USER MOD reduce.3.24.130724 H: found=0, std=0, add=526, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 527 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 21 ASN : amide:sc= 0.89 K(o=3.2,f=1.4) USER MOD Set 1.2: A 22 GLN : amide:sc= 2.3 K(o=3.2,f=1.4) USER MOD Set 2.1: A 13 TYR OH : rot 159:sc= 0.564 USER MOD Set 2.2: A 34 THR OG1 : rot 67:sc= 1.95 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ -142:sc= 1.24 (180deg=0.309) USER MOD Single : A 24 SER OG : rot -158:sc= 0.851 USER MOD Single : A 25 LYS NZ :NH3+ 176:sc= 0.974 (180deg=0.96) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.746 K(o=-0.75,f=-2.1!) USER MOD Single : A 45 THR OG1 : rot -19:sc= 0.466 USER MOD Single : A 55 LYS NZ :NH3+ -148:sc= 1.06 (180deg=0.473) USER MOD Single : A 56 ASN : amide:sc= 2.2 K(o=2.2,f=-5.4!) USER MOD Single : A 62 SER OG : rot -84:sc= 0.773 USER MOD Single : A 67 GLN : amide:sc= -1.46 K(o=-1.5,f=-2.5) USER MOD Single : A 71 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0637) USER MOD Single : A 72 LYS NZ :NH3+ 164:sc= -0.0219 (180deg=-0.239) USER MOD Single : A 74 SER OG : rot 31:sc= 1.07 USER MOD Single : A 75 GLN : amide:sc= -0.341 K(o=-0.34,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 36 N PRO A 3 -11.799 0.628 -5.398 1.00 0.00 N ATOM 37 CA PRO A 3 -10.920 1.788 -5.300 1.00 0.00 C ATOM 38 C PRO A 3 -11.137 2.654 -4.055 1.00 0.00 C ATOM 39 O PRO A 3 -10.203 2.870 -3.291 1.00 0.00 O ATOM 40 CB PRO A 3 -11.124 2.569 -6.598 1.00 0.00 C ATOM 41 CG PRO A 3 -11.415 1.456 -7.600 1.00 0.00 C ATOM 42 CD PRO A 3 -12.224 0.448 -6.780 1.00 0.00 C ATOM 0 HA PRO A 3 -9.888 1.458 -5.178 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -11.951 3.276 -6.523 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -10.238 3.142 -6.872 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -11.980 1.823 -8.457 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -10.497 1.014 -7.989 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -13.294 0.627 -6.886 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -12.036 -0.571 -7.117 1.00 0.00 H new ATOM 50 N GLU A 4 -12.357 3.152 -3.836 1.00 0.00 N ATOM 51 CA GLU A 4 -12.659 3.996 -2.683 1.00 0.00 C ATOM 52 C GLU A 4 -12.363 3.270 -1.365 1.00 0.00 C ATOM 53 O GLU A 4 -11.846 3.860 -0.421 1.00 0.00 O ATOM 54 CB GLU A 4 -14.115 4.481 -2.759 1.00 0.00 C ATOM 55 CG GLU A 4 -14.450 5.516 -1.672 1.00 0.00 C ATOM 56 CD GLU A 4 -13.545 6.745 -1.726 1.00 0.00 C ATOM 57 OE1 GLU A 4 -13.443 7.328 -2.828 1.00 0.00 O ATOM 58 OE2 GLU A 4 -12.961 7.076 -0.671 1.00 0.00 O ATOM 0 H GLU A 4 -13.155 2.982 -4.448 1.00 0.00 H new ATOM 0 HA GLU A 4 -12.008 4.870 -2.707 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -14.298 4.918 -3.741 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -14.785 3.626 -2.661 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -15.488 5.830 -1.783 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -14.361 5.048 -0.692 1.00 0.00 H new ATOM 65 N GLU A 5 -12.671 1.976 -1.295 1.00 0.00 N ATOM 66 CA GLU A 5 -12.417 1.193 -0.098 1.00 0.00 C ATOM 67 C GLU A 5 -10.909 1.127 0.116 1.00 0.00 C ATOM 68 O GLU A 5 -10.419 1.328 1.223 1.00 0.00 O ATOM 69 CB GLU A 5 -13.019 -0.210 -0.226 1.00 0.00 C ATOM 70 CG GLU A 5 -14.493 -0.174 -0.644 1.00 0.00 C ATOM 71 CD GLU A 5 -15.351 0.656 0.303 1.00 0.00 C ATOM 72 OE1 GLU A 5 -15.552 0.185 1.444 1.00 0.00 O ATOM 73 OE2 GLU A 5 -15.779 1.749 -0.127 1.00 0.00 O ATOM 0 H GLU A 5 -13.098 1.451 -2.058 1.00 0.00 H new ATOM 0 HA GLU A 5 -12.890 1.665 0.763 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -12.450 -0.782 -0.959 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -12.926 -0.731 0.727 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -14.571 0.235 -1.651 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -14.881 -1.192 -0.682 1.00 0.00 H new ATOM 80 N LEU A 6 -10.171 0.867 -0.964 1.00 0.00 N ATOM 81 CA LEU A 6 -8.720 0.779 -0.920 1.00 0.00 C ATOM 82 C LEU A 6 -8.142 2.142 -0.531 1.00 0.00 C ATOM 83 O LEU A 6 -7.138 2.209 0.170 1.00 0.00 O ATOM 84 CB LEU A 6 -8.166 0.222 -2.237 1.00 0.00 C ATOM 85 CG LEU A 6 -8.560 -1.252 -2.456 1.00 0.00 C ATOM 86 CD1 LEU A 6 -8.139 -1.689 -3.859 1.00 0.00 C ATOM 87 CD2 LEU A 6 -7.913 -2.204 -1.438 1.00 0.00 C ATOM 0 H LEU A 6 -10.567 0.712 -1.891 1.00 0.00 H new ATOM 0 HA LEU A 6 -8.408 0.070 -0.154 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -8.536 0.823 -3.068 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.080 0.310 -2.239 1.00 0.00 H new ATOM 0 HG LEU A 6 -9.641 -1.310 -2.327 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -8.417 -2.731 -4.014 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -8.639 -1.065 -4.600 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -7.059 -1.582 -3.965 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -8.229 -3.227 -1.644 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -6.828 -2.137 -1.515 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -8.223 -1.925 -0.431 1.00 0.00 H new ATOM 99 N LYS A 7 -8.776 3.231 -0.961 1.00 0.00 N ATOM 100 CA LYS A 7 -8.405 4.587 -0.594 1.00 0.00 C ATOM 101 C LYS A 7 -8.587 4.771 0.914 1.00 0.00 C ATOM 102 O LYS A 7 -7.680 5.245 1.597 1.00 0.00 O ATOM 103 CB LYS A 7 -9.252 5.569 -1.412 1.00 0.00 C ATOM 104 CG LYS A 7 -8.675 6.988 -1.405 1.00 0.00 C ATOM 105 CD LYS A 7 -9.533 7.897 -2.291 1.00 0.00 C ATOM 106 CE LYS A 7 -8.946 9.311 -2.330 1.00 0.00 C ATOM 107 NZ LYS A 7 -9.766 10.206 -3.166 1.00 0.00 N ATOM 0 H LYS A 7 -9.579 3.189 -1.588 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.357 4.782 -0.820 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -9.323 5.214 -2.440 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -10.266 5.590 -1.012 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.649 7.376 -0.387 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -7.647 6.975 -1.768 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -9.584 7.489 -3.301 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -10.553 7.930 -1.909 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -8.884 9.710 -1.318 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -7.929 9.275 -2.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -9.344 11.157 -3.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -9.804 9.836 -4.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -10.729 10.258 -2.778 1.00 0.00 H new ATOM 121 N GLY A 8 -9.751 4.383 1.437 1.00 0.00 N ATOM 122 CA GLY A 8 -10.046 4.480 2.858 1.00 0.00 C ATOM 123 C GLY A 8 -8.994 3.703 3.643 1.00 0.00 C ATOM 124 O GLY A 8 -8.372 4.229 4.559 1.00 0.00 O ATOM 0 H GLY A 8 -10.513 3.993 0.883 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -10.052 5.524 3.170 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -11.039 4.080 3.064 1.00 0.00 H new ATOM 128 N ILE A 9 -8.791 2.443 3.262 1.00 0.00 N ATOM 129 CA ILE A 9 -7.820 1.533 3.851 1.00 0.00 C ATOM 130 C ILE A 9 -6.425 2.171 3.831 1.00 0.00 C ATOM 131 O ILE A 9 -5.772 2.274 4.867 1.00 0.00 O ATOM 132 CB ILE A 9 -7.894 0.209 3.072 1.00 0.00 C ATOM 133 CG1 ILE A 9 -9.214 -0.533 3.359 1.00 0.00 C ATOM 134 CG2 ILE A 9 -6.675 -0.685 3.294 1.00 0.00 C ATOM 135 CD1 ILE A 9 -9.189 -1.376 4.636 1.00 0.00 C ATOM 0 H ILE A 9 -9.322 2.014 2.504 1.00 0.00 H new ATOM 0 HA ILE A 9 -8.040 1.329 4.899 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.881 0.469 2.013 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -10.020 0.197 3.433 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.447 -1.180 2.513 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -6.787 -1.603 2.718 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -5.776 -0.161 2.970 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -6.591 -0.929 4.353 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -10.154 -1.866 4.767 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -8.406 -2.131 4.559 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.989 -0.733 5.493 1.00 0.00 