 80 15.341 20.061 12.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 17.515 20.211 11.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 17.076 18.582 11.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 16.988 19.309 10.125 1.00 0.00 H new ATOM 1231 N GLY A 81 16.719 15.427 10.533 1.00 0.00 N ATOM 1232 CA GLY A 81 18.007 15.047 11.081 1.00 0.00 C ATOM 1233 C GLY A 81 18.788 14.140 10.151 1.00 0.00 C ATOM 1234 O GLY A 81 18.401 12.994 9.921 1.00 0.00 O ATOM 0 H GLY A 81 16.758 15.872 9.616 1.00 0.00 H new ATOM 0 HA2 GLY A 81 18.591 15.945 11.283 1.00 0.00 H new ATOM 0 HA3 GLY A 81 17.858 14.542 12.035 1.00 0.00 H new ATOM 1238 N SER A 82 19.890 14.653 9.613 1.00 0.00 N ATOM 1239 CA SER A 82 20.724 13.883 8.698 1.00 0.00 C ATOM 1240 C SER A 82 22.179 14.336 8.777 1.00 0.00 C ATOM 1241 O SER A 82 22.479 15.410 9.297 1.00 0.00 O ATOM 1242 CB SER A 82 20.211 14.024 7.264 1.00 0.00 C ATOM 1243 OG SER A 82 20.667 12.957 6.451 1.00 0.00 O ATOM 0 H SER A 82 20.226 15.599 9.795 1.00 0.00 H new ATOM 0 HA SER A 82 20.671 12.835 8.993 1.00 0.00 H new ATOM 0 HB2 SER A 82 19.121 14.044 7.265 1.00 0.00 H new ATOM 0 HB3 SER A 82 20.547 14.973 6.846 1.00 0.00 H new ATOM 0 HG SER A 82 20.324 13.070 5.540 1.00 0.00 H new ATOM 1249 N GLY A 83 23.079 13.509 8.255 1.00 0.00 N ATOM 1250 CA GLY A 83 24.492 13.841 8.276 1.00 0.00 C ATOM 1251 C GLY A 83 25.237 13.283 7.080 1.00 0.00 C ATOM 1252 O GLY A 83 24.665 13.069 6.011 1.00 0.00 O ATOM 0 H GLY A 83 22.855 12.615 7.818 1.00 0.00 H new ATOM 0 HA2 GLY A 83 24.607 14.925 8.298 1.00 0.00 H new ATOM 0 HA3 GLY A 83 24.939 13.454 9.192 1.00 0.00 H new ATOM 1256 N PRO A 84 26.544 13.039 7.253 1.00 0.00 N ATOM 1257 CA PRO A 84 27.397 12.500 6.189 1.00 0.00 C ATOM 1258 C PRO A 84 27.069 11.047 5.864 1.00 0.00 C ATOM 1259 O PRO A 84 27.228 10.161 6.704 1.00 0.00 O ATOM 1260 CB PRO A 84 28.807 12.612 6.773 1.00 0.00 C ATOM 1261 CG PRO A 84 28.608 12.589 8.250 1.00 0.00 C ATOM 1262 CD PRO A 84 27.291 13.270 8.501 1.00 0.00 C ATOM 0 HA PRO A 84 27.266 13.038 5.250 1.00 0.00 H new ATOM 0 HB2 PRO A 84 29.438 11.786 6.446 1.00 0.00 H new ATOM 0 HB3 PRO A 84 29.296 13.532 6.454 1.00 0.00 H new ATOM 0 HG2 PRO A 84 28.596 11.566 8.626 1.00 0.00 H new ATOM 0 HG3 PRO A 84 29.419 13.107 8.761 1.00 0.00 H new ATOM 0 HD2 PRO A 84 26.776 12.844 9.362 1.00 0.00 H new ATOM 0 HD3 PRO A 84 27.420 14.334 8.701 1.00 0.00 H new ATOM 1270 N SER A 85 26.610 10.808 4.639 1.00 0.00 N ATOM 1271 CA SER A 85 26.256 9.462 4.204 1.00 0.00 C ATOM 1272 C SER A 85 27.458 8.526 4.302 1.00 0.00 C ATOM 1273 O SER A 85 28.560 8.948 4.651 1.00 0.00 O ATOM 1274 CB SER A 85 25.732 9.489 2.767 1.00 0.00 C ATOM 1275 OG SER A 85 24.341 9.758 2.737 1.00 0.00 O ATOM 0 H SER A 85 26.475 11.529 3.931 1.00 0.00 H new ATOM 0 HA SER A 85 25.472 9.088 4.862 1.00 0.00 H new ATOM 0 HB2 SER A 85 26.265 10.249 2.196 1.00 0.00 H new ATOM 0 HB3 SER A 85 25.931 8.531 2.286 1.00 0.00 H new ATOM 0 HG SER A 85 24.030 9.772 1.808 1.00 0.00 H new ATOM 1281 N SER A 86 27.235 7.253 3.992 1.00 0.00 N ATOM 1282 CA SER A 86 28.297 6.256 4.049 1.00 0.00 C ATOM 1283 C SER A 86 28.327 5.422 2.771 1.00 0.00 C ATOM 1284 O SER A 86 29.357 5.325 2.105 1.00 0.00 O ATOM 1285 CB SER A 86 28.105 5.343 5.262 1.00 0.00 C ATOM 1286 OG SER A 86 28.571 5.966 6.447 1.00 0.00 O ATOM 0 H SER A 86 26.329 6.888 3.699 1.00 0.00 H new ATOM 0 HA SER A 86 29.248 6.779 4.144 1.00 0.00 H new ATOM 0 HB2 SER A 86 27.050 5.093 5.370 1.00 0.00 H new ATOM 0 HB3 SER A 86 28.640 4.407 5.105 1.00 0.00 H new ATOM 0 HG SER A 86 28.436 5.364 7.208 1.00 0.00 H new ATOM 1292 N GLY A 87 27.190 4.821 2.436 1.00 0.00 N ATOM 1293 CA GLY A 87 27.106 4.003 1.241 1.00 0.00 C ATOM 1294 C GLY A 87 27.052 2.521 1.554 1.00 0.00 C ATOM 1295 O GLY A 87 27.239 2.116 2.701 1.00 0.00 O ATOM 0 H GLY A 87 26.324 4.886 2.972 1.00 0.00 H new ATOM 0 HA2 GLY A 87 26.218 4.284 0.674 1.00 0.00 H new ATOM 0 HA3 GLY A 87 27.968 4.205 0.605 1.00 0.00 H new TER 1299 GLY A 87