H new ATOM 147 N PHE A 10 -5.973 2.609 2.654 1.00 0.00 N ATOM 148 CA PHE A 10 -4.687 3.267 2.475 1.00 0.00 C ATOM 149 C PHE A 10 -4.563 4.389 3.499 1.00 0.00 C ATOM 150 O PHE A 10 -3.588 4.438 4.239 1.00 0.00 O ATOM 151 CB PHE A 10 -4.570 3.833 1.050 1.00 0.00 C ATOM 152 CG PHE A 10 -3.390 4.761 0.824 1.00 0.00 C ATOM 153 CD1 PHE A 10 -3.478 6.092 1.277 1.00 0.00 C ATOM 154 CD2 PHE A 10 -2.130 4.250 0.460 1.00 0.00 C ATOM 155 CE1 PHE A 10 -2.335 6.716 1.791 1.00 0.00 C ATOM 156 CE2 PHE A 10 -0.979 5.012 0.719 1.00 0.00 C ATOM 157 CZ PHE A 10 -1.076 6.169 1.510 1.00 0.00 C ATOM 0 H PHE A 10 -6.502 2.513 1.788 1.00 0.00 H new ATOM 0 HA PHE A 10 -3.883 2.545 2.621 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -4.498 3.001 0.349 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -5.487 4.372 0.812 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -4.416 6.625 1.228 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -2.049 3.283 -0.013 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -2.422 7.607 2.396 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -0.025 4.710 0.312 1.00 0.00 H new ATOM 0 HZ PHE A 10 -0.183 6.635 1.900 1.00 0.00 H new ATOM 167 N GLU A 11 -5.551 5.287 3.538 1.00 0.00 N ATOM 168 CA GLU A 11 -5.535 6.423 4.442 1.00 0.00 C ATOM 169 C GLU A 11 -5.471 5.966 5.902 1.00 0.00 C ATOM 170 O GLU A 11 -4.659 6.473 6.672 1.00 0.00 O ATOM 171 CB GLU A 11 -6.742 7.331 4.163 1.00 0.00 C ATOM 172 CG GLU A 11 -6.483 8.772 4.635 1.00 0.00 C ATOM 173 CD GLU A 11 -5.501 9.552 3.754 1.00 0.00 C ATOM 174 OE1 GLU A 11 -5.107 9.017 2.693 1.00 0.00 O ATOM 175 OE2 GLU A 11 -5.186 10.695 4.150 1.00 0.00 O ATOM 0 H GLU A 11 -6.378 5.241 2.943 1.00 0.00 H new ATOM 0 HA GLU A 11 -4.633 7.008 4.264 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.960 7.330 3.095 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -7.622 6.934 4.669 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -7.431 9.309 4.667 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -6.098 8.745 5.654 1.00 0.00 H new ATOM 182 N LYS A 12 -6.317 5.010 6.295 1.00 0.00 N ATOM 183 CA LYS A 12 -6.366 4.484 7.634 1.00 0.00 C ATOM 184 C LYS A 12 -4.992 3.972 8.055 1.00 0.00 C ATOM 185 O LYS A 12 -4.535 4.310 9.145 1.00 0.00 O ATOM 186 CB LYS A 12 -7.421 3.377 7.672 1.00 0.00 C ATOM 187 CG LYS A 12 -8.846 3.922 7.829 1.00 0.00 C ATOM 188 CD LYS A 12 -9.849 2.812 8.176 1.00 0.00 C ATOM 189 CE LYS A 12 -9.853 1.678 7.145 1.00 0.00 C ATOM 190 NZ LYS A 12 -10.942 0.719 7.403 1.00 0.00 N ATOM 0 H LYS A 12 -6.996 4.580 5.667 1.00 0.00 H new ATOM 0 HA LYS A 12 -6.642 5.265 8.342 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -7.360 2.791 6.755 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -7.202 2.700 8.498 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -8.860 4.681 8.611 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -9.152 4.411 6.904 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -9.609 2.404 9.158 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -10.849 3.240 8.244 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -9.963 2.095 6.144 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -8.895 1.158 7.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -10.917 -0.036 6.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -10.822 0.304 8.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -11.857 1.211 7.355 1.00 0.00 H new ATOM 204 N TYR A 13 -4.318 3.171 7.222 1.00 0.00 N ATOM 205 CA TYR A 13 -2.998 2.699 7.595 1.00 0.00 C ATOM 206 C TYR A 13 -2.021 3.867 7.570 1.00 0.00 C ATOM 207 O TYR A 13 -1.335 4.073 8.564 1.00 0.00 O ATOM 208 CB TYR A 13 -2.549 1.496 6.765 1.00 0.00 C ATOM 209 CG TYR A 13 -3.137 0.200 7.293 1.00 0.00 C ATOM 210 CD1 TYR A 13 -4.494 -0.080 7.058 1.00 0.00 C ATOM 211 CD2 TYR A 13 -2.346 -0.723 8.011 1.00 0.00 C ATOM 212 CE1 TYR A 13 -5.070 -1.258 7.547 1.00 0.00 C ATOM 213 CE2 TYR A 13 -2.948 -1.869 8.561 1.00 0.00 C ATOM 214 CZ TYR A 13 -4.306 -2.141 8.323 1.00 0.00 C ATOM 215 OH TYR A 13 -4.886 -3.265 8.822 1.00 0.00 O ATOM 0 H TYR A 13 -4.658 2.849 6.316 1.00 0.00 H new ATOM 0 HA TYR A 13 -3.030 2.317 8.615 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.851 1.637 5.727 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.461 1.433 6.775 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -5.096 0.619 6.496 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -1.287 -0.551 8.137 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -6.102 -1.487 7.327 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.364 -2.543 9.169 1.00 0.00 H new ATOM 0 HH TYR A 13 -4.192 -3.923 9.037 1.00 0.00 H new ATOM 225 N ALA A 14 -1.959 4.639 6.478 1.00 0.00 N ATOM 226 CA ALA A 14 -1.053 5.777 6.371 1.00 0.00 C ATOM 227 C ALA A 14 -1.109 6.677 7.608 1.00 0.00 C ATOM 228 O ALA A 14 -0.082 7.159 8.073 1.00 0.00 O ATOM 229 CB ALA A 14 -1.378 6.556 5.102 1.00 0.00 C ATOM 0 H ALA A 14 -2.535 4.489 5.650 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.031 5.403 6.314 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -0.704 7.408 5.016 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -1.255 5.907 4.235 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -2.408 6.911 5.146 1.00 0.00 H new ATOM 235 N ALA A 15 -2.312 6.894 8.148 1.00 0.00 N ATOM 236 CA ALA A 15 -2.548 7.716 9.323 1.00 0.00 C ATOM 237 C ALA A 15 -1.693 7.350 10.540 1.00 0.00 C ATOM 238 O ALA A 15 -1.495 8.214 11.390 1.00 0.00 O ATOM 239 CB ALA A 15 -4.036 7.710 9.681 1.00 0.00 C ATOM 0 H ALA A 15 -3.166 6.489 7.765 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.234 8.723 9.049 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.201 8.329 10.563 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.613 8.107 8.846 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.356 6.689 9.890 1.00 0.00 H new ATOM 245 N LYS A 16 -1.189 6.115 10.671 1.00 0.00 N ATOM 246 CA LYS A 16 -0.354 5.790 11.814 1.00 0.00 C ATOM 247 C LYS A 16 0.970 6.568 11.725 1.00 0.00 C ATOM 248 O LYS A 16 1.416 7.165 12.702 1.00 0.00 O ATOM 249 CB LYS A 16 -0.141 4.272 11.877 1.00 0.00 C ATOM 250 CG LYS A 16 -0.971 3.602 12.982 1.00 0.00 C ATOM 251 CD LYS A 16 -2.479 3.590 12.689 1.00 0.00 C ATOM 252 CE LYS A 16 -2.812 2.599 11.569 1.00 0.00 C ATOM 253 NZ LYS A 16 -4.259 2.542 11.304 1.00 0.00 N ATOM 0 H LYS A 16 -1.344 5.350 10.015 1.00 0.00 H new ATOM 0 HA LYS A 16 -0.844 6.090 12.741 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.403 3.832 10.915 1.00 0.00 H new ATOM 0 HB3 LYS A 16 0.916 4.064 12.045 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -0.626 2.577 13.114 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.795 4.122 13.924 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.027 3.321 13.592 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -2.806 4.590 12.404 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.287 2.889 10.659 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -2.453 1.607 11.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.536 1.561 11.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.778 2.879 12.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -4.487 3.146 10.488 1.00 0.00 H new ATOM 267 N GLU A 17 1.603 6.551 10.552 1.00 0.00 N ATOM 268 CA GLU A 17 2.851 7.237 10.271 1.00 0.00 C ATOM 269 C GLU A 17 2.621 8.743 10.140 1.00 0.00 C ATOM 270 O GLU A 17 1.505 9.219 9.943 1.00 0.00 O ATOM 271 CB GLU A 17 3.415 6.651 8.964 1.00 0.00 C ATOM 272 CG GLU A 17 4.755 7.206 8.468 1.00 0.00 C ATOM 273 CD GLU A 17 5.864 6.984 9.487 1.00 0.00 C ATOM 274 OE1 GLU A 17 6.462 5.885 9.441 1.00 0.00 O ATOM 275 OE2 GLU A 17 6.069 7.909 10.303 1.00 0.00 O ATOM 0 H GLU A 17 1.243 6.039 9.747 1.00 0.00 H new ATOM 0 HA GLU A 17 3.559 7.092 11.087 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.523 5.574 9.096 1.00 0.00 H new ATOM 0 HB3 GLU A 17 2.675 6.803 8.178 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.023 6.725 7.527 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.655 8.272 8.264 1.00 0.00 H new ATOM 282 N GLY A 18 3.710 9.506 10.232 1.00 0.00 N ATOM 283 CA GLY A 18 3.665 10.943 10.049 1.00 0.00 C ATOM 284 C GLY A 18 3.239 11.202 8.602 1.00 0.00 C ATOM 285 O GLY A 18 3.782 10.579 7.694 1.00 0.00 O ATOM 0 H GLY A 18 4.640 9.141 10.435 1.00 0.00 H new ATOM 0 HA2 GLY A 18 2.960 11.398 10.745 1.00 0.00 H new ATOM 0 HA3 GLY A 18 4.640 11.387 10.248 1.00 0.00 H new ATOM 289 N ASP A 19 2.276 12.107 8.397 1.00 0.00 N ATOM 290 CA ASP A 19 1.697 12.467 7.107 1.00 0.00 C ATOM 291 C ASP A 19 0.733 11.365 6.631 1.00 0.00 C ATOM 292 O ASP A 19 1.176 10.380 6.040 1.00 0.00 O ATOM 293 CB ASP A 19 2.776 12.791 6.066 1.00 0.00 C ATOM 294 CG ASP A 19 2.203 13.428 4.804 1.00 0.00 C ATOM 295 OD1 ASP A 19 0.973 13.314 4.598 1.00 0.00 O ATOM 296 OD2 ASP A 19 3.020 14.018 4.064 1.00 0.00 O ATOM 0 H ASP A 19 1.862 12.632 9.167 1.00 0.00 H new ATOM 0 HA ASP A 19 1.119 13.383 7.233 1.00 0.00 H new ATOM 0 HB2 ASP A 19 3.510 13.465 6.507 1.00 0.00 H new ATOM 0 HB3 ASP A 19 3.304 11.876 5.799 1.00 0.00 H new ATOM 301 N PRO A 20 -0.588 11.514 6.854 1.00 0.00 N ATOM 302 CA PRO A 20 -1.576 10.503 6.494 1.00 0.00 C ATOM 303 C PRO A 20 -1.665 10.206 4.994 1.00 0.00 C ATOM 304 O PRO A 20 -2.408 9.313 4.601 1.00 0.00 O ATOM 305 CB PRO A 20 -2.912 10.993 7.067 1.00 0.00 C ATOM 306 CG PRO A 20 -2.730 12.505 7.145 1.00 0.00 C ATOM 307 CD PRO A 20 -1.248 12.649 7.487 1.00 0.00 C ATOM 0 HA PRO A 20 -1.281 9.542 6.915 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -3.749 10.722 6.423 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -3.111 10.561 8.048 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -2.977 12.992 6.201 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -3.367 12.950 7.909 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -0.849 13.592 7.114 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -1.092 12.642 8.566 1.00 0.00 H new ATOM 315 N ASN A 21 -0.926 10.918 4.139 1.00 0.00 N ATOM 316 CA ASN A 21 -0.918 10.645 2.717 1.00 0.00 C ATOM 317 C ASN A 21 0.120 9.568 2.381 1.00 0.00 C ATOM 318 O ASN A 21 0.064 9.032 1.276 1.00 0.00 O ATOM 319 CB ASN A 21 -0.634 11.952 1.977 1.00 0.00 C ATOM 320 CG ASN A 21 -0.439 11.740 0.481 1.00 0.00 C ATOM 321 OD1 ASN A 21 -1.382 11.527 -0.269 1.00 0.00 O ATOM 322 ND2 ASN A 21 0.798 11.792 0.016 1.00 0.00 N ATOM 0 H ASN A 21 -0.324 11.692 4.419 1.00 0.00 H new ATOM 0 HA ASN A 21 -1.888 10.259 2.402 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -1.460 12.645 2.139 1.00 0.00 H new ATOM 0 HB3 ASN A 21 0.259 12.417 2.395 1.00 0.00 H new ATOM 0 HD21 ASN A 21 0.975 11.654 -0.979 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.575 11.970 0.652 1.00 0.00 H new ATOM 329 N GLN A 22 1.057 9.239 3.289 1.00 0.00 N ATOM 330 CA GLN A 22 2.105 8.256 3.013 1.00 0.00 C ATOM 331 C GLN A 22 2.062 6.967 3.844 1.00 0.00 C ATOM 332 O GLN A 22 1.766 6.985 5.033 1.00 0.00 O ATOM 333 CB GLN A 22 3.498 8.871 3.190 1.00 0.00 C ATOM 334 CG GLN A 22 3.977 9.766 2.039 1.00 0.00 C ATOM 335 CD GLN A 22 3.766 11.220 2.400 1.00 0.00 C ATOM 336 OE1 GLN A 22 2.879 11.886 1.885 1.00 0.00 O ATOM 337 NE2 GLN A 22 4.586 11.734 3.301 1.00 0.00 N ATOM 0 H GLN A 22 1.104 9.646 4.223 1.00 0.00 H new ATOM 0 HA GLN A 22 1.904 7.972 1.980 1.00 0.00 H new ATOM 0 HB2 GLN A 22 3.503 9.457 4.109 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.218 8.064 3.323 1.00 0.00 H new ATOM 0 HG2 GLN A 22 5.032 9.581 1.837 1.00 0.00 H new ATOM 0 HG3 GLN A 22 3.431 9.525 1.127 1.00 0.00 H new ATOM 0 HE21 GLN A 22 5.317 11.155 3.714 1.00 0.00 H new ATOM 0 HE22 GLN A 22 4.487 12.709 3.583 1.00 0.00 H new ATOM 346 N LEU A 23 2.411 5.851 3.193 1.00 0.00 N ATOM 347 CA LEU A 23 2.554 4.514 3.761 1.00 0.00 C ATOM 348 C LEU A 23 4.036 4.190 3.945 1.00 0.00 C ATOM 349 O LEU A 23 4.729 3.998 2.947 1.00 0.00 O ATOM 350 CB LEU A 23 1.980 3.473 2.791 1.00 0.00 C ATOM 351 CG LEU A 23 0.503 3.159 3.012 1.00 0.00 C ATOM 352 CD1 LEU A 23 0.063 2.163 1.931 1.00 0.00 C ATOM 353 CD2 LEU A 23 0.190 2.539 4.377 1.00 0.00 C ATOM 0 H LEU A 23 2.613 5.863 2.193 1.00 0.00 H new ATOM 0 HA LEU A 23 2.027 4.487 4.715 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.115 3.831 1.770 1.00 0.00 H new ATOM 0 HB3 LEU A 23 2.554 2.551 2.884 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.031 4.108 2.965 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -0.991 1.921 2.066 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.210 2.606 0.946 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.657 1.253 2.011 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.880 2.347 4.453 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.735 1.601 4.484 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.492 3.227 5.167 1.00 0.00 H new ATOM 365 N SER A 24 4.553 4.096 5.170 1.00 0.00 N ATOM 366 CA SER A 24 5.961 3.752 5.344 1.00 0.00 C ATOM 367 C SER A 24 6.141 2.243 5.137 1.00 0.00 C ATOM 368 O SER A 24 5.176 1.485 5.140 1.00 0.00 O ATOM 369 CB SER A 24 6.481 4.243 6.698 1.00 0.00 C ATOM 370 OG SER A 24 5.582 3.923 7.736 1.00 0.00 O ATOM 0 H SER A 24 4.033 4.249 6.034 1.00 0.00 H new ATOM 0 HA SER A 24 6.566 4.261 4.594 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.452 3.792 6.903 1.00 0.00 H new ATOM 0 HB3 SER A 24 6.631 5.322 6.663 1.00 0.00 H new ATOM 0 HG SER A 24 5.736 4.520 8.498 1.00 0.00 H new ATOM 376 N LYS A 25 7.383 1.798 4.944 1.00 0.00 N ATOM 377 CA LYS A 25 7.730 0.398 4.717 1.00 0.00 C ATOM 378 C LYS A 25 7.090 -0.508 5.769 1.00 0.00 C ATOM 379 O LYS A 25 6.357 -1.443 5.447 1.00 0.00 O ATOM 380 CB LYS A 25 9.262 0.316 4.642 1.00 0.00 C ATOM 381 CG LYS A 25 9.818 -1.111 4.575 1.00 0.00 C ATOM 382 CD LYS A 25 11.352 -1.135 4.494 1.00 0.00 C ATOM 383 CE LYS A 25 11.891 -0.456 3.228 1.00 0.00 C ATOM 384 NZ LYS A 25 13.347 -0.633 3.099 1.00 0.00 N ATOM 0 H LYS A 25 8.194 2.417 4.941 1.00 0.00 H new ATOM 0 HA LYS A 25 7.326 0.027 3.775 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.600 0.866 3.764 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.683 0.816 5.514 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.494 -1.667 5.455 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.402 -1.620 3.706 1.00 0.00 H new ATOM 0 HD2 LYS A 25 11.765 -0.638 5.372 1.00 0.00 H new ATOM 0 HD3 LYS A 25 11.697 -2.169 4.521 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.394 -0.871 2.351 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.654 0.608 3.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 13.668 -0.221 2.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 13.826 -0.156 3.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 13.576 -1.647 3.117 1.00 0.00 H new ATOM 398 N GLU A 26 7.358 -0.217 7.040 1.00 0.00 N ATOM 399 CA GLU A 26 6.793 -0.970 8.151 1.00 0.00 C ATOM 400 C GLU A 26 5.259 -0.955 8.077 1.00 0.00 C ATOM 401 O GLU A 26 4.606 -1.970 8.296 1.00 0.00 O ATOM 402 CB GLU A 26 7.313 -0.376 9.469 1.00 0.00 C ATOM 403 CG GLU A 26 6.922 -1.234 10.678 1.00 0.00 C ATOM 404 CD GLU A 26 7.492 -0.654 11.968 1.00 0.00 C ATOM 405 OE1 GLU A 26 6.785 0.176 12.578 1.00 0.00 O ATOM 406 OE2 GLU A 26 8.630 -1.043 12.310 1.00 0.00 O ATOM 0 H GLU A 26 7.972 0.546 7.326 1.00 0.00 H new ATOM 0 HA GLU A 26 7.104 -2.013 8.098 1.00 0.00 H new ATOM 0 HB2 GLU A 26 8.398 -0.287 9.423 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.915 0.631 9.595 1.00 0.00 H new ATOM 0 HG2 GLU A 26 5.836 -1.293 10.750 1.00 0.00 H new ATOM 0 HG3 GLU A 26 7.288 -2.251 10.540 1.00 0.00 H new ATOM 413 N GLU A 27 4.678 0.202 7.762 1.00 0.00 N ATOM 414 CA GLU A 27 3.238 0.380 7.682 1.00 0.00 C ATOM 415 C GLU A 27 2.621 -0.486 6.584 1.00 0.00 C ATOM 416 O GLU A 27 1.581 -1.117 6.781 1.00 0.00 O ATOM 417 CB GLU A 27 2.970 1.869 7.468 1.00 0.00 C ATOM 418 CG GLU A 27 1.586 2.332 7.902 1.00 0.00 C ATOM 419 CD GLU A 27 1.647 3.846 8.027 1.00 0.00 C ATOM 420 OE1 GLU A 27 2.166 4.469 7.077 1.00 0.00 O ATOM 421 OE2 GLU A 27 1.277 4.341 9.106 1.00 0.00 O ATOM 0 H GLU A 27 5.205 1.050 7.553 1.00 0.00 H new ATOM 0 HA GLU A 27 2.764 0.051 8.607 1.00 0.00 H new ATOM 0 HB2 GLU A 27 3.719 2.442 8.015 1.00 0.00 H new ATOM 0 HB3 GLU A 27 3.101 2.100 6.411 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.833 2.035 7.172 1.00 0.00 H new ATOM 0 HG3 GLU A 27 1.307 1.877 8.852 1.00 0.00 H new ATOM 428 N LEU A 28 3.266 -0.525 5.418 1.00 0.00 N ATOM 429 CA LEU A 28 2.811 -1.335 4.306 1.00 0.00 C ATOM 430 C LEU A 28 2.707 -2.788 4.765 1.00 0.00 C ATOM 431 O LEU A 28 1.730 -3.459 4.449 1.00 0.00 O ATOM 432 CB LEU A 28 3.794 -1.196 3.135 1.00 0.00 C ATOM 433 CG LEU A 28 3.375 -1.984 1.881 1.00 0.00 C ATOM 434 CD1 LEU A 28 2.096 -1.426 1.245 1.00 0.00 C ATOM 435 CD2 LEU A 28 4.508 -1.950 0.853 1.00 0.00 C ATOM 0 H LEU A 28 4.116 0.005 5.226 1.00 0.00 H new ATOM 0 HA LEU A 28 1.830 -1.001 3.968 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.890 -0.142 2.876 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.778 -1.537 3.456 1.00 0.00 H new ATOM 0 HG LEU A 28 3.171 -3.009 2.191 1.00 0.00 H new ATOM 0 HD11 LEU A 28 1.841 -2.015 0.364 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.279 -1.478 1.965 1.00 0.00 H new ATOM 0 HD13 LEU A 28 2.258 -0.388 0.953 1.00 0.00 H new ATOM 0 HD21 LEU A 28 4.211 -2.508 -0.035 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.719 -0.917 0.578 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.403 -2.401 1.282 1.00 0.00 H new ATOM 447 N LYS A 29 3.702 -3.271 5.514 1.00 0.00 N ATOM 448 CA LYS A 29 3.721 -4.655 5.979 1.00 0.00 C ATOM 449 C LYS A 29 2.400 -5.012 6.663 1.00 0.00 C ATOM 450 O LYS A 29 1.654 -5.857 6.171 1.00 0.00 O ATOM 451 CB LYS A 29 4.916 -4.900 6.908 1.00 0.00 C ATOM 452 CG LYS A 29 5.021 -6.363 7.350 1.00 0.00 C ATOM 453 CD LYS A 29 5.566 -7.243 6.217 1.00 0.00 C ATOM 454 CE LYS A 29 5.710 -8.706 6.643 1.00 0.00 C ATOM 455 NZ LYS A 29 6.406 -9.499 5.615 1.00 0.00 N ATOM 0 H LYS A 29 4.507 -2.719 5.811 1.00 0.00 H new ATOM 0 HA LYS A 29 3.835 -5.308 5.114 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.835 -4.610 6.398 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.826 -4.263 7.788 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.674 -6.438 8.219 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.040 -6.725 7.656 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.899 -7.180 5.357 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.536 -6.862 5.897 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.261 -8.761 7.582 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.724 -9.132 6.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.488 -10.486 5.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.866 -9.466 4.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.356 -9.106 5.458 1.00 0.00 H new ATOM 469 N LEU A 30 2.120 -4.371 7.800 1.00 0.00 N ATOM 470 CA LEU A 30 0.875 -4.566 8.535 1.00 0.00 C ATOM 471 C LEU A 30 -0.337 -4.479 7.598 1.00 0.00 C ATOM 472 O LEU A 30 -1.242 -5.307 7.677 1.00 0.00 O ATOM 473 CB LEU A 30 0.703 -3.610 9.729 1.00 0.00 C ATOM 474 CG LEU A 30 1.691 -2.451 9.913 1.00 0.00 C ATOM 475 CD1 LEU A 30 1.025 -1.318 10.703 1.00 0.00 C ATOM 476 CD2 LEU A 30 2.930 -2.914 10.678 1.00 0.00 C ATOM 0 H LEU A 30 2.754 -3.701 8.235 1.00 0.00 H new ATOM 0 HA LEU A 30 0.935 -5.570 8.954 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.297 -3.181 9.663 1.00 0.00 H new ATOM 0 HB3 LEU A 30 0.732 -4.212 10.637 1.00 0.00 H new ATOM 0 HG LEU A 30 1.986 -2.098 8.925 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.732 -0.498 10.830 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.150 -0.961 10.160 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.719 -1.688 11.682 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.618 -2.077 10.798 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.634 -3.284 11.660 1.00 0.00 H new ATOM 0 HD23 LEU A 30 3.423 -3.712 10.123 1.00 0.00 H new ATOM 488 N LEU A 31 -0.357 -3.478 6.716 1.00 0.00 N ATOM 489 CA LEU A 31 -1.438 -3.292 5.754 1.00 0.00 C ATOM 490 C LEU A 31 -1.685 -4.585 4.976 1.00 0.00 C ATOM 491 O LEU A 31 -2.767 -5.173 5.037 1.00 0.00 O ATOM 492 CB LEU A 31 -1.096 -2.135 4.800 1.00 0.00 C ATOM 493 CG LEU A 31 -2.312 -1.377 4.256 1.00 0.00 C ATOM 494 CD1 LEU A 31 -1.876 -0.501 3.084 1.00 0.00 C ATOM 495 CD2 LEU A 31 -3.481 -2.255 3.825 1.00 0.00 C ATOM 0 H LEU A 31 0.378 -2.774 6.651 1.00 0.00 H new ATOM 0 HA LEU A 31 -2.353 -3.040 6.290 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.449 -1.430 5.322 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.525 -2.531 3.960 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.686 -0.782 5.089 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.738 0.040 2.694 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.123 0.211 3.422 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -1.455 -1.128 2.298 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.291 -1.626 3.455 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -3.156 -2.931 3.034 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -3.833 -2.837 4.677 1.00 0.00 H new ATOM 507 N LEU A 32 -0.664 -5.029 4.243 1.00 0.00 N ATOM 508 CA LEU A 32 -0.760 -6.222 3.417 1.00 0.00 C ATOM 509 C LEU A 32 -1.115 -7.434 4.271 1.00 0.00 C ATOM 510 O LEU A 32 -1.954 -8.238 3.878 1.00 0.00 O ATOM 511 CB LEU A 32 0.531 -6.485 2.633 1.00 0.00 C ATOM 512 CG LEU A 32 1.026 -5.319 1.771 1.00 0.00 C ATOM 513 CD1 LEU A 32 2.341 -5.715 1.092 1.00 0.00 C ATOM 514 CD2 LEU A 32 0.006 -4.902 0.714 1.00 0.00 C ATOM 0 H LEU A 32 0.247 -4.571 4.208 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.555 -6.050 2.691 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.317 -6.752 3.340 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.375 -7.350 1.989 1.00 0.00 H new ATOM 0 HG LEU A 32 1.178 -4.463 2.428 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.697 -4.888 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.087 -5.949 1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.177 -6.590 0.463 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.405 -4.073 0.130 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.199 -5.745 0.054 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.917 -4.591 1.202 1.00 0.00 H new ATOM 526 N GLN A 33 -0.490 -7.567 5.441 1.00 0.00 N ATOM 527 CA GLN A 33 -0.736 -8.652 6.361 1.00 0.00 C ATOM 528 C GLN A 33 -2.216 -8.711 6.742 1.00 0.00 C ATOM 529 O GLN A 33 -2.785 -9.794 6.818 1.00 0.00 O ATOM 530 CB GLN A 33 0.113 -8.406 7.606 1.00 0.00 C ATOM 531 CG GLN A 33 1.542 -8.951 7.515 1.00 0.00 C ATOM 532 CD GLN A 33 2.340 -8.754 8.807 1.00 0.00 C ATOM 533 OE1 GLN A 33 3.475 -9.191 8.915 1.00 0.00 O ATOM 534 NE2 GLN A 33 1.791 -8.102 9.822 1.00 0.00 N ATOM 0 H GLN A 33 0.213 -6.906 5.772 1.00 0.00 H new ATOM 0 HA GLN A 33 -0.474 -9.602 5.896 1.00 0.00 H new ATOM 0 HB2 GLN A 33 0.157 -7.333 7.794 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -0.382 -8.860 8.464 1.00 0.00 H new ATOM 0 HG2 GLN A 33 1.505 -10.014 7.275 1.00 0.00 H new ATOM 0 HG3 GLN A 33 2.062 -8.457 6.694 1.00 0.00 H new ATOM 0 HE21 GLN A 33 0.843 -7.734 9.739 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.316 -7.968 10.686 1.00 0.00 H new ATOM 543 N THR A 34 -2.837 -7.558 6.995 1.00 0.00 N ATOM 544 CA THR A 34 -4.237 -7.523 7.390 1.00 0.00 C ATOM 545 C THR A 34 -5.163 -7.805 6.204 1.00 0.00 C ATOM 546 O THR A 34 -6.097 -8.593 6.317 1.00 0.00 O ATOM 547 CB THR A 34 -4.607 -6.162 8.012 1.00 0.00 C ATOM 548 OG1 THR A 34 -3.642 -5.718 8.952 1.00 0.00 O ATOM 549 CG2 THR A 34 -5.959 -6.271 8.730 1.00 0.00 C ATOM 0 H THR A 34 -2.391 -6.643 6.933 1.00 0.00 H new ATOM 0 HA THR A 34 -4.373 -8.306 8.136 1.00 0.00 H new ATOM 0 HB THR A 34 -4.651 -5.442 7.195 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.804 -5.512 8.488 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.217 -5.307 9.168 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.728 -6.562 8.015 1.00 0.00 H new ATOM 0 HG23 THR A 34 -5.893 -7.022 9.518 1.00 0.00 H new ATOM 557 N GLU A 35 -4.928 -7.132 5.077 1.00 0.00 N ATOM 558 CA GLU A 35 -5.816 -7.194 3.926 1.00 0.00 C ATOM 559 C GLU A 35 -5.633 -8.415 3.032 1.00 0.00 C ATOM 560 O GLU A 35 -6.623 -9.009 2.610 1.00 0.00 O ATOM 561 CB GLU A 35 -5.681 -5.903 3.111 1.00 0.00 C ATOM 562 CG GLU A 35 -5.997 -4.654 3.944 1.00 0.00 C ATOM 563 CD GLU A 35 -7.409 -4.685 4.518 1.00 0.00 C ATOM 564 OE1 GLU A 35 -8.353 -4.706 3.698 1.00 0.00 O ATOM 565 OE2 GLU A 35 -7.517 -4.689 5.763 1.00 0.00 O ATOM 0 H GLU A 35 -4.116 -6.530 4.941 1.00 0.00 H new ATOM 0 HA GLU A 35 -6.824 -7.297 4.329 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -4.667 -5.828 2.718 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -6.353 -5.945 2.254 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -5.278 -4.571 4.759 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -5.879 -3.766 3.323 1.00 0.00 H new ATOM 572 N PHE A 36 -4.396 -8.789 2.706 1.00 0.00 N ATOM 573 CA PHE A 36 -4.173 -9.896 1.790 1.00 0.00 C ATOM 574 C PHE A 36 -2.752 -10.444 1.997 1.00 0.00 C ATOM 575 O PHE A 36 -1.853 -10.108 1.222 1.00 0.00 O ATOM 576 CB PHE A 36 -4.386 -9.441 0.328 1.00 0.00 C ATOM 577 CG PHE A 36 -4.526 -7.944 0.089 1.00 0.00 C ATOM 578 CD1 PHE A 36 -3.373 -7.143 0.123 1.00 0.00 C ATOM 579 CD2 PHE A 36 -5.778 -7.354 -0.173 1.00 0.00 C ATOM 580 CE1 PHE A 36 -3.449 -5.782 -0.213 1.00 0.00 C ATOM 581 CE2 PHE A 36 -5.864 -5.974 -0.435 1.00 0.00 C ATOM 582 CZ PHE A 36 -4.696 -5.192 -0.479 1.00 0.00 C ATOM 0 H PHE A 36 -3.547 -8.346 3.059 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.892 -10.689 1.995 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -3.547 -9.803 -0.266 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -5.282 -9.931 -0.053 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.425 -7.575 0.408 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -6.672 -7.961 -0.173 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.548 -5.188 -0.267 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.827 -5.515 -0.602 1.00 0.00 H new ATOM 0 HZ PHE A 36 -4.757 -4.140 -0.717 1.00 0.00 H new ATOM 592 N PRO A 37 -2.525 -11.304 3.009 1.00 0.00 N ATOM 593 CA PRO A 37 -1.230 -11.939 3.262 1.00 0.00 C ATOM 594 C PRO A 37 -0.672 -12.658 2.019 1.00 0.00 C ATOM 595 O PRO A 37 0.514 -12.963 1.966 1.00 0.00 O ATOM 596 CB PRO A 37 -1.452 -12.893 4.442 1.00 0.00 C ATOM 597 CG PRO A 37 -2.965 -13.104 4.480 1.00 0.00 C ATOM 598 CD PRO A 37 -3.498 -11.761 3.989 1.00 0.00 C ATOM 0 HA PRO A 37 -0.471 -11.194 3.501 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -0.923 -13.835 4.297 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -1.087 -12.463 5.375 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -3.277 -13.925 3.834 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -3.317 -13.338 5.485 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -4.487 -11.868 3.543 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -3.594 -11.051 4.810 1.00 0.00 H new ATOM 702 N THR A 45 9.767 -10.006 -1.009 1.00 0.00 N ATOM 703 CA THR A 45 10.514 -9.158 -0.102 1.00 0.00 C ATOM 704 C THR A 45 9.856 -7.787 0.030 1.00 0.00 C ATOM 705 O THR A 45 9.552 -7.115 -0.955 1.00 0.00 O ATOM 706 CB THR A 45 11.974 -9.089 -0.552 1.00 0.00 C ATOM 707 OG1 THR A 45 12.056 -9.117 -1.964 1.00 0.00 O ATOM 708 CG2 THR A 45 12.773 -10.283 -0.021 1.00 0.00 C ATOM 0 HA THR A 45 10.504 -9.588 0.899 1.00 0.00 H new ATOM 0 HB THR A 45 12.387 -8.160 -0.159 1.00 0.00 H new ATOM 0 HG1 THR A 45 11.221 -9.474 -2.333 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.807 -10.207 -0.357 1.00 0.00 H new ATOM 0 HG22 THR A 45 12.744 -10.284 1.069 1.00 0.00 H new ATOM 0 HG23 THR A 45 12.337 -11.209 -0.396 1.00 0.00 H new ATOM 716 N LEU A 46 9.643 -7.382 1.284 1.00 0.00 N ATOM 717 CA LEU A 46 9.002 -6.130 1.653 1.00 0.00 C ATOM 718 C LEU A 46 9.746 -4.960 1.024 1.00 0.00 C ATOM 719 O LEU A 46 9.134 -4.095 0.415 1.00 0.00 O ATOM 720 CB LEU A 46 8.968 -5.997 3.183 1.00 0.00 C ATOM 721 CG LEU A 46 8.325 -4.687 3.674 1.00 0.00 C ATOM 722 CD1 LEU A 46 6.817 -4.649 3.396 1.00 0.00 C ATOM 723 CD2 LEU A 46 8.591 -4.521 5.175 1.00 0.00 C ATOM 0 H LEU A 46 9.923 -7.938 2.092 1.00 0.00 H new ATOM 0 HA LEU A 46 7.977 -6.123 1.281 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.418 -6.841 3.600 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.986 -6.059 3.567 1.00 0.00 H new ATOM 0 HG LEU A 46 8.776 -3.861 3.123 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.404 -3.708 3.758 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.643 -4.733 2.323 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.332 -5.480 3.908 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.137 -3.594 5.525 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.160 -5.363 5.716 1.00 0.00 H new ATOM 0 HD23 LEU A 46 9.666 -4.488 5.353 1.00 0.00 H new ATOM 735 N ASP A 47 11.068 -4.939 1.186 1.00 0.00 N ATOM 736 CA ASP A 47 11.961 -3.913 0.689 1.00 0.00 C ATOM 737 C ASP A 47 11.773 -3.780 -0.810 1.00 0.00 C ATOM 738 O ASP A 47 11.456 -2.702 -1.281 1.00 0.00 O ATOM 739 CB ASP A 47 13.414 -4.250 1.044 1.00 0.00 C ATOM 740 CG ASP A 47 13.598 -4.401 2.550 1.00 0.00 C ATOM 741 OD1 ASP A 47 13.215 -5.481 3.052 1.00 0.00 O ATOM 742 OD2 ASP A 47 14.085 -3.431 3.169 1.00 0.00 O ATOM 0 H ASP A 47 11.561 -5.675 1.692 1.00 0.00 H new ATOM 0 HA ASP A 47 11.726 -2.958 1.159 1.00 0.00 H new ATOM 0 HB2 ASP A 47 13.707 -5.174 0.546 1.00 0.00 H new ATOM 0 HB3 ASP A 47 14.072 -3.465 0.672 1.00 0.00 H new ATOM 747 N GLU A 48 11.950 -4.866 -1.559 1.00 0.00 N ATOM 748 CA GLU A 48 11.794 -4.859 -3.003 1.00 0.00 C ATOM 749 C GLU A 48 10.411 -4.335 -3.398 1.00 0.00 C ATOM 750 O GLU A 48 10.292 -3.438 -4.232 1.00 0.00 O ATOM 751 CB GLU A 48 12.033 -6.277 -3.538 1.00 0.00 C ATOM 752 CG GLU A 48 13.459 -6.783 -3.263 1.00 0.00 C ATOM 753 CD GLU A 48 14.532 -5.856 -3.823 1.00 0.00 C ATOM 754 OE1 GLU A 48 14.689 -5.852 -5.063 1.00 0.00 O ATOM 755 OE2 GLU A 48 15.166 -5.160 -2.999 1.00 0.00 O ATOM 0 H GLU A 48 12.206 -5.776 -1.176 1.00 0.00 H new ATOM 0 HA GLU A 48 12.528 -4.187 -3.447 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.316 -6.959 -3.081 1.00 0.00 H new ATOM 0 HB3 GLU A 48 11.848 -6.292 -4.612 1.00 0.00 H new ATOM 0 HG2 GLU A 48 13.601 -6.888 -2.187 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.578 -7.775 -3.699 1.00 0.00 H new ATOM 762 N LEU A 49 9.362 -4.890 -2.794 1.00 0.00 N ATOM 763 CA LEU A 49 7.990 -4.509 -3.080 1.00 0.00 C ATOM 764 C LEU A 49 7.769 -3.016 -2.825 1.00 0.00 C ATOM 765 O LEU A 49 7.413 -2.266 -3.731 1.00 0.00 O ATOM 766 CB LEU A 49 7.063 -5.423 -2.267 1.00 0.00 C ATOM 767 CG LEU A 49 5.588 -5.017 -2.327 1.00 0.00 C ATOM 768 CD1 LEU A 49 5.054 -5.001 -3.765 1.00 0.00 C ATOM 769 CD2 LEU A 49 4.754 -5.996 -1.494 1.00 0.00 C ATOM 0 H LEU A 49 9.446 -5.621 -2.088 1.00 0.00 H new ATOM 0 HA LEU A 49 7.758 -4.648 -4.136 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.164 -6.445 -2.632 1.00 0.00 H new ATOM 0 HB3 LEU A 49 7.388 -5.422 -1.227 1.00 0.00 H new ATOM 0 HG LEU A 49 5.508 -4.007 -1.926 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.004 -4.708 -3.760 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.627 -4.288 -4.358 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.151 -5.996 -4.200 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.704 -5.707 -1.537 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.870 -7.004 -1.893 1.00 0.00 H new ATOM 0 HD23 LEU A 49 5.094 -5.975 -0.459 1.00 0.00 H new ATOM 781 N PHE A 50 7.995 -2.574 -1.592 1.00 0.00 N ATOM 782 CA PHE A 50 7.885 -1.202 -1.171 1.00 0.00 C ATOM 783 C PHE A 50 8.772 -0.331 -2.046 1.00 0.00 C ATOM 784 O PHE A 50 8.384 0.782 -2.356 1.00 0.00 O ATOM 785 CB PHE A 50 8.340 -1.139 0.287 1.00 0.00 C ATOM 786 CG PHE A 50 8.586 0.256 0.790 1.00 0.00 C ATOM 787 CD1 PHE A 50 7.542 1.003 1.348 1.00 0.00 C ATOM 788 CD2 PHE A 50 9.858 0.825 0.632 1.00 0.00 C ATOM 789 CE1 PHE A 50 7.822 2.252 1.927 1.00 0.00 C ATOM 790 CE2 PHE A 50 10.137 2.083 1.194 1.00 0.00 C ATOM 791 CZ PHE A 50 9.142 2.736 1.942 1.00 0.00 C ATOM 0 H PHE A 50 8.271 -3.198 -0.834 1.00 0.00 H new ATOM 0 HA PHE A 50 6.861 -0.839 -1.263 1.00 0.00 H new ATOM 0 HB2 PHE A 50 7.584 -1.612 0.914 1.00 0.00 H new ATOM 0 HB3 PHE A 50 9.255 -1.721 0.397 1.00 0.00 H new ATOM 0 HD1 PHE A 50 6.531 0.623 1.334 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.622 0.298 0.080 1.00 0.00 H new ATOM 0 HE1 PHE A 50 7.025 2.839 2.360 1.00 0.00 H new ATOM 0 HE2 PHE A 50 11.104 2.542 1.053 1.00 0.00 H new ATOM 0 HZ PHE A 50 9.391 3.609 2.528 1.00 0.00 H new ATOM 801 N GLU A 51 9.953 -0.803 -2.450 1.00 0.00 N ATOM 802 CA GLU A 51 10.821 0.012 -3.295 1.00 0.00 C ATOM 803 C GLU A 51 10.215 0.183 -4.685 1.00 0.00 C ATOM 804 O GLU A 51 10.261 1.281 -5.227 1.00 0.00 O ATOM 805 CB GLU A 51 12.255 -0.534 -3.356 1.00 0.00 C ATOM 806 CG GLU A 51 13.059 -0.204 -2.088 1.00 0.00 C ATOM 807 CD GLU A 51 13.329 1.290 -1.950 1.00 0.00 C ATOM 808 OE1 GLU A 51 14.069 1.810 -2.811 1.00 0.00 O ATOM 809 OE2 GLU A 51 12.783 1.884 -0.994 1.00 0.00 O ATOM 0 H GLU A 51 10.322 -1.723 -2.212 1.00 0.00 H new ATOM 0 HA GLU A 51 10.892 0.999 -2.837 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.224 -1.615 -3.493 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.764 -0.117 -4.225 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.513 -0.555 -1.212 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.007 -0.742 -2.110 1.00 0.00 H new ATOM 816 N GLU A 52 9.629 -0.868 -5.263 1.00 0.00 N ATOM 817 CA GLU A 52 8.971 -0.744 -6.559 1.00 0.00 C ATOM 818 C GLU A 52 7.853 0.288 -6.408 1.00 0.00 C ATOM 819 O GLU A 52 7.687 1.193 -7.219 1.00 0.00 O ATOM 820 CB GLU A 52 8.407 -2.113 -6.978 1.00 0.00 C ATOM 821 CG GLU A 52 7.350 -2.023 -8.094 1.00 0.00 C ATOM 822 CD GLU A 52 7.881 -1.399 -9.384 1.00 0.00 C ATOM 823 OE1 GLU A 52 9.068 -1.642 -9.693 1.00 0.00 O ATOM 824 OE2 GLU A 52 7.079 -0.708 -10.049 1.00 0.00 O ATOM 0 H GLU A 52 9.598 -1.803 -4.857 1.00 0.00 H new ATOM 0 HA GLU A 52 9.669 -0.420 -7.331 1.00 0.00 H new ATOM 0 HB2 GLU A 52 9.227 -2.748 -7.314 1.00 0.00 H new ATOM 0 HB3 GLU A 52 7.965 -2.598 -6.107 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.975 -3.023 -8.311 1.00 0.00 H new ATOM 0 HG3 GLU A 52 6.504 -1.436 -7.737 1.00 0.00 H new ATOM 831 N LEU A 53 7.079 0.110 -5.344 1.00 0.00 N ATOM 832 CA LEU A 53 5.947 0.939 -4.993 1.00 0.00 C ATOM 833 C LEU A 53 6.332 2.398 -4.717 1.00 0.00 C ATOM 834 O LEU A 53 5.622 3.310 -5.127 1.00 0.00 O ATOM 835 CB LEU A 53 5.306 0.309 -3.748 1.00 0.00 C ATOM 836 CG LEU A 53 4.392 -0.877 -4.080 1.00 0.00 C ATOM 837 CD1 LEU A 53 4.101 -1.621 -2.776 1.00 0.00 C ATOM 838 CD2 LEU A 53 3.071 -0.437 -4.719 1.00 0.00 C ATOM 0 H LEU A 53 7.235 -0.648 -4.680 1.00 0.00 H new ATOM 0 HA LEU A 53 5.254 0.975 -5.834 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.092 -0.024 -3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.730 1.068 -3.219 1.00 0.00 H new ATOM 0 HG LEU A 53 4.899 -1.515 -4.804 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.451 -2.472 -2.980 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.036 -1.974 -2.342 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.607 -0.948 -2.075 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.461 -1.314 -4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.535 0.218 -4.032 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.276 0.099 -5.646 1.00 0.00 H new ATOM 850 N ASP A 54 7.434 2.631 -4.005 1.00 0.00 N ATOM 851 CA ASP A 54 7.892 3.944 -3.591 1.00 0.00 C ATOM 852 C ASP A 54 8.661 4.604 -4.729 1.00 0.00 C ATOM 853 O ASP A 54 9.846 4.344 -4.900 1.00 0.00 O ATOM 854 CB ASP A 54 8.753 3.816 -2.319 1.00 0.00 C ATOM 855 CG ASP A 54 9.282 5.154 -1.797 1.00 0.00 C ATOM 856 OD1 ASP A 54 9.044 6.182 -2.471 1.00 0.00 O ATOM 857 OD2 ASP A 54 9.963 5.126 -0.747 1.00 0.00 O ATOM 0 H ASP A 54 8.050 1.880 -3.693 1.00 0.00 H new ATOM 0 HA ASP A 54 7.038 4.578 -3.355 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.162 3.339 -1.537 1.00 0.00 H new ATOM 0 HB3 ASP A 54 9.597 3.158 -2.527 1.00 0.00 H new ATOM 862 N LYS A 55 8.009 5.486 -5.487 1.00 0.00 N ATOM 863 CA LYS A 55 8.624 6.234 -6.580 1.00 0.00 C ATOM 864 C LYS A 55 9.934 6.922 -6.154 1.00 0.00 C ATOM 865 O LYS A 55 10.852 7.072 -6.953 1.00 0.00 O ATOM 866 CB LYS A 55 7.614 7.243 -7.149 1.00 0.00 C ATOM 867 CG LYS A 55 7.352 8.436 -6.214 1.00 0.00 C ATOM 868 CD LYS A 55 6.133 9.263 -6.644 1.00 0.00 C ATOM 869 CE LYS A 55 6.297 9.842 -8.054 1.00 0.00 C ATOM 870 NZ LYS A 55 5.247 10.833 -8.346 1.00 0.00 N ATOM 0 H LYS A 55 7.021 5.703 -5.355 1.00 0.00 H new ATOM 0 HA LYS A 55 8.896 5.527 -7.364 1.00 0.00 H new ATOM 0 HB2 LYS A 55 7.982 7.614 -8.106 1.00 0.00 H new ATOM 0 HB3 LYS A 55 6.672 6.731 -7.346 1.00 0.00 H new ATOM 0 HG2 LYS A 55 7.199 8.071 -5.198 1.00 0.00 H new ATOM 0 HG3 LYS A 55 8.233 9.077 -6.193 1.00 0.00 H new ATOM 0 HD2 LYS A 55 5.241 8.637 -6.611 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.978 10.076 -5.935 1.00 0.00 H new ATOM 0 HE2 LYS A 55 7.278 10.309 -8.147 1.00 0.00 H new ATOM 0 HE3 LYS A 55 6.256 9.037 -8.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.021 10.810 -9.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.394 10.607 -7.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 5.584 11.782 -8.088 1.00 0.00 H new ATOM 884 N ASN A 56 10.011 7.345 -4.888 1.00 0.00 N ATOM 885 CA ASN A 56 11.162 8.016 -4.288 1.00 0.00 C ATOM 886 C ASN A 56 12.186 6.995 -3.764 1.00 0.00 C ATOM 887 O ASN A 56 13.351 7.331 -3.581 1.00 0.00 O ATOM 888 CB ASN A 56 10.658 8.981 -3.196 1.00 0.00 C ATOM 889 CG ASN A 56 11.445 8.889 -1.893 1.00 0.00 C ATOM 890 OD1 ASN A 56 11.155 8.056 -1.046 1.00 0.00 O ATOM 891 ND2 ASN A 56 12.445 9.730 -1.697 1.00 0.00 N ATOM 0 H ASN A 56 9.241 7.223 -4.230 1.00 0.00 H new ATOM 0 HA ASN A 56 11.691 8.602 -5.040 1.00 0.00 H new ATOM 0 HB2 ASN A 56 10.711 10.003 -3.572 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.608 8.771 -2.993 1.00 0.00 H new ATOM 0 HD21 ASN A 56 12.984 9.689 -0.832 1.00 0.00 H new ATOM 0 HD22 ASN A 56 12.678 10.421 -2.411 1.00 0.00 H new ATOM 898 N GLY A 57 11.749 5.757 -3.532 1.00 0.00 N ATOM 899 CA GLY A 57 12.537 4.640 -3.039 1.00 0.00 C ATOM 900 C GLY A 57 13.372 4.973 -1.808 1.00 0.00 C ATOM 901 O GLY A 57 14.580 4.749 -1.826 1.00 0.00 O ATOM 0 H GLY A 57 10.776 5.497 -3.695 1.00 0.00 H new ATOM 0 HA2 GLY A 57 11.868 3.813 -2.800 1.00 0.00 H new ATOM 0 HA3 GLY A 57 13.199 4.296 -3.833 1.00 0.00 H new ATOM 905 N ASP A 58 12.769 5.496 -0.730 1.00 0.00 N ATOM 906 CA ASP A 58 13.563 5.804 0.457 1.00 0.00 C ATOM 907 C ASP A 58 12.697 6.141 1.667 1.00 0.00 C ATOM 908 O ASP A 58 12.989 5.699 2.775 1.00 0.00 O ATOM 909 CB ASP A 58 14.593 6.922 0.157 1.00 0.00 C ATOM 910 CG ASP A 58 14.483 8.153 1.057 1.00 0.00 C ATOM 911 OD1 ASP A 58 15.115 8.129 2.134 1.00 0.00 O ATOM 912 OD2 ASP A 58 13.775 9.099 0.649 1.00 0.00 O ATOM 0 H ASP A 58 11.773 5.706 -0.659 1.00 0.00 H new ATOM 0 HA ASP A 58 14.114 4.901 0.720 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.597 6.507 0.253 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.476 7.236 -0.880 1.00 0.00 H new ATOM 917 N GLY A 59 11.650 6.938 1.462 1.00 0.00 N ATOM 918 CA GLY A 59 10.810 7.427 2.531 1.00 0.00 C ATOM 919 C GLY A 59 9.573 6.571 2.706 1.00 0.00 C ATOM 920 O GLY A 59 9.499 5.769 3.636 1.00 0.00 O ATOM 0 H GLY A 59 11.366 7.260 0.537 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.377 7.442 3.462 1.00 0.00 H new ATOM 0 HA3 GLY A 59 10.515 8.455 2.321 1.00 0.00 H new ATOM 924 N GLU A 60 8.590 6.754 1.823 1.00 0.00 N ATOM 925 CA GLU A 60 7.311 6.076 1.929 1.00 0.00 C ATOM 926 C GLU A 60 6.622 5.954 0.568 1.00 0.00 C ATOM 927 O GLU A 60 7.057 6.540 -0.418 1.00 0.00 O ATOM 928 CB GLU A 60 6.372 6.910 2.814 1.00 0.00 C ATOM 929 CG GLU A 60 6.832 7.407 4.196 1.00 0.00 C ATOM 930 CD GLU A 60 7.403 8.825 4.149 1.00 0.00 C ATOM 931 OE1 GLU A 60 6.585 9.762 3.993 1.00 0.00 O ATOM 932 OE2 GLU A 60 8.639 8.951 4.274 1.00 0.00 O ATOM 0 H GLU A 60 8.664 7.376 1.018 1.00 0.00 H new ATOM 0 HA GLU A 60 7.503 5.085 2.341 1.00 0.00 H new ATOM 0 HB2 GLU A 60 6.083 7.788 2.237 1.00 0.00 H new ATOM 0 HB3 GLU A 60 5.469 6.320 2.969 1.00 0.00 H new ATOM 0 HG2 GLU A 60 5.989 7.381 4.887 1.00 0.00 H new ATOM 0 HG3 GLU A 60 7.588 6.727 4.590 1.00 0.00 H new ATOM 939 N VAL A 61 5.505 5.230 0.560 1.00 0.00 N ATOM 940 CA VAL A 61 4.586 5.040 -0.557 1.00 0.00 C ATOM 941 C VAL A 61 3.458 6.047 -0.284 1.00 0.00 C ATOM 942 O VAL A 61 3.461 6.691 0.760 1.00 0.00 O ATOM 943 CB VAL A 61 4.088 3.572 -0.571 1.00 0.00 C ATOM 944 CG1 VAL A 61 3.095 3.266 -1.703 1.00 0.00 C ATOM 945 CG2 VAL A 61 5.284 2.634 -0.760 1.00 0.00 C ATOM 0 H VAL A 61 5.198 4.726 1.392 1.00 0.00 H new ATOM 0 HA VAL A 61 5.032 5.209 -1.537 1.00 0.00 H new ATOM 0 HB VAL A 61 3.578 3.421 0.381 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.792 2.221 -1.648 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.218 3.904 -1.600 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.571 3.456 -2.665 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.938 1.601 -0.770 1.00 0.00 H new ATOM 0 HG22 VAL A 61 5.778 2.861 -1.705 1.00 0.00 H new ATOM 0 HG23 VAL A 61 5.988 2.772 0.060 1.00 0.00 H new ATOM 955 N SER A 62 2.477 6.197 -1.167 1.00 0.00 N ATOM 956 CA SER A 62 1.323 7.072 -0.989 1.00 0.00 C ATOM 957 C SER A 62 0.209 6.505 -1.854 1.00 0.00 C ATOM 958 O SER A 62 0.492 5.652 -2.694 1.00 0.00 O ATOM 959 CB SER A 62 1.630 8.526 -1.361 1.00 0.00 C ATOM 960 OG SER A 62 1.954 8.639 -2.729 1.00 0.00 O ATOM 0 H SER A 62 2.462 5.697 -2.056 1.00 0.00 H new ATOM 0 HA SER A 62 1.032 7.098 0.061 1.00 0.00 H new ATOM 0 HB2 SER A 62 0.768 9.153 -1.135 1.00 0.00 H new ATOM 0 HB3 SER A 62 2.459 8.893 -0.756 1.00 0.00 H new ATOM 0 HG SER A 62 2.904 8.435 -2.858 1.00 0.00 H new ATOM 966 N PHE A 63 -1.040 6.949 -1.673 1.00 0.00 N ATOM 967 CA PHE A 63 -2.155 6.454 -2.477 1.00 0.00 C ATOM 968 C PHE A 63 -1.801 6.508 -3.966 1.00 0.00 C ATOM 969 O PHE A 63 -1.995 5.534 -4.690 1.00 0.00 O ATOM 970 CB PHE A 63 -3.453 7.175 -2.127 1.00 0.00 C ATOM 971 CG PHE A 63 -4.647 6.714 -2.941 1.00 0.00 C ATOM 972 CD1 PHE A 63 -5.357 5.574 -2.528 1.00 0.00 C ATOM 973 CD2 PHE A 63 -4.927 7.288 -4.197 1.00 0.00 C ATOM 974 CE1 PHE A 63 -6.432 5.092 -3.297 1.00 0.00 C ATOM 975 CE2 PHE A 63 -5.954 6.758 -5.000 1.00 0.00 C ATOM 976 CZ PHE A 63 -6.777 5.733 -4.497 1.00 0.00 C ATOM 0 H PHE A 63 -1.300 7.649 -0.978 1.00 0.00 H new ATOM 0 HA PHE A 63 -2.333 5.405 -2.239 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -3.667 7.026 -1.069 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -3.315 8.246 -2.276 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -5.077 5.066 -1.617 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.353 8.135 -4.544 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -6.991 4.230 -2.964 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -6.110 7.137 -5.999 1.00 0.00 H new ATOM 0 HZ PHE A 63 -7.669 5.441 -5.031 1.00 0.00 H new ATOM 986 N GLU A 64 -1.249 7.648 -4.386 1.00 0.00 N ATOM 987 CA GLU A 64 -0.791 7.952 -5.735 1.00 0.00 C ATOM 988 C GLU A 64 -0.122 6.750 -6.416 1.00 0.00 C ATOM 989 O GLU A 64 -0.517 6.305 -7.489 1.00 0.00 O ATOM 990 CB GLU A 64 0.236 9.098 -5.628 1.00 0.00 C ATOM 991 CG GLU A 64 0.529 9.714 -7.001 1.00 0.00 C ATOM 992 CD GLU A 64 1.680 10.708 -6.919 1.00 0.00 C ATOM 993 OE1 GLU A 64 2.835 10.230 -6.914 1.00 0.00 O ATOM 994 OE2 GLU A 64 1.388 11.921 -6.857 1.00 0.00 O ATOM 0 H GLU A 64 -1.102 8.431 -3.749 1.00 0.00 H new ATOM 0 HA GLU A 64 -1.655 8.225 -6.341 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -0.143 9.867 -4.955 1.00 0.00 H new ATOM 0 HB3 GLU A 64 1.161 8.721 -5.192 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.775 8.925 -7.712 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -0.363 10.215 -7.376 1.00 0.00 H new ATOM 1001 N GLU A 65 0.926 6.258 -5.763 1.00 0.00 N ATOM 1002 CA GLU A 65 1.807 5.188 -6.213 1.00 0.00 C ATOM 1003 C GLU A 65 1.165 3.843 -5.891 1.00 0.00 C ATOM 1004 O GLU A 65 1.257 2.891 -6.662 1.00 0.00 O ATOM 1005 CB GLU A 65 3.207 5.325 -5.571 1.00 0.00 C ATOM 1006 CG GLU A 65 3.291 6.528 -4.621 1.00 0.00 C ATOM 1007 CD GLU A 65 4.631 6.815 -3.979 1.00 0.00 C ATOM 1008 OE1 GLU A 65 5.633 6.253 -4.453 1.00 0.00 O ATOM 1009 OE2 GLU A 65 4.608 7.608 -3.013 1.00 0.00 O ATOM 0 H GLU A 65 1.199 6.619 -4.849 1.00 0.00 H new ATOM 0 HA GLU A 65 1.946 5.256 -7.292 1.00 0.00 H new ATOM 0 HB2 GLU A 65 3.445 4.413 -5.023 1.00 0.00 H new ATOM 0 HB3 GLU A 65 3.956 5.430 -6.355 1.00 0.00 H new ATOM 0 HG2 GLU A 65 2.985 7.416 -5.174 1.00 0.00 H new ATOM 0 HG3 GLU A 65 2.561 6.381 -3.825 1.00 0.00 H new ATOM 1016 N PHE A 66 0.486 3.777 -4.744 1.00 0.00 N ATOM 1017 CA PHE A 66 -0.221 2.584 -4.295 1.00 0.00 C ATOM 1018 C PHE A 66 -1.214 2.112 -5.364 1.00 0.00 C ATOM 1019 O PHE A 66 -1.551 0.931 -5.392 1.00 0.00 O ATOM 1020 CB PHE A 66 -0.857 2.857 -2.930 1.00 0.00 C ATOM 1021 CG PHE A 66 -1.957 1.918 -2.488 1.00 0.00 C ATOM 1022 CD1 PHE A 66 -1.659 0.593 -2.123 1.00 0.00 C ATOM 1023 CD2 PHE A 66 -3.285 2.377 -2.428 1.00 0.00 C ATOM 1024 CE1 PHE A 66 -2.700 -0.289 -1.783 1.00 0.00 C ATOM 1025 CE2 PHE A 66 -4.309 1.521 -1.995 1.00 0.00 C ATOM 1026 CZ PHE A 66 -4.021 0.181 -1.688 1.00 0.00 C ATOM 0 H PHE A 66 0.413 4.561 -4.096 1.00 0.00 H new ATOM 0 HA PHE A 66 0.474 1.755 -4.159 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -0.069 2.834 -2.178 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -1.259 3.870 -2.940 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -0.634 0.254 -2.104 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -3.517 3.392 -2.716 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -2.484 -1.330 -1.594 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.318 1.892 -1.898 1.00 0.00 H new ATOM 0 HZ PHE A 66 -4.812 -0.486 -1.380 1.00 0.00 H new ATOM 1036 N GLN A 67 -1.660 2.987 -6.277 1.00 0.00 N ATOM 1037 CA GLN A 67 -2.516 2.554 -7.377 1.00 0.00 C ATOM 1038 C GLN A 67 -1.895 1.387 -8.158 1.00 0.00 C ATOM 1039 O GLN A 67 -2.620 0.566 -8.715 1.00 0.00 O ATOM 1040 CB GLN A 67 -3.019 3.711 -8.260 1.00 0.00 C ATOM 1041 CG GLN A 67 -3.647 4.856 -7.470 1.00 0.00 C ATOM 1042 CD GLN A 67 -4.678 4.298 -6.503 1.00 0.00 C ATOM 1043 OE1 GLN A 67 -5.815 4.026 -6.865 1.00 0.00 O ATOM 1044 NE2 GLN A 67 -4.293 4.101 -5.256 1.00 0.00 N ATOM 0 H GLN A 67 -1.443 3.984 -6.272 1.00 0.00 H new ATOM 0 HA GLN A 67 -3.427 2.159 -6.927 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -2.185 4.099 -8.845 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -3.752 3.324 -8.968 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -2.877 5.400 -6.923 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -4.117 5.566 -8.150 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -3.341 4.334 -4.973 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -4.947 3.716 -4.575 1.00 0.00 H new ATOM 1053 N VAL A 68 -0.564 1.268 -8.176 1.00 0.00 N ATOM 1054 CA VAL A 68 0.094 0.130 -8.805 1.00 0.00 C ATOM 1055 C VAL A 68 -0.363 -1.150 -8.089 1.00 0.00 C ATOM 1056 O VAL A 68 -0.664 -2.149 -8.733 1.00 0.00 O ATOM 1057 CB VAL A 68 1.622 0.313 -8.774 1.00 0.00 C ATOM 1058 CG1 VAL A 68 2.350 -0.926 -9.314 1.00 0.00 C ATOM 1059 CG2 VAL A 68 2.036 1.526 -9.619 1.00 0.00 C ATOM 0 H VAL A 68 0.074 1.947 -7.762 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.185 0.054 -9.856 1.00 0.00 H new ATOM 0 HB VAL A 68 1.903 0.466 -7.732 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.427 -0.760 -9.277 1.00 0.00 H new ATOM 0 HG12 VAL A 68 2.095 -1.793 -8.704 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.046 -1.106 -10.345 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.119 1.640 -9.585 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.719 1.376 -10.651 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.564 2.425 -9.221 1.00 0.00 H new ATOM 1069 N LEU A 69 -0.449 -1.115 -6.757 1.00 0.00 N ATOM 1070 CA LEU A 69 -0.904 -2.230 -5.937 1.00 0.00 C ATOM 1071 C LEU A 69 -2.381 -2.467 -6.269 1.00 0.00 C ATOM 1072 O LEU A 69 -2.785 -3.594 -6.559 1.00 0.00 O ATOM 1073 CB LEU A 69 -0.691 -1.882 -4.452 1.00 0.00 C ATOM 1074 CG LEU A 69 -0.640 -3.051 -3.454 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -1.918 -3.889 -3.469 1.00 0.00 C ATOM 1076 CD2 LEU A 69 0.584 -3.949 -3.661 1.00 0.00 C ATOM 0 H LEU A 69 -0.198 -0.291 -6.211 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.344 -3.143 -6.139 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.242 -1.325 -4.367 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.493 -1.211 -4.144 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.553 -2.588 -2.471 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.829 -4.701 -2.747 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.769 -3.260 -3.206 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -2.069 -4.305 -4.465 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.570 -4.758 -2.930 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.562 -4.369 -4.667 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.493 -3.361 -3.534 1.00 0.00 H new ATOM 1088 N VAL A 70 -3.181 -1.392 -6.242 1.00 0.00 N ATOM 1089 CA VAL A 70 -4.608 -1.442 -6.571 1.00 0.00 C ATOM 1090 C VAL A 70 -4.816 -2.142 -7.917 1.00 0.00 C ATOM 1091 O VAL A 70 -5.759 -2.908 -8.078 1.00 0.00 O ATOM 1092 CB VAL A 70 -5.247 -0.040 -6.572 1.00 0.00 C ATOM 1093 CG1 VAL A 70 -6.731 -0.101 -6.955 1.00 0.00 C ATOM 1094 CG2 VAL A 70 -5.109 0.636 -5.202 1.00 0.00 C ATOM 0 H VAL A 70 -2.852 -0.460 -5.990 1.00 0.00 H new ATOM 0 HA VAL A 70 -5.110 -2.019 -5.794 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.712 0.549 -7.317 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -7.151 0.905 -6.946 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -6.832 -0.527 -7.953 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -7.266 -0.724 -6.239 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.570 1.623 -5.235 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.606 0.029 -4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.053 0.737 -4.951 1.00 0.00 H new ATOM 1104 N LYS A 71 -3.946 -1.896 -8.894 1.00 0.00 N ATOM 1105 CA LYS A 71 -4.033 -2.571 -10.175 1.00 0.00 C ATOM 1106 C LYS A 71 -3.570 -4.027 -10.023 1.00 0.00 C ATOM 1107 O LYS A 71 -4.239 -4.949 -10.490 1.00 0.00 O ATOM 1108 CB LYS A 71 -3.194 -1.808 -11.211 1.00 0.00 C ATOM 1109 CG LYS A 71 -3.392 -2.373 -12.624 1.00 0.00 C ATOM 1110 CD LYS A 71 -2.549 -1.581 -13.633 1.00 0.00 C ATOM 1111 CE LYS A 71 -2.796 -2.050 -15.072 1.00 0.00 C ATOM 1112 NZ LYS A 71 -2.409 -3.458 -15.271 1.00 0.00 N ATOM 0 H LYS A 71 -3.175 -1.233 -8.817 1.00 0.00 H new ATOM 0 HA LYS A 71 -5.065 -2.587 -10.525 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -3.470 -0.754 -11.198 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -2.140 -1.865 -10.940 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -3.107 -3.425 -12.647 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -4.445 -2.322 -12.900 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -2.785 -0.520 -13.551 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -1.492 -1.692 -13.391 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -3.851 -1.927 -15.317 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -2.233 -1.419 -15.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -2.513 -3.708 -16.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -1.419 -3.590 -14.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -3.022 -4.071 -14.696 1.00 0.00 H new ATOM 1126 N LYS A 72 -2.417 -4.242 -9.383 1.00 0.00 N ATOM 1127 CA LYS A 72 -1.797 -5.553 -9.240 1.00 0.00 C ATOM 1128 C LYS A 72 -2.602 -6.592 -8.489 1.00 0.00 C ATOM 1129 O LYS A 72 -2.429 -7.782 -8.736 1.00 0.00 O ATOM 1130 CB LYS A 72 -0.332 -5.448 -8.825 1.00 0.00 C ATOM 1131 CG LYS A 72 0.417 -6.688 -8.306 1.00 0.00 C ATOM 1132 CD LYS A 72 0.133 -7.005 -6.829 1.00 0.00 C ATOM 1133 CE LYS A 72 1.143 -8.001 -6.244 1.00 0.00 C ATOM 1134 NZ LYS A 72 2.509 -7.457 -6.163 1.00 0.00 N ATOM 0 H LYS A 72 -1.882 -3.493 -8.943 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.801 -5.976 -10.245 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.222 -5.073 -9.686 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.270 -4.685 -8.049 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.141 -7.550 -8.914 1.00 0.00 H new ATOM 0 HG3 LYS A 72 1.488 -6.536 -8.437 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.159 -6.082 -6.250 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.873 -7.413 -6.734 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.817 -8.297 -5.247 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.153 -8.902 -6.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 3.081 -8.049 -5.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 2.938 -7.452 -7.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 2.474 -6.485 -5.794 1.00 0.00 H new ATOM 1148 N ILE A 73 -3.505 -6.190 -7.606 1.00 0.00 N ATOM 1149 CA ILE A 73 -4.380 -7.191 -6.984 1.00 0.00 C ATOM 1150 C ILE A 73 -5.163 -7.910 -8.101 1.00 0.00 C ATOM 1151 O ILE A 73 -5.495 -9.085 -7.968 1.00 0.00 O ATOM 1152 CB ILE A 73 -5.344 -6.590 -5.950 1.00 0.00 C ATOM 1153 CG1 ILE A 73 -5.943 -5.277 -6.457 1.00 0.00 C ATOM 1154 CG2 ILE A 73 -4.646 -6.376 -4.604 1.00 0.00 C ATOM 1155 CD1 ILE A 73 -7.346 -5.041 -5.914 1.00 0.00 C ATOM 0 H ILE A 73 -3.654 -5.225 -7.310 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.755 -7.894 -6.434 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.156 -7.302 -5.803 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -5.298 -4.448 -6.166 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.974 -5.290 -7.546 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -5.352 -5.950 -3.892 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.282 -7.332 -4.227 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.806 -5.694 -4.734 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -7.732 -4.097 -6.300 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.999 -5.855 -6.227 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -7.313 -5.001 -4.825 1.00 0.00 H new ATOM 1167 N SER A 74 -5.417 -7.216 -9.216 1.00 0.00 N ATOM 1168 CA SER A 74 -6.066 -7.724 -10.413 1.00 0.00 C ATOM 1169 C SER A 74 -5.041 -7.811 -11.559 1.00 0.00 C ATOM 1170 O SER A 74 -5.412 -7.731 -12.727 1.00 0.00 O ATOM 1171 CB SER A 74 -7.247 -6.803 -10.752 1.00 0.00 C ATOM 1172 OG SER A 74 -6.920 -5.442 -10.529 1.00 0.00 O ATOM 0 H SER A 74 -5.159 -6.233 -9.304 1.00 0.00 H new ATOM 0 HA SER A 74 -6.453 -8.731 -10.254 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.533 -6.944 -11.794 1.00 0.00 H new ATOM 0 HB3 SER A 74 -8.110 -7.076 -10.144 1.00 0.00 H new ATOM 0 HG SER A 74 -5.962 -5.306 -10.683 1.00 0.00 H new ATOM 1178 N GLN A 75 -3.751 -7.975 -11.241 1.00 0.00 N ATOM 1179 CA GLN A 75 -2.668 -8.078 -12.222 1.00 0.00 C ATOM 1180 C GLN A 75 -3.019 -9.040 -13.364 1.00 0.00 C ATOM 1181 O GLN A 75 -2.328 -9.068 -14.380 1.00 0.00 O ATOM 1182 CB GLN A 75 -1.311 -8.436 -11.571 1.00 0.00 C ATOM 1183 CG GLN A 75 -1.194 -9.800 -10.852 1.00 0.00 C ATOM 1184 CD GLN A 75 -2.508 -10.535 -10.582 1.00 0.00 C ATOM 1185 OE1 GLN A 75 -2.959 -11.337 -11.388 1.00 0.00 O ATOM 1186 NE2 GLN A 75 -3.153 -10.270 -9.460 1.00 0.00 N ATOM 0 H GLN A 75 -3.427 -8.041 -10.276 1.00 0.00 H new ATOM 0 HA GLN A 75 -2.553 -7.085 -12.658 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -0.547 -8.400 -12.348 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -1.069 -7.655 -10.850 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -0.555 -10.449 -11.450 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -0.687 -9.643 -9.900 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -2.767 -9.599 -8.796 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -4.037 -10.736 -9.258 1.00 0.00 H new